==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=8-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER LYASE 03-FEB-03 1NVF . COMPND 2 MOLECULE: 3-DEHYDROQUINATE SYNTHASE; . SOURCE 2 ORGANISM_SCIENTIFIC: EMERICELLA NIDULANS; . AUTHOR C.E.NICHOLS,J.REN,H.K.LAMB,A.R.HAWKINS,D.K.STAMMERS . 1161 3 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 45687.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 858 73.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 84 7.2 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 70 6.0 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 . 3 0.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 12 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 . 1 0.1 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 . 80 6.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 144 12.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 443 38.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 19 1.6 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 2 5 1 3 5 0 0 3 1 8 0 0 3 0 3 5 1 3 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 3 0 6 0 3 3 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 . 5 6 0 3 3 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 . 7 2 0 0 0 3 0 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 4 A P 0 0 121 0, 0.0 2,-0.3 0, 0.0 14,-0.2 0.000 360.0 360.0 360.0 91.9 67.8 -97.2 40.4 2 5 A T E -A 14 0A 35 12,-2.7 12,-4.2 2,-0.0 2,-0.4 -0.713 360.0-160.8 -96.2 143.5 70.8 -94.8 40.7 3 6 A K E -A 13 0A 106 -2,-0.3 2,-0.4 10,-0.3 10,-0.2 -0.984 0.6-160.3-125.4 133.8 70.4 -91.0 41.0 4 7 A I E -A 12 0A 16 8,-2.6 8,-1.9 -2,-0.4 2,-0.5 -0.872 14.8-134.8-111.4 145.8 73.1 -88.4 40.4 5 8 A S E - 0 0 61 -2,-0.4 2,-0.4 5,-0.2 5,-0.3 -0.877 22.5-177.4-103.7 128.0 73.0 -84.8 41.7 6 9 A I E > -A 9 0A 5 3,-3.4 3,-1.0 -2,-0.5 5,-0.2 -0.989 67.3 -11.3-130.5 127.1 73.8 -81.9 39.4 7 10 A L T 3 S- 0 0 50 -2,-0.4 -1,-0.2 241,-0.4 3,-0.1 0.898 133.4 -45.9 52.8 46.8 73.9 -78.3 40.4 8 11 A G T 3 S+ 0 0 78 1,-0.1 2,-0.4 -3,-0.1 -1,-0.2 0.558 123.2 90.0 79.6 9.2 72.4 -79.0 43.8 9 12 A R E < S-A 6 0A 117 -3,-1.0 -3,-3.4 -5,-0.0 2,-2.2 -0.998 73.9-130.5-142.8 137.2 69.6 -81.2 42.6 10 13 A E E + 0 0 113 -2,-0.4 -5,-0.2 -5,-0.3 -3,-0.1 -0.512 53.6 143.1 -79.6 71.2 69.2 -85.0 42.0 11 14 A S E + 0 0 4 -2,-2.2 159,-2.6 -5,-0.2 2,-0.6 0.481 45.7 85.8 -91.4 -2.2 67.8 -84.5 38.5 12 15 A I E +Ab 4 170A 0 -8,-1.9 -8,-2.6 -3,-0.2 2,-0.5 -0.892 51.2 176.9-106.2 117.4 69.6 -87.6 37.1 13 16 A I E -Ab 3 171A 3 157,-2.3 159,-2.3 -2,-0.6 2,-0.5 -0.971 8.4-171.1-118.8 119.2 67.9 -91.0 37.5 14 17 A A E +Ab 2 172A 3 -12,-4.2 -12,-2.7 -2,-0.5 2,-0.3 -0.945 25.4 113.0-119.8 127.8 69.7 -93.9 35.9 15 18 A D E - b 0 173A 46 157,-2.0 159,-1.3 -2,-0.5 2,-0.5 -0.952 62.5 -82.7-168.8-180.0 68.3 -97.4 35.4 16 19 A F S S+ 0 0 85 -2,-0.3 157,-0.1 157,-0.2 -2,-0.0 -0.893 107.5 16.0-104.0 122.4 67.2 -100.0 32.9 17 20 A G S > S+ 0 0 1 -2,-0.5 4,-1.8 3,-0.0 -1,-0.2 0.717 74.9 137.2 91.8 23.8 63.6 -99.7 31.7 18 21 A L T 4> + 0 0 7 -3,-0.4 5,-1.6 1,-0.2 6,-0.3 0.942 68.9 55.1 -64.5 -49.4 62.9 -96.2 32.8 19 22 A W T 4>S+ 0 0 3 1,-0.2 5,-0.5 3,-0.2 3,-0.5 0.909 110.5 44.2 -50.8 -51.3 61.1 -95.2 29.6 20 23 A R T 45S+ 0 0 116 1,-0.2 -1,-0.2 3,-0.1 2,-0.2 0.959 130.8 15.8 -62.8 -52.1 58.6 -98.0 29.7 21 24 A N T <5S+ 0 0 105 -4,-1.8 -1,-0.2 3,-0.1 -2,-0.2 -0.462 129.3 21.6-128.0 63.2 57.7 -97.8 33.4 22 25 A Y T >5S+ 0 0 63 -3,-0.5 4,-2.6 -4,-0.3 5,-0.4 -0.063 98.6 68.9-177.9 -68.4 58.7 -94.6 35.2 23 26 A V H >> S+ 0 0 115 -3,-0.3 4,-1.4 1,-0.2 3,-0.5 0.965 116.0 52.0 -63.2 -56.9 54.6 -91.4 35.9 26 29 A D H 3X S+ 0 0 16 -4,-2.6 4,-3.2 1,-0.2 5,-0.5 0.857 106.6 56.6 -49.3 -41.1 57.4 -89.3 37.3 27 30 A L H 3X S+ 0 0 0 -4,-2.7 4,-1.6 -5,-0.4 -1,-0.2 0.922 107.0 47.2 -58.4 -46.0 56.7 -86.6 34.7 28 31 A I H << S+ 0 0 15 -4,-1.3 -1,-0.2 -3,-0.5 -2,-0.2 0.725 120.4 38.6 -70.8 -21.9 53.1 -86.2 35.8 29 32 A S H < S+ 0 0 73 -4,-1.4 3,-0.4 -3,-0.3 -2,-0.2 0.862 127.5 28.7 -95.8 -44.1 54.0 -86.0 39.5 30 33 A D H < S+ 0 0 93 -4,-3.2 -3,-0.2 1,-0.2 -2,-0.2 0.528 126.5 44.6 -95.4 -8.9 57.3 -84.0 39.5 31 34 A C S < S- 0 0 0 -4,-1.6 -1,-0.2 -5,-0.5 -2,-0.1 -0.394 79.9-170.7-131.1 54.4 56.5 -82.0 36.4 32 35 A S + 0 0 90 -3,-0.4 2,-0.3 2,-0.1 -4,-0.1 -0.207 25.6 137.6 -48.3 128.0 52.9 -81.0 36.9 33 36 A S - 0 0 15 -5,-0.2 71,-0.1 1,-0.1 3,-0.1 -0.974 58.8-133.6-168.8 164.5 51.6 -79.4 33.8 34 37 A T S S+ 0 0 46 -2,-0.3 34,-2.0 1,-0.2 2,-0.4 0.524 95.9 46.6 -98.9 -15.3 48.6 -79.3 31.4 35 38 A T E -c 68 0A 3 68,-0.4 70,-1.9 32,-0.2 2,-0.4 -0.991 58.2-179.8-137.9 130.3 50.8 -79.6 28.4 36 39 A Y E -cd 69 105A 2 32,-1.7 34,-3.1 -2,-0.4 2,-0.6 -0.994 11.3-159.0-127.7 129.1 53.7 -81.9 27.5 37 40 A V E -cd 70 106A 0 68,-2.2 70,-3.8 -2,-0.4 2,-0.5 -0.936 2.7-159.5-115.0 120.2 55.6 -81.8 24.2 38 41 A L E -cd 71 107A 0 32,-3.0 34,-3.5 -2,-0.6 2,-0.4 -0.844 9.4-171.6 -98.4 126.4 57.5 -84.7 23.0 39 42 A V E +cd 72 108A 1 68,-2.7 70,-2.4 -2,-0.5 2,-0.3 -0.961 24.7 124.2-119.3 136.9 60.2 -84.0 20.4 40 43 A T E -c 73 0A 0 32,-2.0 34,-2.3 -2,-0.4 2,-0.2 -0.953 52.2 -94.8-173.3 172.2 62.1 -86.8 18.6 41 44 A D E > -c 74 0A 20 68,-0.4 4,-2.5 -2,-0.3 5,-0.2 -0.534 39.6-101.0-100.1 171.9 62.9 -87.9 15.0 42 45 A T H > S+ 0 0 74 32,-1.3 4,-1.8 2,-0.2 5,-0.2 0.846 118.2 56.2 -59.1 -35.7 61.1 -90.5 12.9 43 46 A N H > S+ 0 0 101 1,-0.2 4,-0.6 2,-0.2 -1,-0.2 0.969 116.6 32.2 -63.0 -56.2 63.8 -93.1 13.6 44 47 A I H > S+ 0 0 20 1,-0.2 4,-2.5 2,-0.1 5,-0.3 0.798 116.2 60.3 -72.1 -28.7 63.5 -93.1 17.4 45 48 A G H X S+ 0 0 1 -4,-2.5 4,-2.5 1,-0.2 -2,-0.2 0.946 100.2 49.8 -65.4 -52.4 59.8 -92.2 17.4 46 49 A S H < S+ 0 0 91 -4,-1.8 -1,-0.2 1,-0.2 -2,-0.1 0.758 119.6 40.8 -59.6 -24.4 58.4 -95.2 15.5 47 50 A I H < S+ 0 0 95 -4,-0.6 -1,-0.2 -5,-0.2 4,-0.2 0.833 131.9 16.9 -90.9 -37.0 60.4 -97.5 17.9 48 51 A Y H X S+ 0 0 20 -4,-2.5 4,-0.9 -5,-0.1 -3,-0.2 0.679 105.8 69.1-117.2 -21.2 59.8 -95.7 21.2 49 52 A T H >X S+ 0 0 12 -4,-2.5 4,-2.2 -5,-0.3 3,-0.8 0.932 91.0 62.7 -71.8 -42.6 56.9 -93.2 21.2 50 53 A P H 3> S+ 0 0 68 0, 0.0 4,-1.5 0, 0.0 3,-0.5 0.923 103.3 49.1 -44.6 -58.7 54.0 -95.7 21.0 51 54 A S H 3> S+ 0 0 53 1,-0.2 4,-1.9 -4,-0.2 -2,-0.2 0.825 112.2 51.1 -52.0 -35.0 54.9 -97.3 24.3 52 55 A F H S- 0 0 40 1,-0.1 3,-1.9 2,-0.1 4,-0.2 -0.324 97.7 -73.5 117.0 159.8 70.5 -86.1 11.2 78 81 A E G > S+ 0 0 52 1,-0.3 3,-1.7 2,-0.2 75,-0.2 0.647 115.0 86.4 -62.3 -13.6 72.6 -83.1 12.2 79 82 A V G 3 S+ 0 0 105 1,-0.3 -1,-0.3 -3,-0.2 6,-0.2 0.667 77.2 64.5 -60.7 -18.9 70.5 -81.3 9.6 80 83 A S G < S+ 0 0 4 -3,-1.9 2,-2.1 1,-0.2 -1,-0.3 0.668 77.4 86.3 -80.9 -17.7 67.8 -80.7 12.3 81 84 A K S < S+ 0 0 9 -3,-1.7 72,-1.5 -4,-0.2 2,-0.3 -0.493 72.0 118.6 -82.4 71.6 70.1 -78.5 14.4 82 85 A S S > S- 0 0 33 -2,-2.1 4,-2.1 70,-0.2 5,-0.3 -0.962 79.7-113.2-139.0 155.0 69.1 -75.4 12.4 83 86 A R H > S+ 0 0 61 70,-0.4 4,-0.8 -2,-0.3 -1,-0.1 0.800 117.2 53.1 -54.3 -30.4 67.5 -72.0 12.9 84 87 A Q H > S+ 0 0 120 2,-0.2 4,-1.8 1,-0.2 -1,-0.2 0.894 105.1 48.4 -75.5 -44.9 64.6 -73.3 10.8 85 88 A T H > S+ 0 0 15 1,-0.2 4,-2.8 -3,-0.2 5,-0.2 0.904 112.7 50.9 -63.9 -38.2 63.8 -76.5 12.6 86 89 A K H X S+ 0 0 17 -4,-2.1 4,-1.3 1,-0.2 -1,-0.2 0.802 112.2 47.9 -66.0 -29.0 63.9 -74.5 15.9 87 90 A A H X S+ 0 0 9 -4,-0.8 4,-2.1 -5,-0.3 -2,-0.2 0.733 111.9 49.8 -82.8 -24.6 61.5 -72.1 14.2 88 91 A D H X S+ 0 0 56 -4,-1.8 4,-1.8 2,-0.2 -2,-0.2 0.895 111.3 46.5 -79.3 -44.4 59.3 -74.9 13.0 89 92 A I H X S+ 0 0 2 -4,-2.8 4,-2.4 2,-0.2 -2,-0.2 0.896 116.4 47.6 -63.1 -40.4 59.0 -76.6 16.4 90 93 A E H X S+ 0 0 4 -4,-1.3 4,-2.7 -5,-0.2 5,-0.3 0.957 111.4 46.7 -65.9 -55.0 58.3 -73.2 17.9 91 94 A D H X S+ 0 0 46 -4,-2.1 4,-0.7 1,-0.2 -1,-0.2 0.814 113.4 53.5 -57.1 -29.5 55.7 -72.1 15.4 92 95 A W H >< S+ 0 0 63 -4,-1.8 3,-1.0 2,-0.2 4,-0.5 0.971 109.4 45.1 -68.7 -53.6 54.1 -75.5 15.9 93 96 A M H >< S+ 0 0 0 -4,-2.4 7,-2.0 1,-0.3 3,-1.1 0.889 113.1 51.1 -57.0 -42.1 53.9 -75.2 19.7 94 97 A L H 3< S+ 0 0 4 -4,-2.7 -1,-0.3 1,-0.2 -2,-0.2 0.707 109.1 54.6 -69.5 -18.4 52.6 -71.8 19.4 95 98 A S T << S+ 0 0 74 -3,-1.0 -1,-0.2 -4,-0.7 -2,-0.2 0.449 80.5 108.9 -97.4 0.8 50.0 -73.1 17.0 96 99 A Q S < S- 0 0 45 -3,-1.1 -3,-0.0 -4,-0.5 4,-0.0 -0.232 83.6 -82.7 -70.6 165.9 48.4 -75.9 19.0 97 100 A N S S+ 0 0 152 1,-0.2 -1,-0.1 2,-0.1 -2,-0.1 -0.901 125.8 15.7-116.5 106.2 44.9 -75.5 20.4 98 101 A P S S- 0 0 45 0, 0.0 -1,-0.2 0, 0.0 -2,-0.1 0.620 115.0-104.9 -81.9 169.3 45.3 -74.0 22.8 99 102 A P - 0 0 19 0, 0.0 2,-0.5 0, 0.0 -5,-0.2 -0.038 38.6 -97.2 -53.0 155.1 48.8 -72.6 22.4 100 103 A C - 0 0 0 -7,-2.0 2,-0.1 -8,-0.1 -4,-0.0 -0.675 51.7-160.3 -77.9 125.0 51.6 -74.2 24.3 101 104 A G > - 0 0 12 -2,-0.5 3,-2.5 -3,-0.1 640,-0.1 -0.353 36.2 -81.6-102.4-178.0 52.2 -72.0 27.3 102 105 A R T 3 S+ 0 0 70 641,-0.4 28,-0.3 639,-0.4 642,-0.1 0.483 124.0 64.4 -62.2 -3.5 54.9 -71.3 29.8 103 106 A D T 3 S+ 0 0 18 26,-0.1 -68,-0.4 640,-0.1 -1,-0.3 0.393 75.5 126.3 -99.0 1.1 53.7 -74.4 31.8 104 107 A T < - 0 0 0 -3,-2.5 26,-0.9 -70,-0.1 2,-0.6 -0.290 50.7-151.9 -60.0 139.3 54.7 -76.6 28.9 105 108 A V E -de 36 130A 0 -70,-1.9 -68,-2.2 24,-0.1 2,-0.4 -0.966 12.4-152.8-117.2 111.4 57.0 -79.4 29.8 106 109 A V E -de 37 131A 2 24,-2.5 26,-2.6 -2,-0.6 2,-0.6 -0.733 0.9-151.9 -91.1 131.6 59.2 -80.4 26.8 107 110 A I E -de 38 132A 0 -70,-3.8 -68,-2.7 -2,-0.4 2,-1.0 -0.899 1.7-154.5-107.6 115.8 60.5 -83.9 26.5 108 111 A A E +de 39 133A 0 24,-3.1 26,-2.9 -2,-0.6 2,-0.8 -0.766 17.1 178.1 -89.2 99.8 63.8 -84.4 24.6 109 112 A L E + e 0 134A 0 -70,-2.4 -68,-0.4 -2,-1.0 2,-0.3 -0.802 47.3 47.3-107.2 92.2 63.7 -88.0 23.3 110 113 A G E S- e 0 135A 0 24,-1.0 26,-1.0 -2,-0.8 27,-0.4 -0.988 84.7 -63.6 169.1-169.2 66.9 -88.5 21.3 111 114 A G S > S- 0 0 11 -2,-0.3 4,-2.0 24,-0.2 5,-0.2 0.301 78.3 -56.0 -83.8-145.4 70.6 -88.2 21.1 112 115 A G H > S+ 0 0 15 2,-0.2 4,-3.1 3,-0.2 5,-0.3 0.829 132.3 54.4 -69.5 -33.6 72.7 -85.0 21.1 113 116 A V H > S+ 0 0 29 2,-0.2 4,-2.6 1,-0.2 5,-0.3 0.988 115.7 36.4 -64.5 -57.5 71.0 -83.5 18.0 114 117 A I H > S+ 0 0 9 1,-0.2 4,-2.5 2,-0.2 5,-0.3 0.851 120.0 51.7 -64.9 -31.4 67.5 -83.8 19.4 115 118 A G H X S+ 0 0 0 -4,-2.0 4,-2.5 2,-0.2 5,-0.3 0.968 112.2 42.7 -69.3 -53.8 68.8 -83.0 22.9 116 119 A D H X S+ 0 0 20 -4,-3.1 4,-1.4 2,-0.2 -2,-0.2 0.923 120.7 44.1 -57.9 -43.6 70.7 -79.8 21.9 117 120 A L H X S+ 0 0 1 -4,-2.6 4,-2.5 -5,-0.3 3,-0.4 0.976 114.7 45.3 -65.7 -58.1 67.8 -78.7 19.7 118 121 A T H X S+ 0 0 2 -4,-2.5 4,-2.1 -5,-0.3 -2,-0.2 0.891 113.4 51.0 -54.1 -44.4 64.9 -79.5 22.1 119 122 A G H X S+ 0 0 0 -4,-2.5 4,-1.4 -5,-0.3 -1,-0.2 0.837 109.9 49.6 -65.4 -33.0 66.7 -77.9 25.0 120 123 A F H X S+ 0 0 4 -4,-1.4 4,-1.4 -3,-0.4 -2,-0.2 0.918 109.1 51.0 -72.6 -43.3 67.5 -74.7 23.1 121 124 A V H X S+ 0 0 2 -4,-2.5 4,-1.2 1,-0.2 3,-0.4 0.919 111.3 50.0 -56.9 -43.6 63.9 -74.3 22.0 122 125 A A H < S+ 0 0 0 -4,-2.1 7,-2.7 1,-0.2 -1,-0.2 0.809 104.5 58.9 -64.0 -34.1 62.8 -74.8 25.6 123 126 A S H < S+ 0 0 6 -4,-1.4 -1,-0.2 5,-0.2 -2,-0.2 0.806 119.1 27.2 -68.0 -31.8 65.3 -72.1 26.8 124 127 A T H >< S+ 0 0 1 -4,-1.4 426,-2.1 -3,-0.4 3,-1.8 0.440 85.0 121.7-111.5 -1.7 63.8 -69.4 24.6 125 128 A Y B >< S-G 549 0B 0 -4,-1.2 3,-2.3 1,-0.3 424,-0.2 -0.513 107.4 -21.3 -67.3 112.0 60.2 -70.5 24.3 126 129 A M T 3 S- 0 0 6 422,-2.1 -1,-0.3 -2,-0.6 423,-0.2 0.803 130.2 -55.5 54.7 27.3 58.2 -67.7 25.7 127 130 A R T < S- 0 0 24 -3,-1.8 425,-0.4 423,-0.4 -1,-0.3 0.528 122.0 -11.8 81.4 12.8 61.5 -66.9 27.4 128 131 A G < - 0 0 17 -3,-2.3 2,-0.3 -7,-0.2 -5,-0.2 0.122 56.2-178.3 129.9 116.8 61.8 -70.3 29.0 129 132 A V - 0 0 4 -7,-2.7 -24,-0.1 -26,-0.1 -26,-0.1 -0.858 39.5 -91.8-128.4 163.5 59.8 -73.5 29.7 130 133 A R E +e 105 0A 77 -26,-0.9 -24,-2.5 -28,-0.3 2,-0.3 -0.370 45.9 174.6 -73.5 157.1 60.7 -76.7 31.6 131 134 A Y E -e 106 0A 0 -26,-0.2 37,-2.9 35,-0.2 38,-0.7 -0.986 17.8-146.3-159.7 159.4 62.2 -79.7 29.8 132 135 A V E -ef 107 169A 0 -26,-2.6 -24,-3.1 -2,-0.3 2,-0.5 -0.926 14.7-128.6-130.9 156.3 63.6 -83.1 30.3 133 136 A Q E +ef 108 170A 2 36,-2.1 38,-3.0 -2,-0.3 -24,-0.2 -0.910 18.8 177.6-110.9 128.8 66.3 -85.3 28.7 134 137 A V E -e 109 0A 1 -26,-2.9 -24,-1.0 -2,-0.5 2,-0.2 -0.722 22.6-157.4-126.5 74.0 65.7 -88.8 27.6 135 138 A P E +e 110 0A 0 0, 0.0 38,-0.5 0, 0.0 -24,-0.2 -0.386 17.2 178.6 -58.8 118.8 69.1 -89.6 26.0 136 139 A T + 0 0 7 -26,-1.0 2,-0.3 -2,-0.2 -25,-0.2 0.481 60.9 65.7-100.7 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30.4 198 201 A I T 3< S+ 0 0 6 -4,-1.0 -1,-0.3 171,-0.2 -2,-0.2 0.349 125.0 33.3-104.7 4.5 90.6 -85.9 32.2 199 202 A S T <4 S- 0 0 41 -3,-1.8 2,-0.3 1,-0.3 -2,-0.2 0.725 117.8 -1.4-125.9 -47.8 89.6 -87.5 35.5 200 203 A S X - 0 0 27 -4,-2.3 4,-1.8 -5,-0.1 -1,-0.3 -0.967 33.6-149.3-157.1 138.7 91.3 -90.7 36.4 201 204 A E H > S+ 0 0 79 -2,-0.3 4,-0.6 167,-0.3 168,-0.1 0.711 105.0 61.6 -73.3 -19.9 93.9 -93.2 35.1 202 205 A E H >> S+ 0 0 144 2,-0.2 4,-1.9 1,-0.2 3,-1.4 0.984 107.0 38.7 -68.1 -60.8 91.8 -95.7 37.1 203 206 A E H 3> S+ 0 0 42 1,-0.3 4,-1.6 2,-0.2 -2,-0.2 0.900 115.5 56.4 -55.6 -40.5 88.6 -95.3 35.2 204 207 A F H 3X S+ 0 0 0 -4,-1.8 4,-1.0 -8,-0.3 -1,-0.3 0.678 105.9 50.9 -67.0 -18.3 90.8 -95.0 32.0 205 208 A T H X S+ 0 0 1 -4,-1.6 4,-0.7 -5,-0.2 3,-0.6 0.941 107.2 48.9 -67.1 -44.9 88.1 -98.7 29.8 208 211 A E H >< S+ 0 0 62 -4,-1.0 3,-0.8 1,-0.2 4,-0.4 0.906 111.8 50.0 -59.6 -41.5 91.2 -100.3 28.4 209 212 A E H 3< S+ 0 0 140 -4,-2.3 4,-0.4 1,-0.2 -1,-0.2 0.705 110.4 49.7 -70.4 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24.5 303 306 A G T < 5S+ 0 0 66 -3,-1.5 -3,-0.2 2,-0.2 -2,-0.1 0.854 92.4 106.5 73.7 34.6 106.6 -80.7 26.9 304 307 A I S > - 0 0 152 60,-0.4 3,-1.4 -2,-0.4 4,-1.3 -0.528 19.4-127.5 -76.9 140.1 104.6 -87.7 28.2 307 310 A G H 3> S+ 0 0 16 1,-0.3 4,-2.1 -2,-0.2 5,-0.2 0.841 107.6 61.6 -55.2 -39.1 104.8 -89.6 24.9 308 311 A V H 34 S+ 0 0 118 1,-0.2 -1,-0.3 2,-0.2 5,-0.1 0.788 103.8 52.4 -59.0 -27.1 103.8 -92.9 26.5 309 312 A A H X> S+ 0 0 12 -3,-1.4 4,-1.6 2,-0.2 3,-1.4 0.892 106.1 50.8 -75.7 -43.1 100.5 -91.3 27.4 310 313 A V H 3X S+ 0 0 4 -4,-1.3 4,-1.9 1,-0.3 -2,-0.2 0.883 109.5 51.7 -62.2 -37.5 99.8 -90.1 23.9 311 314 A S H 3X S+ 0 0 70 -4,-2.1 4,-0.5 1,-0.2 -1,-0.3 0.379 109.0 51.5 -81.3 4.8 100.5 -93.7 22.6 312 315 A R H <> S+ 0 0 58 -3,-1.4 4,-2.0 2,-0.2 -1,-0.2 0.645 106.2 52.0-107.9 -29.9 98.0 -95.1 25.2 313 316 A I H X S+ 0 0 1 -4,-1.6 4,-2.8 2,-0.2 5,-0.3 0.926 112.3 47.8 -69.8 -46.1 95.3 -92.7 24.2 314 317 A V H X S+ 0 0 41 -4,-1.9 4,-2.8 1,-0.2 5,-0.2 0.957 111.7 48.6 -58.7 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28.0-124.8 5.4 93.1 -91.9 15.5 325 328 A S S > S- 0 0 42 -32,-0.0 3,-2.1 1,-0.0 -1,-0.2 -0.977 75.2-114.4-164.0 152.3 94.2 -89.9 12.4 326 329 A L T 3 S+ 0 0 28 -2,-0.3 14,-0.1 1,-0.3 -1,-0.0 0.588 115.7 63.4 -65.1 -9.3 92.7 -88.0 9.4 327 330 A K T 3 S+ 0 0 167 5,-0.0 -1,-0.3 4,-0.0 5,-0.1 0.443 74.7 137.0 -94.1 -2.9 94.4 -90.7 7.3 328 331 A D <> - 0 0 22 -3,-2.1 4,-1.4 3,-0.1 5,-0.1 -0.060 60.8-123.3 -47.2 144.5 92.3 -93.5 8.8 329 332 A A H >> S+ 0 0 77 2,-0.2 4,-1.9 1,-0.2 3,-0.9 0.970 107.6 39.4 -53.3 -67.4 90.9 -96.1 6.4 330 333 A R H 3> S+ 0 0 105 1,-0.3 4,-2.2 2,-0.2 -1,-0.2 0.896 116.4 51.7 -52.5 -47.2 87.2 -95.8 7.1 331 334 A I H 3> S+ 0 0 5 1,-0.2 4,-1.1 2,-0.2 -1,-0.3 0.751 106.7 56.2 -65.3 -22.6 87.4 -92.1 7.5 332 335 A R H - 0 0 55 -2,-0.5 4,-2.1 1,-0.1 5,-0.2 -0.585 21.9-125.5 -83.5 151.5 93.8 -78.2 4.8 342 345 A V H > S+ 0 0 76 1,-0.2 4,-2.0 -2,-0.2 5,-0.2 0.893 110.8 53.1 -65.8 -38.4 95.9 -76.9 7.7 343 346 A D H > S+ 0 0 106 1,-0.2 4,-2.1 2,-0.2 -1,-0.2 0.872 108.0 51.7 -63.9 -36.7 94.8 -73.3 7.0 344 347 A Q H > S+ 0 0 82 2,-0.2 4,-2.5 1,-0.2 5,-0.2 0.954 107.6 50.2 -64.4 -50.7 91.2 -74.3 7.1 345 348 A L H X S+ 0 0 28 -4,-2.1 4,-0.9 1,-0.2 -1,-0.2 0.898 111.3 50.1 -54.6 -42.7 91.5 -76.0 10.5 346 349 A M H >< S+ 0 0 13 -4,-2.0 3,-0.9 1,-0.2 4,-0.4 0.925 108.7 52.5 -61.9 -44.5 93.2 -73.0 11.9 347 350 A F H >X S+ 0 0 109 -4,-2.1 3,-1.6 1,-0.3 4,-0.6 0.915 107.2 52.0 -56.3 -46.8 90.5 -70.7 10.6 348 351 A N H 3< S+ 0 0 16 -4,-2.5 -1,-0.3 1,-0.3 -2,-0.2 0.681 102.0 60.4 -65.8 -19.1 87.8 -72.8 12.2 349 352 A M T X< S+ 0 0 7 -3,-0.9 3,-0.9 -4,-0.9 -1,-0.3 0.509 89.2 71.2 -86.9 -4.5 89.6 -72.6 15.6 350 353 A A T <4 S+ 0 0 31 -3,-1.6 -1,-0.2 -4,-0.4 -2,-0.2 0.866 96.4 53.4 -73.9 -35.0 89.2 -68.9 15.4 351 354 A L T 3< S+ 0 0 11 -4,-0.6 2,-0.8 -3,-0.2 -1,-0.2 0.200 78.4 130.9 -83.2 15.2 85.5 -69.6 16.1 352 355 A D X - 0 0 10 -3,-0.9 3,-2.6 1,-0.2 9,-0.2 -0.614 55.9-143.4 -79.5 111.1 86.3 -71.7 19.2 353 356 A K T 3 S+ 0 0 17 -2,-0.8 137,-0.2 1,-0.3 -1,-0.2 0.579 95.3 63.5 -45.2 -15.8 84.0 -70.5 22.0 354 357 A K T 3 S+ 0 0 9 7,-0.2 -1,-0.3 2,-0.1 8,-0.1 0.772 75.7 112.9 -84.7 -23.8 86.8 -71.1 24.6 355 358 A N < - 0 0 14 -3,-2.6 2,-1.2 6,-0.2 135,-0.3 -0.195 66.5-135.6 -55.0 130.1 89.2 -68.5 23.1 356 359 A D B > S-K 359 0D 82 3,-1.5 3,-1.7 133,-0.1 -1,-0.1 -0.747 72.9 -50.9 -86.9 96.1 90.0 -65.5 25.3 357 360 A G T 3 S- 0 0 14 -2,-1.2 133,-0.1 1,-0.3 135,-0.1 -0.563 122.4 -20.6 73.0-133.3 89.7 -62.8 22.6 358 361 A P T 3 S+ 0 0 84 0, 0.0 2,-1.1 0, 0.0 -1,-0.3 0.394 114.4 108.6 -88.8 5.2 91.8 -63.7 19.6 359 362 A K B < -K 356 0D 118 -3,-1.7 -3,-1.5 21,-0.0 21,-0.1 -0.676 68.8-138.0 -87.7 92.2 93.8 -66.1 21.9 360 363 A K - 0 0 25 -2,-1.1 19,-1.8 -5,-0.2 2,-0.4 -0.089 19.5-157.1 -46.8 139.5 93.0 -69.7 21.0 361 364 A K E +L 378 0E 31 17,-0.2 2,-0.3 -9,-0.2 17,-0.2 -0.979 13.6 177.3-127.8 139.6 92.6 -71.9 24.0 362 365 A I E -L 377 0E 0 15,-2.5 15,-3.0 -2,-0.4 2,-0.5 -0.960 33.7-109.7-137.7 152.7 93.0 -75.7 24.2 363 366 A V - 0 0 0 -2,-0.3 2,-0.5 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40.6 634 249 B H H X S+ 0 0 37 -4,-1.9 4,-2.5 -5,-0.3 -1,-0.2 0.923 111.0 48.8 -69.2 -41.9 59.7 -49.4 40.9 635 250 B K H X S+ 0 0 12 -4,-2.2 4,-3.2 1,-0.2 5,-0.3 0.950 109.3 54.6 -60.0 -44.3 60.4 -51.8 38.0 636 251 B A H X S+ 0 0 3 -4,-2.6 4,-2.5 1,-0.2 -241,-0.4 0.915 109.2 48.5 -53.0 -47.3 63.9 -52.5 39.6 637 252 B Y H X S+ 0 0 136 -4,-2.1 4,-2.3 2,-0.2 -1,-0.2 0.959 113.8 44.0 -58.5 -55.4 62.2 -53.5 42.8 638 253 B V H X S+ 0 0 2 -4,-2.5 4,-1.7 1,-0.2 -2,-0.2 0.955 114.5 49.3 -56.0 -53.5 59.6 -55.8 41.2 639 254 B V H < S+ 0 0 0 -4,-3.2 3,-0.3 1,-0.2 -1,-0.2 0.899 109.7 53.4 -53.9 -43.3 62.2 -57.4 38.9 640 255 B S H >< S+ 0 0 48 -4,-2.5 3,-0.6 -5,-0.3 -1,-0.2 0.951 110.6 45.4 -58.1 -49.1 64.4 -57.9 41.9 641 256 B A H 3< S+ 0 0 66 -4,-2.3 -1,-0.2 1,-0.3 -2,-0.2 0.697 134.4 12.6 -69.5 -21.1 61.7 -59.7 43.9 642 257 B D T >< + 0 0 28 -4,-1.7 3,-1.4 -3,-0.3 -1,-0.3 -0.447 68.4 169.1-157.6 71.3 60.6 -61.9 41.1 643 258 B E T < S+ 0 0 53 -3,-0.6 -3,-0.1 1,-0.3 -2,-0.1 0.897 80.5 42.6 -53.6 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-98.1 14.8 52.0 -56.4 32.6 654 269 B W T <4 S+ 0 0 2 -3,-1.4 26,-0.2 1,-0.3 25,-0.1 -0.401 77.8 13.2 -61.1 131.0 49.0 -54.4 33.6 655 270 B G T 3> S+ 0 0 0 24,-0.3 4,-1.0 96,-0.3 -1,-0.3 0.341 107.9 93.8 84.5 -6.9 47.2 -53.3 30.4 656 271 B H H <> + 0 0 7 -3,-2.3 4,-2.9 3,-0.2 5,-0.3 0.671 66.8 67.8 -92.2 -20.0 49.3 -55.7 28.4 657 272 B S H X S+ 0 0 2 -4,-0.6 4,-1.0 2,-0.2 -1,-0.1 0.975 121.0 22.1 -62.0 -52.6 46.9 -58.7 28.3 658 273 B I H > S+ 0 0 10 21,-0.2 4,-2.1 2,-0.2 5,-0.2 0.823 123.0 60.6 -81.0 -34.5 44.5 -56.7 26.2 659 274 B G H X S+ 0 0 0 -4,-1.0 4,-2.9 1,-0.2 -3,-0.2 0.932 107.5 43.3 -58.9 -47.5 47.2 -54.4 25.0 660 275 B H H X S+ 0 0 24 -4,-2.9 4,-2.0 2,-0.2 -1,-0.2 0.862 110.3 55.5 -66.5 -37.8 49.3 -57.2 23.4 661 276 B A H < S+ 0 0 2 -4,-1.0 4,-0.3 -5,-0.3 -1,-0.2 0.898 115.2 40.4 -61.8 -38.5 46.2 -58.8 21.9 662 277 B I H >X S+ 0 0 1 -4,-2.1 4,-2.6 1,-0.2 3,-1.2 0.877 111.3 56.4 -75.5 -42.2 45.4 -55.4 20.2 663 278 B E H 3X S+ 0 0 6 -4,-2.9 4,-0.9 1,-0.3 -2,-0.2 0.799 99.7 59.3 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111.0 53.1 -49.4 -39.3 52.6 -47.6 24.4 674 289 B E H 3> S+ 0 0 17 2,-0.2 4,-1.4 1,-0.2 -1,-0.3 0.911 111.9 45.3 -66.4 -39.7 49.5 -46.5 22.5 675 290 B C H S+ 0 0 1 -4,-1.5 5,-3.3 -3,-0.3 6,-1.8 0.842 111.1 46.6 -69.2 -33.1 38.2 -54.9 37.1 688 303 B R H ><5S+ 0 0 112 -4,-1.8 3,-2.0 4,-0.3 -2,-0.2 0.916 108.2 56.9 -73.9 -40.2 35.2 -52.7 37.7 689 304 B H H 3<5S+ 0 0 89 -4,-2.2 -2,-0.2 1,-0.3 -1,-0.2 0.876 107.6 47.9 -54.5 -40.0 33.1 -55.2 35.8 690 305 B L T 3<5S- 0 0 56 -4,-1.7 -1,-0.3 -5,-0.1 -2,-0.2 0.388 119.7-111.8 -83.0 1.3 34.3 -57.9 38.3 691 306 B G T < 5S+ 0 0 65 -3,-2.0 -3,-0.2 2,-0.2 -2,-0.1 0.826 92.6 107.3 71.2 33.1 33.5 -55.5 41.2 692 307 B I S > - 0 0 152 60,-0.4 4,-1.3 -2,-0.4 3,-1.2 -0.497 19.4-127.1 -76.5 140.8 35.8 -48.5 41.6 695 310 B G H 3> S+ 0 0 25 1,-0.3 4,-2.0 2,-0.2 5,-0.2 0.853 107.7 61.5 -57.0 -37.9 34.3 -46.6 38.6 696 311 B V H 3> S+ 0 0 115 1,-0.2 4,-1.4 2,-0.2 -1,-0.3 0.808 103.6 52.4 -59.9 -28.1 35.8 -43.3 39.7 697 312 B A H <> S+ 0 0 11 -3,-1.2 4,-1.7 2,-0.2 -1,-0.2 0.880 104.9 54.1 -74.0 -39.2 39.2 -44.9 39.3 698 313 B V H X S+ 0 0 5 -4,-1.3 4,-2.0 1,-0.2 -2,-0.2 0.902 109.9 47.9 -60.9 -42.6 38.4 -46.0 35.8 699 314 B S H X S+ 0 0 70 -4,-2.0 4,-2.8 1,-0.2 -1,-0.2 0.878 110.0 52.0 -66.3 -39.3 37.5 -42.5 34.8 700 315 B R H X S+ 0 0 57 -4,-1.4 4,-1.7 2,-0.2 -1,-0.2 0.793 107.7 51.7 -69.1 -30.5 40.6 -41.1 36.4 701 316 B I H X S+ 0 0 2 -4,-1.7 4,-2.6 2,-0.2 5,-0.3 0.955 112.6 46.4 -68.3 -50.4 42.8 -43.5 34.5 702 317 B V H X S+ 0 0 35 -4,-2.0 4,-2.5 1,-0.2 -2,-0.2 0.908 112.0 49.9 -57.7 -48.0 41.1 -42.4 31.2 703 318 B K H X S+ 0 0 139 -4,-2.8 4,-2.1 1,-0.2 -1,-0.2 0.874 112.2 48.5 -61.5 -37.8 41.4 -38.8 32.0 704 319 B C H X S+ 0 0 2 -4,-1.7 4,-0.6 2,-0.2 -2,-0.2 0.927 113.3 45.0 -68.6 -46.2 45.1 -39.1 32.8 705 320 B L H ><>S+ 0 0 0 -4,-2.6 5,-2.4 1,-0.2 3,-0.7 0.875 114.1 51.4 -63.4 -37.8 45.9 -41.1 29.6 706 321 B A H ><5S+ 0 0 42 -4,-2.5 3,-2.0 -5,-0.3 -1,-0.2 0.902 102.2 59.8 -65.6 -42.0 43.9 -38.6 27.7 707 322 B A H 3<5S+ 0 0 46 -4,-2.1 -1,-0.2 1,-0.3 -2,-0.2 0.662 104.9 50.8 -61.1 -18.7 45.7 -35.7 29.2 708 323 B Y T <<5S- 0 0 1 -3,-0.7 -1,-0.3 -4,-0.6 -2,-0.2 0.373 122.0-102.5-102.0 4.2 48.9 -37.1 27.8 709 324 B G T < 5S+ 0 0 29 -3,-2.0 -3,-0.2 1,-0.3 -2,-0.1 0.693 77.0 139.3 84.9 18.4 47.7 -37.5 24.2 710 325 B L < - 0 0 1 -5,-2.4 -1,-0.3 -6,-0.2 -2,-0.1 -0.733 55.2-110.1 -98.1 145.3 47.2 -41.2 24.6 711 326 B P - 0 0 2 0, 0.0 3,-0.1 0, 0.0 -1,-0.1 -0.393 22.3-170.1 -72.7 150.5 44.2 -43.1 23.2 712 327 B T + 0 0 36 1,-0.2 2,-0.3 -2,-0.1 -6,-0.1 0.328 66.9 28.4-122.9 6.2 41.6 -44.6 25.5 713 328 B S S > S- 0 0 44 -32,-0.0 3,-1.9 1,-0.0 -1,-0.2 -0.980 74.1-115.3-163.4 154.1 39.5 -46.7 23.1 714 329 B L T 3 S+ 0 0 43 -2,-0.3 14,-0.1 1,-0.3 -1,-0.0 0.589 115.7 63.0 -67.8 -9.5 39.7 -48.6 19.8 715 330 B K T 3 S+ 0 0 142 5,-0.0 -1,-0.3 4,-0.0 5,-0.1 0.399 75.4 138.1 -95.1 1.5 37.3 -46.0 18.4 716 331 B D <> - 0 0 21 -3,-1.9 4,-1.6 3,-0.1 5,-0.1 -0.104 59.9-124.1 -49.4 142.0 39.8 -43.2 18.9 717 332 B A H >> S+ 0 0 76 2,-0.2 4,-1.9 1,-0.2 3,-1.0 0.970 107.6 38.6 -51.3 -69.0 40.0 -40.7 16.1 718 333 B R H 3> S+ 0 0 110 1,-0.3 4,-2.3 2,-0.2 -1,-0.2 0.893 116.7 52.2 -52.4 -46.3 43.8 -40.9 15.4 719 334 B I H 3> S+ 0 0 4 1,-0.2 4,-1.1 2,-0.2 -1,-0.3 0.766 106.9 55.6 -64.3 -25.1 43.8 -44.6 15.9 720 335 B R H - 0 0 35 -2,-0.5 4,-2.4 1,-0.1 5,-0.2 -0.619 23.6-125.0 -84.2 149.8 37.2 -58.6 16.2 730 345 B V H > S+ 0 0 73 -2,-0.2 4,-1.7 1,-0.2 5,-0.1 0.857 115.1 56.2 -62.6 -28.7 36.3 -59.8 19.7 731 346 B D H > S+ 0 0 99 2,-0.2 4,-2.5 1,-0.2 -1,-0.2 0.946 106.7 44.5 -66.6 -52.1 37.3 -63.2 18.3 732 347 B Q H > S+ 0 0 92 1,-0.2 4,-2.6 2,-0.2 5,-0.2 0.930 113.7 51.1 -59.2 -46.6 40.8 -62.2 17.1 733 348 B L H X S+ 0 0 26 -4,-2.4 4,-1.3 1,-0.2 -1,-0.2 0.838 112.8 45.6 -59.0 -37.2 41.5 -60.4 20.4 734 349 B M H X S+ 0 0 16 -4,-1.7 4,-0.7 -5,-0.2 -1,-0.2 0.861 111.4 53.3 -74.1 -36.8 40.4 -63.4 22.4 735 350 B F H < S+ 0 0 113 -4,-2.5 3,-0.4 1,-0.2 4,-0.3 0.873 110.9 46.9 -64.5 -38.4 42.4 -65.7 20.1 736 351 B N H >< S+ 0 0 16 -4,-2.6 3,-1.0 1,-0.2 -1,-0.2 0.798 104.3 59.4 -75.3 -28.4 45.5 -63.6 20.7 737 352 B M H >< S+ 0 0 6 -4,-1.3 3,-1.6 1,-0.3 -1,-0.2 0.692 92.7 67.7 -73.7 -15.6 45.0 -63.5 24.5 738 353 B A T 3< S+ 0 0 28 -4,-0.7 -1,-0.3 -3,-0.4 -2,-0.2 0.773 97.1 56.9 -70.6 -23.3 45.2 -67.2 24.4 739 354 B L T < S+ 0 0 11 -3,-1.0 2,-0.6 -4,-0.3 -1,-0.3 0.241 76.1 129.4 -89.6 9.1 48.8 -66.5 23.5 740 355 B D X - 0 0 14 -3,-1.6 3,-1.9 1,-0.2 9,-0.2 -0.563 56.0-145.1 -72.4 118.4 49.4 -64.4 26.6 741 356 B K T 3 S+ 0 0 20 -2,-0.6 -639,-0.4 1,-0.3 -1,-0.2 0.723 96.5 63.9 -55.6 -21.7 52.6 -65.7 28.1 742 357 B K T 3 S+ 0 0 6 7,-0.2 -1,-0.3 2,-0.1 22,-0.1 0.811 77.3 112.1 -74.4 -26.4 51.2 -65.0 31.6 743 358 B N < - 0 0 11 -3,-1.9 2,-0.8 -6,-0.2 -641,-0.4 -0.070 65.3-140.3 -46.9 143.1 48.4 -67.5 31.1 744 359 B D B > S-T 747 0H 72 3,-2.0 3,-1.6 -643,-0.1 -1,-0.1 -0.888 70.2 -50.4-108.1 95.2 48.7 -70.6 33.3 745 360 B G T 3 S- 0 0 14 -2,-0.8 -643,-0.1 1,-0.2 -641,-0.1 -0.561 121.5 -23.3 71.2-139.8 47.7 -73.3 30.9 746 361 B P T 3 S+ 0 0 84 0, 0.0 2,-0.9 0, 0.0 -1,-0.2 0.378 113.7 109.4 -85.0 3.8 44.4 -72.3 29.2 747 362 B K B < -T 744 0H 112 -3,-1.6 -3,-2.0 21,-0.0 2,-0.3 -0.718 68.2-137.8 -85.6 106.7 43.6 -70.0 32.2 748 363 B K - 0 0 20 -2,-0.9 19,-3.0 19,-0.4 2,-0.5 -0.480 16.7-158.4 -67.4 124.4 43.9 -66.4 31.0 749 364 B K E +U 766 0I 34 -2,-0.3 2,-0.3 17,-0.2 17,-0.2 -0.915 14.9 173.5-108.6 123.6 45.7 -64.2 33.7 750 365 B I E -U 765 0I 2 15,-2.3 15,-2.3 -2,-0.5 2,-0.5 -0.967 36.4-109.6-128.6 145.6 45.1 -60.4 33.7 751 366 B V - 0 0 0 -2,-0.3 2,-0.5 -98,-0.3 -96,-0.3 -0.624 34.2-164.1 -77.5 123.5 46.3 -57.8 36.2 752 367 B L - 0 0 7 -2,-0.5 8,-3.2 11,-0.4 9,-0.5 -0.944 6.3-152.4-113.1 123.2 43.4 -56.4 38.1 753 368 B L E -V 759 0J 3 -2,-0.5 3,-0.1 6,-0.3 -61,-0.1 -0.808 7.8-165.3 -93.8 133.0 43.8 -53.3 40.1 754 369 B S E S- 0 0 41 4,-2.0 -60,-0.4 -2,-0.5 2,-0.3 0.627 79.2 -13.3 -87.9 -13.2 41.5 -52.9 43.2 755 370 B A E > S-V 758 0J 39 3,-1.5 3,-2.3 -62,-0.1 -1,-0.4 -0.931 95.8 -63.3-177.0 157.6 42.4 -49.2 43.3 756 371 B I T 3 S+ 0 0 19 1,-0.3 -167,-0.3 -2,-0.3 -170,-0.2 -0.347 125.8 7.8 -57.0 115.2 44.9 -46.7 41.8 757 372 B G T 3 S+ 0 0 11 -172,-3.3 -1,-0.3 -2,-0.2 -171,-0.2 0.669 116.4 92.1 85.9 19.8 48.3 -47.8 43.1 758 373 B T E < -V 755 0J 70 -3,-2.3 -4,-2.0 -173,-0.6 -3,-1.5 -0.798 63.2-151.0-151.8 100.4 46.9 -51.0 44.6 759 374 B P E -V 753 0J 31 0, 0.0 -6,-0.3 0, 0.0 3,-0.1 -0.367 18.9-131.1 -68.5 152.3 46.8 -54.3 42.8 760 375 B Y S S+ 0 0 122 -8,-3.2 2,-0.3 3,-0.1 -7,-0.1 0.907 91.6 11.9 -69.0 -46.2 44.1 -56.8 43.7 761 376 B E S S- 0 0 77 -9,-0.5 -1,-0.1 2,-0.4 4,-0.1 -0.837 81.1-111.0-126.6 165.1 46.6 -59.7 44.0 762 377 B T S S+ 0 0 96 -2,-0.3 2,-0.3 2,-0.1 -112,-0.2 0.055 105.5 25.5 -83.8 25.7 50.4 -59.8 44.2 763 378 B R S S- 0 0 88 -11,-0.1 -2,-0.4 -113,-0.1 -11,-0.4 -0.935 107.5 -56.8-166.2-177.5 50.1 -61.4 40.7 764 379 B A - 0 0 2 -117,-0.4 2,-0.2 -2,-0.3 -13,-0.2 -0.573 54.0-129.9 -78.0 139.5 47.8 -61.7 37.7 765 380 B S E -U 750 0I 4 -15,-2.3 -15,-2.3 -2,-0.3 2,-0.4 -0.620 18.0-111.8 -91.9 148.1 44.3 -63.0 38.4 766 381 B V E -U 749 0I 85 -2,-0.2 2,-0.4 -17,-0.2 -17,-0.2 -0.678 40.1-173.0 -78.8 128.2 42.6 -65.8 36.6 767 382 B V - 0 0 8 -19,-3.0 -19,-0.4 -2,-0.4 2,-0.2 -0.974 20.1-122.9-127.4 140.4 39.8 -64.4 34.5 768 383 B A >> - 0 0 45 -2,-0.4 4,-1.4 1,-0.1 3,-0.5 -0.495 22.7-119.5 -80.5 149.9 37.1 -66.3 32.5 769 384 B N H >> S+ 0 0 74 1,-0.2 4,-2.6 2,-0.2 3,-0.6 0.903 109.9 57.7 -52.7 -51.3 36.6 -65.7 28.8 770 385 B E H 3> S+ 0 0 142 1,-0.3 4,-1.2 2,-0.2 -1,-0.2 0.844 106.4 49.9 -51.1 -40.1 33.0 -64.5 29.1 771 386 B D H <> S+ 0 0 47 -3,-0.5 4,-0.6 2,-0.2 -1,-0.3 0.834 110.5 50.1 -68.1 -34.8 34.0 -61.7 31.5 772 387 B I H X< S+ 0 0 11 -4,-1.4 3,-1.3 -3,-0.6 -2,-0.2 0.948 106.1 55.9 -67.8 -47.3 36.8 -60.6 29.1 773 388 B R H 3< S+ 0 0 114 -4,-2.6 -1,-0.2 1,-0.3 -2,-0.2 0.788 96.0 66.0 -54.9 -34.9 34.4 -60.5 26.1 774 389 B V H 3< 0 0 84 -4,-1.2 -1,-0.3 1,-0.3 -2,-0.2 0.798 360.0 360.0 -61.2 -31.0 32.1 -58.1 27.9 775 390 B V << 0 0 36 -3,-1.3 -1,-0.3 -4,-0.6 -2,-0.2 0.481 360.0 360.0 -95.4 360.0 34.6 -55.3 27.9 776 !* 0 0 0 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 360.0 0.0 0.0 0.0 777 4 C P 0 0 124 0, 0.0 14,-0.2 0, 0.0 2,-0.1 0.000 360.0 360.0 360.0 76.0 4.0 97.7 87.2 778 5 C T E -W 790 0K 32 12,-1.6 12,-4.1 11,-0.1 2,-0.4 -0.414 360.0-165.8 -76.4 142.5 1.0 95.4 87.8 779 6 C K E -W 789 0K 101 10,-0.2 2,-0.4 -2,-0.1 10,-0.2 -0.963 5.1-165.9-128.4 143.3 1.2 91.7 88.4 780 7 C I E -W 788 0K 13 8,-2.2 8,-1.5 -2,-0.4 2,-0.3 -0.960 15.1-138.0-126.0 144.1 -1.5 89.0 88.4 781 8 C S E + 0 0 61 -2,-0.4 2,-0.3 5,-0.2 5,-0.3 -0.770 21.5 179.6 -99.1 149.5 -1.1 85.4 89.7 782 9 C I E > -W 785 0K 5 3,-2.2 3,-1.7 -2,-0.3 5,-0.2 -0.973 67.7 -2.2-149.8 133.1 -2.6 82.5 87.8 783 10 C L T 3 S- 0 0 56 241,-0.4 -1,-0.1 -2,-0.3 3,-0.1 0.902 134.2 -50.4 50.5 44.8 -2.5 78.8 88.7 784 11 C G T 3 S+ 0 0 76 1,-0.1 2,-0.3 -3,-0.0 -1,-0.3 0.393 120.4 88.4 78.5 1.1 -0.4 79.7 91.8 785 12 C R E < S-W 782 0K 120 -3,-1.7 -3,-2.2 -5,-0.0 2,-2.1 -0.990 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39.9 -99.3-104.3 174.3 4.5 87.9 61.4 818 45 C T H > S+ 0 0 53 32,-1.5 4,-1.8 1,-0.2 5,-0.2 0.825 118.3 55.0 -60.2 -35.3 5.9 90.5 59.0 819 46 C N H > S+ 0 0 92 1,-0.2 4,-0.6 2,-0.2 -1,-0.2 0.938 116.6 34.4 -65.5 -48.6 3.6 93.3 60.1 820 47 C I H > S+ 0 0 34 1,-0.1 4,-2.6 2,-0.1 5,-0.3 0.868 115.8 59.4 -72.1 -39.8 4.5 93.1 63.8 821 48 C G H X S+ 0 0 0 -4,-2.8 4,-2.8 1,-0.2 -2,-0.2 0.924 100.5 49.1 -57.6 -53.6 8.1 92.2 63.2 822 49 C S H < S+ 0 0 84 -4,-1.8 -1,-0.2 1,-0.2 -2,-0.1 0.768 118.9 43.1 -60.4 -25.6 9.3 95.1 61.2 823 50 C I H < S+ 0 0 98 -4,-0.6 -1,-0.2 -3,-0.3 -2,-0.2 0.844 131.9 13.7 -88.0 -36.6 7.8 97.4 63.8 824 51 C Y H X S+ 0 0 25 -4,-2.6 4,-0.9 2,-0.1 -3,-0.2 0.667 105.4 71.4-121.0 -16.4 8.8 95.6 66.9 825 52 C T H >X S+ 0 0 13 -4,-2.8 4,-2.1 -5,-0.3 3,-0.7 0.941 90.8 62.7 -73.0 -43.1 11.6 92.9 66.6 826 53 C P H 3> S+ 0 0 69 0, 0.0 4,-1.5 0, 0.0 3,-0.4 0.915 103.1 48.7 -43.5 -58.9 14.5 95.3 65.8 827 54 C S H 3> S+ 0 0 56 1,-0.2 4,-2.1 -4,-0.2 -2,-0.2 0.850 111.7 52.3 -50.8 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93 C E H X S+ 0 0 39 -4,-2.5 4,-2.4 1,-0.2 -2,-0.2 0.888 111.8 48.0 -60.6 -40.0 8.4 73.0 63.7 867 94 C D H X S+ 0 0 89 -4,-2.8 4,-0.9 1,-0.2 -1,-0.2 0.826 111.9 50.3 -69.2 -33.0 10.4 72.1 60.6 868 95 C W H X S+ 0 0 70 -4,-2.2 4,-0.7 -5,-0.2 -2,-0.2 0.870 111.7 48.3 -72.0 -37.6 12.2 75.4 60.6 869 96 C M H >< S+ 0 0 1 -4,-2.4 7,-1.5 1,-0.2 3,-1.0 0.929 110.7 48.1 -68.5 -47.8 13.1 74.9 64.3 870 97 C L H 3< S+ 0 0 80 -4,-2.4 -1,-0.2 1,-0.2 -2,-0.2 0.785 109.6 58.9 -62.6 -25.2 14.4 71.4 63.9 871 98 C S H 3< S+ 0 0 90 -4,-0.9 -1,-0.2 -5,-0.2 -2,-0.2 0.669 80.8 108.1 -79.1 -20.7 16.3 72.8 60.9 872 99 C Q S << S- 0 0 42 -3,-1.0 -3,-0.0 -4,-0.7 4,-0.0 -0.013 80.5 -92.5 -52.7 162.8 18.3 75.4 62.8 873 100 C N S S+ 0 0 146 1,-0.3 -1,-0.1 2,-0.1 -2,-0.1 -0.957 122.5 19.6-128.9 109.7 22.0 74.8 63.4 874 101 C P S S- 0 0 76 0, 0.0 -1,-0.3 0, 0.0 3,-0.1 0.654 115.9-113.0 -75.4 160.2 22.3 73.5 66.0 875 102 C P - 0 0 76 0, 0.0 2,-0.2 0, 0.0 -5,-0.2 -0.114 35.5 -95.7 -54.7 155.4 18.7 72.2 66.1 876 103 C C 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69.8 886 113 C G E S- a 0 911K 1 24,-1.0 26,-1.0 -2,-0.8 27,-0.4 -0.988 84.4 -65.5 169.4-170.6 1.5 88.5 68.3 887 114 C G S > S- 0 0 14 -2,-0.3 4,-1.9 24,-0.2 5,-0.1 0.300 78.4 -55.5 -83.2-144.7 -2.2 88.3 68.8 888 115 C G H > S+ 0 0 15 2,-0.2 4,-3.1 3,-0.2 5,-0.3 0.827 132.4 54.3 -69.7 -34.3 -4.4 85.3 69.2 889 116 C V H > S+ 0 0 69 2,-0.2 4,-2.5 1,-0.2 5,-0.2 0.986 116.0 36.7 -63.3 -56.6 -3.3 83.7 65.9 890 117 C I H > S+ 0 0 4 2,-0.2 4,-2.3 1,-0.2 5,-0.3 0.830 119.9 51.0 -65.5 -30.5 0.4 83.8 66.7 891 118 C G H X S+ 0 0 2 -4,-1.9 4,-2.6 2,-0.2 5,-0.3 0.964 112.5 43.4 -71.6 -52.0 -0.3 83.0 70.4 892 119 C D H X S+ 0 0 21 -4,-3.1 4,-1.3 2,-0.2 35,-0.3 0.915 120.5 43.4 -58.5 -44.2 -2.5 80.0 69.7 893 120 C L H X S+ 0 0 0 -4,-2.5 4,-2.6 -5,-0.3 3,-0.5 0.981 115.5 45.2 -65.5 -59.3 -0.1 78.7 67.1 894 121 C T H X S+ 0 0 0 -4,-2.3 4,-2.2 1,-0.3 -2,-0.2 0.907 113.3 51.2 -52.8 -47.0 3.2 79.4 68.9 895 122 C G H X S+ 0 0 0 -4,-2.6 4,-1.4 -5,-0.3 -1,-0.3 0.837 110.4 48.9 -62.3 -33.3 1.9 78.0 72.2 896 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