==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=25-JAN-2013 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER LYASE 19-SEP-00 1E8D . COMPND 2 MOLECULE: HYDROXYNITRILE LYASE; . SOURCE 2 ORGANISM_SCIENTIFIC: MANIHOT ESCULENTA; . AUTHOR H.LAUBLE,B.MIEHLICH,S.FOERSTER,H.WAJANT,F.EFFENBERGER . 520 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 19694.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 345 66.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 61 11.7 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 19 3.7 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 . 2 0.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 0 0.0 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 . 32 6.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 64 12.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 142 27.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 9 1.7 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 1 3 2 0 4 4 1 1 0 0 2 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 0 0 5 3 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 PARALLEL BRIDGES PER LADDER . 1 1 0 0 0 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 ANTIPARALLEL BRIDGES PER LADDER . 0 2 0 0 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 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 0 182 0, 0.0 2,-0.4 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 -52.8 42.6 19.2 153.6 2 -3 A I - 0 0 158 2,-0.0 2,-0.3 0, 0.0 0, 0.0 -0.965 360.0-160.4-137.8 131.1 41.0 19.0 150.2 3 -2 A S - 0 0 119 -2,-0.4 2,-0.3 2,-0.0 0, 0.0 -0.826 8.3-160.8-104.8 154.6 43.1 19.6 147.1 4 -1 A K - 0 0 139 -2,-0.3 2,-0.4 2,-0.0 255,-0.0 -0.999 12.7-175.7-142.7 131.2 41.3 20.5 143.8 5 1 A M - 0 0 142 -2,-0.3 2,-0.3 254,-0.1 251,-0.1 -0.993 15.9-170.0-126.7 133.9 42.6 20.3 140.2 6 2 A V - 0 0 26 -2,-0.4 2,-0.4 249,-0.3 253,-0.2 -0.921 18.8-140.7-126.8 146.5 40.3 21.6 137.4 7 3 A T - 0 0 96 -2,-0.3 2,-0.3 251,-0.1 28,-0.1 -0.922 29.0-172.8-107.5 133.5 40.2 21.5 133.6 8 4 A A - 0 0 9 -2,-0.4 28,-2.3 254,-0.1 2,-0.7 -0.761 29.4-117.0-114.6 171.5 39.0 24.7 131.9 9 5 A H E -a 36 0A 36 68,-0.4 70,-2.3 -2,-0.3 2,-0.3 -0.954 35.4-162.8-112.0 109.8 38.2 25.9 128.5 10 6 A F E -ab 37 79A 0 26,-2.6 28,-2.4 -2,-0.7 2,-0.5 -0.703 11.0-159.2 -93.4 141.4 40.6 28.6 127.6 11 7 A V E -ab 38 80A 0 68,-2.4 70,-2.8 -2,-0.3 2,-0.5 -0.993 16.1-152.0-120.5 116.1 40.0 31.1 124.8 12 8 A L E -ab 39 81A 0 26,-2.8 28,-1.5 -2,-0.5 2,-0.5 -0.820 8.9-165.1 -95.8 124.1 43.4 32.7 123.7 13 9 A I E -ab 40 82A 0 68,-3.1 70,-2.1 -2,-0.5 73,-0.2 -0.935 7.2-149.1-118.7 114.2 43.3 36.2 122.2 14 10 A H - 0 0 0 26,-0.6 6,-0.1 -2,-0.5 3,-0.1 -0.311 22.7-107.5 -63.8 164.7 46.3 37.6 120.3 15 11 A T > - 0 0 7 1,-0.2 3,-1.7 4,-0.2 27,-0.1 -0.345 54.1 -60.6 -90.7 175.5 47.2 41.4 120.2 16 12 A I T 3 S+ 0 0 8 1,-0.2 -1,-0.2 -2,-0.1 165,-0.2 -0.046 122.1 19.0 -56.7 147.2 46.8 43.8 117.2 17 13 A C T 3 S+ 0 0 1 163,-0.5 162,-2.8 1,-0.2 -1,-0.2 0.155 114.0 82.9 78.5 -18.6 48.8 42.9 114.1 18 14 A H < - 0 0 0 -3,-1.7 28,-0.7 160,-0.2 2,-0.2 -0.140 62.6-154.4 -98.2-163.3 49.2 39.3 115.2 19 15 A G > - 0 0 0 26,-0.2 3,-1.8 -3,-0.1 4,-0.3 -0.898 45.9 -66.7-157.0-173.3 46.8 36.2 115.0 20 16 A A G > S+ 0 0 3 1,-0.3 3,-2.1 -2,-0.2 416,-0.1 0.804 114.8 81.6 -52.9 -32.6 46.0 32.9 116.6 21 17 A W G > S+ 0 0 0 1,-0.3 3,-1.7 414,-0.2 -1,-0.3 0.673 75.1 70.2 -47.9 -28.2 49.5 31.6 115.5 22 18 A I G < S+ 0 0 0 -3,-1.8 3,-0.5 1,-0.3 4,-0.3 0.812 97.2 54.5 -66.4 -23.2 51.3 33.3 118.5 23 19 A W G <> S+ 0 0 0 -3,-2.1 4,-2.8 -4,-0.3 -1,-0.3 0.270 72.6 113.5 -91.4 14.2 49.6 30.7 120.7 24 20 A H T <4 S+ 0 0 2 -3,-1.7 407,-0.2 1,-0.2 -1,-0.2 0.712 83.8 36.1 -67.8 -18.3 51.0 27.7 118.8 25 21 A K T > S+ 0 0 68 -3,-0.5 4,-1.8 218,-0.2 -1,-0.2 0.781 118.2 48.6 -98.1 -37.7 53.2 26.5 121.6 26 22 A L H > S+ 0 0 0 -4,-0.3 4,-2.6 217,-0.3 5,-0.3 0.939 103.9 60.9 -69.6 -39.6 50.9 27.4 124.6 27 23 A K H X S+ 0 0 22 -4,-2.8 4,-2.3 1,-0.2 5,-0.2 0.937 109.4 41.3 -57.3 -50.1 47.8 25.7 123.0 28 24 A P H > S+ 0 0 10 0, 0.0 4,-2.2 0, 0.0 -1,-0.2 0.923 112.1 55.7 -62.2 -38.2 49.4 22.3 122.9 29 25 A A H X S+ 0 0 3 -4,-1.8 4,-0.9 1,-0.2 -2,-0.2 0.913 111.4 45.4 -57.6 -40.1 51.0 22.8 126.4 30 26 A L H ><>S+ 0 0 0 -4,-2.6 5,-2.0 1,-0.2 3,-0.6 0.899 110.4 52.2 -72.4 -39.2 47.5 23.4 127.8 31 27 A E H ><5S+ 0 0 75 -4,-2.3 3,-1.3 -5,-0.3 -1,-0.2 0.821 101.0 61.5 -70.1 -25.3 46.0 20.5 125.9 32 28 A R H 3<5S+ 0 0 154 -4,-2.2 -1,-0.2 1,-0.3 -2,-0.2 0.861 102.6 52.6 -64.6 -31.4 48.6 18.2 127.4 33 29 A A T <<5S- 0 0 50 -4,-0.9 -1,-0.3 -3,-0.6 -2,-0.2 0.448 126.8-104.5 -80.2 -5.4 47.2 19.2 130.8 34 30 A G T < 5S+ 0 0 47 -3,-1.3 -3,-0.2 1,-0.3 -2,-0.1 0.462 73.3 139.8 98.8 1.0 43.7 18.2 129.5 35 31 A H < - 0 0 9 -5,-2.0 2,-0.5 -28,-0.1 -1,-0.3 -0.343 54.4-122.0 -79.0 163.2 42.3 21.7 129.0 36 32 A K E -a 9 0A 124 -28,-2.3 -26,-2.6 -2,-0.0 2,-0.4 -0.882 34.2-165.6 -95.2 134.5 40.1 22.6 126.0 37 33 A V E -a 10 0A 3 -2,-0.5 2,-0.4 -28,-0.2 -26,-0.2 -0.983 16.2-174.7-130.8 128.8 41.8 25.5 124.1 38 34 A T E -a 11 0A 19 -28,-2.4 -26,-2.8 -2,-0.4 2,-0.5 -0.998 5.9-169.8-117.9 126.3 40.3 27.8 121.5 39 35 A A E -a 12 0A 24 -2,-0.4 2,-0.3 -28,-0.2 -26,-0.2 -0.977 14.5-163.2-119.3 112.5 42.7 30.3 119.8 40 36 A L E -a 13 0A 29 -28,-1.5 -26,-0.6 -2,-0.5 2,-0.4 -0.725 19.3-135.8-102.0 146.8 40.9 32.9 117.7 41 37 A D - 0 0 29 -2,-0.3 3,-0.1 -22,-0.1 -22,-0.1 -0.816 27.4-141.1 -87.7 136.2 41.9 35.3 114.9 42 38 A M > - 0 0 0 -2,-0.4 3,-1.5 1,-0.2 6,-0.2 -0.365 47.9 -57.1 -90.8 175.8 40.4 38.7 115.5 43 39 A A T 3 S+ 0 0 0 18,-2.7 -1,-0.2 1,-0.3 3,-0.1 -0.236 125.4 1.3 -59.9 141.9 39.1 40.7 112.5 44 40 A A T 3 S+ 0 0 1 1,-0.2 2,-0.3 -3,-0.1 8,-0.3 0.711 109.9 111.6 55.7 28.5 41.9 41.3 109.9 45 41 A S S X S- 0 0 2 -3,-1.5 3,-2.3 16,-0.1 -26,-0.2 -0.912 76.2 -10.3-128.4 155.7 44.4 39.4 111.9 46 42 A G T 3 S- 0 0 1 -28,-0.7 390,-0.1 -2,-0.3 -27,-0.1 -0.386 132.9 -25.2 54.4-122.5 46.2 36.0 111.3 47 43 A I T 3 S+ 0 0 47 388,-0.4 -1,-0.3 -2,-0.1 -28,-0.1 0.091 95.2 138.0-107.5 19.8 44.3 34.5 108.2 48 44 A D < - 0 0 21 -3,-2.3 -6,-0.1 -6,-0.2 -5,-0.0 -0.508 56.0-134.2 -64.8 135.7 41.1 36.3 108.8 49 45 A P S S+ 0 0 76 0, 0.0 -1,-0.1 0, 0.0 2,-0.1 0.624 74.0 94.2 -71.3 -17.8 40.0 37.4 105.4 50 46 A R - 0 0 68 -5,-0.1 2,-0.3 2,-0.0 -2,-0.0 -0.411 69.6-132.8 -75.0 157.6 39.0 41.0 106.3 51 47 A Q > - 0 0 54 -2,-0.1 3,-1.9 1,-0.1 4,-0.2 -0.851 24.7-113.3-104.9 152.3 41.5 43.9 105.8 52 48 A I G > S+ 0 0 5 -2,-0.3 3,-2.0 1,-0.3 -1,-0.1 0.795 111.9 65.5 -58.9 -27.4 42.0 46.4 108.6 53 49 A E G 3 S+ 0 0 79 1,-0.3 -1,-0.3 86,-0.1 88,-0.0 0.694 95.5 57.0 -70.6 -18.7 40.4 49.2 106.5 54 50 A Q G < S+ 0 0 119 -3,-1.9 2,-0.5 88,-0.1 -1,-0.3 0.407 92.6 87.8 -85.1 1.6 37.1 47.5 106.5 55 51 A I < - 0 0 4 -3,-2.0 3,-0.1 -4,-0.2 0, 0.0 -0.895 53.8-174.6-112.7 130.0 37.1 47.5 110.4 56 52 A N + 0 0 21 -2,-0.5 2,-0.3 1,-0.2 88,-0.1 0.533 59.5 4.4-108.6 -6.2 35.7 50.6 112.2 57 53 A S S > S- 0 0 22 1,-0.1 4,-2.3 130,-0.0 -1,-0.2 -0.964 74.4 -99.0-163.5 171.5 36.3 50.1 115.9 58 54 A F H > S+ 0 0 2 -2,-0.3 4,-1.7 126,-0.2 5,-0.1 0.772 122.0 58.9 -70.8 -25.9 37.9 47.8 118.4 59 55 A D H 4 S+ 0 0 28 2,-0.2 4,-0.2 1,-0.2 -1,-0.2 0.938 107.1 44.9 -66.4 -45.5 34.5 46.3 119.0 60 56 A E H >4 S+ 0 0 83 1,-0.2 3,-2.1 2,-0.2 -2,-0.2 0.926 110.9 54.4 -60.6 -46.2 34.2 45.3 115.3 61 57 A Y H 3< S+ 0 0 5 -4,-2.3 -18,-2.7 1,-0.3 -1,-0.2 0.870 105.3 55.4 -51.5 -37.8 37.7 44.0 115.5 62 58 A S T >X S+ 0 0 0 -4,-1.7 4,-1.7 1,-0.2 3,-1.2 0.480 75.9 108.6 -77.3 -2.7 36.5 41.9 118.5 63 59 A E H <> S+ 0 0 62 -3,-2.1 4,-2.9 1,-0.3 5,-0.3 0.823 70.3 57.2 -48.6 -46.8 33.7 40.3 116.4 64 60 A P H 3> S+ 0 0 19 0, 0.0 4,-1.7 0, 0.0 -1,-0.3 0.873 111.1 44.5 -56.1 -34.3 35.3 36.8 116.2 65 61 A L H <> S+ 0 0 0 -3,-1.2 4,-2.6 2,-0.2 -2,-0.2 0.936 113.9 48.3 -73.4 -41.5 35.4 36.6 120.1 66 62 A L H X S+ 0 0 19 -4,-1.7 4,-3.1 2,-0.2 5,-0.2 0.950 112.5 49.3 -68.9 -41.8 31.9 37.9 120.6 67 63 A T H X S+ 0 0 52 -4,-2.9 4,-2.0 1,-0.2 -1,-0.2 0.897 111.0 49.9 -58.1 -45.0 30.5 35.5 117.9 68 64 A F H X S+ 0 0 43 -4,-1.7 4,-0.7 -5,-0.3 -1,-0.2 0.933 112.8 45.9 -60.1 -47.6 32.3 32.6 119.6 69 65 A L H >< S+ 0 0 0 -4,-2.6 3,-1.5 1,-0.2 -2,-0.2 0.942 108.2 57.1 -69.2 -39.8 30.9 33.6 123.0 70 66 A E H 3< S+ 0 0 117 -4,-3.1 -1,-0.2 1,-0.3 -2,-0.2 0.906 109.7 47.2 -49.5 -41.5 27.4 34.0 121.5 71 67 A K H 3< S+ 0 0 150 -4,-2.0 -1,-0.3 -5,-0.2 -2,-0.2 0.587 83.2 116.9 -81.9 -10.0 27.7 30.4 120.3 72 68 A L S << S- 0 0 16 -3,-1.5 3,-0.1 -4,-0.7 4,-0.1 -0.331 71.9-103.3 -60.3 136.8 28.9 28.9 123.7 73 69 A P > - 0 0 73 0, 0.0 3,-2.8 0, 0.0 -1,-0.1 -0.173 49.9 -73.8 -55.4 150.3 26.5 26.3 125.2 74 70 A Q T 3 S+ 0 0 171 1,-0.3 3,-0.1 3,-0.0 26,-0.0 -0.161 118.1 5.7 -41.9 121.6 24.3 27.0 128.0 75 71 A G T 3 S+ 0 0 76 1,-0.3 2,-0.4 -3,-0.1 -1,-0.3 0.608 91.6 132.5 75.6 10.1 26.2 27.2 131.2 76 72 A E < - 0 0 91 -3,-2.8 2,-0.3 -4,-0.1 -1,-0.3 -0.824 35.4-169.3 -91.0 140.5 29.7 26.8 129.6 77 73 A K - 0 0 107 -2,-0.4 -68,-0.4 185,-0.1 2,-0.3 -0.930 1.7-159.9-125.1 148.6 32.1 29.4 130.9 78 74 A V E - c 0 101A 0 22,-2.7 24,-2.6 -2,-0.3 25,-0.9 -0.839 20.1-127.2-124.9 160.5 35.6 30.1 129.5 79 75 A I E -bc 10 103A 1 -70,-2.3 -68,-2.4 -2,-0.3 2,-0.6 -0.970 27.4-149.4-105.7 113.6 38.8 31.7 130.8 80 76 A I E -bc 11 104A 0 23,-1.7 25,-2.8 -2,-0.6 2,-0.5 -0.797 11.7-167.7 -88.0 121.6 39.8 34.4 128.2 81 77 A V E -bc 12 105A 0 -70,-2.8 -68,-3.1 -2,-0.6 2,-0.4 -0.968 11.1-179.8-108.6 124.8 43.5 34.9 128.1 82 78 A G E -bc 13 106A 0 23,-2.8 25,-3.0 -2,-0.5 2,-0.3 -0.974 16.0-146.2-132.7 140.6 44.6 38.0 126.2 83 79 A E E > - c 0 107A 0 -70,-2.1 3,-2.7 -2,-0.4 25,-0.2 -0.798 59.0 -36.1-103.7 147.8 48.0 39.4 125.4 84 80 A A E > S+ c 0 109A 2 23,-1.3 26,-2.5 24,-0.5 3,-1.5 -0.134 135.2 11.1 44.5-116.9 49.0 43.1 125.1 85 81 A C T >> S+ 0 0 4 1,-0.3 3,-1.6 24,-0.2 4,-0.5 0.665 110.5 86.3 -67.8 -6.0 46.2 45.1 123.5 86 82 A A H <> + 0 0 0 -3,-2.7 4,-2.2 1,-0.3 3,-0.4 0.688 64.8 81.4 -71.0 -11.8 43.8 42.1 123.9 87 83 A G H <> S+ 0 0 0 -3,-1.5 4,-2.3 1,-0.2 -1,-0.3 0.877 91.0 55.1 -54.9 -31.7 42.9 43.3 127.4 88 84 A L H <> S+ 0 0 0 -3,-1.6 4,-2.5 2,-0.2 -1,-0.2 0.863 104.1 52.2 -66.8 -34.8 40.5 45.6 125.5 89 85 A N H X S+ 0 0 0 -4,-0.5 4,-2.2 -3,-0.4 -2,-0.2 0.917 108.9 51.1 -66.3 -40.4 39.0 42.6 123.7 90 86 A I H X S+ 0 0 0 -4,-2.2 4,-2.3 2,-0.2 -2,-0.2 0.950 111.0 47.9 -63.6 -44.2 38.4 41.0 127.2 91 87 A A H X S+ 0 0 0 -4,-2.3 4,-1.4 2,-0.2 108,-0.2 0.920 112.1 48.6 -64.1 -40.8 36.7 44.2 128.4 92 88 A I H < S+ 0 0 0 -4,-2.5 -1,-0.2 1,-0.2 -2,-0.2 0.933 114.2 47.1 -61.3 -43.1 34.4 44.4 125.3 93 89 A A H >X S+ 0 0 0 -4,-2.2 4,-2.8 1,-0.2 3,-1.6 0.891 107.3 54.3 -66.9 -44.9 33.5 40.8 125.7 94 90 A A H 3X S+ 0 0 0 -4,-2.3 4,-0.6 1,-0.3 -1,-0.2 0.773 102.2 58.3 -67.1 -27.9 32.7 40.8 129.4 95 91 A D H 3< S+ 0 0 40 -4,-1.4 -1,-0.3 103,-0.3 -2,-0.2 0.514 119.4 31.6 -78.5 -1.7 30.3 43.7 129.0 96 92 A R H <4 S+ 0 0 123 -3,-1.6 -2,-0.2 -4,-0.1 -1,-0.2 0.615 134.3 22.9-116.9 -27.7 28.4 41.4 126.6 97 93 A Y H >X + 0 0 31 -4,-2.8 3,-2.4 1,-0.1 4,-0.6 -0.156 67.5 145.1-135.1 44.4 28.9 37.8 127.9 98 94 A V G >< S+ 0 0 41 -4,-0.6 3,-1.7 1,-0.3 -1,-0.1 0.914 74.6 55.7 -53.3 -39.4 29.8 38.3 131.6 99 95 A D G 34 S+ 0 0 105 1,-0.3 -1,-0.3 -3,-0.1 -5,-0.1 0.595 104.8 54.7 -69.3 -10.5 27.9 35.1 132.5 100 96 A K G <4 S+ 0 0 22 -3,-2.4 -22,-2.7 -23,-0.1 2,-0.6 0.479 91.8 86.0-101.0 -7.8 30.1 33.1 130.0 101 97 A I E << -c 78 0A 5 -3,-1.7 102,-0.2 -4,-0.6 -22,-0.2 -0.845 46.5-179.0-104.5 110.7 33.4 34.2 131.5 102 98 A A E S- 0 0 9 -24,-2.6 101,-0.4 -2,-0.6 2,-0.3 0.896 77.2 -24.4 -69.7 -37.9 35.0 32.3 134.5 103 99 A A E -c 79 0A 0 -25,-0.9 -23,-1.7 99,-0.1 2,-0.4 -0.976 56.2-126.9-163.4 159.8 38.0 34.8 134.6 104 100 A G E -cd 80 204A 0 99,-2.8 101,-2.3 -2,-0.3 2,-0.5 -0.971 22.2-159.1-110.8 131.2 39.9 37.2 132.4 105 101 A V E -cd 81 205A 0 -25,-2.8 -23,-2.8 -2,-0.4 2,-0.6 -0.973 2.1-157.2-114.2 124.2 43.8 36.7 132.3 106 102 A F E -cd 82 206A 0 99,-3.1 101,-3.1 -2,-0.5 2,-0.7 -0.871 6.3-165.8-104.8 119.6 45.9 39.7 131.1 107 103 A H E S-cd 83 207A 0 -25,-3.0 -23,-1.3 -2,-0.6 101,-0.2 -0.866 77.1 -34.5-117.1 96.0 49.2 38.5 129.8 108 104 A N E S+ 0 0 0 99,-2.7 -24,-0.5 -2,-0.7 2,-0.3 0.943 115.6 150.2 50.3 48.1 51.6 41.5 129.5 109 105 A S E -c 84 0A 0 98,-0.3 -1,-0.2 -26,-0.2 -24,-0.2 -0.773 61.6 -96.9-116.9 155.0 48.4 43.1 128.6 110 106 A L - 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0 0 13 4,-2.1 3,-2.5 -2,-0.5 -86,-0.1 -0.205 35.5 -78.2 -83.5-178.1 36.0 54.8 108.9 143 139 A I T 3 S+ 0 0 129 1,-0.3 -1,-0.0 2,-0.1 -87,-0.0 0.606 130.1 37.2 -59.8 -18.8 32.2 54.5 108.5 144 140 A T T 3 S- 0 0 107 -88,-0.1 -1,-0.3 2,-0.1 -2,-0.0 0.176 125.0 -92.6-117.1 13.5 31.4 57.6 110.5 145 141 A G S < S+ 0 0 47 -3,-2.5 2,-0.2 1,-0.2 -2,-0.1 0.501 75.1 143.3 92.4 -0.2 34.3 59.8 109.3 146 142 A E - 0 0 54 -90,-0.1 -4,-2.1 1,-0.0 2,-0.5 -0.512 51.0-125.7 -66.1 140.6 37.0 59.1 112.1 147 143 A T E -F 141 0B 79 -6,-0.2 2,-0.5 -2,-0.2 -6,-0.2 -0.810 27.3-156.1 -94.6 130.9 40.6 58.9 110.8 148 144 A I E -F 140 0B 0 -8,-3.0 -8,-1.7 -2,-0.5 2,-0.5 -0.924 5.8-143.0-107.7 129.9 42.0 55.7 112.0 149 145 A T E -F 139 0B 68 -2,-0.5 35,-0.6 -10,-0.2 34,-0.5 -0.816 21.3-176.7 -94.8 127.8 45.7 55.2 112.3 150 146 A T E -F 138 0B 1 -12,-2.7 -12,-2.1 -2,-0.5 2,-0.3 -0.790 5.6-158.5-113.9 169.2 47.0 51.7 111.3 151 147 A M E -FG 137 181B 5 30,-2.1 30,-1.7 -2,-0.3 2,-0.5 -0.990 22.5-146.7-148.9 150.1 50.6 50.4 111.6 152 148 A K E -F 136 0B 90 -16,-1.9 -16,-2.2 -2,-0.3 28,-0.1 -0.995 41.6-124.0-110.0 111.9 53.0 47.7 110.2 153 149 A L - 0 0 12 -2,-0.5 2,-0.1 26,-0.3 -18,-0.1 -0.332 27.7-115.6 -58.7 131.1 55.2 46.9 113.2 154 150 A G > - 0 0 3 -22,-0.5 4,-2.5 1,-0.1 -19,-0.2 -0.415 14.5-124.6 -70.1 152.6 58.8 47.4 112.3 155 151 A F H > S+ 0 0 99 -21,-0.2 4,-2.5 2,-0.2 -1,-0.1 0.781 110.5 51.6 -72.9 -26.9 61.1 44.4 112.2 156 152 A V H >>S+ 0 0 59 2,-0.2 4,-3.2 3,-0.2 5,-0.5 0.952 110.5 49.4 -69.3 -48.6 63.7 45.9 114.7 157 153 A L H >>S+ 0 0 0 1,-0.2 4,-2.3 -25,-0.2 5,-1.9 0.914 113.4 48.2 -54.1 -45.3 60.8 46.7 117.1 158 154 A L H <>S+ 0 0 0 -4,-2.5 5,-3.4 3,-0.2 4,-0.4 0.965 116.0 43.1 -57.4 -53.1 59.7 43.1 116.6 159 155 A R H <5S+ 0 0 57 -4,-2.5 7,-0.2 1,-0.2 -2,-0.2 0.893 128.1 24.3 -60.4 -49.0 63.3 41.7 117.2 160 156 A E H <5S+ 0 0 105 -4,-3.2 -3,-0.2 -5,-0.1 -1,-0.2 0.757 131.3 28.6 -94.6 -31.6 64.3 43.8 120.1 161 157 A N T < - 0 0 89 -2,-0.1 4,-3.0 1,-0.1 5,-0.2 -0.271 30.5-112.4 -56.2 156.0 64.1 31.9 118.9 168 164 A D H > S+ 0 0 71 1,-0.2 4,-2.6 2,-0.2 5,-0.2 0.827 120.3 53.6 -61.8 -38.4 65.1 32.7 115.4 169 165 A G H > S+ 0 0 10 2,-0.2 4,-2.0 1,-0.2 -1,-0.2 0.843 111.5 46.4 -64.6 -31.8 62.4 30.4 114.1 170 166 A E H > S+ 0 0 16 -3,-0.2 4,-2.2 2,-0.2 -2,-0.2 0.932 114.1 45.4 -77.2 -45.6 59.9 32.2 116.2 171 167 A Y H X S+ 0 0 31 -4,-3.0 4,-1.8 2,-0.2 -2,-0.2 0.910 113.7 49.8 -65.7 -42.0 61.0 35.6 115.2 172 168 A E H X S+ 0 0 13 -4,-2.6 4,-2.2 -5,-0.2 -2,-0.2 0.948 108.2 54.7 -60.6 -43.3 61.2 34.6 111.5 173 169 A L H X S+ 0 0 0 -4,-2.0 4,-1.4 1,-0.2 5,-0.2 0.948 106.3 52.0 -50.7 -51.3 57.6 33.1 111.8 174 170 A A H >X S+ 0 0 0 -4,-2.2 4,-1.9 1,-0.3 3,-0.5 0.897 108.5 49.5 -57.0 -40.9 56.3 36.5 113.1 175 171 A K H 3< S+ 0 0 45 -4,-1.8 -1,-0.3 1,-0.2 -2,-0.2 0.876 109.0 55.3 -68.3 -34.7 57.8 38.4 110.2 176 172 A M H 3< S+ 0 0 15 -4,-2.2 130,-0.4 -3,-0.2 -1,-0.2 0.757 123.2 21.2 -67.8 -27.2 56.2 35.8 107.9 177 173 A V H << S+ 0 0 2 -4,-1.4 -131,-0.3 -3,-0.5 -2,-0.2 0.467 84.8 123.4-126.3 2.9 52.6 36.4 109.2 178 174 A M < - 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0 0 1 -3,-1.0 -50,-0.1 27,-0.3 27,-0.1 -0.546 49.1-159.5 -70.5 127.3 57.0 10.8 103.4 472 209 B K S S+ 0 0 80 -52,-0.7 3,-0.2 -2,-0.4 -51,-0.1 0.349 83.1 30.0 -97.1 3.9 53.5 9.8 104.0 473 210 B I S S+ 0 0 4 1,-0.2 2,-1.2 -53,-0.2 -1,-0.1 0.583 117.5 49.4-126.5 -38.8 51.7 11.6 101.2 474 211 B F S S- 0 0 5 -54,-0.2 -1,-0.2 -53,-0.1 -3,-0.2 -0.836 98.0-152.5 -96.0 87.8 54.3 11.9 98.3 475 212 B L > - 0 0 52 -2,-1.2 4,-2.6 -3,-0.2 3,-0.5 -0.229 19.7-104.3 -72.3 158.6 55.0 8.2 98.7 476 213 B P H > S+ 0 0 33 0, 0.0 4,-3.0 0, 0.0 5,-0.2 0.857 117.3 49.4 -52.3 -43.2 58.2 6.4 97.8 477 214 B D H > S+ 0 0 124 2,-0.2 4,-2.2 1,-0.2 5,-0.1 0.870 112.1 47.9 -72.0 -31.8 57.0 4.8 94.7 478 215 B F H > S+ 0 0 8 -3,-0.5 4,-2.6 2,-0.2 -1,-0.2 0.919 114.3 46.9 -68.6 -42.8 55.6 8.0 93.3 479 216 B Q H X S+ 0 0 0 -4,-2.6 4,-2.1 1,-0.2 5,-0.2 0.947 113.7 48.1 -67.8 -38.6 58.9 9.8 94.1 480 217 B R H X S+ 0 0 110 -4,-3.0 4,-2.0 -5,-0.3 -1,-0.2 0.910 109.8 52.7 -64.0 -39.7 60.9 7.0 92.6 481 218 B W H X S+ 0 0 65 -4,-2.2 4,-2.6 1,-0.2 -2,-0.2 0.927 108.7 51.4 -60.9 -44.8 58.6 7.1 89.5 482 219 B Q H X S+ 0 0 0 -4,-2.6 4,-1.6 1,-0.2 -1,-0.2 0.876 109.7 47.3 -62.2 -42.8 59.3 10.9 89.2 483 220 B I H < S+ 0 0 35 -4,-2.1 -1,-0.2 2,-0.2 -2,-0.2 0.891 115.9 45.7 -64.4 -39.3 63.1 10.5 89.4 484 221 B A H < S+ 0 0 69 -4,-2.0 3,-0.4 -5,-0.2 -2,-0.2 0.869 112.3 52.5 -70.2 -36.8 62.9 7.7 86.8 485 222 B N H < S+ 0 0 42 -4,-2.6 2,-0.2 1,-0.3 -1,-0.2 0.782 130.5 9.9 -70.8 -30.4 60.5 9.7 84.6 486 223 B Y S < S- 0 0 43 -4,-1.6 -1,-0.3 -5,-0.2 -2,-0.1 -0.635 84.7-139.5-155.1 84.3 62.7 12.8 84.4 487 224 B K - 0 0 168 -3,-0.4 -3,-0.1 -2,-0.2 -4,-0.1 -0.270 16.1-142.8 -54.4 121.1 66.2 12.3 85.9 488 225 B P - 0 0 18 0, 0.0 -24,-0.2 0, 0.0 3,-0.1 -0.323 23.3-113.9 -70.2 167.7 67.4 15.3 88.0 489 226 B D S S+ 0 0 80 -26,-1.6 2,-0.3 1,-0.3 -25,-0.2 0.884 101.8 11.6 -67.8 -39.5 71.0 16.4 87.9 490 227 B K E -l 464 0C 67 -27,-1.5 -25,-2.6 2,-0.0 2,-0.4 -0.996 63.5-162.6-142.3 139.0 71.3 15.4 91.6 491 228 B V E -l 465 0C 64 -2,-0.3 2,-0.5 -27,-0.2 -25,-0.2 -0.993 9.2-171.1-119.3 125.4 69.0 13.4 93.9 492 229 B Y E -l 466 0C 44 -27,-3.1 -25,-1.7 -2,-0.4 2,-0.5 -0.984 5.1-161.4-113.7 130.3 69.6 13.7 97.6 493 230 B Q E -l 467 0C 82 -2,-0.5 2,-0.4 -27,-0.2 -25,-0.2 -0.962 4.5-154.5-113.4 129.7 67.8 11.4 100.0 494 231 B V - 0 0 11 -27,-2.8 -25,-0.4 -2,-0.5 2,-0.3 -0.801 20.9-122.8 -98.3 136.3 67.5 12.3 103.7 495 232 B Q S S- 0 0 147 -2,-0.4 2,-0.1 -27,-0.1 -27,-0.0 -0.634 71.4 -15.4 -80.0 137.7 67.0 9.5 106.1 496 233 B G S S+ 0 0 27 -2,-0.3 -26,-0.5 1,-0.1 -2,-0.1 -0.350 82.8 103.3 81.8-151.4 63.9 9.8 108.3 497 234 B G - 0 0 14 7,-0.2 2,-0.3 -2,-0.1 -1,-0.1 -0.256 64.0-107.8 68.9-150.0 61.8 12.9 108.8 498 235 B D - 0 0 0 -27,-0.1 3,-0.3 -75,-0.1 -27,-0.3 -0.832 51.7 -54.7-158.2-167.3 58.4 13.2 107.0 499 236 B H S S+ 0 0 4 -79,-0.4 2,-1.6 -29,-0.3 3,-0.2 0.862 126.4 62.2 -52.4 -40.3 56.9 15.2 104.2 500 237 B K >> + 0 0 0 -79,-1.0 3,-2.7 1,-0.2 4,-2.4 -0.384 60.7 161.3 -89.8 64.5 58.0 18.5 105.9 501 238 B L H 3> + 0 0 0 -2,-1.6 4,-2.5 -3,-0.3 8,-0.3 0.821 68.8 66.9 -52.4 -28.9 61.7 18.0 105.8 502 239 B Q H 34 S+ 0 0 0 -3,-0.2 -1,-0.3 1,-0.2 -218,-0.1 0.627 112.9 32.6 -73.6 -8.6 62.3 21.7 106.3 503 240 B L H <4 S+ 0 0 8 -3,-2.7 3,-0.4 -5,-0.1 -2,-0.2 0.683 128.0 36.2-108.0 -40.4 60.8 21.3 109.8 504 241 B T H < S+ 0 0 34 -4,-2.4 -3,-0.2 1,-0.2 -7,-0.2 0.740 134.6 21.5 -89.7 -18.7 61.9 17.7 110.7 505 242 B K S X S+ 0 0 56 -4,-2.5 4,-2.2 -5,-0.3 3,-0.4 -0.242 77.0 149.6-138.0 44.5 65.4 17.7 109.1 506 243 B T H > S+ 0 0 12 -3,-0.4 4,-2.4 1,-0.3 5,-0.2 0.868 73.7 45.4 -53.5 -45.2 66.1 21.4 108.8 507 244 B E H > S+ 0 0 105 1,-0.2 4,-1.9 2,-0.2 -1,-0.3 0.871 110.1 55.6 -74.5 -26.2 69.8 21.3 109.2 508 245 B E H > S+ 0 0 84 -3,-0.4 4,-2.1 1,-0.2 -1,-0.2 0.934 111.0 45.2 -67.2 -41.2 70.0 18.4 106.7 509 246 B V H X S+ 0 0 0 -4,-2.2 4,-2.7 -8,-0.3 -2,-0.2 0.897 110.4 53.0 -70.0 -39.5 68.2 20.5 104.1 510 247 B A H X S+ 0 0 14 -4,-2.4 4,-1.2 -5,-0.2 -1,-0.2 0.873 110.7 49.7 -65.2 -29.7 70.3 23.6 104.9 511 248 B H H X S+ 0 0 114 -4,-1.9 4,-1.6 2,-0.2 -2,-0.2 0.926 110.3 46.6 -76.2 -45.0 73.4 21.4 104.2 512 249 B I H X S+ 0 0 11 -4,-2.1 4,-2.2 1,-0.2 3,-0.4 0.942 111.8 53.6 -57.9 -46.8 72.2 20.0 100.9 513 250 B L H X S+ 0 0 0 -4,-2.7 4,-2.3 1,-0.2 -1,-0.2 0.828 103.4 56.5 -59.8 -28.0 71.3 23.6 99.9 514 251 B Q H X S+ 0 0 22 -4,-1.2 4,-2.3 2,-0.2 -249,-0.3 0.919 106.9 49.6 -67.1 -39.8 74.8 24.6 100.8 515 252 B E H X S+ 0 0 81 -4,-1.6 4,-2.5 -3,-0.4 -2,-0.2 0.849 109.1 51.4 -64.2 -39.4 76.0 21.9 98.2 516 253 B V H X S+ 0 0 0 -4,-2.2 4,-3.2 2,-0.2 5,-0.4 0.935 110.0 49.8 -64.9 -43.9 73.6 23.3 95.6 517 254 B A H X S+ 0 0 0 -4,-2.3 4,-2.5 2,-0.2 -2,-0.2 0.948 112.5 47.9 -56.8 -49.5 75.0 26.9 96.2 518 255 B D H < S+ 0 0 73 -4,-2.3 -2,-0.2 1,-0.2 -1,-0.2 0.937 118.0 41.7 -57.3 -46.4 78.6 25.5 95.8 519 256 B A H < S+ 0 0 48 -4,-2.5 -2,-0.2 -5,-0.1 -1,-0.2 0.887 131.8 19.6 -70.0 -43.6 77.7 23.7 92.7 520 257 B Y H < 0 0 46 -4,-3.2 -3,-0.2 1,-0.3 -2,-0.2 0.509 360.0 360.0-119.1 6.4 75.5 26.3 90.9 521 258 B A < 0 0 75 -4,-2.5 -1,-0.3 -5,-0.4 -2,-0.1 -0.519 360.0 360.0 53.7 360.0 76.6 29.5 92.7