==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=20-JUL-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE 03-SEP-10 3OQP . COMPND 2 MOLECULE: PUTATIVE ISOCHORISMATASE; . SOURCE 2 ORGANISM_SCIENTIFIC: BURKHOLDERIA XENOVORANS; . AUTHOR JOINT CENTER FOR STRUCTURAL GENOMICS (JCSG) . 416 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 15646.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 296 71.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 64 15.4 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 16 3.8 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 2 0.5 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 . 19 4.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 36 8.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 126 30.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 17 4.1 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 0 1 1 0 1 2 1 2 0 0 2 0 0 2 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 2 0 2 2 2 4 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 PARALLEL BRIDGES PER LADDER . 4 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 0 0 ANTIPARALLEL BRIDGES PER LADDER . 2 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 0 LADDERS PER SHEET . # RESIDUE AA STRUCTURE BP1 BP2 ACC N-H-->O O-->H-N N-H-->O O-->H-N TCO KAPPA ALPHA PHI PSI X-CA Y-CA Z-CA 1 1 A X 0 0 202 0, 0.0 2,-0.3 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 148.2 13.7 7.0 10.0 2 2 A T - 0 0 124 1,-0.1 3,-0.1 3,-0.0 186,-0.0 -0.616 360.0-109.3 -79.6 136.7 15.2 6.4 13.4 3 3 A T - 0 0 93 -2,-0.3 186,-0.2 1,-0.1 -1,-0.1 -0.436 40.4-103.9 -61.3 130.1 13.0 4.5 15.9 4 4 A P - 0 0 20 0, 0.0 2,-0.7 0, 0.0 -1,-0.1 -0.309 24.9-148.0 -54.5 139.2 11.8 6.8 18.7 5 5 A R - 0 0 86 102,-0.1 104,-2.1 -3,-0.1 105,-1.8 -0.924 30.1-170.3-110.9 94.0 13.7 6.2 22.0 6 6 A R E -a 110 0A 8 -2,-0.7 2,-0.4 102,-0.2 105,-0.2 -0.650 24.6-166.2 -94.4 147.6 11.0 7.0 24.5 7 7 A A E -a 111 0A 0 103,-1.7 105,-3.0 -2,-0.3 2,-0.6 -0.996 19.9-140.4-120.9 137.8 10.9 7.4 28.2 8 8 A L E -ab 112 50A 0 41,-2.8 43,-3.1 -2,-0.4 2,-0.5 -0.846 16.4-163.5 -94.9 121.3 7.5 7.5 29.9 9 9 A I E -ab 113 51A 0 103,-3.0 105,-2.0 -2,-0.6 2,-0.7 -0.911 5.6-159.4-109.3 129.8 7.4 10.1 32.7 10 10 A V E -ab 114 52A 0 41,-2.8 43,-2.4 -2,-0.5 2,-0.6 -0.942 17.8-152.6-110.7 99.2 4.5 9.7 35.2 11 11 A I E -ab 115 53A 0 103,-2.8 105,-2.6 -2,-0.7 3,-0.1 -0.705 55.6 -33.3 -94.8 117.9 4.1 13.2 36.8 12 12 A D + 0 0 0 41,-1.4 2,-2.0 -2,-0.6 -1,-0.2 0.794 63.9 173.8 52.5 47.5 2.7 13.6 40.3 13 13 A V + 0 0 0 40,-0.5 61,-2.9 -3,-0.3 64,-0.3 -0.570 29.7 149.2 -86.5 79.0 0.3 10.8 40.4 14 14 A Q B > -F 73 0B 0 -2,-2.0 3,-1.6 59,-0.3 4,-0.3 -0.723 63.0-108.7-121.4 155.2 -0.5 11.4 44.0 15 15 A N G >>>S+ 0 0 15 57,-2.7 3,-2.0 54,-0.4 5,-2.0 0.789 107.6 74.2 -60.2 -24.7 -3.5 10.9 46.3 16 16 A E G 345S+ 0 0 14 54,-2.5 6,-2.3 1,-0.3 -1,-0.3 0.803 97.8 49.7 -54.7 -37.3 -4.1 14.7 46.6 17 17 A Y G <45S+ 0 0 3 -3,-1.6 7,-2.4 53,-0.3 -1,-0.3 0.567 124.1 26.8 -76.8 -13.6 -5.5 14.6 43.0 18 18 A V T <45S+ 0 0 26 -3,-2.0 -2,-0.2 -4,-0.3 -3,-0.1 0.766 139.8 8.3-116.0 -67.0 -7.8 11.7 43.7 19 19 A T T <5S+ 0 0 103 -4,-1.7 -3,-0.2 51,-0.1 -4,-0.1 0.528 118.7 72.2 -98.7 -9.2 -8.9 11.4 47.3 20 20 A G S - 0 0 101 -2,-0.2 4,-1.9 1,-0.2 3,-0.3 -0.284 35.6-132.3 -50.0 134.6 -12.5 11.8 34.6 29 29 A V H > S+ 0 0 20 -5,-0.5 4,-2.6 1,-0.3 5,-0.2 0.818 102.6 54.2 -71.4 -32.5 -9.8 10.8 37.1 30 30 A Q H > S+ 0 0 114 1,-0.2 4,-1.9 2,-0.2 -1,-0.3 0.900 109.3 50.3 -65.7 -33.8 -10.6 7.1 37.2 31 31 A S H > S+ 0 0 50 -3,-0.3 4,-1.4 2,-0.2 -2,-0.2 0.845 112.9 45.1 -71.0 -39.3 -10.3 6.9 33.5 32 32 A S H X S+ 0 0 0 -4,-1.9 4,-2.6 2,-0.2 5,-0.2 0.903 109.9 54.3 -72.2 -37.3 -6.9 8.7 33.5 33 33 A L H X S+ 0 0 4 -4,-2.6 4,-2.2 1,-0.2 -2,-0.2 0.925 108.8 50.1 -58.8 -42.9 -5.6 6.6 36.4 34 34 A A H X S+ 0 0 53 -4,-1.9 4,-1.9 1,-0.2 -1,-0.2 0.879 111.5 47.6 -63.0 -37.4 -6.5 3.5 34.4 35 35 A N H X S+ 0 0 23 -4,-1.4 4,-2.8 106,-0.3 -1,-0.2 0.866 107.7 55.0 -74.3 -33.2 -4.7 4.8 31.3 36 36 A I H X S+ 0 0 0 -4,-2.6 4,-2.7 2,-0.2 -1,-0.2 0.933 109.7 48.6 -56.9 -50.2 -1.6 5.8 33.3 37 37 A A H X S+ 0 0 10 -4,-2.2 4,-2.5 2,-0.2 -2,-0.2 0.897 111.5 48.7 -61.5 -44.0 -1.5 2.2 34.6 38 38 A R H X S+ 0 0 93 -4,-1.9 4,-2.8 2,-0.2 5,-0.2 0.934 111.6 50.1 -61.3 -43.9 -1.9 0.8 31.0 39 39 A A H X S+ 0 0 0 -4,-2.8 4,-2.7 1,-0.2 -2,-0.2 0.927 111.9 47.5 -62.5 -40.7 0.9 3.1 29.8 40 40 A X H X S+ 0 0 6 -4,-2.7 4,-2.4 2,-0.2 -1,-0.2 0.914 114.2 46.7 -65.1 -42.7 3.2 2.0 32.6 41 41 A D H X S+ 0 0 81 -4,-2.5 4,-1.9 1,-0.2 -1,-0.2 0.894 114.3 47.3 -67.9 -40.6 2.5 -1.7 31.9 42 42 A A H X S+ 0 0 25 -4,-2.8 4,-1.9 -5,-0.2 -2,-0.2 0.909 111.3 51.5 -64.8 -43.6 2.9 -1.3 28.2 43 43 A A H X>S+ 0 0 0 -4,-2.7 5,-2.4 -5,-0.2 4,-0.8 0.922 109.4 49.5 -58.9 -46.9 6.2 0.6 28.8 44 44 A R H ><5S+ 0 0 183 -4,-2.4 3,-0.9 1,-0.2 -1,-0.2 0.932 111.7 49.0 -61.9 -40.2 7.6 -2.1 31.1 45 45 A A H 3<5S+ 0 0 95 -4,-1.9 -1,-0.2 1,-0.2 -2,-0.2 0.857 116.2 43.3 -68.1 -30.8 6.7 -4.8 28.5 46 46 A A H 3<5S- 0 0 57 -4,-1.9 -1,-0.2 -5,-0.1 -2,-0.2 0.376 113.6-111.7 -96.3 -2.8 8.3 -2.8 25.7 47 47 A G T <<5 + 0 0 51 -3,-0.9 -3,-0.2 -4,-0.8 -4,-0.1 0.765 64.0 150.1 75.7 21.8 11.5 -1.8 27.5 48 48 A V < - 0 0 12 -5,-2.4 -1,-0.3 -6,-0.2 -41,-0.2 -0.827 52.6-115.7 -82.2 120.6 10.5 1.9 27.6 49 49 A P - 0 0 11 0, 0.0 -41,-2.8 0, 0.0 2,-0.5 -0.318 26.0-145.7 -60.8 141.2 12.1 3.4 30.8 50 50 A V E -b 8 0A 5 -43,-0.2 33,-2.5 -41,-0.0 34,-1.6 -0.928 12.5-167.4-113.0 122.8 9.5 4.6 33.3 51 51 A V E -bc 9 84A 0 -43,-3.1 -41,-2.8 -2,-0.5 2,-0.5 -0.960 6.4-154.9-115.1 122.1 10.3 7.7 35.4 52 52 A I E -bc 10 85A 1 32,-2.5 34,-2.2 -2,-0.5 2,-0.4 -0.873 6.3-163.1 -97.5 135.3 8.1 8.5 38.4 53 53 A V E -bc 11 86A 0 -43,-2.4 -41,-1.4 -2,-0.5 -40,-0.5 -0.960 3.1-168.8-116.7 134.2 7.9 12.2 39.7 54 54 A Q E - c 0 87A 15 32,-2.1 34,-2.3 -2,-0.4 2,-0.5 -0.995 10.2-148.3-126.7 131.9 6.6 13.1 43.1 55 55 A N E - c 0 88A 21 -2,-0.4 2,-0.4 32,-0.2 34,-0.2 -0.813 16.4-171.7-103.0 126.5 5.9 16.6 44.1 56 56 A F - 0 0 18 32,-2.5 9,-0.2 -2,-0.5 8,-0.1 -0.959 13.7-175.3-121.3 146.0 6.3 17.8 47.7 57 57 A A B -h 65 0D 23 7,-2.5 9,-2.3 -2,-0.4 3,-0.1 -0.781 50.3 -72.5-115.7 164.7 5.5 20.9 49.7 58 58 A P > - 0 0 95 0, 0.0 3,-2.0 0, 0.0 -1,-0.1 -0.167 60.8 -83.9 -56.1 154.4 6.5 21.4 53.3 59 59 A A T 3 S+ 0 0 77 1,-0.3 8,-0.1 6,-0.2 6,-0.0 -0.241 119.7 28.4 -52.7 142.5 4.8 19.5 56.2 60 60 A G T 3 S+ 0 0 80 6,-0.4 -1,-0.3 1,-0.3 5,-0.1 0.309 87.4 136.5 82.0 -10.4 1.6 21.3 57.2 61 61 A S < - 0 0 33 -3,-2.0 4,-0.3 1,-0.1 -1,-0.3 -0.285 66.4-118.6 -64.1 156.2 1.1 22.8 53.7 62 62 A P S S+ 0 0 95 0, 0.0 2,-0.3 0, 0.0 -41,-0.2 0.802 95.2 29.3 -71.4 -22.6 -2.5 22.6 52.5 63 63 A L S S+ 0 0 19 -5,-0.1 -2,-0.1 1,-0.1 -6,-0.1 -0.985 125.4 3.5-137.7 142.5 -1.6 20.4 49.5 64 64 A F S S+ 0 0 12 -2,-0.3 -7,-2.5 1,-0.2 2,-0.2 0.749 80.0 178.2 59.5 29.0 1.2 17.8 48.9 65 65 A A B > -h 57 0D 7 -4,-0.3 3,-2.3 -9,-0.2 6,-0.5 -0.407 36.0-105.3 -71.0 128.2 2.5 18.2 52.4 66 66 A R T 3 S+ 0 0 103 -9,-2.3 -6,-0.4 1,-0.3 -1,-0.1 -0.193 106.7 19.3 -42.4 129.6 5.4 16.0 53.3 67 67 A G T 3 S+ 0 0 79 1,-0.3 -1,-0.3 -8,-0.1 2,-0.2 0.371 100.9 116.9 88.3 -6.7 4.2 13.1 55.5 68 68 A S S X> S- 0 0 37 -3,-2.3 3,-0.8 1,-0.1 4,-0.6 -0.610 74.7-120.7 -95.3 156.1 0.5 13.4 54.5 69 69 A N G >4 S+ 0 0 108 1,-0.2 3,-1.2 -2,-0.2 -54,-0.4 0.870 111.6 61.6 -56.6 -40.9 -1.7 10.9 52.7 70 70 A G G 34 S+ 0 0 8 1,-0.3 -54,-2.5 -55,-0.2 -53,-0.3 0.796 100.7 52.5 -62.7 -30.0 -2.2 13.4 49.9 71 71 A A G <4 S+ 0 0 0 -3,-0.8 -1,-0.3 -6,-0.5 -2,-0.2 0.618 88.3 102.1 -79.4 -14.0 1.5 13.6 49.1 72 72 A E S << S- 0 0 93 -3,-1.2 -57,-2.7 -4,-0.6 -56,-0.2 -0.387 83.8-102.0 -71.1 148.5 1.8 9.8 48.7 73 73 A L B -F 14 0B 20 -59,-0.3 -59,-0.3 -58,-0.1 -1,-0.1 -0.420 43.5-105.7 -64.4 139.3 1.9 8.2 45.3 74 74 A H >> - 0 0 29 -61,-2.9 4,-2.4 1,-0.1 3,-1.7 -0.362 31.8-106.1 -64.4 146.6 -1.4 6.7 44.3 75 75 A P H 3> S+ 0 0 70 0, 0.0 4,-2.1 0, 0.0 -1,-0.1 0.780 117.2 69.3 -46.7 -27.4 -1.5 2.9 44.4 76 76 A V H 34 S+ 0 0 22 1,-0.2 -3,-0.0 2,-0.2 -2,-0.0 0.883 114.1 28.4 -57.8 -39.8 -1.4 2.8 40.5 77 77 A V H X4 S+ 0 0 4 -3,-1.7 3,-2.3 -64,-0.3 -1,-0.2 0.918 118.7 55.1 -80.3 -50.6 2.1 4.0 40.8 78 78 A S H 3< S+ 0 0 58 -4,-2.4 -2,-0.2 1,-0.3 -1,-0.1 0.744 106.0 50.8 -67.6 -25.7 3.2 2.6 44.1 79 79 A E T 3< S+ 0 0 153 -4,-2.1 -1,-0.3 -5,-0.2 2,-0.3 0.378 103.6 76.1 -91.6 9.8 2.3 -1.0 43.3 80 80 A R S < S- 0 0 84 -3,-2.3 -39,-0.0 -5,-0.1 2,-0.0 -0.796 82.7-105.7-117.1 159.7 4.3 -0.9 40.0 81 81 A A - 0 0 45 -2,-0.3 2,-0.3 -41,-0.0 -1,-0.1 -0.237 34.8-173.5 -70.9 163.3 7.9 -1.1 39.0 82 82 A R - 0 0 124 1,-0.1 -31,-0.2 -38,-0.0 3,-0.1 -0.979 27.0-145.6-150.5 162.0 9.8 1.9 37.8 83 83 A D S S+ 0 0 98 -33,-2.5 2,-0.3 -2,-0.3 -32,-0.2 0.685 82.5 12.4-104.0 -18.3 13.3 2.7 36.4 84 84 A H E -c 51 0A 29 -34,-1.6 -32,-2.5 2,-0.0 2,-0.3 -0.983 58.6-153.2-155.6 157.1 13.9 6.1 37.9 85 85 A Y E -c 52 0A 61 -2,-0.3 2,-0.4 -34,-0.2 -32,-0.2 -0.990 9.2-177.1-134.7 136.3 12.4 8.5 40.6 86 86 A V E -c 53 0A 7 -34,-2.2 -32,-2.1 -2,-0.3 2,-0.4 -0.993 10.7-156.6-135.3 121.1 12.6 12.3 40.8 87 87 A E E +c 54 0A 93 -2,-0.4 2,-0.3 -34,-0.2 -32,-0.2 -0.856 20.7 178.7 -94.0 143.9 11.2 14.4 43.6 88 88 A K E -c 55 0A 8 -34,-2.3 -32,-2.5 -2,-0.4 5,-0.1 -0.937 33.8-169.2-139.7 162.2 10.4 18.1 42.9 89 89 A S S S+ 0 0 74 -2,-0.3 -34,-0.1 -34,-0.2 4,-0.1 -0.014 77.7 64.9-135.2 13.9 9.0 21.2 44.5 90 90 A L S S- 0 0 60 2,-0.3 -34,-0.1 1,-0.1 249,-0.0 -0.907 94.3-104.3-128.9 163.4 8.5 23.3 41.3 91 91 A P S S+ 0 0 2 0, 0.0 2,-0.3 0, 0.0 34,-0.2 0.940 101.0 71.8 -56.0 -45.4 6.1 22.6 38.4 92 92 A S - 0 0 1 32,-0.2 -2,-0.3 1,-0.1 -3,-0.2 -0.468 69.0-151.1 -80.5 133.3 8.9 21.4 36.1 93 93 A A S S+ 0 0 0 28,-0.3 6,-0.4 -2,-0.3 -1,-0.1 0.592 93.5 57.8 -74.5 -7.5 10.4 18.0 36.7 94 94 A F S > S+ 0 0 23 5,-0.1 3,-1.9 4,-0.1 2,-0.3 0.828 71.7 107.3 -90.1 -38.8 13.7 19.2 35.2 95 95 A T T 3 S- 0 0 46 1,-0.3 3,-0.1 -3,-0.2 -5,-0.1 -0.306 106.0 -20.4 -61.6 111.4 14.7 22.2 37.2 96 96 A G T 3 S+ 0 0 84 -2,-0.3 -1,-0.3 1,-0.2 2,-0.1 0.413 113.4 113.4 78.2 2.0 17.6 21.4 39.4 97 97 A T S < S- 0 0 44 -3,-1.9 4,-0.2 -4,-0.1 3,-0.2 -0.313 78.9-110.8 -97.5-177.7 17.0 17.6 39.2 98 98 A D S > S+ 0 0 88 1,-0.2 4,-2.3 2,-0.1 5,-0.2 0.334 86.5 104.3 -91.2 9.6 18.9 14.7 37.6 99 99 A L H > S+ 0 0 0 -6,-0.4 4,-2.6 1,-0.2 5,-0.3 0.915 75.8 47.6 -65.0 -50.6 16.2 14.2 34.9 100 100 A A H > S+ 0 0 57 -6,-0.3 4,-2.2 -3,-0.2 -1,-0.2 0.909 116.5 44.9 -58.1 -46.3 17.9 15.7 31.9 101 101 A G H > S+ 0 0 51 -4,-0.2 4,-2.2 2,-0.2 -1,-0.2 0.905 112.1 51.6 -63.4 -39.1 21.2 13.8 32.6 102 102 A W H < S+ 0 0 32 -4,-2.3 4,-0.4 1,-0.2 -2,-0.2 0.925 112.1 46.2 -66.8 -47.0 19.4 10.5 33.3 103 103 A L H ><>S+ 0 0 3 -4,-2.6 5,-2.2 -5,-0.2 3,-1.5 0.921 111.7 51.2 -56.6 -47.4 17.5 10.7 30.1 104 104 A A H ><5S+ 0 0 72 -4,-2.2 3,-1.7 1,-0.3 -2,-0.2 0.896 103.2 58.9 -62.0 -33.8 20.6 11.6 28.1 105 105 A A T 3<5S+ 0 0 78 -4,-2.2 -1,-0.3 1,-0.3 -2,-0.2 0.607 108.1 47.6 -70.2 -13.8 22.5 8.7 29.5 106 106 A R T < 5S- 0 0 90 -3,-1.5 -1,-0.3 -4,-0.4 -2,-0.2 0.112 115.2-113.6-114.5 15.8 19.7 6.4 28.1 107 107 A Q T < 5 + 0 0 162 -3,-1.7 2,-0.2 1,-0.2 -3,-0.2 0.745 51.4 176.1 62.6 22.6 19.8 7.9 24.6 108 108 A I < + 0 0 13 -5,-2.2 -1,-0.2 1,-0.2 -102,-0.2 -0.439 18.5 164.9 -66.9 128.1 16.2 9.3 25.1 109 109 A D + 0 0 63 -104,-2.1 26,-2.7 1,-0.2 2,-0.4 0.481 66.6 48.1-113.1 -8.5 15.0 11.4 22.2 110 110 A T E -ad 6 135A 10 -105,-1.8 -103,-1.7 24,-0.2 2,-0.6 -0.994 63.9-158.8-142.6 121.2 11.3 11.4 23.0 111 111 A L E -ad 7 136A 0 24,-2.6 26,-2.7 -2,-0.4 2,-0.6 -0.927 9.2-156.6-106.9 118.7 9.7 12.1 26.4 112 112 A T E -ad 8 137A 0 -105,-3.0 -103,-3.0 -2,-0.6 2,-0.5 -0.865 15.6-150.4 -98.9 118.7 6.1 10.7 26.7 113 113 A V E +ad 9 138A 0 24,-3.1 26,-2.2 -2,-0.6 2,-0.3 -0.764 25.9 156.0-102.0 130.0 4.2 12.7 29.4 114 114 A T E +a 10 0A 0 -105,-2.0 -103,-2.8 -2,-0.5 29,-0.2 -0.906 36.4 52.3-135.6 166.4 1.4 11.4 31.6 115 115 A G E S+ad 11 143A 0 27,-2.8 29,-0.6 -2,-0.3 2,-0.3 -0.611 73.7 6.3 100.4-164.7 0.1 12.5 35.0 116 116 A Y E S+ d 0 144A 0 -105,-2.6 29,-0.1 -2,-0.2 -2,-0.1 -0.875 95.3 13.1-128.4 154.0 -1.1 15.7 36.5 117 117 A X > > - 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0 0 33 -2,-0.3 4,-2.5 -9,-0.2 5,-0.2 -0.317 29.2-108.3 -73.4 164.7 -11.0 29.7 20.1 365 157 B A H > S+ 0 0 4 1,-0.2 4,-2.7 2,-0.2 5,-0.3 0.912 121.3 53.1 -60.6 -41.4 -8.7 32.7 20.7 366 158 B E H > S+ 0 0 66 1,-0.2 4,-2.6 2,-0.2 5,-0.3 0.936 110.4 45.9 -59.3 -45.7 -10.9 33.8 23.6 367 159 B E H > S+ 0 0 31 2,-0.2 4,-2.6 1,-0.2 5,-0.2 0.923 114.5 47.6 -63.1 -45.6 -10.7 30.3 25.2 368 160 B I H X S+ 0 0 0 -4,-2.5 4,-2.6 2,-0.2 5,-0.2 0.960 115.5 44.1 -63.6 -49.6 -7.0 30.0 24.8 369 161 B H H X S+ 0 0 6 -4,-2.7 4,-2.5 -5,-0.2 -2,-0.2 0.912 116.5 46.2 -66.0 -41.6 -6.2 33.5 26.1 370 162 B R H X S+ 0 0 44 -4,-2.6 4,-2.8 -5,-0.3 5,-0.3 0.937 112.6 49.0 -65.7 -48.4 -8.6 33.2 29.1 371 163 B V H X S+ 0 0 0 -4,-2.6 4,-2.9 -5,-0.3 5,-0.3 0.957 115.1 45.0 -58.1 -47.0 -7.4 29.7 30.1 372 164 B F H X S+ 0 0 11 -4,-2.6 4,-3.0 -5,-0.2 -1,-0.2 0.915 112.0 52.0 -67.1 -36.4 -3.8 30.9 29.9 373 165 B S H X S+ 0 0 6 -4,-2.5 4,-2.1 -5,-0.2 -1,-0.2 0.928 113.5 44.6 -62.7 -45.4 -4.6 34.1 31.8 374 166 B V H X S+ 0 0 0 -4,-2.8 4,-1.5 2,-0.2 -2,-0.2 0.920 115.1 46.9 -65.7 -45.4 -6.3 32.1 34.6 375 167 B V H X>S+ 0 0 4 -4,-2.9 4,-0.8 -5,-0.3 5,-0.6 0.932 111.3 52.0 -64.5 -37.9 -3.6 29.5 34.8 376 168 B L H >X>S+ 0 0 7 -4,-3.0 5,-2.3 -5,-0.3 4,-1.4 0.928 109.1 49.7 -64.2 -42.2 -0.9 32.1 34.9 377 169 B Q H 3<5S+ 0 0 6 -4,-2.1 25,-1.7 1,-0.2 -1,-0.2 0.798 104.2 61.7 -63.6 -30.7 -2.6 33.9 37.8 378 170 B S H 3<5S- 0 0 0 -4,-1.5 -1,-0.2 -3,-0.2 26,-0.2 0.742 134.1 -23.9 -68.7 -18.7 -2.9 30.6 39.6 379 171 B R H <<5S+ 0 0 92 -3,-1.1 -2,-0.2 -4,-0.8 -3,-0.2 0.564 125.7 51.8-160.7 -34.3 0.9 30.1 39.9 380 172 B F T < - 0 0 21 -2,-0.3 4,-2.3 -38,-0.2 5,-0.2 -0.453 40.8-109.1 -79.4 162.5 -4.3 45.3 33.2 386 178 B T H > S+ 0 0 0 1,-0.2 4,-2.7 2,-0.2 5,-0.2 0.893 120.6 52.5 -57.9 -43.9 -2.0 47.8 31.6 387 179 B D H > S+ 0 0 96 2,-0.2 4,-2.2 1,-0.2 -1,-0.2 0.915 108.2 50.1 -59.2 -42.5 -3.5 50.5 33.8 388 180 B E H > S+ 0 0 107 1,-0.2 4,-1.9 2,-0.2 -1,-0.2 0.881 112.4 47.8 -62.9 -38.8 -2.9 48.5 36.9 389 181 B W H X S+ 0 0 0 -4,-2.3 4,-2.7 2,-0.2 -2,-0.2 0.934 109.4 51.7 -66.4 -46.6 0.7 47.9 35.9 390 182 B I H X S+ 0 0 24 -4,-2.7 4,-2.5 1,-0.2 -2,-0.2 0.898 111.0 49.5 -55.2 -44.1 1.3 51.6 35.1 391 183 B A H X S+ 0 0 57 -4,-2.2 4,-2.2 2,-0.2 -1,-0.2 0.878 110.4 50.1 -62.2 -40.4 -0.1 52.4 38.6 392 184 B A H X>S+ 0 0 3 -4,-1.9 5,-2.2 2,-0.2 4,-0.7 0.892 111.7 47.8 -66.0 -37.6 2.2 49.9 40.2 393 185 B V H ><5S+ 0 0 20 -4,-2.7 3,-0.8 2,-0.2 -2,-0.2 0.937 113.3 47.4 -67.5 -45.5 5.2 51.2 38.4 394 186 B Q H 3<5S+ 0 0 160 -4,-2.5 -2,-0.2 1,-0.2 -1,-0.2 0.882 119.8 40.7 -64.9 -36.7 4.3 54.9 39.3 395 187 B G H 3<5S- 0 0 53 -4,-2.2 -1,-0.2 -5,-0.2 -2,-0.2 0.465 106.0-125.8 -87.0 -4.5 3.8 53.7 42.9 396 188 B G T <<5 + 0 0 17 -3,-0.8 -3,-0.2 -4,-0.7 -4,-0.1 0.816 64.5 133.8 57.2 37.8 6.8 51.3 43.1 397 189 B T < - 0 0 67 -5,-2.2 -1,-0.2 -186,-0.2 -186,-0.1 -0.751 54.8-115.8-116.3 157.5 4.6 48.4 44.3 398 190 B P - 0 0 70 0, 0.0 2,-0.3 0, 0.0 -1,-0.1 -0.352 30.2-116.6 -78.6 170.3 4.3 44.7 43.2 399 191 B L - 0 0 25 -2,-0.1 2,-0.2 1,-0.0 -15,-0.1 -0.808 35.5 -92.8-107.8 154.3 1.2 43.2 41.6 400 192 B A - 0 0 77 -2,-0.3 -17,-0.4 -17,-0.1 2,-0.4 -0.435 33.6-159.1 -71.2 136.1 -1.0 40.5 43.2 401 193 B R - 0 0 107 -2,-0.2 -19,-0.2 -19,-0.2 -23,-0.1 -0.865 6.1-146.1-112.2 142.1 -0.5 36.8 42.5 402 194 B G - 0 0 24 -25,-1.7 2,-0.3 -21,-0.4 -24,-0.1 -0.192 13.1-136.0 -87.5-169.6 -3.0 34.0 43.0 403 195 B N > - 0 0 85 1,-0.1 4,-2.0 -2,-0.1 -24,-0.2 -0.969 19.0-113.7-154.1 156.6 -2.4 30.4 44.1 404 196 B I H > S+ 0 0 28 -2,-0.3 4,-2.5 2,-0.2 5,-0.2 0.922 110.5 48.8 -63.5 -47.3 -3.5 27.0 43.0 405 197 B Y H > S+ 0 0 63 1,-0.2 4,-2.9 2,-0.2 5,-0.2 0.964 114.6 44.8 -63.0 -47.1 -5.5 26.0 46.1 406 198 B A H > S+ 0 0 51 1,-0.2 4,-2.2 2,-0.2 -1,-0.2 0.880 112.6 52.3 -59.7 -40.4 -7.5 29.3 46.2 407 199 B S H X S+ 0 0 1 -4,-2.0 -258,-1.9 2,-0.2 4,-1.6 0.911 112.9 44.2 -65.4 -44.0 -8.1 29.2 42.5 408 200 B N H X S+ 0 0 0 -4,-2.5 4,-2.5 -260,-0.2 -2,-0.2 0.919 111.6 52.9 -69.2 -40.8 -9.5 25.6 42.7 409 201 B Q H X S+ 0 0 82 -4,-2.9 4,-1.5 -5,-0.2 -2,-0.2 0.909 107.7 50.8 -61.0 -41.5 -11.6 26.3 45.8 410 202 B K H < S+ 0 0 118 -4,-2.2 4,-0.4 -261,-0.3 -1,-0.2 0.925 112.9 46.2 -64.6 -38.1 -13.3 29.3 44.2 411 203 B A H >< S+ 0 0 7 -4,-1.6 3,-1.5 -262,-0.2 4,-0.3 0.905 108.2 55.4 -69.6 -39.5 -14.2 27.3 41.1 412 204 B R H >< S+ 0 0 93 -4,-2.5 3,-1.8 1,-0.3 4,-0.3 0.817 93.1 71.4 -66.0 -27.4 -15.5 24.3 43.1 413 205 B A G >< S+ 0 0 70 -4,-1.5 3,-1.3 1,-0.3 -1,-0.3 0.718 78.8 78.0 -61.0 -18.5 -17.9 26.6 44.9 414 206 B R G < S+ 0 0 141 -3,-1.5 -1,-0.3 -4,-0.4 -2,-0.2 0.772 78.7 70.8 -65.0 -20.3 -20.0 26.9 41.7 415 207 B R G < S- 0 0 215 -3,-1.8 -1,-0.3 -4,-0.3 -2,-0.2 0.857 86.8-159.2 -64.4 -32.2 -21.4 23.4 42.5 416 208 B A < 0 0 85 -3,-1.3 -2,-0.1 -4,-0.3 -3,-0.1 0.852 360.0 360.0 61.5 37.8 -23.3 25.2 45.3 417 209 B T 0 0 164 -4,-0.0 -1,-0.2 0, 0.0 -2,-0.0 -0.281 360.0 360.0 -58.2 360.0 -23.8 21.9 47.3