==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=7-AUG-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER METAL BINDING PROTEIN 07-JUN-11 3SCG . COMPND 2 MOLECULE: EPOXIDASE; . SOURCE 2 ORGANISM_SCIENTIFIC: STREPTOMYCES WEDMORENSIS; . AUTHOR C.L.DRENNAN . 579 3 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 30388.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 401 69.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 146 25.2 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 . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 9 1.6 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 0.2 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 . 57 9.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 58 10.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 101 17.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 14 2.4 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 0 3 3 0 3 0 0 1 0 2 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 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 0 0 0 PARALLEL BRIDGES PER LADDER . 4 1 2 3 9 4 3 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 3 0 0 2 1 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 6 A T > 0 0 125 0, 0.0 4,-1.9 0, 0.0 5,-0.1 0.000 360.0 360.0 360.0 166.4 103.6 79.9 28.4 2 7 A A H > + 0 0 12 2,-0.2 4,-2.8 1,-0.2 5,-0.2 0.881 360.0 51.6 -74.7 -39.3 101.3 77.3 26.9 3 8 A S H > S+ 0 0 20 1,-0.2 4,-0.9 2,-0.2 40,-0.4 0.711 113.4 45.5 -69.2 -22.6 100.4 79.7 24.1 4 9 A T H > S+ 0 0 61 2,-0.2 4,-1.7 3,-0.1 -2,-0.2 0.842 113.1 47.7 -88.0 -39.9 104.1 80.3 23.4 5 10 A G H X S+ 0 0 7 -4,-1.9 4,-2.8 2,-0.2 5,-0.2 0.928 115.7 46.2 -65.0 -44.4 105.1 76.7 23.5 6 11 A F H X S+ 0 0 0 -4,-2.8 4,-3.1 1,-0.2 5,-0.3 0.893 109.8 55.5 -62.6 -41.9 102.1 75.9 21.2 7 12 A A H X S+ 0 0 6 -4,-0.9 4,-0.9 -5,-0.2 -1,-0.2 0.836 114.2 38.7 -62.5 -33.5 103.1 78.8 19.0 8 13 A E H X S+ 0 0 121 -4,-1.7 4,-2.0 2,-0.2 -2,-0.2 0.902 119.8 45.2 -83.1 -42.8 106.6 77.5 18.5 9 14 A L H X S+ 0 0 50 -4,-2.8 4,-2.4 56,-0.3 -2,-0.2 0.855 109.9 54.8 -68.0 -38.9 105.6 73.8 18.3 10 15 A L H X S+ 0 0 0 -4,-3.1 4,-2.5 55,-0.3 -1,-0.2 0.907 108.9 49.2 -60.9 -44.2 102.7 74.5 15.9 11 16 A K H X S+ 0 0 97 -4,-0.9 4,-2.2 -5,-0.3 5,-0.2 0.942 109.8 50.9 -61.8 -48.2 105.0 76.3 13.5 12 17 A D H X S+ 0 0 87 -4,-2.0 4,-1.9 1,-0.2 -2,-0.2 0.948 112.9 45.6 -53.4 -54.6 107.5 73.4 13.6 13 18 A R H X S+ 0 0 15 -4,-2.4 4,-2.5 2,-0.2 -1,-0.2 0.911 109.0 53.7 -56.6 -50.2 104.9 70.8 12.8 14 19 A R H <>S+ 0 0 16 -4,-2.5 5,-2.6 1,-0.3 -1,-0.2 0.929 113.6 44.3 -52.2 -46.0 103.2 72.8 10.0 15 20 A E H ><5S+ 0 0 91 -4,-2.2 3,-0.9 3,-0.2 -1,-0.3 0.815 108.7 58.7 -69.1 -30.9 106.6 73.1 8.4 16 21 A Q H 3<5S+ 0 0 67 -4,-1.9 -2,-0.2 1,-0.2 -1,-0.2 0.957 109.0 42.1 -63.7 -51.5 107.4 69.4 9.0 17 22 A V T 3<5S- 0 0 1 -4,-2.5 -1,-0.2 -5,-0.1 -2,-0.2 0.302 119.3-113.5 -80.7 12.4 104.4 68.2 7.1 18 23 A K T < 5 + 0 0 50 -3,-0.9 2,-0.4 1,-0.2 -3,-0.2 0.922 65.7 143.6 56.1 53.8 105.1 70.8 4.4 19 24 A M < - 0 0 20 -5,-2.6 -1,-0.2 -6,-0.1 2,-0.2 -0.918 36.4-150.8-118.7 146.3 102.1 73.0 4.8 20 25 A D > - 0 0 66 -2,-0.4 4,-2.4 1,-0.1 5,-0.3 -0.513 41.4 -91.3-102.9 177.9 102.0 76.8 4.5 21 26 A H H > S+ 0 0 61 1,-0.2 4,-3.6 2,-0.2 5,-0.3 0.974 127.9 50.6 -53.3 -56.9 99.6 78.9 6.4 22 27 A A H > S+ 0 0 46 1,-0.2 4,-2.2 2,-0.2 -1,-0.2 0.869 110.2 49.3 -44.8 -52.6 97.1 78.8 3.6 23 28 A A H > S+ 0 0 36 2,-0.2 4,-1.5 1,-0.2 -1,-0.2 0.930 116.8 40.2 -56.7 -53.0 97.2 75.0 3.3 24 29 A L H X S+ 0 0 0 -4,-2.4 4,-1.1 1,-0.2 -2,-0.2 0.957 111.7 56.4 -63.5 -51.4 96.7 74.5 7.1 25 30 A A H >X>S+ 0 0 1 -4,-3.6 5,-2.6 -5,-0.3 4,-0.7 0.863 104.9 54.6 -48.5 -41.6 94.1 77.2 7.4 26 31 A S H ><5S+ 0 0 81 -4,-2.2 3,-2.1 -5,-0.3 -1,-0.2 0.972 104.0 50.8 -58.1 -59.3 92.0 75.5 4.7 27 32 A L H 3<5S+ 0 0 61 -4,-1.5 444,-0.5 1,-0.3 -1,-0.2 0.686 116.3 45.5 -53.0 -19.0 91.8 72.1 6.3 28 33 A L H <<5S- 0 0 5 -4,-1.1 -1,-0.3 -3,-0.6 -2,-0.2 0.492 108.4-119.7-105.5 -4.8 90.7 73.9 9.5 29 34 A G T <<5S+ 0 0 55 -3,-2.1 2,-0.2 -4,-0.7 -3,-0.2 0.825 75.9 119.7 69.2 30.4 88.1 76.3 8.0 30 35 A E < - 0 0 65 -5,-2.6 -1,-0.3 -6,-0.2 -2,-0.2 -0.697 67.8-101.0-119.1 172.3 90.2 79.2 9.2 31 36 A T >> - 0 0 64 -2,-0.2 4,-1.7 -3,-0.1 3,-1.1 -0.704 28.7-117.6 -96.6 147.6 92.0 82.2 7.5 32 37 A P H 3> S+ 0 0 49 0, 0.0 4,-2.2 0, 0.0 5,-0.2 0.839 117.1 57.3 -50.3 -34.4 95.7 82.2 6.8 33 38 A E H 3> S+ 0 0 130 2,-0.2 4,-2.1 1,-0.2 5,-0.1 0.859 102.6 53.6 -66.3 -36.3 96.0 85.2 9.1 34 39 A T H <> S+ 0 0 39 -3,-1.1 4,-2.0 2,-0.2 -1,-0.2 0.958 110.3 46.3 -62.9 -50.9 94.4 83.3 12.0 35 40 A V H X S+ 0 0 0 -4,-1.7 4,-1.8 1,-0.2 -2,-0.2 0.893 111.7 50.8 -58.7 -42.5 97.0 80.5 11.7 36 41 A A H < S+ 0 0 39 -4,-2.2 4,-0.3 -5,-0.2 -1,-0.2 0.900 107.7 56.0 -62.0 -37.7 99.8 83.0 11.5 37 42 A A H ><>S+ 0 0 23 -4,-2.1 5,-1.8 1,-0.2 3,-1.3 0.914 104.5 51.3 -59.2 -46.8 98.3 84.6 14.6 38 43 A W H ><>S+ 0 0 20 -4,-2.0 3,-1.7 1,-0.3 5,-0.5 0.893 106.1 53.1 -57.6 -45.5 98.5 81.4 16.6 39 44 A E T 3<5S+ 0 0 31 -4,-1.8 -1,-0.3 1,-0.3 -2,-0.2 0.557 103.0 63.2 -68.1 -7.1 102.1 80.9 15.7 40 45 A N T < 5S- 0 0 119 -3,-1.3 -1,-0.3 -4,-0.3 -2,-0.2 0.018 127.6 -97.5-105.0 24.1 102.5 84.4 17.0 41 46 A G T X 5S+ 0 0 23 -3,-1.7 3,-0.8 -38,-0.3 2,-0.2 0.259 95.0 116.8 81.7 -13.0 101.4 83.3 20.5 42 47 A E T 3 < + 0 0 136 -5,-1.8 3,-0.3 1,-0.2 -4,-0.2 0.091 47.4 92.1 -77.4 28.0 97.8 84.4 20.1 43 48 A G T > < + 0 0 0 -5,-0.5 3,-2.2 -40,-0.4 199,-0.3 0.449 45.4 106.4-102.2 2.3 96.4 80.9 20.5 44 49 A G T < S+ 0 0 9 -3,-0.8 199,-2.0 1,-0.3 198,-0.7 0.748 75.4 57.6 -50.8 -31.5 95.7 80.8 24.2 45 50 A E T 3 S+ 0 0 148 -3,-0.3 -1,-0.3 196,-0.2 2,-0.1 0.544 76.3 122.5 -80.6 -5.8 91.9 81.0 23.8 46 51 A L < - 0 0 12 -3,-2.2 196,-1.2 195,-0.1 197,-0.1 -0.350 62.9-125.6 -59.7 126.0 91.7 77.9 21.6 47 52 A T B > -A 241 0A 35 194,-0.2 4,-1.9 -2,-0.1 194,-0.2 -0.238 22.5-105.6 -70.1 163.5 89.4 75.3 23.2 48 53 A L H > S+ 0 0 0 192,-1.4 4,-1.0 189,-0.4 191,-0.2 0.810 119.1 52.0 -57.8 -32.1 90.5 71.8 23.9 49 54 A T H > S+ 0 0 61 189,-1.4 4,-1.6 2,-0.2 -1,-0.2 0.861 106.8 48.6 -77.2 -36.9 88.5 70.5 20.9 50 55 A Q H > S+ 0 0 59 2,-0.2 4,-3.5 188,-0.2 5,-0.2 0.869 111.4 52.6 -68.9 -34.9 89.9 72.9 18.3 51 56 A L H X S+ 0 0 2 -4,-1.9 4,-2.0 1,-0.2 -1,-0.2 0.841 107.6 52.9 -66.2 -32.2 93.3 71.9 19.6 52 57 A G H X S+ 0 0 14 -4,-1.0 4,-2.1 -5,-0.2 -2,-0.2 0.845 112.8 43.2 -71.0 -32.6 92.2 68.3 19.1 53 58 A R H X S+ 0 0 46 -4,-1.6 4,-3.2 2,-0.2 5,-0.3 0.939 111.9 51.0 -77.8 -48.9 91.2 69.1 15.5 54 59 A I H X S+ 0 0 1 -4,-3.5 4,-1.8 2,-0.2 -2,-0.2 0.910 113.0 49.3 -52.1 -44.4 94.4 71.2 14.7 55 60 A A H ><>S+ 0 0 3 -4,-2.0 5,-2.1 -5,-0.2 3,-0.5 0.982 111.7 47.0 -57.8 -59.8 96.3 68.2 16.0 56 61 A H H ><5S+ 0 0 66 -4,-2.1 3,-1.9 1,-0.3 -2,-0.2 0.885 110.3 52.3 -49.0 -48.4 94.4 65.7 13.9 57 62 A V H 3<5S+ 0 0 16 -4,-3.2 -1,-0.3 1,-0.3 -2,-0.2 0.858 109.2 49.9 -59.0 -37.2 94.7 67.8 10.8 58 63 A L T <<5S- 0 0 1 -4,-1.8 -1,-0.3 -3,-0.5 -2,-0.2 0.030 117.6-120.3 -89.2 24.8 98.5 67.9 11.4 59 64 A G T < 5S+ 0 0 17 -3,-1.9 -3,-0.2 1,-0.2 2,-0.2 0.743 80.2 85.7 39.5 40.6 98.3 64.2 11.8 60 65 A T S - 0 0 29 -2,-0.2 4,-0.8 202,-0.2 3,-0.1 -0.710 29.9-116.0-113.3 165.3 98.6 64.7 18.9 62 67 A I H >> S+ 0 0 7 199,-0.6 4,-1.0 -2,-0.2 3,-0.7 0.881 115.3 57.8 -63.9 -39.0 97.8 67.7 21.2 63 68 A G H >4 S+ 0 0 21 198,-0.4 3,-0.7 194,-0.3 194,-0.3 0.880 99.3 56.6 -59.2 -40.4 100.8 66.8 23.3 64 69 A A H 34 S+ 0 0 51 1,-0.2 -1,-0.3 193,-0.1 -2,-0.2 0.803 111.5 45.6 -62.2 -26.5 103.2 67.0 20.4 65 70 A L H << S+ 0 0 4 -4,-0.8 -55,-0.3 -3,-0.7 -56,-0.3 0.608 104.4 73.8 -92.3 -14.2 101.9 70.6 20.0 66 71 A T S << S- 0 0 9 -4,-1.0 -64,-0.1 -3,-0.7 -63,-0.1 -0.685 84.0-104.4-102.0 156.5 102.1 71.6 23.6 67 72 A P - 0 0 23 0, 0.0 189,-0.6 0, 0.0 190,-0.4 -0.296 42.8 -85.5 -76.8 160.3 105.1 72.5 25.8 68 73 A P - 0 0 113 0, 0.0 3,-0.1 0, 0.0 40,-0.1 -0.200 48.2 -98.5 -60.0 152.8 106.8 70.3 28.5 69 74 A A - 0 0 24 38,-0.2 2,-0.2 1,-0.2 185,-0.1 0.821 69.0-125.7 -42.0 -38.2 105.3 70.5 32.0 70 75 A G - 0 0 30 37,-0.3 2,-0.5 183,-0.1 -1,-0.2 -0.534 22.1 -67.8 114.8 177.3 108.2 72.9 32.8 71 76 A N + 0 0 87 -2,-0.2 35,-0.0 -3,-0.1 0, 0.0 -0.937 39.6 164.1-115.4 126.3 110.9 73.1 35.3 72 77 A D + 0 0 56 -2,-0.5 -1,-0.1 2,-0.0 2,-0.0 0.207 41.4 117.5-120.1 13.3 110.3 73.8 39.0 73 78 A L - 0 0 49 5,-0.1 2,-0.6 1,-0.0 5,-0.2 -0.300 62.5-130.4 -79.8 165.3 113.7 72.8 40.4 74 79 A D B > S-B 77 0B 120 3,-3.3 3,-1.1 1,-0.1 -1,-0.0 -0.874 87.7 -36.2-116.7 92.4 116.2 75.0 42.3 75 80 A D T 3 S- 0 0 167 -2,-0.6 -1,-0.1 1,-0.3 3,-0.1 0.872 129.1 -40.2 58.0 36.5 119.6 74.4 40.6 76 81 A G T 3 S+ 0 0 53 1,-0.2 2,-0.3 0, 0.0 -1,-0.3 0.352 124.7 93.6 96.1 -3.7 118.5 70.7 40.2 77 82 A V B < -B 74 0B 84 -3,-1.1 -3,-3.3 2,-0.0 2,-0.4 -0.925 45.2-173.1-127.5 149.7 116.8 70.3 43.5 78 83 A I - 0 0 67 -2,-0.3 2,-0.3 -5,-0.2 -5,-0.1 -0.987 16.5-166.4-138.9 123.0 113.3 70.6 45.0 79 84 A I - 0 0 126 -2,-0.4 2,-0.3 25,-0.0 26,-0.1 -0.796 6.8-166.9-113.1 155.0 112.8 70.3 48.8 80 85 A Q - 0 0 47 -2,-0.3 24,-0.2 24,-0.1 5,-0.1 -0.988 14.7-137.1-143.8 133.3 109.8 69.8 51.0 81 86 A M > - 0 0 98 -2,-0.3 3,-1.4 1,-0.1 4,-0.2 -0.592 25.1-117.1 -88.6 149.3 109.3 70.1 54.7 82 87 A P G > S+ 0 0 87 0, 0.0 3,-0.9 0, 0.0 -1,-0.1 0.823 113.3 52.3 -51.7 -38.1 107.3 67.6 56.8 83 88 A D G 3 S+ 0 0 142 1,-0.2 -3,-0.0 0, 0.0 0, 0.0 0.693 103.9 57.4 -76.5 -18.1 104.7 70.2 57.8 84 89 A E G < S+ 0 0 107 -3,-1.4 -1,-0.2 2,-0.0 -3,-0.0 0.318 76.9 120.1 -97.3 11.6 104.0 71.3 54.3 85 90 A R < - 0 0 65 -3,-0.9 18,-0.1 -4,-0.2 17,-0.1 -0.662 64.2-116.1 -89.2 126.5 102.9 68.0 52.8 86 91 A P - 0 0 65 0, 0.0 16,-1.3 0, 0.0 2,-0.3 0.006 29.2-150.9 -47.4 151.4 99.4 67.5 51.2 87 92 A I E -C 101 0C 97 14,-0.2 2,-0.4 2,-0.0 14,-0.2 -0.987 16.1-179.8-135.8 141.8 97.0 65.0 52.8 88 93 A L E -C 100 0C 27 12,-1.0 12,-2.3 -2,-0.3 2,-0.4 -0.938 22.9-136.8-144.8 119.2 94.2 62.8 51.5 89 94 A K E -C 99 0C 137 -2,-0.4 2,-0.8 10,-0.2 10,-0.2 -0.607 18.9-148.8 -76.9 125.8 92.0 60.4 53.5 90 95 A G E -C 98 0C 10 8,-2.8 7,-3.1 -2,-0.4 8,-1.8 -0.826 18.1-179.2-103.0 104.0 91.5 57.1 51.6 91 96 A V E -C 96 0C 85 -2,-0.8 2,-0.4 5,-0.3 5,-0.2 -0.835 5.9-175.5-104.0 135.6 88.1 55.5 52.3 92 97 A R S S- 0 0 55 3,-2.2 -2,-0.0 -2,-0.4 0, 0.0 -0.941 76.0 -8.2-134.0 112.7 87.1 52.2 50.7 93 98 A D S S- 0 0 127 -2,-0.4 -1,-0.1 1,-0.2 3,-0.1 0.758 132.9 -54.0 73.7 27.1 83.6 50.7 51.3 94 99 A N S S+ 0 0 161 1,-0.2 2,-0.4 0, 0.0 -1,-0.2 0.848 115.6 111.6 75.4 37.0 83.0 53.5 53.8 95 100 A V S S- 0 0 58 26,-0.0 -3,-2.2 0, 0.0 2,-0.6 -0.962 74.6-115.1-145.6 124.8 86.1 52.7 55.9 96 101 A D E +C 91 0C 92 -2,-0.4 -5,-0.3 -5,-0.2 3,-0.1 -0.417 43.8 163.9 -58.9 107.6 89.2 54.8 56.4 97 102 A Y E + 0 0 1 -7,-3.1 23,-1.8 -2,-0.6 24,-0.7 0.842 57.8 0.4 -96.2 -42.9 91.8 52.6 54.8 98 103 A Y E -C 90 0C 12 -8,-1.8 -8,-2.8 21,-0.2 2,-0.4 -0.874 50.1-145.5-140.6 172.2 94.8 54.9 54.3 99 104 A V E -C 89 0C 15 19,-0.5 19,-2.1 -2,-0.3 2,-0.7 -0.969 24.9-142.2-141.0 123.0 95.9 58.5 54.8 100 105 A Y E -CD 88 117C 21 -12,-2.3 -12,-1.0 -2,-0.4 2,-1.0 -0.829 12.9-169.2 -97.9 115.5 98.2 59.8 52.1 101 106 A N E -CD 87 116C 21 15,-2.6 15,-0.8 -2,-0.7 -14,-0.2 -0.741 22.9-145.6-103.7 85.3 101.0 62.1 53.2 102 107 A C E - D 0 115C 1 -16,-1.3 13,-0.2 -2,-1.0 3,-0.1 -0.266 15.1-161.9 -56.2 120.7 102.3 63.4 49.8 103 108 A L - 0 0 31 11,-2.0 -1,-0.1 1,-0.2 -22,-0.1 -0.099 42.9 -39.5 -90.2-169.3 106.0 64.0 49.6 104 109 A V + 0 0 46 -24,-0.2 2,-0.3 9,-0.1 -1,-0.2 -0.164 60.6 177.2 -55.7 145.2 108.0 66.1 47.1 105 110 A R - 0 0 59 8,-0.1 2,-0.3 -3,-0.1 8,-0.1 -0.867 7.2-163.2-139.6 172.0 107.0 66.0 43.5 106 111 A T B > -I 109 0D 15 3,-0.6 3,-1.3 6,-0.4 6,-0.3 -0.982 32.5-130.5-163.4 149.8 108.3 67.7 40.3 107 112 A K T 3 S+ 0 0 36 -2,-0.3 -37,-0.3 1,-0.3 -38,-0.2 0.634 109.4 65.7 -73.3 -15.7 107.4 68.6 36.7 108 113 A R T 3 S+ 0 0 154 1,-0.3 -1,-0.3 -39,-0.1 -37,-0.1 0.386 119.3 22.8 -82.3 -6.7 110.8 67.3 35.7 109 114 A A B X S+I 106 0D 30 -3,-1.3 3,-1.2 144,-0.2 -3,-0.6 -0.383 70.0 165.2-155.7 72.6 109.5 63.9 36.8 110 115 A P T 3 S+ 0 0 35 0, 0.0 -2,-0.1 0, 0.0 -3,-0.1 0.885 76.5 61.7 -62.1 -39.7 105.7 63.8 36.7 111 116 A S T 3 S+ 0 0 61 -4,-0.1 2,-0.7 -6,-0.0 -4,-0.1 0.690 84.5 95.8 -61.0 -19.9 105.5 60.1 37.0 112 117 A L < + 0 0 49 -3,-1.2 -6,-0.4 -6,-0.3 81,-0.2 -0.646 44.6 163.5 -80.5 111.4 107.3 60.3 40.4 113 118 A V E -E 192 0C 1 79,-3.4 79,-1.8 -2,-0.7 2,-0.2 -0.813 12.2-175.0-131.1 91.8 104.8 60.3 43.3 114 119 A P E +E 191 0C 13 0, 0.0 -11,-2.0 0, 0.0 2,-0.3 -0.597 11.5 173.7 -85.2 147.6 106.4 59.6 46.7 115 120 A L E -D 102 0C 3 75,-2.9 2,-0.5 -13,-0.2 75,-0.4 -0.958 36.8-135.8-149.7 164.8 104.1 59.2 49.7 116 121 A V E -D 101 0C 6 -15,-0.8 -15,-2.6 -2,-0.3 2,-0.5 -0.988 34.7-160.8-122.9 111.9 104.0 58.3 53.4 117 122 A V E -DF 100 188C 9 71,-1.6 71,-2.6 -2,-0.5 2,-0.8 -0.867 12.8-149.2-104.8 128.6 101.0 56.1 53.8 118 123 A D E - 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0 0 29 -5,-2.1 2,-0.3 -6,-0.1 -1,-0.2 -0.766 39.5-147.8-125.5 170.9 93.7 64.5 45.1 214 25 B D > - 0 0 63 -2,-0.2 4,-3.0 1,-0.1 5,-0.3 -0.847 40.0 -93.8-131.9 169.4 89.9 64.7 45.1 215 26 B H H > S+ 0 0 61 -2,-0.3 4,-3.4 1,-0.2 5,-0.3 0.929 127.0 48.8 -50.5 -49.4 87.7 67.1 43.2 216 27 B A H > S+ 0 0 46 1,-0.2 4,-1.7 2,-0.2 -1,-0.2 0.921 113.3 45.5 -56.6 -49.8 87.5 69.4 46.3 217 28 B A H > S+ 0 0 34 2,-0.2 4,-0.8 1,-0.2 -1,-0.2 0.913 118.7 42.4 -61.6 -45.7 91.3 69.4 46.8 218 29 B L H >X S+ 0 0 0 -4,-3.0 4,-1.4 2,-0.2 3,-1.3 0.955 108.4 55.9 -67.4 -53.9 92.0 70.0 43.1 219 30 B A H >X>S+ 0 0 0 -4,-3.4 5,-2.3 -5,-0.3 4,-1.3 0.886 103.6 60.6 -44.9 -42.8 89.3 72.6 42.5 220 31 B S H 3<5S+ 0 0 90 -4,-1.7 -1,-0.3 -5,-0.3 -2,-0.2 0.811 102.3 47.2 -57.0 -38.9 91.0 74.5 45.3 221 32 B L H <<5S+ 0 0 92 -3,-1.3 -1,-0.3 -4,-0.8 -2,-0.2 0.735 119.1 42.8 -77.0 -21.0 94.4 74.9 43.6 222 33 B L H <<5S- 0 0 29 -4,-1.4 -2,-0.2 -3,-0.6 -1,-0.2 0.510 110.2-119.4-100.0 -8.9 92.6 76.0 40.4 223 34 B G T <5S+ 0 0 64 -4,-1.3 2,-0.3 1,-0.3 -3,-0.2 0.934 70.8 127.6 68.8 45.6 90.0 78.3 42.1 224 35 B E < - 0 0 84 -5,-2.3 -1,-0.3 -8,-0.1 -2,-0.1 -0.880 65.7 -94.9-130.3 162.2 87.1 76.3 40.8 225 36 B T > - 0 0 64 -2,-0.3 4,-1.5 1,-0.1 3,-0.3 -0.423 33.9-119.1 -74.8 150.5 84.0 74.6 42.3 226 37 B P H > S+ 0 0 54 0, 0.0 4,-1.3 0, 0.0 -1,-0.1 0.772 116.7 52.9 -61.1 -22.8 84.3 71.0 43.2 227 38 B E H > S+ 0 0 137 2,-0.2 4,-2.0 1,-0.1 5,-0.1 0.829 98.9 61.6 -80.0 -35.5 81.5 70.3 40.8 228 39 B T H > S+ 0 0 32 -3,-0.3 4,-1.8 2,-0.2 3,-0.4 0.964 106.3 47.3 -52.3 -55.8 83.3 72.1 37.9 229 40 B V H X S+ 0 0 0 -4,-1.5 4,-2.4 1,-0.3 5,-0.2 0.918 109.1 51.7 -52.6 -51.4 86.1 69.6 38.1 230 41 B A H < S+ 0 0 41 -4,-1.3 -1,-0.3 1,-0.2 4,-0.2 0.837 106.0 58.8 -56.8 -31.7 83.7 66.6 38.2 231 42 B A H >X>S+ 0 0 21 -4,-2.0 5,-1.8 -3,-0.4 4,-1.7 0.953 105.6 46.6 -61.6 -51.4 82.2 68.1 35.1 232 43 B W H 3<>S+ 0 0 23 -4,-1.8 5,-0.7 1,-0.3 -2,-0.2 0.926 107.6 56.7 -55.2 -49.5 85.5 67.9 33.3 233 44 B E T 3<5S+ 0 0 27 -4,-2.4 -1,-0.3 1,-0.2 -2,-0.2 0.516 106.1 53.9 -63.3 -4.1 86.0 64.3 34.4 234 45 B N T <45S- 0 0 125 -3,-1.7 -1,-0.2 -4,-0.2 -2,-0.2 0.875 129.8 -85.5 -93.4 -51.5 82.7 63.5 32.8 235 46 B G T ><5S+ 0 0 28 -4,-1.7 3,-0.8 -34,-0.1 -3,-0.2 0.251 99.6 108.2 159.1 0.3 83.3 64.8 29.3 236 47 B E G > < + 0 0 135 -5,-1.8 3,-0.6 1,-0.2 -4,-0.2 0.271 48.8 97.6 -83.3 12.5 82.4 68.5 29.6 237 48 B G G > < + 0 0 0 -5,-0.7 3,-2.7 -40,-0.4 -189,-0.4 0.639 50.6 107.8 -74.8 -10.9 86.0 69.7 29.4 238 49 B G G < S+ 0 0 13 -3,-0.8 -189,-1.4 1,-0.3 -190,-0.3 0.687 76.6 44.4 -36.0 -41.1 85.5 70.4 25.7 239 50 B E G < S+ 0 0 168 -3,-0.6 -1,-0.3 -192,-0.2 2,-0.2 0.349 77.3 128.9 -94.9 7.1 85.5 74.2 25.9 240 51 B L < - 0 0 10 -3,-2.7 -192,-1.4 -193,-0.1 -191,-0.1 -0.432 60.0-122.6 -63.2 129.9 88.5 74.6 28.2 241 52 B T B > -A 47 0A 14 -194,-0.2 4,-1.8 -2,-0.2 -194,-0.2 -0.238 18.7-109.1 -71.5 163.5 90.9 77.1 26.7 242 53 B L H > S+ 0 0 0 -196,-1.2 4,-1.8 -198,-0.7 3,-0.5 0.952 121.7 48.6 -56.0 -50.4 94.6 76.3 25.9 243 54 B T H >> S+ 0 0 62 -199,-2.0 4,-1.9 1,-0.3 3,-0.6 0.943 107.5 54.0 -56.5 -50.7 95.7 78.6 28.8 244 55 B Q H 3> S+ 0 0 90 -200,-0.3 4,-2.1 1,-0.3 -1,-0.3 0.827 109.5 49.9 -52.2 -33.8 93.2 77.0 31.2 245 56 B L H 3X S+ 0 0 2 -4,-1.8 4,-2.3 -3,-0.5 -1,-0.3 0.803 103.4 59.0 -76.3 -29.6 94.7 73.6 30.3 246 57 B G H S+ 0 0 1 -4,-2.3 5,-2.9 1,-0.2 -1,-0.2 0.912 112.5 50.7 -60.4 -41.5 98.4 70.6 33.9 250 61 B H H ><5S+ 0 0 81 -4,-1.4 3,-2.5 3,-0.2 -2,-0.2 0.938 107.2 49.8 -60.4 -55.2 100.6 72.8 36.2 251 62 B V H 3<5S+ 0 0 27 -4,-2.9 -1,-0.2 1,-0.3 -2,-0.2 0.858 113.3 48.7 -53.6 -37.4 98.5 72.3 39.4 252 63 B L T 3<5S- 0 0 2 -4,-1.8 -1,-0.3 -5,-0.3 -2,-0.2 0.181 113.2-124.7 -89.6 16.8 98.8 68.6 38.7 253 64 B G T < 5S+ 0 0 16 -3,-2.5 -3,-0.2 1,-0.2 2,-0.2 0.810 77.5 92.5 42.1 44.7 102.5 69.0 38.1 254 65 B T S - 0 0 28 -2,-0.2 4,-0.8 -3,-0.1 3,-0.2 -0.716 28.4-115.0-112.8 164.0 102.1 68.6 31.1 256 67 B I H >> S+ 0 0 11 -189,-0.6 3,-1.7 -2,-0.2 4,-0.7 0.950 117.1 58.0 -60.5 -46.9 99.1 69.3 28.8 257 68 B G H >4 S+ 0 0 19 -190,-0.4 3,-1.0 -194,-0.3 -194,-0.3 0.841 99.9 56.1 -49.4 -41.0 100.1 66.4 26.6 258 69 B A H 34 S+ 0 0 48 1,-0.2 -1,-0.3 -3,-0.2 -2,-0.2 0.747 109.7 47.1 -64.8 -24.5 100.0 64.0 29.5 259 70 B L H << S+ 0 0 3 -3,-1.7 -1,-0.2 -4,-0.8 -56,-0.2 0.444 104.5 72.6 -96.9 -4.7 96.3 65.0 30.1 260 71 B T S << S- 0 0 8 -3,-1.0 -63,-0.1 -4,-0.7 -64,-0.1 -0.807 86.4-103.7-111.6 155.1 95.3 64.7 26.4 261 72 B P - 0 0 27 0, 0.0 -199,-0.6 0, 0.0 -198,-0.4 -0.312 37.9-101.6 -74.7 157.1 94.8 61.6 24.3 262 73 B P - 0 0 108 0, 0.0 3,-0.1 0, 0.0 -63,-0.1 -0.362 55.5 -77.2 -72.5 157.7 97.3 60.4 21.7 263 74 B A - 0 0 21 38,-0.2 -202,-0.2 1,-0.1 3,-0.1 -0.316 63.1-108.7 -54.4 137.9 96.5 61.1 18.0 264 75 B G - 0 0 38 -204,-0.2 2,-0.5 1,-0.1 -1,-0.1 0.305 33.2 -91.7 -55.7-166.1 93.8 58.6 17.0 265 76 B N - 0 0 87 1,-0.1 -1,-0.1 -3,-0.1 35,-0.0 -0.965 35.3-179.8-116.3 119.7 94.3 55.6 14.7 266 77 B D + 0 0 60 -2,-0.5 2,-0.2 -3,-0.1 -1,-0.1 0.079 39.7 119.7-108.8 27.8 93.6 56.2 11.0 267 78 B L - 0 0 44 5,-0.1 2,-1.0 33,-0.0 5,-0.2 -0.630 59.2-138.1-100.2 151.8 94.4 52.8 9.6 268 79 B D S S- 0 0 132 3,-3.1 3,-0.2 -2,-0.2 -2,-0.0 -0.763 92.7 -35.7-102.7 82.9 92.3 50.2 7.6 269 80 B D S S- 0 0 162 -2,-1.0 -1,-0.2 1,-0.2 3,-0.1 0.893 126.4 -41.2 66.4 41.7 93.5 47.0 9.3 270 81 B G S S+ 0 0 58 1,-0.3 2,-0.3 0, 0.0 -1,-0.2 0.491 123.2 91.7 87.8 6.5 97.0 48.3 9.8 271 82 B V - 0 0 79 -3,-0.2 -3,-3.1 2,-0.0 2,-0.3 -0.882 44.4-175.8-133.0 161.8 97.3 49.9 6.4 272 83 B I - 0 0 62 -2,-0.3 2,-0.3 -5,-0.2 -5,-0.1 -0.891 13.0-163.7-157.7 122.8 96.8 53.3 4.6 273 84 B I - 0 0 123 -2,-0.3 2,-0.3 25,-0.0 -2,-0.0 -0.732 4.3-165.8-109.0 159.3 97.2 53.9 0.9 274 85 B Q - 0 0 45 -2,-0.3 24,-0.1 24,-0.1 5,-0.1 -0.987 15.4-137.9-143.9 133.4 97.6 57.1 -1.1 275 86 B M > - 0 0 100 -2,-0.3 3,-2.3 1,-0.1 4,-0.1 -0.677 26.5-111.3 -94.6 150.8 97.2 57.5 -4.9 276 87 B P G > S+ 0 0 89 0, 0.0 3,-0.8 0, 0.0 -1,-0.1 0.770 114.8 54.0 -46.6 -36.0 99.6 59.6 -7.0 277 88 B D G 3 S+ 0 0 95 1,-0.2 -2,-0.0 3,-0.0 0, 0.0 0.221 100.3 59.9 -91.2 17.1 96.8 62.1 -7.8 278 89 B E G < S+ 0 0 110 -3,-2.3 -1,-0.2 2,-0.1 -3,-0.0 0.140 73.5 126.4-126.0 19.5 95.9 62.8 -4.2 279 90 B R < - 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