==== 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 ISOMERASE 12-JUN-08 3DG6 . COMPND 2 MOLECULE: MUCONATE CYCLOISOMERASE; . SOURCE 2 ORGANISM_SCIENTIFIC: MYCOBACTERIUM SMEGMATIS; . AUTHOR A.A.FEDOROV,E.V.FEDOROV,A.SAKAI,J.A.GERLT,S.C.ALMO . 366 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 14153.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 252 68.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 30 8.2 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 38 10.4 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 . 1 0.3 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 . 16 4.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 29 7.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 118 32.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 7 1.9 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 2 0 1 1 0 4 1 0 1 0 2 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 1 4 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 0 PARALLEL BRIDGES PER LADDER . 5 0 1 0 0 1 0 0 0 0 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 ANTIPARALLEL BRIDGES PER LADDER . 0 1 1 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 LADDERS PER SHEET . # RESIDUE AA STRUCTURE BP1 BP2 ACC N-H-->O O-->H-N N-H-->O O-->H-N TCO KAPPA ALPHA PHI PSI X-CA Y-CA Z-CA 1 1 A M 0 0 65 0, 0.0 78,-2.0 0, 0.0 2,-0.4 0.000 360.0 360.0 360.0 43.7 42.5 29.2 -5.6 2 2 A K B -A 78 0A 103 76,-0.2 37,-1.7 77,-0.1 2,-0.5 -0.742 360.0-118.0 -94.0 138.5 43.5 26.4 -7.9 3 3 A I E +B 38 0B 1 74,-3.1 73,-2.5 -2,-0.4 35,-0.3 -0.643 35.5 170.7 -76.6 121.8 44.4 22.9 -6.4 4 4 A V E + 0 0 83 33,-2.9 2,-0.3 -2,-0.5 34,-0.2 0.644 64.7 1.9-104.3 -21.7 48.0 22.1 -7.2 5 5 A A E -B 37 0B 38 32,-1.4 32,-2.9 69,-0.1 2,-0.4 -0.983 50.3-157.2-164.0 153.7 48.3 19.0 -5.0 6 6 A I E -B 36 0B 14 -2,-0.3 2,-0.3 30,-0.2 30,-0.2 -0.973 20.8-167.8-137.5 118.4 46.4 16.7 -2.7 7 7 A G E -B 35 0B 18 28,-2.5 28,-2.2 -2,-0.4 2,-0.4 -0.766 14.3-158.2-111.3 156.8 48.3 14.6 -0.1 8 8 A A E -B 34 0B 5 -2,-0.3 26,-0.2 26,-0.2 59,-0.1 -0.928 13.5-176.6-133.9 107.1 47.4 11.7 2.1 9 9 A I E -B 33 0B 10 24,-3.0 24,-3.5 -2,-0.4 2,-0.2 -0.909 16.3-143.8-111.1 116.4 49.6 11.2 5.2 10 10 A P E +B 32 0B 18 0, 0.0 355,-2.5 0, 0.0 356,-0.4 -0.515 26.7 170.3 -76.3 142.3 48.9 8.2 7.5 11 11 A F E -BC 31 364B 0 20,-2.4 20,-0.5 353,-0.3 2,-0.4 -0.961 19.8-149.3-146.5 161.8 49.5 8.7 11.2 12 12 A S E +B 30 0B 32 351,-2.3 18,-0.2 -2,-0.3 20,-0.0 -0.979 11.0 179.6-142.5 127.8 48.8 6.8 14.4 13 13 A I E -B 29 0B 0 16,-1.2 16,-3.1 -2,-0.4 316,-0.0 -0.987 29.3-123.6-128.2 121.6 48.1 8.1 17.9 14 14 A P E -B 28 0B 69 0, 0.0 314,-2.4 0, 0.0 2,-0.3 -0.249 21.5-122.9 -63.3 148.5 47.4 5.6 20.8 15 15 A Y E -E 327 0C 18 12,-2.2 312,-0.3 312,-0.2 311,-0.1 -0.726 6.6-140.8 -90.1 141.9 44.2 5.8 22.8 16 16 A T E S+ 0 0 105 310,-2.8 -1,-0.1 1,-0.3 311,-0.1 0.896 96.7 7.3 -66.4 -38.7 44.6 6.3 26.6 17 17 A K E S- 0 0 69 309,-0.9 -1,-0.3 -3,-0.1 309,-0.0 -0.976 91.6-114.3-144.8 126.0 41.7 3.9 26.9 18 18 A P E - 0 0 43 0, 0.0 2,-0.6 0, 0.0 9,-0.2 -0.247 21.1-130.2 -62.7 147.1 40.1 1.9 24.0 19 19 A L E -B 26 0B 3 7,-2.0 7,-2.1 276,-0.0 2,-0.4 -0.891 28.0-166.2-100.1 120.4 36.6 2.6 22.9 20 20 A R E +B 25 0B 118 -2,-0.6 117,-2.4 117,-0.4 2,-0.3 -0.867 15.9 155.0-112.4 143.3 34.6 -0.7 22.6 21 21 A F E > -B 24 0B 13 3,-2.2 3,-0.9 -2,-0.4 143,-0.1 -0.924 55.2 -83.8-153.2 174.1 31.2 -1.3 20.9 22 22 A A T 3 S+ 0 0 37 141,-0.6 171,-0.1 -2,-0.3 142,-0.1 0.847 122.4 41.9 -54.9 -40.8 29.2 -4.0 19.3 23 23 A S T 3 S- 0 0 26 1,-0.1 2,-0.3 -3,-0.0 -1,-0.2 0.554 126.1 -52.4 -87.8 -8.7 30.8 -3.8 15.8 24 24 A G E < -B 21 0B 19 -3,-0.9 -3,-2.2 2,-0.0 2,-0.3 -0.992 52.7 -94.0 167.3-164.1 34.4 -3.4 16.8 25 25 A E E -B 20 0B 92 -2,-0.3 2,-0.5 -5,-0.2 -5,-0.2 -0.977 13.7-145.0-145.6 155.8 37.0 -1.5 18.9 26 26 A V E +B 19 0B 7 -7,-2.1 -7,-2.0 -2,-0.3 3,-0.1 -0.973 23.1 163.8-127.2 115.1 39.3 1.4 18.5 27 27 A H E S+ 0 0 101 -2,-0.5 -12,-2.2 1,-0.3 2,-0.3 0.511 72.0 12.0-105.2 -11.4 42.7 1.2 20.3 28 28 A A E S-B 14 0B 22 -14,-0.3 2,-1.4 299,-0.1 -1,-0.3 -0.978 76.0-109.3-162.6 152.9 44.4 4.0 18.3 29 29 A A E +B 13 0B 0 -16,-3.1 2,-1.4 -2,-0.3 -16,-1.2 -0.722 37.8 174.5 -89.4 88.7 43.6 6.7 15.9 30 30 A E E +B 12 0B 103 -2,-1.4 -18,-0.2 -18,-0.2 2,-0.1 -0.619 29.2 150.7 -94.7 72.9 45.2 5.2 12.7 31 31 A H E -B 11 0B 0 -2,-1.4 -20,-2.4 -20,-0.5 2,-0.4 -0.271 46.5-118.3 -99.5-176.7 43.9 8.0 10.5 32 32 A V E -BD 10 48B 0 16,-1.3 16,-1.8 -22,-0.2 2,-0.6 -0.991 16.3-143.1-128.2 122.7 44.9 9.8 7.4 33 33 A L E -BD 9 47B 0 -24,-3.5 -24,-3.0 -2,-0.4 2,-0.5 -0.771 19.8-158.8 -85.8 120.9 45.7 13.5 7.2 34 34 A V E -BD 8 46B 0 12,-3.1 12,-1.4 -2,-0.6 2,-0.4 -0.888 8.3-170.6-105.6 128.6 44.4 14.9 4.0 35 35 A R E -BD 7 45B 68 -28,-2.2 -28,-2.5 -2,-0.5 2,-0.6 -0.971 12.6-161.3-125.5 129.9 45.9 18.1 2.6 36 36 A V E -BD 6 44B 0 8,-2.7 8,-2.8 -2,-0.4 2,-0.4 -0.934 14.9-160.3-108.9 113.3 44.7 20.2 -0.3 37 37 A H E -BD 5 43B 53 -32,-2.9 -33,-2.9 -2,-0.6 -32,-1.4 -0.797 6.2-162.0 -96.8 133.7 47.4 22.6 -1.5 38 38 A T E > -B 3 0B 9 4,-2.5 3,-1.7 -2,-0.4 -35,-0.2 -0.679 33.9-110.8-111.2 167.2 46.5 25.7 -3.6 39 39 A D T 3 S+ 0 0 89 -37,-1.7 -36,-0.1 1,-0.3 -1,-0.0 0.439 115.0 66.6 -74.3 1.2 48.5 28.0 -5.9 40 40 A D T 3 S- 0 0 93 -38,-0.2 -1,-0.3 2,-0.2 3,-0.1 0.378 119.6-107.3 -99.2 -0.1 48.0 30.7 -3.3 41 41 A G S < S+ 0 0 68 -3,-1.7 2,-0.3 1,-0.3 -2,-0.1 0.502 76.6 138.2 86.1 4.1 50.2 28.8 -0.8 42 42 A I - 0 0 31 67,-0.0 -4,-2.5 68,-0.0 2,-0.5 -0.619 38.2-159.2 -85.5 142.1 47.1 27.9 1.3 43 43 A V E -D 37 0B 48 -2,-0.3 2,-0.3 -6,-0.2 -6,-0.2 -0.976 1.9-162.7-125.0 117.6 46.8 24.4 2.7 44 44 A G E -D 36 0B 0 -8,-2.8 -8,-2.7 -2,-0.5 2,-0.3 -0.763 15.3-164.8 -96.1 145.8 43.4 23.0 3.7 45 45 A V E +D 35 0B 10 -2,-0.3 2,-0.3 -10,-0.2 -10,-0.2 -0.898 21.0 151.3-133.0 162.4 43.3 20.0 5.9 46 46 A A E -D 34 0B 0 -12,-1.4 -12,-3.1 -2,-0.3 2,-0.3 -0.937 32.1-119.1-169.8 170.8 41.0 17.2 7.2 47 47 A E E -D 33 0B 2 -2,-0.3 -14,-0.2 -14,-0.2 57,-0.1 -0.894 7.3-149.7-125.5 157.9 41.3 13.7 8.4 48 48 A A E -D 32 0B 0 -16,-1.8 -16,-1.3 -2,-0.3 50,-0.1 -0.977 12.3-153.7-127.1 113.9 39.9 10.3 7.2 49 49 A P - 0 0 1 0, 0.0 2,-0.5 0, 0.0 -18,-0.1 -0.795 14.9-136.8 -90.8 115.7 39.2 7.7 9.9 50 50 A P + 0 0 10 0, 0.0 -20,-0.2 0, 0.0 9,-0.1 -0.592 25.9 176.8 -73.9 123.7 39.4 4.2 8.5 51 51 A R >>> + 0 0 9 -2,-0.5 4,-3.1 1,-0.1 3,-2.2 -0.750 8.3 176.8-128.3 82.2 36.5 2.1 9.9 52 52 A P T 345S+ 0 0 74 0, 0.0 -1,-0.1 0, 0.0 6,-0.1 0.816 83.1 55.2 -55.1 -32.0 36.6 -1.3 8.3 53 53 A F T 345S+ 0 0 49 1,-0.1 -2,-0.0 2,-0.1 -29,-0.0 0.340 120.2 30.6 -84.1 5.1 33.7 -2.4 10.5 54 54 A T T <45S+ 0 0 29 -3,-2.2 -1,-0.1 3,-0.1 -30,-0.0 0.627 142.4 1.8-126.5 -49.5 31.6 0.5 9.3 55 55 A Y T <5S- 0 0 40 -4,-3.1 40,-0.2 2,-0.2 -2,-0.1 0.545 89.7-117.2-119.7 -16.9 32.6 1.3 5.7 56 56 A G < + 0 0 52 -5,-1.5 2,-0.2 1,-0.3 -3,-0.1 0.485 65.9 138.9 91.1 2.5 35.2 -1.2 4.9 57 57 A E - 0 0 13 -6,-0.5 -1,-0.3 -8,-0.1 2,-0.3 -0.488 34.5-160.3 -81.2 151.9 38.0 1.3 4.4 58 58 A T > - 0 0 71 -2,-0.2 4,-2.4 -7,-0.1 5,-0.2 -0.855 31.7-111.9-124.9 162.3 41.5 0.8 5.7 59 59 A Q H > S+ 0 0 38 -2,-0.3 4,-2.0 1,-0.2 5,-0.2 0.942 121.3 46.1 -59.6 -46.2 44.3 3.3 6.4 60 60 A T H > S+ 0 0 113 1,-0.2 4,-2.2 2,-0.2 -1,-0.2 0.901 112.5 51.4 -62.1 -42.0 46.3 1.8 3.5 61 61 A G H > S+ 0 0 31 2,-0.2 4,-2.7 1,-0.2 -1,-0.2 0.854 107.3 51.7 -65.0 -38.1 43.3 1.8 1.2 62 62 A I H X S+ 0 0 0 -4,-2.4 4,-2.0 2,-0.2 5,-0.2 0.937 111.2 46.9 -65.2 -47.2 42.4 5.5 1.9 63 63 A V H X S+ 0 0 22 -4,-2.0 4,-2.7 -5,-0.2 5,-0.3 0.927 113.8 50.9 -60.4 -42.3 45.9 6.6 1.1 64 64 A A H X S+ 0 0 27 -4,-2.2 4,-2.9 1,-0.2 5,-0.4 0.931 109.6 46.4 -62.6 -49.0 45.8 4.5 -2.1 65 65 A V H X>S+ 0 0 11 -4,-2.7 5,-2.3 1,-0.2 4,-1.8 0.875 115.9 47.1 -65.6 -33.8 42.5 5.7 -3.4 66 66 A I H <>S+ 0 0 0 -4,-2.0 5,-3.1 -5,-0.2 -2,-0.2 0.954 118.3 39.3 -71.2 -48.1 43.5 9.4 -2.8 67 67 A E H <5S+ 0 0 112 -4,-2.7 -2,-0.2 -5,-0.2 -3,-0.2 0.877 125.9 36.5 -69.0 -37.7 46.9 9.1 -4.3 68 68 A Q H <5S+ 0 0 124 -4,-2.9 -3,-0.2 -5,-0.3 -2,-0.2 0.758 135.1 6.4 -89.1 -27.5 45.9 6.9 -7.2 69 69 A Y T X5S+ 0 0 141 -4,-1.8 4,-1.3 -5,-0.4 -3,-0.2 0.740 124.6 41.1-122.6 -56.6 42.5 8.2 -8.2 70 70 A F H >> -A 2 0A 42 -76,-0.3 3,-1.2 -2,-0.1 -76,-0.2 -0.534 25.6-106.7 -95.5 168.3 39.5 25.7 -8.2 79 79 A L T 3 S+ 0 0 1 -78,-2.0 3,-0.3 1,-0.3 -77,-0.1 0.538 119.1 60.6 -71.7 -4.8 38.1 25.8 -4.7 80 80 A T T 3 S+ 0 0 95 -79,-0.2 -1,-0.3 1,-0.2 3,-0.1 -0.086 85.8 75.2-112.8 32.4 34.9 27.2 -6.3 81 81 A E X> + 0 0 73 -3,-1.2 4,-2.1 1,-0.1 3,-0.9 -0.273 52.6 140.3-130.6 40.9 34.2 24.1 -8.5 82 82 A R H 3> + 0 0 72 1,-0.3 4,-2.7 -3,-0.3 5,-0.1 0.833 69.3 54.7 -56.5 -36.6 33.0 21.9 -5.6 83 83 A E H 3> S+ 0 0 82 2,-0.2 4,-2.1 1,-0.2 -1,-0.3 0.790 106.3 51.7 -71.6 -24.9 30.3 20.3 -7.8 84 84 A V H <> S+ 0 0 50 -3,-0.9 4,-2.7 2,-0.2 5,-0.2 0.928 112.8 45.3 -73.0 -44.7 32.9 19.3 -10.4 85 85 A A H X S+ 0 0 5 -4,-2.1 4,-2.6 2,-0.2 5,-0.2 0.911 112.9 51.8 -62.3 -41.5 34.9 17.7 -7.7 86 86 A H H X S+ 0 0 62 -4,-2.7 4,-1.7 1,-0.2 -1,-0.2 0.933 112.6 44.6 -60.7 -47.1 31.8 16.1 -6.2 87 87 A T H < S+ 0 0 87 -4,-2.1 4,-0.4 2,-0.2 -2,-0.2 0.889 113.7 49.3 -66.7 -41.3 30.8 14.6 -9.6 88 88 A R H >< S+ 0 0 113 -4,-2.7 3,-1.3 1,-0.2 4,-0.3 0.927 112.2 47.1 -66.1 -44.4 34.3 13.4 -10.4 89 89 A M H >< S+ 0 0 14 -4,-2.6 3,-1.9 1,-0.3 -1,-0.2 0.855 102.5 65.8 -65.2 -31.8 34.7 11.7 -7.1 90 90 A A T 3< S+ 0 0 58 -4,-1.7 -1,-0.3 1,-0.3 -2,-0.2 0.649 82.7 75.5 -64.4 -15.8 31.3 10.1 -7.5 91 91 A R T < S+ 0 0 224 -3,-1.3 2,-0.5 -4,-0.4 -1,-0.3 0.754 90.6 66.5 -66.5 -23.3 32.6 8.1 -10.4 92 92 A T S < S- 0 0 38 -3,-1.9 2,-0.1 -4,-0.3 -23,-0.0 -0.870 89.9-130.9-100.6 130.4 34.3 6.0 -7.8 93 93 A V - 0 0 129 -2,-0.5 -2,-0.1 2,-0.0 -3,-0.0 -0.473 63.0 -16.2 -80.4 150.3 31.9 4.0 -5.6 94 94 A G + 0 0 40 -2,-0.1 5,-0.1 1,-0.1 -2,-0.1 -0.250 67.6 127.2 62.6-140.9 32.2 4.0 -1.8 95 95 A N > + 0 0 47 -40,-0.2 4,-2.1 3,-0.1 5,-0.2 0.917 37.5 173.9 49.7 50.7 35.4 5.2 -0.1 96 96 A P H > + 0 0 18 0, 0.0 4,-2.7 0, 0.0 5,-0.2 0.899 68.2 42.8 -56.0 -51.2 33.3 7.6 2.1 97 97 A T H > S+ 0 0 0 2,-0.2 4,-2.5 1,-0.2 5,-0.2 0.847 111.9 55.4 -69.9 -29.6 35.9 9.1 4.4 98 98 A A H > S+ 0 0 0 2,-0.2 4,-1.6 1,-0.2 -1,-0.2 0.948 113.8 41.1 -64.4 -47.1 38.5 9.5 1.7 99 99 A K H X S+ 0 0 48 -4,-2.1 4,-2.3 1,-0.2 -2,-0.2 0.918 115.0 51.0 -65.0 -46.1 36.0 11.6 -0.3 100 100 A A H X S+ 0 0 4 -4,-2.7 4,-2.8 168,-0.3 172,-0.2 0.897 107.5 53.2 -60.1 -42.8 34.7 13.5 2.7 101 101 A A H X S+ 0 0 0 -4,-2.5 4,-2.4 167,-0.2 -1,-0.2 0.903 109.3 48.5 -61.2 -43.0 38.2 14.4 3.8 102 102 A I H X S+ 0 0 0 -4,-1.6 4,-2.2 2,-0.2 -1,-0.2 0.942 112.5 49.1 -63.1 -45.7 39.1 15.9 0.4 103 103 A D H X S+ 0 0 20 -4,-2.3 4,-2.1 1,-0.2 -2,-0.2 0.930 113.6 45.2 -59.6 -46.0 35.8 17.9 0.4 104 104 A M H X S+ 0 0 2 -4,-2.8 4,-2.3 1,-0.2 -1,-0.2 0.872 111.2 52.4 -67.9 -35.4 36.4 19.2 3.9 105 105 A A H X S+ 0 0 0 -4,-2.4 4,-2.5 -5,-0.2 -1,-0.2 0.867 109.1 51.7 -67.0 -35.5 40.0 20.1 3.2 106 106 A M H X S+ 0 0 3 -4,-2.2 4,-2.5 2,-0.2 -2,-0.2 0.917 110.7 47.3 -65.9 -42.6 38.8 22.0 0.1 107 107 A W H X S+ 0 0 15 -4,-2.1 4,-2.8 2,-0.2 -2,-0.2 0.869 110.3 52.9 -65.6 -36.8 36.3 23.9 2.3 108 108 A D H X S+ 0 0 2 -4,-2.3 4,-2.2 2,-0.2 -2,-0.2 0.946 111.4 46.0 -63.2 -46.3 39.0 24.6 4.8 109 109 A A H X S+ 0 0 0 -4,-2.5 4,-2.3 1,-0.2 -2,-0.2 0.898 112.2 51.5 -62.6 -41.0 41.2 26.0 2.1 110 110 A L H X S+ 0 0 12 -4,-2.5 4,-1.9 1,-0.2 -2,-0.2 0.939 109.5 49.6 -61.7 -47.7 38.3 28.0 0.7 111 111 A G H X>S+ 0 0 0 -4,-2.8 5,-2.3 1,-0.2 4,-1.2 0.899 111.4 48.5 -58.8 -42.6 37.6 29.5 4.1 112 112 A Q H <5S+ 0 0 67 -4,-2.2 3,-0.3 237,-0.3 -1,-0.2 0.904 110.6 51.9 -64.1 -40.4 41.2 30.5 4.6 113 113 A S H <5S+ 0 0 34 -4,-2.3 -1,-0.2 1,-0.2 -2,-0.2 0.815 119.4 35.0 -65.4 -31.4 41.3 32.0 1.2 114 114 A L H <5S- 0 0 84 -4,-1.9 -1,-0.2 2,-0.2 -2,-0.2 0.461 106.3-121.3-102.5 -3.6 38.2 34.1 1.9 115 115 A R T <5S+ 0 0 201 -4,-1.2 2,-0.3 -3,-0.3 -3,-0.2 0.896 73.4 122.9 62.2 41.7 38.8 34.8 5.6 116 116 A L < - 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j 0 159F 2 25,-2.2 27,-2.5 -2,-0.4 2,-0.6 -0.883 10.5-134.8-109.1 136.4 29.5 11.8 24.7 134 134 A M E - j 0 160F 1 -2,-0.4 2,-0.7 25,-0.2 27,-0.2 -0.780 15.8-149.7 -89.9 122.5 29.4 8.2 23.6 135 135 A L E - j 0 161F 3 25,-2.3 27,-2.3 -2,-0.6 3,-0.1 -0.834 15.8-150.2 -95.3 111.6 30.0 5.7 26.4 136 136 A G - 0 0 15 -2,-0.7 -115,-0.2 1,-0.2 -117,-0.0 -0.252 33.4 -69.3 -77.1 166.6 31.7 2.6 25.2 137 137 A F S S+ 0 0 34 -117,-2.4 -117,-0.4 26,-0.1 2,-0.3 -0.141 71.7 124.7 -53.3 148.1 31.4 -0.9 26.7 138 138 A D - 0 0 58 -3,-0.1 5,-0.1 0, 0.0 -3,-0.0 -0.921 66.9 -44.4 172.7 171.4 32.9 -1.6 30.1 139 139 A D > - 0 0 85 -2,-0.3 4,-2.2 1,-0.1 3,-0.4 -0.250 59.5-116.5 -53.6 141.6 31.8 -2.9 33.5 140 140 A P H > S+ 0 0 58 0, 0.0 4,-1.9 0, 0.0 3,-0.2 0.912 116.0 47.2 -47.1 -52.6 28.5 -1.4 34.5 141 141 A V H > S+ 0 0 113 1,-0.2 4,-1.8 2,-0.2 5,-0.1 0.846 111.9 52.2 -60.6 -34.4 29.9 0.4 37.5 142 142 A K H > S+ 0 0 110 -3,-0.4 4,-1.9 2,-0.2 -1,-0.2 0.828 106.0 52.6 -72.8 -33.1 32.8 1.7 35.4 143 143 A M H X S+ 0 0 3 -4,-2.2 4,-2.1 -3,-0.2 -2,-0.2 0.904 110.9 47.1 -69.5 -40.1 30.5 3.1 32.7 144 144 A V H X S+ 0 0 25 -4,-1.9 4,-2.4 -5,-0.2 -2,-0.2 0.901 111.5 51.6 -66.6 -40.4 28.5 5.1 35.3 145 145 A A H X S+ 0 0 58 -4,-1.8 4,-2.4 1,-0.2 -1,-0.2 0.881 109.0 51.0 -62.9 -38.3 31.7 6.4 36.8 146 146 A E H X S+ 0 0 27 -4,-1.9 4,-2.6 2,-0.2 -2,-0.2 0.908 109.8 49.6 -65.7 -42.1 32.9 7.5 33.3 147 147 A A H X S+ 0 0 0 -4,-2.1 4,-2.4 1,-0.2 -2,-0.2 0.914 111.7 48.6 -62.9 -43.2 29.6 9.4 32.8 148 148 A E H X S+ 0 0 73 -4,-2.4 4,-2.2 2,-0.2 5,-0.3 0.912 111.8 49.4 -64.2 -42.4 29.9 11.1 36.2 149 149 A R H X S+ 0 0 100 -4,-2.4 4,-2.5 1,-0.2 5,-0.2 0.943 113.7 45.6 -61.3 -48.9 33.5 12.1 35.5 150 150 A I H X S+ 0 0 0 -4,-2.6 4,-2.3 1,-0.2 6,-0.9 0.870 113.1 49.4 -64.2 -39.1 32.7 13.5 32.1 151 151 A R H X S+ 0 0 57 -4,-2.4 4,-1.4 4,-0.2 -1,-0.2 0.910 116.1 41.4 -68.6 -42.5 29.6 15.4 33.3 152 152 A E H < S+ 0 0 136 -4,-2.2 -2,-0.2 -5,-0.2 -1,-0.2 0.885 119.8 44.1 -72.3 -39.0 31.4 17.0 36.2 153 153 A T H < S+ 0 0 83 -4,-2.5 -2,-0.2 -5,-0.3 -3,-0.2 0.928 131.9 16.4 -72.4 -47.2 34.6 17.8 34.3 154 154 A Y H < S- 0 0 58 -4,-2.3 187,-3.1 -5,-0.2 188,-0.3 0.488 95.3-118.8-109.2 -5.5 33.1 19.1 31.0 155 155 A G < + 0 0 21 -4,-1.4 2,-0.3 -5,-0.4 -4,-0.2 0.616 53.0 164.7 77.2 11.5 29.5 19.9 31.9 156 156 A I + 0 0 0 -6,-0.9 -1,-0.3 1,-0.1 -24,-0.1 -0.478 15.5 178.3 -67.0 124.7 28.3 17.4 29.3 157 157 A N + 0 0 69 -26,-0.5 30,-2.6 -2,-0.3 2,-0.4 0.237 56.0 70.8-113.6 10.7 24.6 16.6 29.9 158 158 A T E -jk 132 187F 4 -27,-0.7 -25,-2.2 28,-0.2 2,-0.4 -0.997 56.4-176.1-132.4 130.8 23.9 14.2 27.0 159 159 A F E -jk 133 188F 0 28,-2.3 30,-1.6 -2,-0.4 2,-0.7 -0.989 17.6-156.3-131.8 135.2 25.1 10.6 26.7 160 160 A K E -jk 134 189F 0 -27,-2.5 -25,-2.3 -2,-0.4 2,-0.4 -0.938 23.8-147.0-107.2 110.5 24.7 8.0 24.0 161 161 A V E -jk 135 190F 1 28,-2.8 30,-2.4 -2,-0.7 2,-0.5 -0.648 8.2-132.7 -82.8 127.9 25.2 4.6 25.6 162 162 A K E + k 0 191F 10 -27,-2.3 30,-0.2 -2,-0.4 2,-0.2 -0.674 40.7 159.7 -78.4 125.5 26.8 1.9 23.5 163 163 A V + 0 0 0 28,-2.8 -141,-0.6 -2,-0.5 32,-0.2 -0.600 26.3 112.2-130.2-167.7 24.7 -1.3 23.8 164 164 A G + 0 0 7 1,-0.3 2,-0.2 -2,-0.2 -1,-0.1 0.620 52.8 129.3 108.8 18.5 24.2 -4.5 21.8 165 165 A R - 0 0 44 3,-0.1 -1,-0.3 2,-0.1 6,-0.2 -0.545 54.7 -82.0-100.9 168.0 25.7 -6.9 24.3 166 166 A R S S+ 0 0 136 -2,-0.2 2,-0.2 2,-0.1 30,-0.0 -0.970 106.9 36.4-125.9 138.9 24.4 -10.2 25.7 167 167 A P S >> S- 0 0 83 0, 0.0 3,-1.7 0, 0.0 4,-0.6 0.582 82.5-141.6 -70.0 160.2 22.6 -10.8 27.8 168 168 A V H >> S+ 0 0 5 1,-0.3 4,-2.1 2,-0.2 3,-0.9 0.845 97.1 70.3 -57.7 -34.8 20.5 -7.8 27.0 169 169 A Q H 3> S+ 0 0 84 1,-0.3 4,-1.8 2,-0.2 -1,-0.3 0.731 86.7 67.5 -56.1 -23.8 19.9 -7.2 30.7 170 170 A L H <> S+ 0 0 51 -3,-1.7 4,-1.1 2,-0.2 -1,-0.3 0.949 108.5 35.5 -62.3 -48.6 23.6 -6.2 31.0 171 171 A D H < S- 0 0 22 -4,-2.3 3,-1.3 1,-0.2 -2,-0.2 0.599 87.3-161.6-109.4 -15.2 21.5 11.5 37.2 183 183 A G G >< - 0 0 26 -4,-1.8 3,-0.8 -5,-0.3 -1,-0.2 -0.343 65.4 -28.6 67.1-149.1 17.7 11.7 37.1 184 184 A D G 3 S+ 0 0 156 1,-0.2 -1,-0.2 -4,-0.1 -5,-0.1 0.236 115.2 96.8 -86.5 15.0 16.2 14.0 34.5 185 185 A A G < S+ 0 0 50 -3,-1.3 2,-0.3 -6,-0.1 -1,-0.2 0.555 84.6 48.6 -79.3 -7.6 19.2 16.2 34.6 186 186 A I S < S- 0 0 8 -3,-0.8 2,-0.4 -7,-0.1 -28,-0.2 -0.934 77.4-126.3-133.8 156.3 20.6 14.4 31.6 187 187 A E E -k 158 0F 63 -30,-2.6 -28,-2.3 -2,-0.3 2,-0.4 -0.813 31.4-168.7 -97.6 141.0 19.5 13.3 28.1 188 188 A L E +k 159 0F 0 24,-0.5 26,-2.6 -2,-0.4 27,-0.3 -0.990 16.4 154.3-135.7 141.0 20.0 9.6 27.3 189 189 A Y E -k 160 0F 5 -30,-1.6 -28,-2.8 -2,-0.4 2,-0.3 -0.940 28.0-124.6-151.7 170.0 19.8 7.5 24.2 190 190 A V E -kl 161 216F 0 25,-1.5 27,-2.7 -2,-0.3 2,-0.4 -0.922 10.5-165.4-129.2 152.5 21.3 4.3 22.9 191 191 A D E -kl 162 217F 0 -30,-2.4 -28,-2.8 -2,-0.3 27,-0.2 -0.981 3.4-177.7-133.6 118.1 23.3 2.9 20.0 192 192 A G > - 0 0 0 25,-2.6 3,-2.5 -2,-0.4 27,-0.2 0.540 28.0-141.6 -94.4 -6.5 23.5 -0.9 19.4 193 193 A N T 3 S- 0 0 9 24,-0.5 26,-0.2 1,-0.3 25,-0.1 0.869 70.3 -58.5 45.5 45.3 25.9 -0.8 16.4 194 194 A R T 3 S+ 0 0 83 24,-2.9 -1,-0.3 26,-0.3 25,-0.1 0.565 107.1 128.8 65.7 12.1 23.9 -3.7 14.9 195 195 A G < + 0 0 19 -3,-2.5 2,-0.2 23,-0.3 25,-0.2 0.764 54.8 55.3 -70.9 -30.9 24.6 -5.9 17.9 196 196 A W S S- 0 0 2 23,-2.1 2,-0.1 1,-0.1 -30,-0.0 -0.629 82.0-114.7-102.3 162.8 21.1 -7.1 18.8 197 197 A S > - 0 0 41 -2,-0.2 4,-2.4 23,-0.2 5,-0.1 -0.473 38.4-106.6 -82.9 166.1 18.5 -9.0 16.8 198 198 A A H > S+ 0 0 8 1,-0.2 4,-2.0 2,-0.2 5,-0.1 0.890 121.9 51.9 -62.0 -38.2 15.3 -7.0 16.2 199 199 A A H > S+ 0 0 60 2,-0.2 4,-1.9 1,-0.2 -1,-0.2 0.913 110.5 46.4 -64.6 -44.2 13.5 -9.2 18.8 200 200 A E H > S+ 0 0 36 1,-0.2 4,-2.4 2,-0.2 -1,-0.2 0.895 110.0 56.2 -64.4 -39.5 16.2 -8.6 21.5 201 201 A S H X S+ 0 0 0 -4,-2.4 4,-2.6 2,-0.2 -2,-0.2 0.901 106.6 48.6 -59.6 -43.6 16.1 -4.9 20.7 202 202 A L H X S+ 0 0 30 -4,-2.0 4,-2.6 2,-0.2 5,-0.2 0.939 111.3 49.1 -64.0 -46.3 12.3 -4.7 21.3 203 203 A R H X S+ 0 0 155 -4,-1.9 4,-1.9 1,-0.2 -2,-0.2 0.901 112.5 49.6 -59.8 -40.4 12.6 -6.5 24.6 204 204 A A H X S+ 0 0 0 -4,-2.4 4,-1.4 2,-0.2 -2,-0.2 0.937 112.6 45.4 -64.5 -47.9 15.4 -4.2 25.7 205 205 A M H < S+ 0 0 9 -4,-2.6 -2,-0.2 1,-0.2 -1,-0.2 0.864 111.0 53.9 -65.5 -35.0 13.6 -1.0 24.7 206 206 A R H >< S+ 0 0 137 -4,-2.6 3,-1.3 1,-0.2 -1,-0.2 0.897 107.3 51.2 -65.7 -38.7 10.4 -2.3 26.4 207 207 A E H 3< S+ 0 0 77 -4,-1.9 3,-0.3 1,-0.3 -1,-0.2 0.817 114.6 43.9 -66.8 -29.1 12.4 -2.9 29.6 208 208 A M T >< S+ 0 0 4 -4,-1.4 3,-2.1 1,-0.2 5,-0.4 0.152 77.6 116.8-100.8 18.3 13.7 0.7 29.4 209 209 A A T < S+ 0 0 79 -3,-1.3 3,-0.4 1,-0.3 -1,-0.2 0.740 76.5 50.3 -58.5 -24.9 10.3 2.2 28.5 210 210 A D T 3 S+ 0 0 108 -3,-0.3 -1,-0.3 1,-0.2 -2,-0.1 0.350 91.5 79.1 -96.4 6.0 10.3 4.2 31.7 211 211 A L S < S- 0 0 4 -3,-2.1 -1,-0.2 2,-0.0 -2,-0.1 0.366 94.2-127.9 -96.1 4.5 13.8 5.7 31.2 212 212 A D - 0 0 112 -3,-0.4 -24,-0.5 1,-0.2 2,-0.3 0.899 31.8-170.0 50.6 53.2 12.8 8.3 28.7 213 213 A L - 0 0 10 -5,-0.4 -24,-0.2 1,-0.1 -1,-0.2 -0.573 14.2-153.0 -74.0 132.0 15.3 7.5 26.0 214 214 A L S S+ 0 0 57 -26,-2.6 2,-0.3 -2,-0.3 -25,-0.2 0.826 70.7 5.5 -75.7 -33.8 15.4 10.1 23.2 215 215 A F - 0 0 17 -27,-0.3 -25,-1.5 22,-0.1 2,-0.5 -0.967 54.5-143.3-147.6 161.1 16.5 7.9 20.4 216 216 A A E -lm 190 239F 0 22,-1.7 24,-2.2 -2,-0.3 2,-0.5 -0.999 26.4-161.0-125.5 121.2 17.3 4.3 19.5 217 217 A E E -lm 191 240F 1 -27,-2.7 -25,-2.6 -2,-0.5 -24,-0.5 -0.930 58.1 -37.1-115.8 123.6 20.2 4.0 17.1 218 218 A E S S+ 0 0 0 22,-2.0 -24,-2.9 -2,-0.5 -23,-0.3 0.816 70.4 166.3 37.0 51.9 21.0 1.0 14.9 219 219 A L + 0 0 0 -26,-0.2 -23,-2.1 -27,-0.2 -1,-0.1 0.887 67.5 15.1 -60.8 -40.0 19.9 -1.5 17.6 220 220 A C S S- 0 0 0 -25,-0.2 -26,-0.3 -26,-0.1 -25,-0.2 -0.789 104.9 -71.3-127.4 170.5 19.8 -4.3 15.1 221 221 A P > - 0 0 29 0, 0.0 3,-1.4 0, 0.0 7,-0.1 -0.418 28.7-145.3 -66.3 135.8 21.3 -4.8 11.6 222 222 A A T 3 S+ 0 0 7 1,-0.3 6,-0.1 -2,-0.1 7,-0.1 0.777 101.3 66.7 -68.6 -23.6 19.5 -2.8 8.9 223 223 A D T 3 S+ 0 0 141 1,-0.2 2,-1.4 5,-0.1 -1,-0.3 0.527 76.1 79.6 -75.4 -6.2 20.3 -5.8 6.7 224 224 A D S <> S- 0 0 72 -3,-1.4 4,-2.6 1,-0.2 5,-0.2 -0.524 80.1-179.9 -91.9 60.3 17.9 -7.9 8.8 225 225 A V H > + 0 0 64 -2,-1.4 4,-2.1 1,-0.2 -1,-0.2 0.781 59.5 35.0 -35.1 -67.2 15.5 -6.0 6.5 226 226 A L H > S+ 0 0 135 1,-0.2 4,-2.0 2,-0.2 -1,-0.2 0.896 120.4 46.5 -67.0 -40.1 12.0 -7.1 7.4 227 227 A S H > S+ 0 0 44 2,-0.2 4,-2.4 1,-0.2 -1,-0.2 0.862 111.3 54.9 -69.5 -31.4 12.5 -7.6 11.2 228 228 A R H X S+ 0 0 0 -4,-2.6 4,-2.5 2,-0.2 -2,-0.2 0.934 108.3 48.0 -63.4 -46.7 14.3 -4.2 11.3 229 229 A R H X S+ 0 0 102 -4,-2.1 4,-1.8 -5,-0.2 -2,-0.2 0.894 110.9 50.9 -62.2 -39.7 11.3 -2.5 9.7 230 230 A R H X S+ 0 0 153 -4,-2.0 4,-0.8 1,-0.2 -1,-0.2 0.938 110.8 49.4 -63.7 -45.5 8.9 -4.2 12.1 231 231 A L H >X S+ 0 0 1 -4,-2.4 4,-1.1 1,-0.2 3,-1.1 0.917 108.3 52.1 -58.9 -47.6 11.0 -3.0 15.0 232 232 A V H 3< S+ 0 0 9 -4,-2.5 3,-0.5 1,-0.3 -1,-0.2 0.885 108.7 51.8 -58.7 -37.6 11.2 0.5 13.8 233 233 A G H 3< S+ 0 0 70 -4,-1.8 -1,-0.3 1,-0.2 -2,-0.2 0.673 107.5 53.8 -73.0 -16.7 7.4 0.6 13.5 234 234 A Q H << S+ 0 0 53 -3,-1.1 2,-0.3 -4,-0.8 -1,-0.2 0.668 91.3 89.4 -90.3 -19.5 7.0 -0.7 17.1 235 235 A L < - 0 0 17 -4,-1.1 4,-0.1 -3,-0.5 -19,-0.0 -0.636 61.3-152.8 -88.9 137.8 9.2 2.0 18.8 236 236 A D S S+ 0 0 162 -2,-0.3 -1,-0.1 2,-0.1 3,-0.1 0.945 78.2 61.6 -66.4 -53.3 7.8 5.3 20.1 237 237 A M S S- 0 0 40 1,-0.1 -22,-0.1 -24,-0.1 -23,-0.1 -0.236 102.0 -82.7 -75.4 163.8 11.0 7.3 19.7 238 238 A P - 0 0 34 0, 0.0 -22,-1.7 0, 0.0 2,-0.7 -0.375 37.9-136.3 -66.6 146.9 12.8 8.0 16.4 239 239 A F E -m 216 0F 0 -24,-0.2 22,-2.3 -4,-0.1 23,-1.3 -0.926 18.4-142.2-108.3 109.7 15.1 5.3 15.3 240 240 A I E -mn 217 262F 0 -24,-2.2 -22,-2.0 -2,-0.7 2,-0.4 -0.584 6.9-153.8 -77.8 125.7 18.4 6.7 14.1 241 241 A A E + n 0 263F 0 21,-2.3 23,-2.4 -2,-0.4 19,-0.1 -0.818 29.0 152.4 -95.4 139.5 20.0 5.1 11.0 242 242 A D > + 0 0 2 -2,-0.4 3,-1.9 21,-0.2 -1,-0.1 0.443 68.9 24.1-130.1 -86.5 23.8 5.6 11.0 243 243 A E T 3 S+ 0 0 18 1,-0.3 -2,-0.1 2,-0.1 -189,-0.0 0.723 120.7 61.2 -63.2 -18.3 26.1 3.0 9.3 244 244 A S T 3 S+ 0 0 19 1,-0.2 -1,-0.3 2,-0.1 3,-0.1 0.524 103.0 49.9 -86.0 -5.6 23.1 2.0 7.1 245 245 A V < + 0 0 3 -3,-1.9 -1,-0.2 1,-0.1 6,-0.1 -0.410 58.3 143.3-129.6 59.5 22.7 5.5 5.5 246 246 A P S S+ 0 0 32 0, 0.0 -1,-0.1 0, 0.0 -2,-0.1 0.686 71.4 36.4 -71.1 -17.5 26.2 6.6 4.3 247 247 A T S > S- 0 0 58 -3,-0.1 4,-1.9 1,-0.1 3,-0.4 -0.908 86.6-110.9-133.5 161.1 24.7 8.3 1.2 248 248 A P H > S+ 0 0 43 0, 0.0 4,-2.4 0, 0.0 5,-0.2 0.877 118.3 57.4 -58.0 -36.6 21.5 10.3 0.4 249 249 A A H > S+ 0 0 47 1,-0.2 4,-2.5 2,-0.2 5,-0.2 0.881 106.0 49.5 -62.5 -36.6 20.3 7.4 -1.7 250 250 A D H > S+ 0 0 31 -3,-0.4 4,-2.9 2,-0.2 5,-0.3 0.879 107.0 55.5 -69.0 -37.3 20.5 5.1 1.3 251 251 A V H X S+ 0 0 0 -4,-1.9 4,-2.6 2,-0.2 5,-0.3 0.956 110.2 46.0 -58.7 -48.1 18.6 7.7 3.3 252 252 A T H X S+ 0 0 51 -4,-2.4 4,-2.6 1,-0.2 5,-0.3 0.947 115.3 45.2 -60.7 -49.8 15.8 7.6 0.8 253 253 A R H X S+ 0 0 144 -4,-2.5 4,-1.6 1,-0.2 6,-0.2 0.913 117.2 43.4 -61.9 -45.1 15.6 3.8 0.6 254 254 A E H X>S+ 0 0 34 -4,-2.9 5,-2.4 2,-0.2 6,-1.0 0.901 117.3 45.3 -70.3 -40.3 15.8 3.3 4.3 255 255 A V H ><5S+ 0 0 24 -4,-2.6 3,-0.7 -5,-0.3 -2,-0.2 0.946 116.8 42.8 -69.9 -46.6 13.3 6.0 5.2 256 256 A L H 3<5S+ 0 0 132 -4,-2.6 -1,-0.2 -5,-0.3 -2,-0.2 0.822 114.6 52.9 -69.2 -27.2 10.7 5.2 2.6 257 257 A G H 3<5S- 0 0 24 -4,-1.6 -1,-0.2 -5,-0.3 -2,-0.2 0.611 114.5-117.6 -81.6 -12.8 11.2 1.5 3.3 258 258 A G T <<5S+ 0 0 28 -4,-0.7 -3,-0.2 -3,-0.7 -26,-0.2 0.647 83.2 115.0 87.4 16.0 10.5 2.0 7.0 259 259 A S S > - 0 0 11 -2,-0.5 4,-1.8 25,-0.2 3,-1.3 -0.973 22.0-156.9-124.8 118.1 28.6 12.4 10.1 267 267 A T H 3> S+ 0 0 1 -2,-0.5 4,-2.0 25,-0.3 -163,-0.1 0.767 91.2 71.9 -62.8 -23.0 30.9 14.8 8.4 268 268 A A H 34 S+ 0 0 3 1,-0.2 -168,-0.3 2,-0.2 -1,-0.3 0.850 111.9 27.0 -61.9 -31.5 33.5 12.0 8.4 269 269 A R H <4 S+ 0 0 10 -3,-1.3 -2,-0.2 2,-0.1 -1,-0.2 0.675 136.2 26.3-104.9 -22.3 31.5 10.2 5.7 270 270 A T H X>S- 0 0 15 -4,-1.8 5,-1.5 1,-0.2 4,-0.8 0.339 85.3-160.1-122.9 7.4 29.7 12.9 3.9 271 271 A G T <5 - 0 0 0 -4,-2.0 -1,-0.2 -5,-0.3 -2,-0.1 -0.186 49.8 -58.2 52.4-136.9 31.9 15.9 4.5 272 272 A F T >5S+ 0 0 0 -172,-0.2 4,-1.9 3,-0.1 5,-0.2 0.748 135.7 46.2-109.1 -43.8 30.3 19.3 4.0 273 273 A T H >5S+ 0 0 6 2,-0.2 4,-1.3 1,-0.2 -2,-0.1 0.956 121.5 39.8 -64.4 -48.2 29.0 19.2 0.4 274 274 A G H X5S+ 0 0 12 -4,-0.8 4,-1.8 1,-0.2 -3,-0.2 0.885 113.0 55.0 -68.3 -38.7 27.6 15.7 0.9 275 275 A S H >S+ 0 0 0 -4,-3.1 5,-2.7 2,-0.2 4,-1.7 0.887 114.9 47.9 -63.3 -40.5 16.2 14.9 5.7 283 283 A E H <5S+ 0 0 92 -4,-2.8 -1,-0.2 -5,-0.3 -2,-0.2 0.920 113.0 49.0 -67.0 -41.7 14.7 18.3 6.3 284 284 A G H <5S+ 0 0 66 -4,-2.3 -2,-0.2 -5,-0.2 -1,-0.2 0.874 113.9 44.6 -65.5 -38.5 12.6 18.0 3.1 285 285 A L H <5S- 0 0 80 -4,-2.4 -1,-0.2 -5,-0.2 -2,-0.2 0.770 116.8-116.5 -76.1 -25.6 11.3 14.6 4.1 286 286 A G T <5 + 0 0 58 -4,-1.7 2,-0.3 1,-0.3 -3,-0.2 0.884 62.0 141.9 91.3 47.5 10.6 15.8 7.6 287 287 A L < - 0 0 29 -5,-2.7 -1,-0.3 -6,-0.1 -25,-0.2 -0.913 52.0-110.4-122.4 147.1 13.0 13.7 9.7 288 288 A D E -o 262 0F 55 -27,-0.6 -25,-2.8 -2,-0.3 2,-0.3 -0.394 33.8-163.2 -70.2 150.7 15.1 14.4 12.8 289 289 A M E -o 263 0F 2 24,-0.4 2,-0.4 -27,-0.2 -25,-0.2 -0.995 7.0-165.7-139.3 142.7 18.9 14.5 12.3 290 290 A V E -o 264 0F 4 -27,-1.9 -25,-2.9 -2,-0.3 2,-0.7 -0.987 27.0-118.8-130.9 138.3 21.7 14.3 14.8 291 291 A M E -o 265 0F 0 23,-0.4 29,-2.6 -2,-0.4 -25,-0.2 -0.662 42.2-160.4 -76.8 115.7 25.4 15.1 14.3 292 292 A G - 0 0 0 -27,-2.4 2,-0.4 -2,-0.7 -25,-0.3 -0.389 13.9-119.2 -95.5 174.6 27.2 11.8 15.0 293 293 A N - 0 0 2 -2,-0.1 28,-0.1 -27,-0.1 -27,-0.1 -0.950 8.7-164.7-117.4 131.4 30.8 10.9 16.0 294 294 A Q S S- 0 0 6 -2,-0.4 3,-0.1 26,-0.1 -1,-0.1 -0.006 70.5 -85.4 -99.5 27.5 32.9 8.6 13.8 295 295 A I S S- 0 0 12 1,-0.1 2,-0.1 -266,-0.0 5,-0.1 0.952 76.9-168.9 62.1 50.2 35.3 8.1 16.8 296 296 A D - 0 0 3 1,-0.1 -1,-0.1 4,-0.1 2,-0.1 -0.309 22.9-134.1 -74.0 152.7 36.8 11.3 15.4 297 297 A G > - 0 0 0 -3,-0.1 4,-1.9 -2,-0.1 5,-0.2 -0.280 49.1 -82.9 -89.0-174.7 40.1 13.0 16.4 298 298 A Q H > S+ 0 0 21 1,-0.2 4,-2.1 2,-0.2 5,-0.2 0.816 130.6 58.4 -63.8 -28.4 40.1 16.7 17.0 299 299 A I H > S+ 0 0 0 1,-0.2 4,-1.1 2,-0.2 -1,-0.2 0.953 110.4 42.1 -64.6 -47.6 40.4 17.4 13.3 300 300 A G H > S+ 0 0 4 1,-0.2 4,-2.1 2,-0.2 -2,-0.2 0.816 112.3 54.6 -68.4 -30.3 37.2 15.5 12.6 301 301 A T H X S+ 0 0 0 -4,-1.9 4,-2.5 2,-0.2 5,-0.2 0.869 102.9 55.7 -71.3 -36.8 35.5 17.0 15.6 302 302 A A H X S+ 0 0 1 -4,-2.1 4,-1.4 1,-0.2 -1,-0.2 0.836 109.5 49.2 -62.8 -31.1 36.3 20.5 14.3 303 303 A C H X S+ 0 0 0 -4,-1.1 4,-2.2 2,-0.2 5,-0.2 0.922 107.6 52.9 -73.8 -44.1 34.5 19.5 11.1 304 304 A T H X S+ 0 0 0 -4,-2.1 4,-2.9 1,-0.2 -2,-0.2 0.937 112.8 43.4 -56.8 -48.4 31.5 18.1 12.9 305 305 A V H X S+ 0 0 3 -4,-2.5 4,-1.9 1,-0.2 -1,-0.2 0.830 108.2 59.7 -69.4 -30.7 30.9 21.4 14.8 306 306 A S H < S+ 0 0 4 -4,-1.4 4,-0.4 -5,-0.2 -1,-0.2 0.935 115.6 34.4 -61.3 -44.7 31.6 23.5 11.7 307 307 A F H >X S+ 0 0 0 -4,-2.2 3,-1.2 1,-0.2 4,-0.6 0.934 115.4 54.7 -75.6 -47.8 28.7 21.8 9.9 308 308 A G H >< S+ 0 0 0 -4,-2.9 3,-0.5 1,-0.3 7,-0.3 0.815 106.5 51.3 -57.1 -35.6 26.4 21.3 12.9 309 309 A T T 3< S+ 0 0 0 -4,-1.9 -183,-2.6 1,-0.2 -1,-0.3 0.663 96.9 71.0 -77.2 -15.5 26.4 25.0 13.9 310 310 A A T <4 S+ 0 0 3 -3,-1.2 -185,-0.9 -4,-0.4 2,-0.3 0.779 99.8 45.2 -72.1 -26.6 25.5 26.1 10.4 311 311 A F S+ 0 0 61 -2,-0.3 4,-1.4 1,-0.2 -1,-0.1 0.910 102.6 57.4 -70.1 -43.4 19.0 24.9 13.0 313 313 A R H 4 S+ 0 0 86 1,-0.2 -24,-0.4 2,-0.2 -1,-0.2 0.768 112.7 40.5 -62.0 -27.3 18.0 21.3 12.4 314 314 A T H >4 S+ 0 0 0 -6,-0.2 3,-0.9 -3,-0.1 -23,-0.4 0.835 114.9 50.1 -89.4 -35.7 21.4 20.0 13.4 315 315 A S H 3< S+ 0 0 21 -4,-1.7 -185,-0.3 -7,-0.3 -2,-0.2 0.603 90.8 77.1 -80.3 -8.9 22.0 22.4 16.3 316 316 A R T 3< S+ 0 0 98 -4,-1.4 2,-0.3 -5,-0.1 -1,-0.2 0.680 98.5 51.7 -72.6 -13.9 18.7 21.8 18.0 317 317 A H S < S- 0 0 33 -3,-0.9 -187,-0.3 -28,-0.1 -26,-0.1 -0.825 101.0 -97.6-116.8 157.5 20.2 18.5 19.2 318 318 A A - 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0 0 57 -218,-2.2 7,-0.1 -2,-0.2 -1,-0.1 -0.531 52.2 -87.6 -74.2 149.4 32.9 26.5 16.3 346 346 A R - 0 0 48 5,-0.3 -227,-0.2 -44,-0.2 -1,-0.1 -0.275 26.7-140.9 -59.7 141.9 36.4 27.8 15.8 347 347 A P S S+ 0 0 115 0, 0.0 -1,-0.1 0, 0.0 5,-0.1 0.700 74.4 89.6 -76.9 -19.4 36.7 31.6 15.4 348 348 A G S S- 0 0 22 4,-0.2 -236,-0.0 1,-0.1 5,-0.0 -0.253 89.8 -82.8 -78.4 165.4 39.4 31.4 12.7 349 349 A P S > S- 0 0 58 0, 0.0 3,-1.9 0, 0.0 -232,-0.3 -0.211 99.0 -0.4 -61.9 156.1 38.9 31.1 8.9 350 350 A G B 3 S-f 117 0D 1 -234,-3.2 -232,-2.2 1,-0.3 -231,-0.4 -0.424 142.3 -18.7 63.6-136.3 38.2 27.7 7.4 351 351 A L T 3 S- 0 0 0 -234,-0.2 -5,-0.3 2,-0.2 -1,-0.3 0.574 88.4-125.5 -78.5 -10.1 38.1 25.1 10.1 352 352 A G S < S+ 0 0 20 -3,-1.9 2,-0.3 1,-0.3 -4,-0.2 0.794 71.4 112.5 70.6 28.6 39.9 27.4 12.4 353 353 A I - 0 0 24 -4,-0.2 2,-0.3 -7,-0.1 -1,-0.3 -0.873 48.8-157.9-130.2 163.4 42.6 24.9 13.1 354 354 A E - 0 0 125 -2,-0.3 -21,-2.1 -20,-0.1 2,-0.4 -0.998 22.8-121.5-142.1 138.5 46.3 24.4 12.4 355 355 A I B -P 332 0G 24 -2,-0.3 -23,-0.2 -23,-0.2 3,-0.1 -0.679 25.5-127.1 -83.1 129.3 48.4 21.2 12.3 356 356 A D > - 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