==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=7-JAN-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER OXIDOREDUCTASE 14-DEC-07 3BNU . COMPND 2 MOLECULE: POLYAMINE OXIDASE FMS1; . SOURCE 2 ORGANISM_SCIENTIFIC: SACCHAROMYCES CEREVISIAE; . AUTHOR Q.HUANG,Q.HAO . 996 5 2 2 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 40345.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 700 70.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 69 6.9 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 107 10.7 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 . 10 1.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 2 0.2 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 . 79 7.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 114 11.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 275 27.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 9 0.9 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 7 1 3 2 1 3 4 1 4 2 0 1 1 0 2 0 1 1 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 4 3 9 0 1 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 PARALLEL BRIDGES PER LADDER . 2 6 3 6 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 ANTIPARALLEL BRIDGES PER LADDER . 3 2 0 0 0 0 4 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 8 B K 0 0 89 0, 0.0 2,-0.3 0, 0.0 238,-0.2 0.000 360.0 360.0 360.0 -27.3 63.6 24.0 136.6 2 9 B K E -a 239 0A 70 236,-2.5 238,-1.6 1,-0.1 26,-0.2 -0.837 360.0-142.3-111.0 148.2 61.7 23.4 133.3 3 10 B K E S+ 0 0 75 24,-2.1 238,-2.1 23,-0.5 237,-0.5 0.975 88.9 7.5 -68.1 -55.9 59.5 25.8 131.4 4 11 B V E -a 241 0A 0 23,-0.5 25,-2.3 22,-0.2 2,-0.6 -0.992 59.9-161.5-133.0 135.8 57.0 23.1 130.4 5 12 B I E -ab 242 29A 0 236,-2.2 238,-2.2 -2,-0.4 2,-0.5 -0.971 14.9-159.4-115.8 116.4 56.6 19.5 131.3 6 13 B I E -ab 243 30A 0 23,-3.5 25,-2.9 -2,-0.6 2,-0.7 -0.838 4.2-151.1 -99.0 129.0 54.4 17.5 128.9 7 14 B I E +ab 244 31A 5 236,-3.1 238,-2.4 -2,-0.5 25,-0.2 -0.890 66.2 24.7-103.0 115.6 52.9 14.3 130.1 8 15 B G - 0 0 10 23,-2.6 24,-0.2 -2,-0.7 23,-0.1 0.256 61.6-138.0 105.2 130.9 52.4 11.7 127.4 9 16 B A + 0 0 0 27,-0.2 29,-2.6 4,-0.2 -1,-0.1 -0.140 61.2 120.9-113.0 36.8 54.2 11.3 124.1 10 17 B G B > S-h 38 0B 14 27,-0.2 4,-2.7 28,-0.1 5,-0.2 -0.063 90.3 -76.6 -79.8-167.3 51.2 10.6 121.9 11 18 B I H > S+ 0 0 15 27,-0.5 4,-1.8 1,-0.2 5,-0.2 0.841 134.8 53.9 -64.7 -29.3 50.4 12.8 118.9 12 19 B A H > S+ 0 0 6 2,-0.2 4,-1.8 1,-0.2 -1,-0.2 0.979 113.6 38.5 -66.5 -58.1 49.0 15.4 121.4 13 20 B G H > S+ 0 0 0 1,-0.2 4,-2.2 2,-0.2 -2,-0.2 0.900 116.5 51.7 -61.3 -42.5 52.1 15.6 123.6 14 21 B L H X S+ 0 0 2 -4,-2.7 4,-2.8 1,-0.2 -1,-0.2 0.883 108.2 49.6 -65.2 -39.1 54.5 15.4 120.8 15 22 B K H X S+ 0 0 9 -4,-1.8 4,-3.3 -5,-0.2 -1,-0.2 0.907 109.7 52.9 -67.7 -38.7 53.0 18.2 118.7 16 23 B A H X S+ 0 0 0 -4,-1.8 4,-3.1 2,-0.2 -2,-0.2 0.971 111.8 44.7 -57.4 -55.2 53.0 20.4 121.8 17 24 B A H X S+ 0 0 0 -4,-2.2 4,-2.5 1,-0.2 5,-0.3 0.934 113.8 50.7 -54.4 -47.7 56.7 19.8 122.4 18 25 B S H X S+ 0 0 11 -4,-2.8 4,-2.4 1,-0.2 -1,-0.2 0.925 112.0 48.2 -56.3 -43.7 57.3 20.3 118.7 19 26 B T H X S+ 0 0 2 -4,-3.3 4,-1.3 2,-0.2 -2,-0.2 0.926 109.7 50.9 -64.1 -46.7 55.3 23.6 118.9 20 27 B L H ><>S+ 0 0 0 -4,-3.1 5,-2.1 2,-0.2 3,-0.9 0.953 112.5 45.5 -57.4 -52.4 57.2 24.9 122.0 21 28 B H H ><5S+ 0 0 89 -4,-2.5 3,-2.3 1,-0.3 -1,-0.2 0.954 109.7 56.7 -55.2 -48.4 60.6 24.2 120.4 22 29 B Q H 3<5S+ 0 0 130 -4,-2.4 -1,-0.3 -5,-0.3 -2,-0.2 0.769 106.7 51.1 -54.0 -27.7 59.3 25.8 117.2 23 30 B N T <<5S- 0 0 39 -4,-1.3 -1,-0.3 -3,-0.9 -2,-0.2 0.048 121.7-103.4-101.4 25.9 58.5 28.9 119.3 24 31 B G T < 5S+ 0 0 56 -3,-2.3 2,-0.2 1,-0.2 -3,-0.2 0.511 73.3 141.9 70.5 5.7 61.9 29.3 120.9 25 32 B I < - 0 0 16 -5,-2.1 -1,-0.2 -6,-0.2 2,-0.2 -0.584 27.2-176.9 -80.7 142.7 60.9 27.9 124.3 26 33 B Q + 0 0 135 -2,-0.2 -23,-0.5 1,-0.2 -22,-0.2 -0.716 48.4 56.0-130.0-179.0 63.5 25.7 126.0 27 34 B D S S+ 0 0 84 -2,-0.2 -24,-2.1 1,-0.2 -23,-0.5 0.927 73.9 147.7 59.3 49.2 64.0 23.5 129.1 28 35 B C - 0 0 2 -26,-0.2 2,-0.3 -25,-0.2 -23,-0.2 -0.846 31.1-155.6-116.4 152.5 60.9 21.4 128.4 29 36 B L E -b 5 0A 11 -25,-2.3 -23,-3.5 -2,-0.3 2,-0.4 -0.877 12.2-156.0-126.5 158.9 60.2 17.7 129.1 30 37 B V E -bc 6 210A 0 179,-2.1 181,-2.4 -2,-0.3 2,-0.7 -0.906 14.7-164.5-135.4 101.0 58.1 14.9 127.7 31 38 B L E -bc 7 211A 1 -25,-2.9 -23,-2.6 -2,-0.4 2,-0.5 -0.812 10.9-177.9 -92.9 113.1 57.4 12.2 130.3 32 39 B E E - c 0 212A 12 179,-2.2 182,-2.3 -2,-0.7 181,-0.9 -0.947 24.7-152.4-117.3 126.5 56.0 9.0 128.7 33 40 B A S S+ 0 0 23 -2,-0.5 182,-0.2 180,-0.3 -1,-0.1 0.897 78.1 68.6 -59.0 -45.0 55.0 5.9 130.6 34 41 B R S S- 0 0 26 2,-0.2 179,-2.7 179,-0.1 180,-0.3 -0.037 90.4-115.0 -69.9 176.3 55.7 3.5 127.7 35 42 B D S S+ 0 0 122 177,-0.2 2,-0.3 178,-0.1 -1,-0.1 0.061 98.3 43.4 -98.7 20.4 59.1 2.6 126.3 36 43 B R S S- 0 0 47 0, 0.0 -2,-0.2 0, 0.0 -27,-0.2 -0.957 78.4-121.4-154.7 166.5 58.1 4.3 123.0 37 44 B V S S+ 0 0 36 -2,-0.3 -27,-0.2 1,-0.1 -26,-0.1 -0.429 76.5 74.9-101.2-177.5 56.4 7.4 121.7 38 45 B G B > -h 10 0B 1 -29,-2.6 3,-1.5 -2,-0.2 -27,-0.5 -0.096 64.0-160.7 106.3 -37.9 53.2 7.4 119.5 39 46 B G T 3 S+ 0 0 8 1,-0.3 396,-0.1 -29,-0.2 -29,-0.0 -0.358 79.6 2.6 59.9-128.3 50.6 6.5 122.1 40 47 B R T 3 S+ 0 0 59 -2,-0.1 16,-1.4 1,-0.1 2,-0.6 0.298 121.7 84.9 -75.2 13.9 47.5 5.2 120.3 41 48 B L < + 0 0 13 -3,-1.5 2,-0.4 14,-0.2 -1,-0.1 -0.950 58.7 151.2-114.6 107.3 49.5 5.6 117.1 42 49 B Q - 0 0 61 -2,-0.6 12,-1.1 14,-0.2 13,-1.0 -0.973 31.5-158.7-144.2 127.9 51.5 2.5 116.7 43 50 B T E -I 53 0C 29 -2,-0.4 10,-0.2 10,-0.2 2,-0.2 -0.918 18.5-167.8-107.9 115.0 52.7 0.7 113.5 44 51 B V E -I 52 0C 33 8,-2.2 8,-2.0 -2,-0.6 2,-0.4 -0.597 13.5-129.8-100.9 163.8 53.6 -2.9 114.0 45 52 B T E +I 51 0C 92 6,-0.2 6,-0.2 -2,-0.2 2,-0.1 -0.925 32.5 155.5-116.4 136.8 55.4 -5.4 111.7 46 53 B G > + 0 0 19 4,-2.5 3,-2.1 -2,-0.4 4,-0.2 -0.242 45.9 11.1-129.6-142.8 54.3 -8.8 110.6 47 54 B Y G > S- 0 0 48 1,-0.3 3,-2.8 2,-0.2 -1,-0.3 -0.047 129.5 -5.5 -43.8 134.4 54.7 -11.4 107.8 48 55 B Q G 3 S- 0 0 132 1,-0.3 -1,-0.3 -3,-0.1 -2,-0.0 0.696 127.5 -66.3 49.3 23.7 57.6 -10.6 105.4 49 56 B G G < S+ 0 0 47 -3,-2.1 -1,-0.3 1,-0.2 -2,-0.2 0.628 85.5 163.1 78.9 12.9 58.1 -7.4 107.2 50 57 B R < - 0 0 31 -3,-2.8 -4,-2.5 -4,-0.2 2,-0.3 -0.301 28.5-137.5 -62.1 151.7 54.7 -5.9 106.1 51 58 B K E +I 45 0C 113 -6,-0.2 2,-0.3 2,-0.0 -6,-0.2 -0.843 22.5 178.3-115.5 152.1 53.7 -2.9 108.2 52 59 B Y E -I 44 0C 10 -8,-2.0 -8,-2.2 -2,-0.3 2,-1.3 -0.993 33.5-123.7-152.1 144.3 50.3 -1.9 109.7 53 60 B D E +I 43 0C 6 -2,-0.3 -10,-0.2 -10,-0.2 138,-0.0 -0.701 26.4 179.3 -89.0 90.9 48.8 0.8 111.8 54 61 B I S S+ 0 0 7 -2,-1.3 -1,-0.2 -12,-1.1 -11,-0.1 0.640 78.8 36.6 -67.2 -11.6 47.2 -1.3 114.7 55 62 B G S S- 0 0 10 -13,-1.0 -14,-0.2 1,-0.4 -2,-0.1 0.181 125.9 -2.1-107.0-129.9 46.1 2.1 116.1 56 63 B A + 0 0 32 -16,-1.4 -1,-0.4 1,-0.1 138,-0.2 -0.357 59.6 165.9 -64.3 141.2 45.0 5.0 114.0 57 64 B S + 0 0 4 1,-0.2 134,-2.9 -3,-0.1 2,-0.3 0.661 48.4 61.8-124.6 -37.2 45.1 4.4 110.2 58 65 B W E -J 190 0D 32 132,-0.3 2,-0.7 25,-0.0 132,-0.3 -0.728 64.3-134.7-106.3 151.4 43.1 7.1 108.4 59 66 B H E -J 189 0D 1 130,-3.1 130,-2.6 -2,-0.3 3,-0.3 -0.881 37.3-156.6 -92.9 115.3 43.2 10.8 107.9 60 67 B H + 0 0 39 -2,-0.7 8,-0.2 1,-0.2 5,-0.2 -0.556 63.5 19.7 -94.5 164.2 39.6 11.8 108.4 61 68 B D >> - 0 0 17 125,-0.4 4,-3.3 -2,-0.2 3,-1.6 0.896 67.6-176.4 46.7 53.6 37.8 15.0 107.2 62 69 B T T 34 S+ 0 0 0 125,-1.7 124,-0.2 -3,-0.3 -1,-0.1 0.606 73.6 66.8 -57.7 -11.3 40.5 15.6 104.5 63 70 B L T 34 S+ 0 0 26 122,-1.8 -1,-0.3 124,-0.1 123,-0.1 0.849 124.2 8.5 -77.6 -33.6 38.7 18.9 103.5 64 71 B T T <4 S+ 0 0 58 -3,-1.6 -2,-0.2 121,-0.5 -3,-0.1 0.553 90.9 122.7-121.9 -15.7 39.5 20.6 106.8 65 72 B N X - 0 0 0 -4,-3.3 4,-2.2 120,-0.3 5,-0.2 -0.342 44.7-162.5 -55.1 105.9 41.9 18.2 108.6 66 73 B P H > S+ 0 0 37 0, 0.0 4,-1.8 0, 0.0 -1,-0.2 0.821 86.5 53.2 -62.8 -35.3 45.0 20.4 109.3 67 74 B L H > S+ 0 0 0 2,-0.2 4,-2.4 1,-0.2 5,-0.2 0.940 110.1 48.3 -67.4 -44.6 47.4 17.6 109.9 68 75 B F H > S+ 0 0 0 1,-0.2 4,-2.3 2,-0.2 -1,-0.2 0.927 109.8 52.0 -58.9 -47.0 46.4 15.9 106.6 69 76 B L H X S+ 0 0 71 -4,-2.2 4,-2.2 1,-0.2 -1,-0.2 0.870 108.2 52.1 -58.4 -37.2 46.9 19.2 104.8 70 77 B E H X S+ 0 0 57 -4,-1.8 4,-2.0 1,-0.2 -1,-0.2 0.937 110.5 47.1 -64.8 -44.9 50.3 19.5 106.3 71 78 B E H X S+ 0 0 4 -4,-2.4 4,-2.2 1,-0.2 -2,-0.2 0.830 109.8 56.0 -64.1 -32.4 51.2 16.0 105.1 72 79 B A H X S+ 0 0 4 -4,-2.3 4,-2.6 2,-0.2 -1,-0.2 0.914 104.9 50.5 -66.7 -45.3 49.7 17.0 101.7 73 80 B Q H X S+ 0 0 102 -4,-2.2 4,-3.0 2,-0.2 -2,-0.2 0.961 109.2 51.3 -57.0 -53.9 52.1 20.0 101.4 74 81 B L H X S+ 0 0 44 -4,-2.0 4,-2.7 1,-0.3 5,-0.3 0.944 113.3 45.2 -48.0 -55.4 55.1 17.9 102.2 75 82 B S H X S+ 0 0 14 -4,-2.2 4,-1.8 1,-0.2 -1,-0.3 0.854 110.5 53.9 -59.2 -36.9 54.1 15.4 99.5 76 83 B L H < S+ 0 0 96 -4,-2.6 -1,-0.2 2,-0.2 -2,-0.2 0.932 114.2 43.0 -64.0 -42.6 53.3 18.2 97.1 77 84 B N H < S+ 0 0 123 -4,-3.0 -2,-0.2 1,-0.2 -3,-0.2 0.975 127.5 25.1 -67.1 -58.3 56.9 19.6 97.6 78 85 B D H < S- 0 0 91 -4,-2.7 -3,-0.2 -5,-0.2 -2,-0.2 0.455 94.4-128.5 -90.7 -1.8 59.0 16.4 97.6 79 86 B G < + 0 0 67 -4,-1.8 2,-0.2 -5,-0.3 -4,-0.1 0.563 58.8 141.4 68.6 7.6 56.7 14.1 95.5 80 87 B R - 0 0 31 -6,-0.3 2,-0.6 1,-0.1 -1,-0.2 -0.510 55.6-114.1 -84.1 153.2 56.8 11.3 98.1 81 88 B T + 0 0 113 -2,-0.2 3,-0.1 1,-0.1 -1,-0.1 -0.760 44.0 155.7 -88.4 121.2 53.8 9.1 98.9 82 89 B R + 0 0 58 -2,-0.6 110,-2.1 1,-0.3 2,-0.3 0.386 67.4 3.2-120.7 -4.0 52.5 9.6 102.5 83 90 B F E -K 191 0D 25 108,-0.3 2,-0.4 109,-0.1 -1,-0.3 -0.979 55.7-142.3-172.5 163.8 48.9 8.5 102.0 84 91 B V E -K 190 0D 41 106,-2.1 106,-2.0 -2,-0.3 2,-1.0 -0.999 25.8-121.9-141.2 135.3 46.3 7.1 99.6 85 92 B F + 0 0 46 -2,-0.4 104,-0.2 104,-0.2 -2,-0.0 -0.692 37.2 171.8 -77.9 105.5 42.6 8.0 99.2 86 93 B D + 0 0 5 -2,-1.0 218,-0.2 102,-0.4 -1,-0.1 0.189 22.4 133.7-105.3 16.5 41.0 4.6 99.8 87 94 B D + 0 0 31 101,-0.5 2,-0.3 217,-0.0 527,-0.1 -0.402 33.2 163.3 -61.5 146.4 37.3 5.4 100.0 88 95 B D - 0 0 10 215,-0.1 2,-0.4 526,-0.0 215,-0.1 -0.961 46.7 -73.6-157.3 169.9 35.5 2.9 97.8 89 96 B N - 0 0 31 -2,-0.3 216,-0.4 213,-0.2 2,-0.1 -0.603 59.8-119.0 -72.9 123.8 32.1 1.4 97.0 90 97 B F - 0 0 61 -2,-0.4 2,-0.6 214,-0.1 216,-0.2 -0.384 15.9-148.1 -70.0 141.1 31.3 -0.9 99.9 91 98 B I E -l 306 0E 1 214,-1.7 216,-2.8 -2,-0.1 2,-0.5 -0.943 15.9-161.4-107.7 120.4 30.7 -4.6 99.4 92 99 B Y E -l 307 0E 14 -2,-0.6 8,-2.1 214,-0.2 9,-0.7 -0.900 4.5-164.0-107.3 134.5 28.2 -6.0 101.9 93 100 B I E -lM 308 99E 0 214,-2.8 216,-2.9 -2,-0.5 2,-0.4 -0.966 10.2-168.7-127.1 126.4 28.1 -9.7 102.6 94 101 B D E > - 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0 0 11 -5,-0.8 2,-0.5 1,-0.2 -1,-0.2 0.962 65.5-128.1 61.2 56.9 17.4 15.5 122.1 129 136 B V S S- 0 0 75 -7,-0.1 -1,-0.2 -6,-0.1 -2,-0.1 -0.054 79.3 -27.1 -38.5 87.0 13.9 14.9 123.6 130 137 B S S S- 0 0 109 -2,-0.5 2,-0.2 -3,-0.3 -1,-0.1 0.882 83.3-130.5 62.5 106.0 14.8 11.8 125.6 131 138 B D + 0 0 59 1,-0.0 2,-0.2 46,-0.0 -1,-0.0 -0.528 27.4 179.1 -88.2 153.1 17.7 9.9 124.0 132 139 B C - 0 0 19 -2,-0.2 45,-2.8 1,-0.0 46,-0.4 -0.616 34.9 -70.0-133.9-166.9 17.8 6.2 123.3 133 140 B S B > -S 176 0F 14 43,-0.2 4,-2.0 -2,-0.2 3,-0.3 -0.601 40.6-113.8 -92.4 155.4 20.2 3.6 121.8 134 141 B F H > S+ 0 0 0 41,-2.3 4,-2.1 38,-0.3 5,-0.2 0.861 120.9 58.0 -53.8 -34.2 21.0 3.4 118.1 135 142 B F H > S+ 0 0 22 37,-2.3 4,-2.0 40,-0.3 -1,-0.3 0.934 103.9 49.1 -62.0 -47.2 19.2 0.1 118.3 136 143 B Q H > S+ 0 0 88 -3,-0.3 4,-2.4 36,-0.3 -1,-0.2 0.887 110.1 52.5 -59.0 -41.2 16.0 1.8 119.5 137 144 B L H X S+ 0 0 0 -4,-2.0 4,-2.1 2,-0.2 -1,-0.2 0.903 107.3 50.0 -63.6 -44.5 16.2 4.4 116.8 138 145 B V H X S+ 0 0 1 -4,-2.1 4,-2.3 1,-0.2 -1,-0.2 0.920 111.7 49.7 -62.6 -41.0 16.5 1.8 114.0 139 146 B M H X S+ 0 0 5 -4,-2.0 4,-2.5 1,-0.2 5,-0.2 0.929 108.4 52.2 -63.0 -44.2 13.5 -0.1 115.4 140 147 B K H X S+ 0 0 72 -4,-2.4 4,-2.6 1,-0.2 -1,-0.2 0.904 110.0 50.3 -58.1 -40.3 11.4 3.2 115.6 141 148 B Y H X S+ 0 0 0 -4,-2.1 4,-2.8 2,-0.2 -1,-0.2 0.943 110.1 48.6 -61.5 -50.2 12.3 3.8 111.9 142 149 B L H X S+ 0 0 1 -4,-2.3 4,-1.0 1,-0.2 -2,-0.2 0.889 113.5 47.7 -58.4 -41.4 11.2 0.3 110.8 143 150 B L H < S+ 0 0 30 -4,-2.5 3,-0.4 1,-0.2 4,-0.3 0.928 115.5 44.6 -67.3 -43.7 8.0 0.6 112.7 144 151 B Q H < S+ 0 0 100 -4,-2.6 -2,-0.2 -5,-0.2 3,-0.2 0.832 123.8 32.9 -71.8 -31.9 7.3 4.1 111.2 145 152 B R H >< S+ 0 0 3 -4,-2.8 3,-2.7 -5,-0.2 -1,-0.2 0.311 77.9 114.0-110.3 9.6 8.2 3.3 107.6 146 153 B R G >< S+ 0 0 71 -4,-1.0 3,-2.1 -3,-0.4 -1,-0.1 0.863 72.8 64.2 -45.7 -43.5 7.2 -0.4 107.3 147 154 B Q G 3 S+ 0 0 69 1,-0.3 -1,-0.3 -4,-0.3 -2,-0.1 0.763 107.7 42.1 -54.9 -24.9 4.5 0.7 104.8 148 155 B F G < S+ 0 0 21 -3,-2.7 2,-0.4 2,-0.1 -1,-0.3 0.119 102.5 81.1-112.5 22.7 7.3 1.8 102.5 149 156 B L < - 0 0 9 -3,-2.1 2,-0.0 -7,-0.1 3,-0.0 -0.979 68.9-131.3-130.8 141.1 9.7 -1.1 102.9 150 157 B T > - 0 0 71 -2,-0.4 4,-1.8 -44,-0.1 5,-0.1 -0.182 36.3-100.6 -76.5 178.2 9.9 -4.6 101.4 151 158 B N H > S+ 0 0 90 1,-0.2 4,-1.5 2,-0.2 5,-0.1 0.951 122.6 47.3 -67.2 -48.2 10.4 -7.7 103.5 152 159 B D H > S+ 0 0 53 1,-0.2 4,-3.4 2,-0.2 5,-0.5 0.850 109.0 55.1 -63.2 -33.7 14.1 -8.0 102.6 153 160 B Q H > S+ 0 0 14 1,-0.2 4,-2.0 2,-0.2 -1,-0.2 0.949 108.0 48.0 -65.1 -45.8 14.7 -4.3 103.3 154 161 B I H < S+ 0 0 0 -4,-1.8 -1,-0.2 1,-0.2 -2,-0.2 0.818 117.6 46.2 -62.9 -26.9 13.2 -4.6 106.8 155 162 B R H < S+ 0 0 21 -4,-1.5 4,-0.3 -5,-0.1 -2,-0.2 0.923 124.1 24.6 -82.9 -48.3 15.5 -7.7 107.2 156 163 B Y H >X S+ 0 0 5 -4,-3.4 4,-2.3 2,-0.1 3,-0.9 0.838 105.9 73.4 -90.3 -31.1 18.8 -6.5 105.9 157 164 B L H 3X S+ 0 0 0 -4,-2.0 4,-2.7 -5,-0.5 3,-0.3 0.920 96.4 50.3 -48.7 -55.3 18.7 -2.7 106.4 158 165 B P H 34 S+ 0 0 0 0, 0.0 4,-0.4 0, 0.0 -1,-0.3 0.811 113.4 47.5 -56.6 -27.8 19.1 -2.8 110.2 159 166 B Q H <4 S+ 0 0 20 -3,-0.9 151,-0.3 -4,-0.3 -2,-0.2 0.844 112.8 47.5 -81.0 -33.6 22.1 -5.2 109.8 160 167 B L H >< S+ 0 0 1 -4,-2.3 3,-1.6 -3,-0.3 -3,-0.2 0.934 106.1 56.7 -70.8 -47.0 23.8 -3.1 107.1 161 168 B C G >< S+ 0 0 0 -4,-2.7 3,-1.5 1,-0.3 -1,-0.2 0.682 88.0 79.9 -59.9 -19.1 23.4 0.2 108.9 162 169 B R G > + 0 0 14 -4,-0.4 3,-2.2 1,-0.3 4,-0.4 0.408 60.2 95.3 -72.0 4.9 25.3 -1.2 111.9 163 170 B Y G X S+ 0 0 48 -3,-1.6 3,-2.3 1,-0.3 -1,-0.3 0.829 70.7 75.0 -63.6 -23.8 28.6 -0.6 110.1 164 171 B L G X> S+ 0 0 6 -3,-1.5 4,-1.7 1,-0.3 3,-1.5 0.712 77.2 72.9 -58.3 -21.1 28.4 2.6 112.2 165 172 B E H <>>S+ 0 0 0 -3,-2.2 4,-3.6 1,-0.3 5,-0.9 0.837 93.2 55.6 -62.5 -29.9 29.4 0.4 115.1 166 173 B L H <45S+ 0 0 12 -3,-2.3 -1,-0.3 -4,-0.4 -2,-0.2 0.513 103.5 53.4 -81.0 -5.0 32.8 0.3 113.5 167 174 B W H <45S+ 0 0 66 -3,-1.5 -2,-0.2 -4,-0.2 -1,-0.2 0.787 123.7 26.7 -92.1 -36.4 33.0 4.1 113.6 168 175 B H H <5S- 0 0 14 -4,-1.7 119,-0.2 2,-0.2 -2,-0.2 0.771 98.1-127.4 -96.8 -30.2 32.2 4.2 117.3 169 176 B G T <5S+ 0 0 0 -4,-3.6 117,-1.8 1,-0.3 198,-1.7 0.754 72.2 106.8 86.4 25.5 33.5 0.9 118.5 170 177 B L B > - 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0 0 13 125,-0.5 4,-2.6 -2,-0.2 3,-1.5 0.904 68.3-178.7 47.4 55.8 10.4 14.6 101.3 566 69 A T T 34 + 0 0 0 125,-1.7 124,-0.2 -3,-0.3 -1,-0.1 0.566 69.6 70.1 -63.2 -10.6 8.2 11.6 102.2 567 70 A L T 34 S+ 0 0 13 122,-2.4 -1,-0.3 124,-0.1 123,-0.1 0.828 124.3 6.9 -74.5 -29.9 9.4 11.6 105.8 568 71 A T T <4 S+ 0 0 62 -3,-1.5 -2,-0.2 121,-0.5 -1,-0.1 0.493 88.7 127.1-129.4 -9.8 7.5 14.8 106.5 569 72 A N X - 0 0 1 -4,-2.6 4,-2.2 120,-0.3 5,-0.2 -0.382 44.0-159.1 -56.6 106.9 5.5 15.7 103.4 570 73 A P H > S+ 0 0 36 0, 0.0 4,-1.3 0, 0.0 -1,-0.2 0.762 88.8 52.3 -61.6 -29.9 1.9 16.2 104.8 571 74 A L H > S+ 0 0 0 2,-0.2 4,-2.1 1,-0.2 5,-0.2 0.919 111.1 46.9 -72.3 -45.2 0.2 15.6 101.5 572 75 A F H > S+ 0 0 0 1,-0.2 4,-2.7 2,-0.2 5,-0.2 0.889 107.3 56.8 -63.4 -41.5 2.0 12.3 101.0 573 76 A L H X S+ 0 0 77 -4,-2.2 4,-2.0 1,-0.2 -1,-0.2 0.910 108.0 49.2 -57.6 -40.1 1.2 11.2 104.5 574 77 A E H X S+ 0 0 61 -4,-1.3 4,-2.0 2,-0.2 -2,-0.2 0.945 111.1 47.9 -62.7 -50.9 -2.5 11.7 103.7 575 78 A E H X S+ 0 0 3 -4,-2.1 4,-1.8 1,-0.2 -1,-0.2 0.881 111.7 51.9 -57.2 -39.7 -2.2 9.8 100.5 576 79 A A H X S+ 0 0 3 -4,-2.7 4,-2.2 2,-0.2 -1,-0.2 0.868 105.6 53.7 -66.5 -38.1 -0.4 7.0 102.3 577 80 A Q H X S+ 0 0 101 -4,-2.0 4,-1.2 1,-0.2 -1,-0.2 0.901 108.3 51.2 -63.8 -40.1 -3.1 6.8 105.0 578 81 A L H X S+ 0 0 59 -4,-2.0 4,-1.7 1,-0.2 6,-0.3 0.906 111.2 46.3 -63.8 -43.2 -5.7 6.3 102.3 579 82 A S H X S+ 0 0 17 -4,-1.8 4,-2.2 1,-0.2 -1,-0.2 0.848 107.4 58.3 -69.7 -32.1 -3.7 3.5 100.7 580 83 A L H < S+ 0 0 101 -4,-2.2 -1,-0.2 1,-0.2 -2,-0.2 0.822 113.8 39.2 -66.2 -28.5 -3.1 1.9 104.1 581 84 A N H < S+ 0 0 124 -4,-1.2 -2,-0.2 -3,-0.2 -1,-0.2 0.709 128.1 27.8 -94.7 -22.3 -6.9 1.7 104.6 582 85 A D H < S- 0 0 67 -4,-1.7 -3,-0.2 2,-0.2 -2,-0.2 0.486 89.1-131.5-118.4 -4.8 -8.1 0.7 101.1 583 86 A G < + 0 0 65 -4,-2.2 2,-0.2 1,-0.2 -4,-0.1 0.429 58.0 140.6 71.3 -4.5 -5.2 -1.2 99.6 584 87 A R - 0 0 167 -6,-0.3 2,-0.6 1,-0.1 -1,-0.2 -0.510 56.3-119.5 -73.5 140.9 -5.3 0.9 96.4 585 88 A T + 0 0 109 -2,-0.2 3,-0.1 1,-0.2 -1,-0.1 -0.714 41.4 161.9 -83.1 118.8 -1.9 1.8 94.9 586 89 A R + 0 0 33 -2,-0.6 110,-2.4 1,-0.2 2,-0.3 0.577 63.6 0.0-111.4 -14.6 -1.5 5.6 94.7 587 90 A F E -E 695 0K 23 108,-0.3 2,-0.3 109,-0.1 -1,-0.2 -0.955 56.5-138.9-161.3 175.3 2.3 5.8 94.4 588 91 A V E -E 694 0K 41 106,-1.5 106,-2.4 -2,-0.3 2,-1.0 -0.944 23.3-123.9-152.1 125.7 5.6 3.9 94.1 589 92 A F + 0 0 42 -2,-0.3 104,-0.2 104,-0.2 -2,-0.0 -0.571 37.7 171.1 -69.1 103.9 9.0 4.5 95.7 590 93 A D + 0 0 7 -2,-1.0 -1,-0.1 102,-0.4 218,-0.1 0.098 20.7 135.2-107.4 22.5 11.1 4.6 92.5 591 94 A D + 0 0 32 101,-0.5 2,-0.3 -484,-0.0 -481,-0.1 -0.384 29.9 162.4 -65.6 153.4 14.5 5.8 93.8 592 95 A D - 0 0 10 215,-0.1 2,-0.5 216,-0.1 215,-0.1 -0.952 47.4 -73.9-161.1 173.8 17.3 3.8 92.3 593 96 A N - 0 0 31 -2,-0.3 216,-0.4 213,-0.2 2,-0.1 -0.713 59.8-119.6 -80.4 125.5 21.1 3.7 91.7 594 97 A F - 0 0 65 -2,-0.5 2,-0.6 214,-0.1 216,-0.2 -0.357 13.8-142.1 -69.5 144.7 21.7 6.1 88.8 595 98 A I E -f 810 0L 1 214,-1.8 216,-3.0 -2,-0.1 2,-0.5 -0.938 17.6-158.7-105.8 120.9 23.2 4.9 85.5 596 99 A Y E -f 811 0L 13 -2,-0.6 8,-2.6 214,-0.2 9,-0.6 -0.904 7.7-167.7-106.5 125.7 25.6 7.6 84.2 597 100 A I E -fG 812 603L 0 214,-2.6 216,-2.3 -2,-0.5 2,-0.3 -0.945 10.4-168.5-122.0 126.9 26.4 7.6 80.5 598 101 A D E > - G 0 602L 2 4,-2.4 4,-1.7 -2,-0.5 216,-0.1 -0.776 28.1-127.5-101.9 149.9 29.1 9.4 78.5 599 102 A E T 4 S+ 0 0 56 -2,-0.3 -1,-0.1 214,-0.3 4,-0.1 0.917 105.2 27.4 -66.3 -44.3 28.9 9.4 74.7 600 103 A E T 4 S+ 0 0 133 1,-0.1 -1,-0.2 2,-0.1 215,-0.0 0.855 130.7 38.2 -85.7 -38.3 32.5 8.2 74.1 601 104 A R T 4 S- 0 0 101 1,-0.2 -2,-0.2 3,-0.0 2,-0.2 0.665 89.9-150.0 -90.4 -17.5 33.1 6.3 77.2 602 105 A G E < +G 598 0L 9 -4,-1.7 -4,-2.4 2,-0.0 -1,-0.2 -0.521 62.4 14.6 81.6-153.5 29.7 4.6 77.9 603 106 A R E +G 597 0L 76 -6,-0.2 -6,-0.2 -2,-0.2 -8,-0.0 -0.317 53.7 169.9 -61.7 133.4 28.7 3.9 81.5 604 107 A V > + 0 0 0 -8,-2.6 3,-0.6 -2,-0.0 8,-0.4 0.154 39.0 116.6-127.1 14.3 30.7 5.7 84.2 605 108 A D T 3 S+ 0 0 13 -9,-0.6 3,-0.1 1,-0.2 -10,-0.1 -0.591 82.2 1.7 -88.0 149.5 28.5 4.9 87.2 606 109 A H T 3 S+ 0 0 46 -2,-0.2 2,-0.5 1,-0.2 -1,-0.2 0.871 88.9 171.1 44.4 42.8 29.6 2.8 90.2 607 110 A D <> - 0 0 40 -3,-0.6 4,-2.6 1,-0.1 -1,-0.2 -0.759 36.8-139.8 -90.5 123.5 33.0 2.5 88.5 608 111 A K T 4 S+ 0 0 122 -2,-0.5 -1,-0.1 1,-0.2 -2,-0.1 0.596 100.2 31.1 -56.8 -15.2 35.8 1.0 90.6 609 112 A E T 4 S+ 0 0 82 -521,-0.0 -1,-0.2 0, 0.0 -3,-0.0 0.721 121.2 45.0-112.8 -36.3 38.4 3.5 89.3 610 113 A L T 4 S- 0 0 3 46,-0.1 -2,-0.2 -5,-0.1 44,-0.1 0.875 72.1-174.7 -77.2 -36.3 36.4 6.7 88.6 611 114 A L >X + 0 0 26 -4,-2.6 4,-1.5 1,-0.1 3,-0.6 0.836 17.1 163.2 42.4 41.8 34.5 6.5 91.9 612 115 A L H 3> + 0 0 0 -8,-0.4 4,-2.3 1,-0.2 5,-0.2 0.899 64.8 58.0 -55.0 -47.5 32.5 9.5 90.6 613 116 A E H 3> S+ 0 0 51 1,-0.2 4,-1.5 2,-0.2 -1,-0.2 0.847 105.6 51.8 -53.3 -38.4 29.7 9.1 93.1 614 117 A I H <> S+ 0 0 32 -3,-0.6 4,-1.5 2,-0.2 -1,-0.2 0.910 111.0 43.6 -68.6 -44.9 32.1 9.4 96.0 615 118 A V H X S+ 0 0 1 -4,-1.5 4,-2.6 1,-0.2 -1,-0.2 0.809 108.2 61.5 -72.2 -25.0 33.8 12.6 94.9 616 119 A D H X S+ 0 0 15 -4,-2.3 4,-2.3 -5,-0.2 -1,-0.2 0.920 102.7 50.6 -64.2 -39.8 30.4 13.9 94.1 617 120 A N H X S+ 0 0 55 -4,-1.5 4,-1.8 1,-0.2 -1,-0.2 0.892 110.7 49.0 -63.6 -38.7 29.5 13.5 97.8 618 121 A E H X S+ 0 0 4 -4,-1.5 4,-2.8 2,-0.2 -2,-0.2 0.912 107.0 55.8 -65.7 -42.5 32.7 15.4 98.7 619 122 A M H X S+ 0 0 0 -4,-2.6 4,-2.6 1,-0.2 -2,-0.2 0.943 109.1 46.8 -53.4 -52.1 31.8 18.2 96.2 620 123 A S H X S+ 0 0 37 -4,-2.3 4,-2.4 1,-0.2 -1,-0.2 0.858 111.7 49.5 -62.1 -36.6 28.5 18.6 98.0 621 124 A K H X S+ 0 0 37 -4,-1.8 4,-2.6 2,-0.2 -1,-0.2 0.877 109.1 54.6 -69.4 -34.5 30.1 18.6 101.4 622 125 A F H X S+ 0 0 8 -4,-2.8 4,-2.0 2,-0.2 -2,-0.2 0.954 109.6 46.0 -59.1 -50.3 32.5 21.2 100.0 623 126 A A H X S+ 0 0 3 -4,-2.6 4,-2.0 1,-0.2 -2,-0.2 0.899 110.3 54.7 -58.3 -43.4 29.5 23.3 99.0 624 127 A E H < S+ 0 0 83 -4,-2.4 -1,-0.2 1,-0.2 -2,-0.2 0.927 111.3 43.1 -58.4 -48.0 28.0 22.9 102.4 625 128 A L H < S+ 0 0 52 -4,-2.6 -1,-0.2 1,-0.2 -2,-0.2 0.803 107.6 62.4 -70.5 -26.9 31.1 24.1 104.2 626 129 A E H < S+ 0 0 43 -4,-2.0 -1,-0.2 -5,-0.2 -2,-0.2 0.931 123.6 3.9 -63.1 -47.0 31.4 26.9 101.6 627 130 A F S < S+ 0 0 21 -4,-2.0 4,-0.1 -5,-0.1 7,-0.0 -0.174 91.4 90.2-113.5-150.8 28.1 28.4 102.7 628 131 A H S S+ 0 0 141 2,-0.2 3,-0.1 1,-0.1 54,-0.0 0.800 97.7 19.2 61.2 121.4 25.6 27.4 105.4 629 132 A Q S S+ 0 0 80 1,-0.2 2,-0.4 0, 0.0 -1,-0.1 0.650 103.8 121.7 65.4 11.8 26.0 28.9 108.9 630 133 A H - 0 0 110 3,-0.1 2,-0.4 0, 0.0 3,-0.3 -0.888 50.2-154.8-112.3 140.2 28.0 31.6 107.2 631 134 A L S S+ 0 0 174 -2,-0.4 3,-0.1 1,-0.2 0, 0.0 -0.911 75.3 12.8-113.2 137.8 27.3 35.4 107.1 632 135 A G S S+ 0 0 87 -2,-0.4 2,-0.6 1,-0.3 -1,-0.2 0.722 80.9 149.6 75.1 20.9 28.4 37.8 104.5 633 136 A V - 0 0 44 -3,-0.3 -1,-0.3 1,-0.0 2,-0.1 -0.794 45.6-128.5 -91.2 122.1 29.4 35.0 102.0 634 137 A S - 0 0 106 -2,-0.6 2,-0.1 -3,-0.1 -1,-0.0 -0.435 21.0-133.3 -68.5 138.7 29.0 36.1 98.4 635 138 A D + 0 0 21 -2,-0.1 2,-0.3 46,-0.0 -1,-0.1 -0.288 26.8 176.4 -83.1 174.9 27.0 33.7 96.3 636 139 A C - 0 0 41 -2,-0.1 45,-3.0 43,-0.1 46,-0.4 -0.868 39.4 -63.8-159.6-172.0 28.1 32.6 92.8 637 140 A S B > -M 680 0M 19 -2,-0.3 4,-2.2 43,-0.2 43,-0.2 -0.574 41.1-120.1 -86.3 153.0 26.9 30.3 90.0 638 141 A F H > S+ 0 0 0 41,-2.6 4,-1.9 38,-0.3 39,-0.2 0.883 116.2 58.0 -56.6 -36.5 26.8 26.5 90.7 639 142 A F H > S+ 0 0 46 37,-2.5 4,-2.0 40,-0.3 3,-0.3 0.953 104.9 46.7 -57.0 -55.4 29.2 26.3 87.8 640 143 A Q H > S+ 0 0 38 36,-0.3 4,-2.2 1,-0.2 -1,-0.2 0.893 108.4 57.3 -55.6 -42.1 31.8 28.5 89.4 641 144 A L H X S+ 0 0 2 -4,-2.2 4,-1.9 1,-0.2 -1,-0.2 0.896 107.3 47.8 -56.5 -43.4 31.5 26.6 92.7 642 145 A V H X S+ 0 0 0 -4,-1.9 4,-2.3 -3,-0.3 -1,-0.2 0.863 109.2 53.8 -66.7 -36.4 32.4 23.4 90.9 643 146 A M H X S+ 0 0 12 -4,-2.0 4,-2.0 1,-0.2 -2,-0.2 0.878 108.2 50.5 -65.8 -35.5 35.3 25.1 89.3 644 147 A K H X S+ 0 0 96 -4,-2.2 4,-2.1 2,-0.2 -2,-0.2 0.902 108.6 51.3 -68.5 -42.1 36.6 26.2 92.7 645 148 A Y H X S+ 0 0 0 -4,-1.9 4,-2.0 1,-0.2 5,-0.2 0.954 110.6 49.3 -58.9 -50.4 36.3 22.7 94.1 646 149 A L H X S+ 0 0 0 -4,-2.3 4,-1.0 1,-0.2 -2,-0.2 0.902 112.1 46.4 -56.8 -46.1 38.3 21.2 91.2 647 150 A L H < S+ 0 0 28 -4,-2.0 -1,-0.2 1,-0.2 4,-0.2 0.858 115.1 48.4 -66.2 -34.8 41.1 23.7 91.5 648 151 A Q H < S+ 0 0 115 -4,-2.1 -2,-0.2 1,-0.2 -1,-0.2 0.753 120.9 32.4 -79.8 -25.1 41.3 23.3 95.2 649 152 A R H >< S+ 0 0 6 -4,-2.0 3,-3.8 -5,-0.2 4,-0.3 0.354 78.4 116.7-113.9 6.0 41.3 19.5 95.3 650 153 A R G >< S+ 0 0 59 -4,-1.0 3,-1.6 1,-0.3 -1,-0.1 0.804 71.6 63.8 -41.9 -38.3 43.2 18.8 92.1 651 154 A Q G 3 S+ 0 0 65 1,-0.3 -1,-0.3 -4,-0.2 -2,-0.1 0.695 110.2 38.6 -63.6 -16.5 46.0 17.2 94.2 652 155 A F G < S+ 0 0 22 -3,-3.8 2,-0.4 2,-0.1 -1,-0.3 0.175 103.8 81.3-120.8 17.3 43.5 14.6 95.2 653 156 A L S < S- 0 0 8 -3,-1.6 2,-0.1 -4,-0.3 3,-0.0 -0.953 71.7-129.4-123.6 142.8 41.6 14.0 92.0 654 157 A T > - 0 0 67 -2,-0.4 4,-2.7 -44,-0.1 5,-0.2 -0.422 31.9-104.4 -83.1 165.7 42.6 11.9 89.0 655 158 A N H > S+ 0 0 87 1,-0.2 4,-1.5 2,-0.2 5,-0.1 0.945 122.9 46.3 -54.0 -52.6 42.6 13.3 85.5 656 159 A D H > S+ 0 0 62 1,-0.2 4,-2.6 2,-0.2 5,-0.4 0.808 110.4 54.0 -61.9 -31.4 39.4 11.4 84.6 657 160 A Q H > S+ 0 0 12 1,-0.2 4,-2.4 2,-0.2 -1,-0.2 0.943 107.9 49.6 -68.6 -44.0 37.8 12.5 87.8 658 161 A I H < S+ 0 0 0 -4,-2.7 -2,-0.2 1,-0.2 -1,-0.2 0.780 115.8 45.2 -64.8 -25.4 38.5 16.1 87.0 659 162 A R H < S+ 0 0 37 -4,-1.5 4,-0.4 -5,-0.2 -2,-0.2 0.937 123.8 27.5 -83.3 -50.1 37.0 15.6 83.6 660 163 A Y H >X S+ 0 0 9 -4,-2.6 4,-1.9 2,-0.1 3,-0.5 0.796 105.1 71.1 -85.4 -31.8 33.8 13.7 84.3 661 164 A L H 3X S+ 0 0 1 -4,-2.4 4,-2.9 -5,-0.4 3,-0.4 0.937 96.5 53.2 -53.0 -51.2 32.9 14.8 87.9 662 165 A P H 3> S+ 0 0 1 0, 0.0 4,-0.6 0, 0.0 -1,-0.2 0.850 110.5 48.3 -54.3 -34.5 31.8 18.3 86.8 663 166 A Q H <4 S+ 0 0 23 -3,-0.5 151,-0.3 -4,-0.4 -2,-0.2 0.825 112.5 47.0 -75.9 -32.3 29.5 16.8 84.2 664 167 A L H >< S+ 0 0 0 -4,-1.9 3,-2.1 -3,-0.4 4,-0.2 0.898 102.2 64.3 -74.3 -40.6 27.9 14.3 86.6 665 168 A C H >< S+ 0 0 0 -4,-2.9 3,-1.4 1,-0.3 -1,-0.2 0.771 88.1 75.5 -50.7 -28.4 27.5 17.0 89.3 666 169 A R G >X + 0 0 13 -4,-0.6 3,-2.5 1,-0.3 4,-0.5 0.471 59.7 94.5 -69.9 -1.4 25.1 18.7 86.9 667 170 A Y G X4 S+ 0 0 63 -3,-2.1 3,-1.3 1,-0.3 -1,-0.3 0.834 76.0 72.3 -58.9 -23.6 22.2 16.2 87.4 668 171 A L G X> S+ 0 0 15 -3,-1.4 3,-1.8 1,-0.3 4,-0.9 0.707 78.2 73.1 -62.6 -20.7 21.2 18.9 89.9 669 172 A E H X>>S+ 0 0 0 -3,-2.5 4,-3.4 1,-0.3 5,-1.1 0.884 92.0 57.7 -61.2 -36.4 20.2 21.2 87.0 670 173 A L H <<5S+ 0 0 9 -3,-1.3 -1,-0.3 -4,-0.5 -2,-0.2 0.453 100.4 55.7 -75.1 0.2 17.2 19.0 86.5 671 174 A W H <45S+ 0 0 78 -3,-1.8 -1,-0.2 3,-0.2 -2,-0.2 0.671 121.0 29.0 -99.5 -21.3 16.1 19.6 90.1 672 175 A H H <<5S- 0 0 20 -4,-0.9 119,-0.2 -3,-0.7 -2,-0.2 0.686 98.7-127.8-106.2 -28.3 16.1 23.4 89.5 673 176 A G T <5S+ 0 0 0 -4,-3.4 117,-2.0 1,-0.3 198,-1.5 0.749 72.9 109.9 81.8 26.4 15.3 23.6 85.8 674 177 A L B > - 0 0 27 196,-0.8 3,-2.0 -2,-0.3 4,-1.3 -0.383 39.0-110.3 -67.9 147.2 21.7 25.5 83.6 676 179 A W T 34 S+ 0 0 17 1,-0.3 -37,-2.5 2,-0.2 -38,-0.3 0.668 116.7 55.5 -56.8 -18.5 24.7 25.4 86.0 677 180 A K T 34 S+ 0 0 124 -39,-0.2 -1,-0.3 1,-0.2 -37,-0.1 0.671 112.2 42.3 -88.1 -15.5 25.9 28.9 84.9 678 181 A L T <4 S+ 0 0 84 -3,-2.0 2,-0.4 193,-0.1 -2,-0.2 0.557 96.5 100.7-101.4 -13.5 22.6 30.5 85.6 679 182 A L S < S- 0 0 0 -4,-1.3 -41,-2.6 262,-0.2 2,-0.4 -0.590 75.2-122.1 -84.2 130.2 22.0 28.7 88.9 680 183 A S B >> -M 637 0M 0 260,-2.2 3,-0.8 -2,-0.4 4,-0.7 -0.515 14.9-151.8 -66.3 121.2 22.6 30.2 92.4 681 184 A A H >> S+ 0 0 3 -45,-3.0 3,-1.0 -2,-0.4 4,-0.7 0.880 93.9 64.1 -63.6 -37.3 25.2 28.0 94.2 682 185 A K H 34 S+ 0 0 104 -46,-0.4 -1,-0.2 1,-0.3 -54,-0.1 0.826 113.5 34.9 -55.6 -30.2 23.8 29.0 97.5 683 186 A D H <4 S+ 0 0 44 -3,-0.8 -1,-0.3 257,-0.1 -2,-0.2 0.452 95.0 89.4-103.3 -3.1 20.6 27.3 96.5 684 187 A T H << S+ 0 0 1 -3,-1.0 -2,-0.1 -4,-0.7 2,-0.1 0.988 87.1 45.1 -58.9 -64.1 22.0 24.4 94.5 685 188 A Y S < S+ 0 0 50 -4,-0.7 2,-0.3 -65,-0.1 -65,-0.0 -0.439 70.3 147.7 -81.0 155.4 22.3 21.9 97.3 686 189 A F - 0 0 97 -2,-0.1 2,-0.2 2,-0.0 -3,-0.0 -0.949 44.7 -77.5-176.0 162.7 19.7 21.3 99.9 687 190 A G - 0 0 41 -2,-0.3 2,-0.6 2,-0.0 -570,-0.0 -0.510 25.7-157.3 -81.2 139.6 18.1 18.7 102.1 688 191 A H - 0 0 60 -2,-0.2 2,-2.1 -124,-0.0 4,-0.0 -0.964 16.0-142.0-111.4 117.8 15.7 16.0 101.0 689 192 A Q - 0 0 45 -2,-0.6 -122,-2.4 2,-0.0 -121,-0.5 -0.453 65.5 -51.5 -80.9 68.4 13.6 14.6 103.9 690 193 A G S S- 0 0 8 -2,-2.1 -125,-0.5 -124,-0.2 -124,-0.1 -0.363 91.5 -21.4 97.9-177.3 13.7 11.0 102.8 691 194 A R - 0 0 18 -126,-0.1 -125,-1.7 -127,-0.1 2,-0.3 -0.050 60.1-113.6 -66.4 167.1 12.9 9.1 99.6 692 195 A N - 0 0 18 -127,-0.1 2,-0.5 -128,-0.1 -101,-0.5 -0.776 19.1-150.6-102.2 147.5 10.7 10.2 96.7 693 196 A A E -D 563 0K 0 -130,-2.4 -130,-3.3 -2,-0.3 2,-0.5 -0.982 14.4-135.5-123.3 118.5 7.4 8.6 95.8 694 197 A F E -DE 562 588K 13 -106,-2.4 -106,-1.5 -2,-0.5 -132,-0.3 -0.605 24.9-125.5 -74.2 118.1 6.3 8.6 92.1 695 198 A A E - E 0 587K 1 -134,-3.1 2,-0.8 -2,-0.5 3,-0.3 -0.453 8.7-150.3 -67.9 132.4 2.6 9.6 91.9 696 199 A L S S- 0 0 75 -110,-2.4 -1,-0.1 1,-0.4 -109,-0.1 -0.475 91.2 -5.6-101.9 59.0 0.6 7.0 90.0 697 200 A N >> - 0 0 10 -2,-0.8 3,-1.0 -136,-0.2 4,-0.6 0.584 60.2-170.2 118.4 86.3 -1.7 9.7 88.9 698 201 A Y H >> S+ 0 0 3 -3,-0.3 4,-2.1 1,-0.3 3,-1.7 0.875 94.5 65.5 -66.3 -30.7 -1.1 13.2 90.5 699 202 A D H 3> S+ 0 0 41 1,-0.3 4,-2.1 2,-0.2 -1,-0.3 0.739 92.2 62.4 -59.2 -21.8 -4.5 13.9 88.8 700 203 A S H <> S+ 0 0 53 -3,-1.0 4,-1.3 2,-0.2 -1,-0.3 0.796 104.0 46.0 -73.0 -30.4 -5.8 11.3 91.3 701 204 A V H < S+ 0 0 3 -4,-1.8 3,-1.0 1,-0.2 -1,-0.2 0.914 113.0 51.7 -67.9 -40.1 -9.3 17.5 96.9 706 209 A A H >< S+ 0 0 6 -4,-2.4 3,-0.7 1,-0.2 -1,-0.2 0.847 109.8 50.3 -63.1 -35.8 -11.6 19.0 94.3 707 210 A Q H 3< S+ 0 0 125 -4,-2.4 -1,-0.2 1,-0.2 -2,-0.2 0.540 90.8 79.9 -82.4 -5.5 -14.4 16.6 95.3 708 211 A S T << S+ 0 0 47 -3,-1.0 -1,-0.2 -4,-0.5 -2,-0.1 0.229 93.6 47.6 -87.0 14.0 -14.0 17.5 99.1 709 212 A F S < S- 0 0 6 -3,-0.7 -187,-0.1 -184,-0.1 4,-0.1 -0.977 107.7 -59.3-148.1 159.5 -16.0 20.8 98.8 710 213 A P > - 0 0 36 0, 0.0 3,-1.8 0, 0.0 4,-0.4 -0.129 42.2-147.1 -43.4 119.4 -19.3 22.0 97.3 711 214 A Q G > S+ 0 0 113 1,-0.3 3,-0.5 2,-0.2 -3,-0.0 0.651 94.8 66.0 -66.3 -16.3 -19.1 21.4 93.5 712 215 A N G 3 S+ 0 0 126 1,-0.2 -1,-0.3 3,-0.0 0, 0.0 0.558 88.0 72.1 -82.7 -4.9 -21.2 24.5 92.8 713 216 A W G < S+ 0 0 12 -3,-1.8 -179,-2.3 -180,-0.1 2,-0.5 0.803 79.1 89.7 -75.2 -31.0 -18.2 26.5 94.1 714 217 A L E < +w 534 0H 50 -3,-0.5 2,-0.5 -4,-0.4 -179,-0.2 -0.567 49.0 177.1 -78.1 120.3 -16.1 25.7 91.1 715 218 A K E -w 535 0H 57 -181,-2.8 -179,-2.2 -2,-0.5 3,-0.5 -0.900 10.8-171.6-122.8 98.7 -16.3 28.1 88.1 716 219 A L + 0 0 60 -2,-0.5 -177,-0.2 1,-0.2 -179,-0.2 -0.335 64.0 36.3 -82.1 171.4 -13.8 27.1 85.4 717 220 A S S S+ 0 0 80 -179,-2.5 2,-0.6 -181,-0.5 -180,-0.3 0.735 81.4 121.7 58.0 26.0 -13.1 29.2 82.3 718 221 A b - 0 0 1 -182,-1.9 2,-0.5 -3,-0.5 -1,-0.2 -0.959 46.5-161.7-118.9 109.5 -13.3 32.5 84.1 719 222 A E - 0 0 16 -2,-0.6 17,-2.4 -182,-0.2 2,-0.5 -0.803 18.2-132.0 -90.2 126.7 -10.1 34.5 83.8 720 223 A V E +X 735 0H 7 -2,-0.5 15,-0.2 15,-0.2 3,-0.1 -0.712 25.9 179.1 -83.9 128.1 -9.9 37.1 86.5 721 224 A K E + 0 0 110 13,-2.6 49,-2.8 -2,-0.5 2,-0.3 0.705 60.4 10.9 -99.5 -28.2 -8.9 40.5 85.1 722 225 A S E -Xy 734 770H 18 12,-1.1 12,-2.1 47,-0.3 2,-0.4 -0.999 47.8-159.5-157.1 152.4 -9.0 42.7 88.2 723 226 A I E -Xy 733 771H 0 47,-2.4 49,-2.0 -2,-0.3 2,-0.4 -0.999 17.6-175.1-132.4 126.4 -9.2 42.8 92.0 724 227 A T E -Xy 732 772H 38 8,-2.3 8,-2.8 -2,-0.4 2,-0.7 -0.984 19.7-141.9-130.0 130.6 -10.2 45.9 93.9 725 228 A R E -X 731 0H 53 47,-2.5 6,-0.2 -2,-0.4 -2,-0.0 -0.792 18.8-143.8 -90.7 118.8 -10.3 46.6 97.6 726 229 A E E >> -X 730 0H 58 4,-3.7 3,-2.2 -2,-0.7 4,-1.4 -0.714 14.3-133.1 -80.8 123.1 -13.4 48.7 98.5 727 230 A P T 34 S+ 0 0 137 0, 0.0 -1,-0.1 0, 0.0 4,-0.1 0.554 103.9 75.5 -55.4 0.6 -12.4 51.1 101.3 728 231 A S T 34 S- 0 0 91 2,-0.1 3,-0.1 0, 0.0 -2,-0.0 0.207 125.8 -92.5 -94.9 12.7 -15.7 49.8 102.7 729 232 A K T <4 S+ 0 0 13 -3,-2.2 2,-0.3 1,-0.3 -4,-0.0 0.860 90.8 105.7 81.2 37.1 -14.1 46.5 103.7 730 233 A N E < -X 726 0H 25 -4,-1.4 -4,-3.7 2,-0.0 2,-0.5 -0.950 57.7-134.1-143.7 163.7 -14.9 44.5 100.6 731 234 A V E -XZ 725 743H 0 12,-2.3 12,-2.5 -2,-0.3 2,-0.5 -0.978 12.2-155.3-125.6 125.2 -13.2 43.0 97.6 732 235 A T E -XZ 724 742H 22 -8,-2.8 -8,-2.3 -2,-0.5 2,-0.5 -0.843 9.6-166.1 -99.6 132.0 -14.6 43.2 94.0 733 236 A V E -XZ 723 741H 0 8,-2.9 8,-2.0 -2,-0.5 2,-0.5 -0.974 2.9-159.0-120.9 123.8 -13.5 40.5 91.6 734 237 A N E -XZ 722 740H 36 -12,-2.1 -13,-2.6 -2,-0.5 -12,-1.1 -0.894 3.4-154.0-108.2 126.0 -14.1 40.9 87.8 735 238 A b E > -X 720 0H 0 4,-2.5 3,-1.7 -2,-0.5 -15,-0.2 -0.564 29.9-115.0 -87.0 158.1 -14.1 37.9 85.4 736 239 A E T 3 S+ 0 0 120 -17,-2.4 -16,-0.1 1,-0.3 -1,-0.1 0.827 114.8 64.4 -64.5 -29.8 -13.2 38.5 81.8 737 240 A D T 3 S- 0 0 76 -18,-0.2 -1,-0.3 1,-0.1 -17,-0.1 0.424 122.0-106.0 -73.1 2.3 -16.8 37.5 80.8 738 241 A G S < S+ 0 0 51 -3,-1.7 -2,-0.1 1,-0.3 2,-0.1 0.243 73.4 139.5 94.7 -15.5 -18.0 40.5 82.7 739 242 A T - 0 0 51 -5,-0.1 -4,-2.5 1,-0.0 2,-0.4 -0.430 38.2-152.7 -66.6 138.6 -19.4 38.9 85.8 740 243 A V E - Z 0 734H 55 -6,-0.2 -236,-0.8 -2,-0.1 2,-0.3 -0.894 12.2-172.7-115.1 142.8 -18.6 40.8 88.9 741 244 A Y E -uZ 504 733H 26 -8,-2.0 -8,-2.9 -2,-0.4 2,-0.4 -0.956 11.6-156.6-133.1 153.2 -18.3 39.4 92.5 742 245 A N E +uZ 505 732H 19 -238,-2.8 -236,-2.5 -2,-0.3 2,-0.3 -0.997 22.2 168.2-129.6 132.6 -17.9 41.0 95.9 743 246 A A E -uZ 506 731H 0 -12,-2.5 -12,-2.3 -2,-0.4 -236,-0.2 -0.973 42.8-127.4-144.9 158.8 -16.4 39.0 98.7 744 247 A D E S+ 0 0 33 -238,-1.3 2,-0.3 -237,-0.5 -236,-0.2 0.888 96.1 13.2 -72.6 -40.3 -15.0 39.5 102.2 745 248 A Y E -u 508 0H 23 -238,-1.9 -236,-2.4 -239,-0.2 2,-0.4 -0.967 62.4-162.6-136.4 152.9 -11.7 37.8 101.5 746 249 A V E -ua 509 961H 0 214,-2.5 216,-2.7 -2,-0.3 2,-0.6 -0.997 7.2-155.4-134.4 139.7 -9.9 36.6 98.4 747 250 A I E -ua 510 962H 0 -238,-2.2 -236,-2.8 -2,-0.4 2,-0.7 -0.972 13.8-155.7-115.4 116.5 -7.0 34.1 98.2 748 251 A I E +ua 511 963H 1 214,-3.0 216,-2.1 -2,-0.6 -236,-0.1 -0.829 23.1 164.3 -97.6 114.7 -4.9 34.6 95.1 749 252 A T + 0 0 12 -238,-2.0 217,-0.2 -2,-0.7 -232,-0.2 0.169 23.7 135.3-115.3 18.7 -3.0 31.5 93.9 750 253 A V - 0 0 19 1,-0.1 214,-0.1 215,-0.1 5,-0.1 -0.303 68.1 -81.5 -65.1 156.2 -1.9 32.4 90.4 751 254 A P >> - 0 0 19 0, 0.0 4,-2.7 0, 0.0 3,-0.7 -0.191 35.0-117.4 -57.0 147.8 1.7 31.5 89.5 752 255 A Q H 3> S+ 0 0 4 1,-0.3 4,-1.7 2,-0.2 5,-0.1 0.846 116.7 54.4 -53.9 -38.9 4.5 34.0 90.5 753 256 A S H 34 S+ 0 0 18 180,-0.3 4,-0.4 1,-0.2 -1,-0.3 0.835 112.2 45.0 -67.1 -30.2 5.4 34.6 86.9 754 257 A V H X4 S+ 0 0 3 -3,-0.7 3,-1.1 2,-0.2 4,-0.4 0.895 110.3 51.1 -78.8 -42.4 1.7 35.5 86.2 755 258 A L H >< S+ 0 0 2 -4,-2.7 3,-1.5 1,-0.3 4,-0.3 0.829 101.0 67.3 -63.1 -29.1 1.3 37.7 89.3 756 259 A N G >< S+ 0 0 42 -4,-1.7 3,-1.4 -5,-0.3 -1,-0.3 0.787 85.7 68.0 -61.1 -30.6 4.5 39.5 88.1 757 260 A L G X S+ 0 0 15 -3,-1.1 3,-1.3 -4,-0.4 -1,-0.3 0.796 85.2 72.9 -60.3 -28.0 2.6 40.8 85.1 758 261 A S G < S+ 0 0 17 -3,-1.5 -1,-0.3 -4,-0.4 13,-0.2 0.765 87.4 61.4 -57.9 -28.8 0.6 43.0 87.6 759 262 A V G < S+ 0 0 43 -3,-1.4 -1,-0.3 -4,-0.3 -2,-0.1 0.025 98.5 74.5 -89.3 28.4 3.6 45.2 88.1 760 263 A Q S < S- 0 0 81 -3,-1.3 2,-0.2 2,-0.1 -3,-0.0 -0.984 84.4-106.3-142.0 150.9 3.7 46.2 84.5 761 264 A P S S+ 0 0 122 0, 0.0 -2,-0.1 0, 0.0 -3,-0.0 -0.519 82.1 70.4 -76.2 143.7 1.7 48.5 82.1 762 265 A E - 0 0 113 -2,-0.2 3,-0.3 -4,-0.1 -2,-0.1 0.535 50.9-164.1 111.1 100.7 -0.6 46.7 79.6 763 266 A K S S+ 0 0 66 1,-0.2 2,-0.1 7,-0.0 7,-0.1 0.458 73.9 84.8 -90.9 -1.1 -3.7 45.0 80.9 764 267 A N + 0 0 114 2,-0.1 2,-0.4 3,-0.0 -1,-0.2 -0.098 62.2 115.5 -93.1 37.5 -4.3 42.9 77.8 765 268 A L S > S- 0 0 55 -3,-0.3 3,-1.5 -2,-0.1 -3,-0.0 -0.902 77.5-100.8-106.9 133.7 -1.9 40.1 78.7 766 269 A R T 3 S+ 0 0 89 -2,-0.4 -2,-0.1 1,-0.2 -45,-0.0 -0.288 104.1 5.7 -54.4 124.8 -3.3 36.6 79.4 767 270 A G T 3 S+ 0 0 7 1,-0.3 -1,-0.2 165,-0.0 -47,-0.1 0.056 90.7 138.8 92.2 -25.0 -3.6 36.0 83.1 768 271 A R < - 0 0 15 -3,-1.5 2,-0.5 -11,-0.1 -1,-0.3 -0.253 39.3-151.5 -59.6 137.2 -2.7 39.4 84.3 769 272 A I - 0 0 4 -15,-0.3 2,-0.7 -14,-0.1 -47,-0.3 -0.941 8.4-139.6-113.4 128.3 -4.7 40.9 87.2 770 273 A E E -y 722 0H 69 -49,-2.8 -47,-2.4 -2,-0.5 2,-0.4 -0.774 23.6-154.3 -86.7 117.3 -5.1 44.7 87.6 771 274 A F E -y 723 0H 6 -2,-0.7 -47,-0.2 -13,-0.2 4,-0.1 -0.812 2.2-141.0 -99.1 133.6 -4.8 45.5 91.3 772 275 A Q E S+y 724 0H 89 -49,-2.0 -47,-2.5 -2,-0.4 -2,-0.0 -0.963 99.5 26.1-139.5 115.5 -6.4 48.5 92.9 773 276 A P S S- 0 0 71 0, 0.0 -1,-0.2 0, 0.0 3,-0.1 0.643 119.0-111.5 -66.4 160.8 -4.7 49.8 94.9 774 277 A P - 0 0 76 0, 0.0 -2,-0.1 0, 0.0 -15,-0.1 -0.081 46.3 -71.5 -58.0 163.3 -1.7 48.4 93.1 775 278 A L - 0 0 6 -17,-0.1 5,-0.1 1,-0.1 182,-0.0 -0.338 62.9 -99.8 -58.1 132.5 0.5 45.7 94.8 776 279 A K >> - 0 0 81 1,-0.1 4,-2.1 -3,-0.1 3,-0.9 -0.120 30.3-111.3 -52.4 148.6 2.4 47.2 97.7 777 280 A P H 3> S+ 0 0 87 0, 0.0 4,-2.3 0, 0.0 5,-0.2 0.774 116.0 65.3 -54.7 -27.9 6.1 48.1 97.0 778 281 A V H 3> S+ 0 0 92 2,-0.2 4,-0.8 1,-0.2 174,-0.1 0.945 109.0 38.3 -60.1 -47.1 7.2 45.3 99.3 779 282 A I H X> S+ 0 0 0 -3,-0.9 3,-0.9 2,-0.2 4,-0.8 0.954 114.1 53.5 -68.4 -53.4 5.6 42.7 96.9 780 283 A Q H >< S+ 0 0 73 -4,-2.1 3,-1.0 1,-0.3 -2,-0.2 0.895 110.4 47.4 -48.3 -49.8 6.6 44.4 93.6 781 284 A D H >X S+ 0 0 91 -4,-2.3 3,-1.6 1,-0.2 4,-0.5 0.715 97.5 69.3 -69.9 -22.7 10.3 44.6 94.6 782 285 A A H X< S+ 0 0 5 -3,-0.9 3,-0.8 -4,-0.8 167,-0.3 0.767 85.4 71.5 -67.1 -22.3 10.4 41.0 95.7 783 286 A F T << S+ 0 0 13 -3,-1.0 3,-0.4 -4,-0.8 -1,-0.3 0.691 92.9 57.2 -65.5 -16.8 10.0 40.1 92.0 784 287 A D T <4 S+ 0 0 113 -3,-1.6 -1,-0.2 1,-0.2 -2,-0.2 0.758 106.0 48.5 -83.8 -26.8 13.6 41.4 91.6 785 288 A K S << S+ 0 0 98 -3,-0.8 160,-2.6 -4,-0.5 2,-0.3 0.207 111.4 46.3-100.9 15.3 15.0 38.9 94.1 786 289 A I - 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