==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=26-NOV-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER GLYCOSYLTRANSFERASE 03-FEB-93 1CYG . COMPND 2 MOLECULE: CYCLODEXTRIN GLUCANOTRANSFERASE; . SOURCE 2 ORGANISM_SCIENTIFIC: GEOBACILLUS STEAROTHERMOPHILUS; . AUTHOR M.KUBOTA,Y.MATSUURA,S.SAKAI,Y.KATSUBE . 680 1 1 1 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 23500.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 423 62.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 50 7.4 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 115 16.9 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 1 0.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 3 0.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 4 0.6 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 0.1 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 . 46 6.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 69 10.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 104 15.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 7 1.0 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 0 2 0 0 0 2 0 1 1 2 1 2 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 5 3 1 4 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 0 PARALLEL BRIDGES PER LADDER . 6 3 5 3 2 3 0 2 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 2 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 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 A 0 0 95 0, 0.0 2,-0.3 0, 0.0 122,-0.1 0.000 360.0 360.0 360.0 167.9 29.4 96.6 73.8 2 2 A G - 0 0 60 120,-0.4 2,-1.1 0, 0.0 123,-0.1 -0.962 360.0 -12.9 161.0-146.8 33.2 96.1 73.8 3 3 A N - 0 0 139 -2,-0.3 2,-0.1 122,-0.0 0, 0.0 -0.703 69.4-153.5 -86.9 94.6 36.1 97.6 71.9 4 4 A L - 0 0 58 -2,-1.1 2,-0.7 122,-0.1 122,-0.0 -0.460 8.1-133.5 -71.3 148.0 34.4 99.5 69.1 5 5 A N > - 0 0 25 3,-0.2 3,-0.6 1,-0.1 122,-0.1 -0.921 20.7-176.9-109.2 111.1 36.4 100.0 65.9 6 6 A K T 3 S+ 0 0 38 -2,-0.7 243,-1.5 1,-0.2 -1,-0.1 0.579 84.5 42.9 -80.2 -14.7 36.3 103.6 64.6 7 7 A V T 3 S+ 0 0 14 1,-0.2 2,-0.3 241,-0.2 -1,-0.2 0.194 107.4 60.5-117.0 13.0 38.4 102.9 61.5 8 8 A N < + 0 0 11 -3,-0.6 -1,-0.2 1,-0.1 -3,-0.2 -0.777 44.0 152.4-145.1 99.8 36.9 99.6 60.4 9 9 A F > + 0 0 1 -2,-0.3 3,-2.5 1,-0.1 -1,-0.1 0.299 43.5 107.0-106.7 2.3 33.2 99.4 59.5 10 10 A T T 3 S+ 0 0 0 1,-0.3 -1,-0.1 341,-0.1 340,-0.0 0.737 82.8 48.8 -56.0 -28.3 33.3 96.5 57.0 11 11 A S T 3 S+ 0 0 41 -3,-0.2 -1,-0.3 340,-0.1 2,-0.2 0.221 99.1 99.9 -96.9 13.4 31.6 94.2 59.5 12 12 A D < - 0 0 11 -3,-2.5 2,-0.5 389,-0.1 56,-0.1 -0.583 60.5-144.2-103.3 162.2 28.8 96.7 60.3 13 13 A V - 0 0 3 -2,-0.2 56,-2.0 54,-0.2 57,-1.7 -0.977 25.5-148.1-122.1 112.4 25.2 97.3 59.4 14 14 A V E -ab 70 353A 3 338,-3.9 340,-4.0 -2,-0.5 2,-0.5 -0.714 11.4-164.3 -97.3 140.2 24.3 100.9 59.1 15 15 A Y E -ab 71 354A 0 55,-2.1 57,-2.6 -2,-0.4 2,-0.6 -0.974 14.0-151.5-116.3 102.1 20.9 102.4 59.9 16 16 A Q E -ab 72 355A 4 338,-3.1 340,-2.9 -2,-0.5 2,-0.5 -0.696 15.3-172.7 -92.4 119.8 20.5 106.0 58.5 17 17 A I E -a 73 0A 2 55,-2.8 2,-0.9 -2,-0.6 57,-0.7 -0.932 25.3-153.7-116.8 130.3 18.1 108.2 60.4 18 18 A V > - 0 0 10 -2,-0.5 3,-2.2 55,-0.2 31,-0.1 -0.901 27.1-147.9-103.4 93.0 16.8 111.6 59.6 19 19 A V G >> S+ 0 0 1 -2,-0.9 3,-2.1 1,-0.3 4,-0.5 0.735 87.2 59.5 -26.4 -62.3 16.2 112.7 63.2 20 20 A D G 34 S+ 0 0 2 73,-0.4 29,-2.9 1,-0.3 -1,-0.3 0.719 112.5 40.8 -49.4 -35.0 13.3 115.0 62.8 21 21 A R G <4 S+ 0 0 0 -3,-2.2 353,-3.0 27,-0.2 -1,-0.3 0.109 101.9 72.9-104.4 15.9 11.2 112.1 61.3 22 22 A F T <4 S- 0 0 3 -3,-2.1 2,-0.3 1,-0.3 352,-0.2 0.902 107.2 -29.3 -90.7 -82.1 12.2 109.2 63.5 23 23 A V < - 0 0 27 -4,-0.5 27,-1.5 27,-0.3 2,-1.2 -0.992 47.6-132.7-140.5 134.9 10.7 109.4 67.0 24 24 A D + 0 0 57 -2,-0.3 3,-0.2 25,-0.3 25,-0.2 -0.817 35.7 166.4 -93.2 93.0 9.7 112.5 69.1 25 25 A G S S+ 0 0 26 -2,-1.2 2,-0.4 1,-0.3 -1,-0.2 0.783 71.0 32.6 -77.2 -36.6 11.4 111.4 72.3 26 26 A N > - 0 0 55 22,-0.4 3,-0.9 -3,-0.2 -1,-0.3 -0.943 60.3-179.2-129.7 103.4 11.1 114.9 73.9 27 27 A T G > S+ 0 0 94 -2,-0.4 3,-1.3 1,-0.2 -1,-0.1 0.756 80.2 69.2 -71.9 -25.9 8.1 116.9 72.9 28 28 A S G 3 S+ 0 0 108 1,-0.3 -1,-0.2 0, 0.0 79,-0.0 0.688 92.9 56.1 -68.8 -21.2 9.2 119.8 75.1 29 29 A N G < S+ 0 0 26 -3,-0.9 -1,-0.3 78,-0.1 -2,-0.2 0.311 84.8 126.8 -92.9 7.7 12.2 120.5 72.8 30 30 A N < - 0 0 35 -3,-1.3 2,-0.1 1,-0.1 6,-0.1 -0.348 61.5-125.5 -67.6 143.8 9.7 120.9 70.0 31 31 A P - 0 0 10 0, 0.0 2,-0.2 0, 0.0 -1,-0.1 -0.454 28.1-160.2 -79.7 161.7 9.7 124.0 67.9 32 32 A S > + 0 0 97 -2,-0.1 3,-1.1 4,-0.1 4,-0.1 -0.623 47.6 38.1-129.2-171.1 6.4 125.9 67.6 33 33 A G G > S- 0 0 62 1,-0.2 3,-1.7 -2,-0.2 0, 0.0 -0.176 122.9 -20.2 60.8-158.8 4.9 128.5 65.2 34 34 A A G 3 S+ 0 0 63 1,-0.3 -1,-0.2 3,-0.1 3,-0.0 0.260 131.1 69.9 -64.3 6.2 5.6 128.3 61.5 35 35 A L G < S+ 0 0 23 -3,-1.1 11,-2.7 10,-0.1 2,-0.3 0.690 94.9 62.5 -97.2 -23.6 8.7 126.1 62.2 36 36 A F B < -g 46 0B 46 -3,-1.7 2,-0.5 9,-0.2 11,-0.2 -0.728 57.1-164.2-111.1 144.2 6.6 123.1 63.3 37 37 A S > - 0 0 10 9,-2.6 3,-1.8 -2,-0.3 2,-0.2 -0.906 19.4-145.4-133.4 100.8 4.0 120.9 61.7 38 38 A S G > S+ 0 0 95 -2,-0.5 3,-0.8 1,-0.3 10,-0.1 -0.421 90.7 16.3 -66.7 129.9 2.0 118.9 64.2 39 39 A G G 3 S- 0 0 69 8,-0.3 -1,-0.3 1,-0.2 334,-0.1 0.419 112.5-102.1 86.9 -9.6 1.2 115.5 62.7 40 40 A a G < S+ 0 0 15 -3,-1.8 -1,-0.2 6,-0.2 333,-0.2 0.795 74.6 148.3 59.3 33.0 3.9 116.0 60.1 41 41 A T < + 0 0 118 -3,-0.8 2,-0.5 1,-0.2 -1,-0.1 0.718 68.4 49.2 -66.7 -27.3 1.3 116.9 57.5 42 42 A N S > S- 0 0 38 4,-0.1 3,-1.3 -4,-0.1 -1,-0.2 -0.948 76.0-162.8-120.1 101.5 3.8 119.3 55.9 43 43 A L T 3 S+ 0 0 31 -2,-0.5 4,-0.1 1,-0.3 -1,-0.1 0.345 80.2 69.0 -66.1 -4.3 7.0 117.3 55.4 44 44 A R T 3 S+ 0 0 93 44,-0.1 47,-2.3 2,-0.1 -1,-0.3 0.235 93.7 65.5-100.4 5.9 9.2 120.5 54.8 45 45 A K S < S- 0 0 28 -3,-1.3 -9,-0.2 45,-0.2 2,-0.2 -0.787 101.6 -71.6-121.3 170.0 8.9 121.7 58.5 46 46 A Y B -g 36 0B 1 -11,-2.7 -9,-2.6 -2,-0.3 -6,-0.2 -0.434 41.4-178.2 -63.6 132.0 10.1 120.3 61.8 47 47 A a - 0 0 12 -11,-0.2 -8,-0.3 -2,-0.2 -1,-0.2 0.723 46.8-102.3-105.2 -29.6 8.1 117.3 62.8 48 48 A G + 0 0 3 1,-0.3 -22,-0.4 -25,-0.1 -23,-0.2 0.275 63.7 143.3 128.9 -15.5 9.6 116.5 66.2 49 49 A G + 0 0 1 -29,-2.9 -1,-0.3 -25,-0.2 -25,-0.3 -0.430 25.7 168.1 -64.6 132.2 12.1 113.7 66.2 50 50 A D > - 0 0 0 -27,-1.5 4,-0.9 -2,-0.2 -27,-0.3 -0.607 51.4 -84.2-130.2-173.1 14.9 114.5 68.6 51 51 A W H >> S+ 0 0 0 57,-4.0 4,-2.1 1,-0.2 3,-0.5 0.890 124.6 60.3 -69.6 -40.2 17.8 112.6 70.2 52 52 A Q H 3> S+ 0 0 42 56,-0.4 4,-2.0 1,-0.2 -1,-0.2 0.823 98.4 63.1 -51.4 -36.4 15.7 111.2 73.0 53 53 A G H 3> S+ 0 0 0 -30,-0.4 4,-1.2 -3,-0.2 -1,-0.2 0.944 105.6 42.5 -49.0 -58.0 13.7 109.6 70.2 54 54 A I H < S+ 0 0 0 -4,-1.8 3,-0.7 4,-0.2 6,-0.3 0.937 117.2 40.3 -75.4 -49.4 18.1 101.9 71.2 59 59 A N H 3< S+ 0 0 89 -4,-3.4 -2,-0.2 1,-0.2 -3,-0.2 0.807 112.2 52.7 -70.4 -34.5 16.9 101.0 74.7 60 60 A D T 3< S- 0 0 83 -4,-2.8 -1,-0.2 -5,-0.2 -3,-0.1 0.393 112.5-116.4 -84.4 -0.3 13.6 99.3 73.8 61 61 A G S <> S+ 0 0 5 -3,-0.7 4,-3.6 -5,-0.2 5,-0.3 0.292 78.8 122.4 87.5 -5.0 15.4 97.0 71.4 62 62 A Y T 4 S+ 0 0 0 -5,-0.3 -4,-0.2 -6,-0.2 -5,-0.1 0.860 87.0 36.5 -54.0 -43.4 14.0 97.9 68.0 63 63 A L T 4>S+ 0 0 0 -6,-1.6 5,-1.5 2,-0.1 3,-0.4 0.866 120.4 46.1 -75.4 -44.3 17.5 98.7 66.6 64 64 A T T >45S+ 0 0 37 -7,-0.4 3,-1.4 -6,-0.3 -2,-0.2 0.889 110.0 50.5 -75.6 -37.7 19.4 96.1 68.5 65 65 A D T 3<5S+ 0 0 88 -4,-3.6 -1,-0.2 1,-0.3 -2,-0.1 0.561 104.6 63.4 -75.1 -5.1 17.1 93.1 67.8 66 66 A M T 3 5S- 0 0 0 -3,-0.4 -1,-0.3 -5,-0.3 325,-0.2 0.614 116.0-113.9 -88.2 -16.4 17.3 94.2 64.2 67 67 A G T < 5 + 0 0 5 -3,-1.4 -54,-0.2 -4,-0.3 -3,-0.2 0.345 62.3 155.3 94.9 -3.9 21.1 93.5 64.0 68 68 A V < + 0 0 5 -5,-1.5 -1,-0.3 1,-0.1 -54,-0.1 -0.334 14.8 172.1 -57.9 136.2 21.8 97.2 63.5 69 69 A T + 0 0 24 -56,-2.0 58,-2.9 1,-0.3 2,-0.4 0.456 60.8 37.7-126.9 -13.0 25.4 98.0 64.7 70 70 A A E -ac 14 127A 0 -57,-1.7 -55,-2.1 56,-0.3 2,-0.4 -0.994 63.7-152.8-149.7 139.8 25.9 101.6 63.6 71 71 A I E -ac 15 128A 0 56,-2.5 58,-3.0 -2,-0.4 2,-0.6 -0.907 4.1-157.5-114.4 134.0 23.6 104.5 63.4 72 72 A W E -ac 16 129A 1 -57,-2.6 -55,-2.8 -2,-0.4 2,-0.3 -0.937 20.4-174.9-117.4 115.8 23.9 107.5 61.0 73 73 A I E -ac 17 130A 0 56,-3.4 58,-2.2 -2,-0.6 -55,-0.2 -0.749 28.8 -89.8-115.4 162.0 22.3 110.7 62.0 74 74 A S - 0 0 7 -57,-0.7 21,-0.1 -2,-0.3 -1,-0.1 -0.009 65.0 -73.8 -52.9 157.2 21.7 114.2 60.7 75 75 A Q - 0 0 1 19,-0.4 -1,-0.2 55,-0.2 57,-0.2 -0.415 44.7-149.5 -58.5 122.0 24.3 117.0 61.3 76 76 A P + 0 0 1 0, 0.0 29,-1.6 0, 0.0 -1,-0.2 0.600 56.3 113.6 -72.0 -20.7 23.8 117.8 65.0 77 77 A V E S-H 104 0C 0 27,-0.2 2,-0.3 18,-0.2 24,-0.2 -0.066 79.9 -82.7 -56.1 154.5 24.8 121.5 64.7 78 78 A E E -H 100 0C 15 25,-2.1 21,-3.5 22,-1.3 22,-2.0 -0.379 49.6-160.1 -64.5 120.0 22.6 124.5 65.3 79 79 A N E -H 98 0C 1 19,-0.3 19,-0.2 -2,-0.3 59,-0.1 -0.497 30.2 -76.2 -97.4 167.1 20.6 125.3 62.2 80 80 A V - 0 0 0 17,-2.0 12,-0.5 -2,-0.2 -1,-0.1 -0.335 29.2-150.5 -67.1 145.3 18.9 128.5 61.1 81 81 A F + 0 0 63 10,-0.1 2,-0.2 -3,-0.1 -1,-0.1 0.302 62.7 101.1-101.9 8.1 15.6 129.5 62.8 82 82 A S - 0 0 28 65,-0.0 2,-0.4 -47,-0.0 10,-0.2 -0.524 66.1-127.8 -86.4 158.6 14.0 131.4 59.9 83 83 A V - 0 0 44 -2,-0.2 65,-0.3 65,-0.1 8,-0.2 -0.849 25.5-108.6-113.9 149.0 11.3 130.1 57.6 84 84 A M - 0 0 38 6,-2.3 -1,-0.1 -2,-0.4 7,-0.0 -0.149 12.8-127.7 -69.9 163.6 11.4 130.1 53.8 85 85 A N S S+ 0 0 124 4,-0.1 -1,-0.1 3,-0.0 -2,-0.0 0.408 73.9 113.0 -83.6 -15.5 9.4 132.2 51.4 86 86 A D S S- 0 0 56 1,-0.1 3,-0.1 4,-0.1 -3,-0.0 -0.097 86.8-100.6 -61.4 168.9 8.3 129.2 49.5 87 87 A A S S+ 0 0 120 1,-0.2 -1,-0.1 2,-0.1 0, 0.0 0.866 122.1 48.4 -57.7 -42.9 4.7 128.0 49.4 88 88 A S S S- 0 0 32 -45,-0.0 -1,-0.2 -44,-0.0 -44,-0.1 0.795 105.6-123.9 -71.3 -37.2 5.4 125.3 51.9 89 89 A G - 0 0 9 1,-0.1 2,-0.1 -3,-0.1 -4,-0.1 0.948 32.0-142.5 82.3 61.4 7.3 127.4 54.5 90 90 A S - 0 0 7 -7,-0.1 -6,-2.3 -45,-0.1 -45,-0.2 -0.295 19.1-168.9 -61.9 124.5 10.5 125.4 54.6 91 91 A A - 0 0 1 -47,-2.3 3,-0.4 -8,-0.2 -8,-0.1 -0.517 38.7-100.7-106.9 171.8 12.4 125.0 57.9 92 92 A S S > S+ 0 0 0 -12,-0.5 3,-1.7 1,-0.2 5,-0.3 -0.035 72.5 133.7 -87.2 32.0 15.9 123.6 58.8 93 93 A Y T 3 + 0 0 7 1,-0.3 -73,-0.4 -49,-0.3 -1,-0.2 0.802 63.1 58.6 -47.6 -46.8 14.4 120.3 59.8 94 94 A H T 3 S- 0 0 17 -3,-0.4 -19,-0.4 -50,-0.1 -1,-0.3 0.319 105.1-124.9 -71.0 -3.3 17.0 118.2 57.8 95 95 A G S < S+ 0 0 0 -3,-1.7 -18,-0.2 -21,-0.1 3,-0.1 0.493 81.2 111.9 62.7 15.7 19.9 119.7 59.8 96 96 A Y + 0 0 27 1,-0.2 2,-0.6 36,-0.1 40,-0.1 0.352 54.9 75.2 -91.2 -4.9 21.7 120.8 56.6 97 97 A W S S- 0 0 34 -5,-0.3 -17,-2.0 -17,-0.1 41,-0.2 -0.641 76.8-160.6-111.3 69.4 21.3 124.7 57.0 98 98 A A E +H 79 0C 1 -2,-0.6 -19,-0.3 39,-0.5 3,-0.1 -0.133 28.0 170.5 -56.9 148.4 23.9 125.3 59.6 99 99 A R E S+ 0 0 45 -21,-3.5 55,-2.8 1,-0.2 2,-0.3 0.546 78.1 11.8-122.1 -40.7 24.0 128.4 61.7 100 100 A D E > -Hi 78 154C 0 -22,-2.0 3,-1.4 53,-0.2 -22,-1.3 -0.826 55.3-162.5-153.3 107.1 26.7 127.5 64.3 101 101 A F E 3 S+ 0 0 0 53,-0.5 54,-0.1 -2,-0.3 -24,-0.1 0.479 90.7 60.1 -69.5 -1.8 28.9 124.5 63.9 102 102 A K E 3 S+ 0 0 31 52,-0.2 -1,-0.3 -24,-0.1 53,-0.1 0.445 97.9 57.3-108.7 -1.3 29.8 124.7 67.6 103 103 A K E < S- 0 0 57 -3,-1.4 -25,-2.1 -25,-0.1 -3,-0.2 -0.852 81.9-103.2-127.0 161.7 26.4 124.3 69.2 104 104 A P E -H 77 0C 20 0, 0.0 -27,-0.2 0, 0.0 -26,-0.1 -0.305 35.6-105.3 -73.8 163.8 23.6 121.7 69.2 105 105 A N >> - 0 0 0 -29,-1.6 4,-1.2 -27,-0.2 3,-0.6 -0.896 32.0-150.0 -87.2 110.2 20.3 121.9 67.3 106 106 A P T 34 S+ 0 0 56 0, 0.0 -1,-0.1 0, 0.0 -28,-0.0 0.727 93.1 60.7 -62.4 -26.8 18.1 122.7 70.3 107 107 A F T 34 S+ 0 0 29 1,-0.2 -78,-0.1 2,-0.1 3,-0.1 0.846 109.9 41.2 -68.4 -31.6 15.1 120.9 68.6 108 108 A F T <4 S- 0 0 1 -3,-0.6 -57,-4.0 1,-0.3 -56,-0.4 0.740 127.9 -88.4 -82.1 -26.1 17.1 117.7 68.5 109 109 A G < - 0 0 2 -4,-1.2 -1,-0.3 -59,-0.2 2,-0.1 -0.829 43.2 -61.1 143.0 177.8 18.5 118.2 72.1 110 110 A T > - 0 0 76 -2,-0.2 4,-2.4 -3,-0.1 -5,-0.1 -0.378 55.1 -97.5 -85.6 176.7 21.1 119.7 74.3 111 111 A L H > S+ 0 0 66 1,-0.2 4,-1.6 2,-0.2 -1,-0.1 0.832 128.0 48.5 -63.4 -35.9 24.8 118.9 74.3 112 112 A S H > S+ 0 0 88 2,-0.3 4,-2.2 1,-0.2 -1,-0.2 0.843 107.2 53.5 -71.5 -42.1 24.2 116.4 77.2 113 113 A D H > S+ 0 0 32 1,-0.3 4,-1.6 2,-0.2 -2,-0.2 0.931 109.4 52.5 -55.6 -45.8 21.2 114.8 75.4 114 114 A F H X S+ 0 0 0 -4,-2.4 4,-1.7 1,-0.3 3,-0.4 0.898 107.4 48.8 -54.4 -51.4 23.8 114.4 72.7 115 115 A Q H X S+ 0 0 58 -4,-1.6 4,-2.1 1,-0.2 -1,-0.3 0.788 107.0 56.6 -64.7 -29.4 26.3 112.7 75.0 116 116 A R H X S+ 0 0 101 -4,-2.2 4,-2.5 2,-0.2 -1,-0.2 0.799 104.6 55.0 -72.4 -26.7 23.5 110.4 76.3 117 117 A L H X S+ 0 0 0 -4,-1.6 4,-3.1 -3,-0.4 -2,-0.2 0.995 109.0 43.0 -68.4 -58.6 22.9 109.3 72.7 118 118 A V H X S+ 0 0 0 -4,-1.7 4,-3.8 1,-0.3 -2,-0.2 0.902 119.0 46.2 -50.6 -50.1 26.5 108.3 71.9 119 119 A D H X S+ 0 0 83 -4,-2.1 4,-3.1 2,-0.3 -1,-0.3 0.886 110.4 51.6 -59.6 -47.1 26.7 106.6 75.3 120 120 A A H X S+ 0 0 16 -4,-2.5 4,-0.6 1,-0.2 -1,-0.2 0.886 115.8 44.5 -61.9 -34.8 23.3 104.9 74.9 121 121 A A H ><>S+ 0 0 0 -4,-3.1 5,-1.6 1,-0.2 3,-1.2 0.963 113.6 49.4 -68.4 -54.2 24.8 103.7 71.5 122 122 A H H ><5S+ 0 0 47 -4,-3.8 3,-2.2 1,-0.3 -120,-0.4 0.839 102.5 58.7 -50.3 -51.2 28.1 102.7 73.0 123 123 A A H 3<5S+ 0 0 70 -4,-3.1 -1,-0.3 1,-0.3 -2,-0.2 0.761 110.8 45.1 -52.7 -31.3 26.8 100.6 75.9 124 124 A K T <<5S- 0 0 99 -3,-1.2 -1,-0.3 -4,-0.6 -2,-0.2 0.207 122.0-101.3-101.9 13.8 25.0 98.4 73.3 125 125 A G T < 5S+ 0 0 15 -3,-2.2 2,-0.5 1,-0.2 -3,-0.2 0.884 75.9 138.2 67.4 42.5 27.8 98.0 70.8 126 126 A I < - 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0 0 0 57,-1.7 -39,-0.5 1,-0.3 -1,-0.2 0.674 61.8 -46.5-107.6 -93.9 25.7 127.7 55.7 138 138 A S E - 0 0 0 -41,-0.2 56,-3.1 54,-0.1 -1,-0.3 -0.845 69.4 -62.5-146.1 169.4 22.1 128.5 54.8 139 139 A P E +K 193 0D 0 0, 0.0 10,-0.6 0, 0.0 12,-0.5 -0.308 64.0 174.6 -61.2 128.8 19.9 130.0 52.0 140 140 A A - 0 0 10 52,-3.4 2,-0.4 10,-0.2 8,-0.1 -0.964 34.1-152.3-145.7 158.7 20.8 133.6 51.4 141 141 A S - 0 0 27 -2,-0.3 6,-0.2 6,-0.3 23,-0.2 -0.993 5.3-163.5-129.7 116.5 20.3 136.6 49.3 142 142 A E S S+ 0 0 89 -2,-0.4 -1,-0.2 1,-0.2 23,-0.0 0.985 97.2 43.2 -59.9 -53.4 23.1 139.1 49.0 143 143 A T S S+ 0 0 133 1,-0.2 -1,-0.2 -3,-0.1 3,-0.0 0.661 116.5 47.3 -64.8 -26.8 20.8 141.7 47.7 144 144 A N > - 0 0 72 1,-0.1 3,-2.4 3,-0.1 -3,-0.3 -0.772 62.7-178.5-123.2 84.0 17.9 140.9 50.2 145 145 A P T 3 S+ 0 0 69 0, 0.0 -1,-0.1 0, 0.0 19,-0.1 0.547 79.0 69.2 -59.6 -7.9 19.5 140.8 53.7 146 146 A S T 3 S+ 0 0 104 3,-0.1 2,-0.4 4,-0.1 -3,-0.0 0.733 70.4 114.1 -82.8 -19.8 16.0 140.0 55.0 147 147 A Y S X S- 0 0 27 -3,-2.4 3,-1.9 -6,-0.2 2,-0.4 -0.332 98.1 -56.9 -59.4 108.9 16.0 136.6 53.4 148 148 A M T 3 S- 0 0 15 -2,-0.4 -65,-0.1 -65,-0.3 -8,-0.1 -0.423 112.1 -32.4 58.5-110.5 16.1 133.9 56.1 149 149 A E T > S- 0 0 10 -10,-0.6 3,-2.0 -2,-0.4 -1,-0.2 0.050 80.9-104.3-131.6 27.9 19.1 134.8 58.2 150 150 A N T < - 0 0 11 -3,-1.9 13,-3.5 1,-0.3 14,-0.3 0.584 68.6 -75.1 58.2 17.4 21.6 136.2 55.6 151 151 A G T 3 S- 0 0 0 -12,-0.5 -1,-0.3 -4,-0.2 -11,-0.1 0.801 77.7-168.0 68.8 28.8 23.5 132.8 55.7 152 152 A R < - 0 0 73 -3,-2.0 2,-0.5 10,-0.1 10,-0.2 -0.105 12.6-150.6 -54.7 137.2 24.8 134.1 59.0 153 153 A L E - J 0 161C 0 8,-1.8 7,-2.7 -3,-0.1 8,-0.9 -0.943 11.5-167.0-112.9 123.8 27.6 132.2 60.6 154 154 A Y E -iJ 100 159C 29 -55,-2.8 -53,-0.5 -2,-0.5 2,-0.5 -0.774 15.4-149.0-110.0 158.9 28.1 132.1 64.4 155 155 A D E > S- J 0 158C 46 3,-4.2 3,-1.8 -2,-0.3 -55,-0.1 -0.888 83.3 -39.8-127.5 91.9 31.0 130.9 66.6 156 156 A N T 3 S- 0 0 104 -2,-0.5 2,-0.2 1,-0.3 3,-0.1 0.921 126.9 -39.1 51.8 48.1 29.6 129.5 69.8 157 157 A G T 3 S+ 0 0 35 1,-0.3 -1,-0.3 -54,-0.0 2,-0.1 -0.175 120.0 106.0 99.6 -44.6 27.0 132.4 69.9 158 158 A T E < S-J 155 0C 101 -3,-1.8 -3,-4.2 -2,-0.2 -1,-0.3 -0.480 72.5-116.8 -71.7 144.9 29.3 135.1 68.6 159 159 A L E -J 154 0C 85 -5,-0.3 -5,-0.2 1,-0.2 -1,-0.1 -0.455 26.8-178.2 -81.6 151.4 28.8 136.3 65.0 160 160 A L E - 0 0 30 -7,-2.7 2,-0.2 1,-0.3 -1,-0.2 0.732 59.1 -83.1-110.8 -47.2 31.3 136.0 62.2 161 161 A G E -J 153 0C 16 -8,-0.9 -8,-1.8 -10,-0.1 -1,-0.3 -0.826 34.6-106.1 156.2 166.9 29.3 137.7 59.5 162 162 A G - 0 0 9 2,-0.5 8,-0.2 -2,-0.2 -11,-0.2 -0.438 38.7 -96.9-107.3 179.7 26.5 137.2 56.9 163 163 A Y S > S+ 0 0 9 -13,-3.5 3,-0.6 -2,-0.2 2,-0.3 0.830 107.0 72.1 -70.5 -36.2 26.4 137.0 53.1 164 164 A T T 3 S+ 0 0 33 -14,-0.3 -2,-0.5 1,-0.2 3,-0.1 -0.699 110.9 10.5 -83.1 135.5 25.5 140.7 52.8 165 165 A N T 3 S+ 0 0 154 -2,-0.3 2,-1.9 1,-0.2 3,-0.3 0.885 73.8 178.5 62.6 51.5 28.5 143.0 53.6 166 166 A D X + 0 0 14 -3,-0.6 3,-1.2 1,-0.2 -1,-0.2 -0.349 15.3 157.3 -79.7 56.1 31.1 140.2 53.6 167 167 A A T 3 S+ 0 0 96 -2,-1.9 -1,-0.2 1,-0.3 -2,-0.1 0.862 77.1 50.5 -43.3 -48.6 34.0 142.6 54.3 168 168 A N T 3 S- 0 0 92 -3,-0.3 -1,-0.3 -8,-0.1 -2,-0.1 0.763 105.6-132.7 -60.6 -33.5 35.9 139.5 55.7 169 169 A M < + 0 0 88 -3,-1.2 31,-0.1 31,-0.0 -2,-0.1 0.939 49.0 155.4 68.6 56.5 35.1 137.4 52.6 170 170 A Y + 0 0 18 -8,-0.2 27,-2.9 26,-0.1 2,-0.2 0.753 64.7 38.7 -78.9 -25.9 34.0 134.4 54.7 171 171 A F B S-L 196 0E 2 25,-0.3 2,-0.3 -9,-0.2 25,-0.2 -0.651 89.3-100.6-122.6 172.7 32.0 133.3 51.7 172 172 A H - 0 0 18 23,-2.4 23,-0.3 -2,-0.2 3,-0.1 -0.673 19.8-165.8 -94.2 150.3 32.2 133.2 47.9 173 173 A H + 0 0 49 -2,-0.3 3,-0.1 14,-0.1 15,-0.1 -0.345 52.6 110.6-136.3 56.5 30.4 135.7 45.7 174 174 A N S S- 0 0 49 1,-0.5 -1,-0.1 13,-0.2 13,-0.0 -0.246 82.6-103.2-121.2 33.9 30.5 134.2 42.2 175 175 A G - 0 0 45 13,-0.1 14,-2.3 -3,-0.1 -1,-0.5 -0.104 52.7 -59.9 70.2-173.8 26.8 133.4 41.8 176 176 A G B -m 189 0F 34 12,-0.3 14,-0.2 1,-0.1 16,-0.1 -0.646 61.8 -91.0-103.7 159.9 25.2 129.9 42.1 177 177 A T - 0 0 20 12,-2.7 14,-0.1 -2,-0.2 -1,-0.1 -0.180 20.8-170.5 -74.4 166.3 26.2 126.9 40.1 178 178 A T - 0 0 105 3,-0.1 -1,-0.1 12,-0.0 7,-0.1 0.207 48.0-120.4-130.6 -8.4 24.7 125.6 36.9 179 179 A F + 0 0 114 2,-0.2 3,-0.1 1,-0.1 -2,-0.1 0.768 68.7 140.7 57.2 37.9 26.7 122.4 37.2 180 180 A S S S- 0 0 79 1,-0.1 2,-0.3 2,-0.1 3,-0.1 0.651 72.3 -2.0 -77.2 -16.6 28.4 123.2 33.9 181 181 A S S > S- 0 0 52 1,-0.1 4,-1.7 0, 0.0 -2,-0.2 -0.971 71.6-102.7-162.4 171.4 31.6 121.9 35.4 182 182 A L H > S+ 0 0 44 -2,-0.3 4,-0.7 2,-0.2 3,-0.2 0.934 125.7 47.0 -64.5 -48.1 33.4 120.5 38.3 183 183 A E H >> S+ 0 0 7 1,-0.2 4,-2.1 2,-0.2 3,-1.5 0.928 107.0 56.9 -59.1 -45.4 34.9 123.9 38.9 184 184 A D H 34 S+ 0 0 6 1,-0.3 4,-0.4 2,-0.2 -1,-0.2 0.880 107.4 50.7 -52.2 -44.0 31.5 125.6 38.4 185 185 A G H 3< S+ 0 0 3 -4,-1.7 -1,-0.3 -3,-0.2 -2,-0.2 0.491 111.5 45.1 -76.4 -9.7 30.2 123.4 41.3 186 186 A I H << S+ 0 0 3 -3,-1.5 -2,-0.2 -4,-0.7 -1,-0.2 0.868 117.4 35.6-102.1 -47.6 33.0 124.2 43.8 187 187 A Y S < S+ 0 0 2 -4,-2.1 2,-0.3 43,-0.1 -13,-0.2 0.300 110.6 73.1 -93.6 14.5 33.5 128.0 43.7 188 188 A R S S- 0 0 63 -4,-0.4 -12,-0.3 -5,-0.2 2,-0.2 -0.859 93.4 -89.7-125.4 153.7 29.8 128.7 43.1 189 189 A N B -m 176 0F 14 -14,-2.3 -12,-2.7 -2,-0.3 2,-0.9 -0.496 30.8-128.2 -66.1 127.8 26.8 128.5 45.4 190 190 A L S > S- 0 0 15 3,-0.3 3,-2.3 -2,-0.2 2,-0.2 -0.700 80.7 -46.3 -78.2 105.9 25.0 125.2 45.6 191 191 A F T 3 S- 0 0 147 -2,-0.9 -2,-0.1 1,-0.3 -14,-0.1 -0.432 115.5 -38.2 63.0-121.8 21.5 126.7 45.0 192 192 A D T 3 S+ 0 0 53 -2,-0.2 -52,-3.4 -16,-0.1 2,-0.3 0.071 100.0 128.5-120.9 20.3 21.3 129.8 47.3 193 193 A L E < S-K 139 0D 14 -3,-2.3 2,-0.4 -54,-0.3 -3,-0.3 -0.616 72.5-104.5 -75.0 134.0 23.2 128.2 50.3 194 194 A A E - 0 0 1 -56,-3.1 -57,-1.7 -2,-0.3 2,-0.6 -0.411 35.5-135.8 -65.9 119.8 26.0 130.6 51.4 195 195 A D E -K 136 0D 2 -2,-0.4 -23,-2.4 -23,-0.3 -59,-0.2 -0.647 13.2-134.6 -82.2 116.2 29.2 129.1 50.1 196 196 A L B -L 171 0E 0 -61,-2.3 2,-1.0 -2,-0.6 -25,-0.3 -0.455 10.7-131.5 -72.5 142.9 32.0 129.1 52.6 197 197 A N > - 0 0 25 -27,-2.9 3,-1.5 1,-0.1 6,-0.3 -0.850 21.5-172.1 -94.0 94.7 35.4 130.2 51.4 198 198 A H T 3 S+ 0 0 6 -2,-1.0 6,-0.2 1,-0.3 -1,-0.1 0.691 79.1 67.2 -64.8 -21.6 37.7 127.5 52.8 199 199 A Q T 3 S+ 0 0 19 4,-0.1 -1,-0.3 -3,-0.1 472,-0.1 0.682 79.3 99.5 -72.4 -20.0 40.8 129.3 51.8 200 200 A N S <> S- 0 0 19 -3,-1.5 4,-2.8 -30,-0.2 5,-0.2 -0.559 74.9-138.7 -71.1 130.7 40.0 132.0 54.4 201 201 A P H > S+ 0 0 69 0, 0.0 4,-2.8 0, 0.0 5,-0.2 0.861 101.1 52.1 -57.1 -47.3 42.0 131.4 57.6 202 202 A V H > S+ 0 0 59 2,-0.2 4,-2.7 1,-0.2 5,-0.1 0.922 115.4 43.3 -54.7 -47.5 39.2 132.2 60.0 203 203 A I H > S+ 0 0 0 -6,-0.3 4,-2.7 2,-0.2 5,-0.3 0.902 111.7 52.8 -64.4 -47.7 37.0 129.6 58.1 204 204 A D H X S+ 0 0 2 -4,-2.8 4,-1.3 -7,-0.2 -1,-0.2 0.863 115.3 40.7 -58.8 -41.8 39.7 127.1 57.8 205 205 A R H X S+ 0 0 61 -4,-2.8 4,-2.5 -5,-0.2 -2,-0.2 0.948 113.5 54.3 -75.3 -43.9 40.4 127.2 61.6 206 206 A Y H X S+ 0 0 5 -4,-2.7 4,-2.2 -5,-0.2 -2,-0.2 0.900 111.2 42.5 -52.4 -54.6 36.7 127.4 62.6 207 207 A L H X S+ 0 0 0 -4,-2.7 4,-2.4 1,-0.2 -1,-0.2 0.896 115.1 50.2 -61.0 -46.6 35.5 124.3 60.7 208 208 A K H X S+ 0 0 3 -4,-1.3 4,-1.4 -5,-0.3 -1,-0.2 0.854 111.4 49.4 -59.1 -40.5 38.6 122.2 61.8 209 209 A D H X S+ 0 0 71 -4,-2.5 4,-1.4 2,-0.2 -1,-0.2 0.882 110.4 50.9 -62.6 -46.4 38.0 123.3 65.4 210 210 A A H X S+ 0 0 0 -4,-2.2 4,-2.1 2,-0.2 3,-0.3 0.910 104.2 54.5 -60.3 -50.0 34.3 122.3 65.2 211 211 A V H X S+ 0 0 0 -4,-2.4 4,-2.4 1,-0.3 -1,-0.2 0.929 109.1 52.4 -51.7 -42.9 34.9 118.8 63.8 212 212 A K H X S+ 0 0 34 -4,-1.4 4,-2.6 1,-0.2 -1,-0.3 0.845 102.4 56.3 -57.5 -45.4 37.1 118.3 66.8 213 213 A M H < S+ 0 0 50 -4,-1.4 4,-0.5 -3,-0.3 -1,-0.2 0.894 112.4 43.9 -55.8 -44.3 34.5 119.4 69.3 214 214 A W H ><>S+ 0 0 1 -4,-2.1 3,-0.9 2,-0.2 5,-0.9 0.858 109.9 52.6 -71.3 -40.9 32.2 116.7 67.9 215 215 A I H ><5S+ 0 0 7 -4,-2.4 3,-3.0 1,-0.3 4,-0.2 0.917 103.8 60.2 -59.8 -40.5 34.8 114.0 67.7 216 216 A D T 3<5S+ 0 0 102 -4,-2.6 -1,-0.3 1,-0.3 -2,-0.2 0.767 91.9 65.5 -55.7 -30.2 35.5 114.8 71.4 217 217 A M T < 5S- 0 0 26 -3,-0.9 -1,-0.3 -4,-0.5 -2,-0.2 0.625 122.8-110.6 -70.3 -10.6 31.9 113.8 72.0 218 218 A G T < 5 + 0 0 20 -3,-3.0 -90,-0.2 -4,-0.3 -3,-0.2 0.710 55.5 167.1 90.5 26.6 33.1 110.3 71.0 219 219 A I < - 0 0 0 -5,-0.9 -90,-0.2 -4,-0.2 -1,-0.1 -0.099 31.9-140.4 -62.2 170.9 31.4 109.8 67.6 220 220 A D - 0 0 1 -92,-3.9 29,-1.6 1,-0.4 2,-0.3 0.611 68.6 -9.1-113.9 -12.9 32.7 106.9 65.5 221 221 A G E -de 129 249A 0 -93,-1.3 -91,-1.6 27,-0.2 2,-0.4 -0.953 58.3-126.7-174.7 163.3 32.6 108.3 62.0 222 222 A I E -de 130 250A 0 27,-2.8 29,-2.9 -2,-0.3 2,-0.5 -0.958 3.8-150.5-129.4 148.7 31.5 111.1 59.8 223 223 A R E -de 131 251A 0 -93,-1.8 -91,-1.8 -2,-0.4 2,-0.4 -0.970 22.4-147.0-117.2 110.2 29.5 111.5 56.6 224 224 A M E -de 132 252A 1 27,-2.9 29,-1.5 -2,-0.5 3,-0.4 -0.661 10.1-140.9 -83.7 131.1 30.7 114.5 54.5 225 225 A D S S+ 0 0 20 -93,-1.7 -90,-0.2 -2,-0.4 4,-0.2 -0.533 74.7 8.1 -92.2 151.6 28.1 116.4 52.5 226 226 A A >> + 0 0 7 -2,-0.2 3,-2.0 27,-0.1 4,-0.6 0.883 69.3 172.4 41.3 53.8 28.6 117.9 48.9 227 227 A V G >4 S+ 0 0 1 26,-1.4 3,-0.7 -3,-0.4 27,-0.2 0.835 76.8 52.1 -55.8 -37.3 32.0 116.3 48.6 228 228 A K G 34 S+ 0 0 50 25,-0.5 -1,-0.3 1,-0.2 -2,-0.1 0.196 101.8 64.0 -88.7 19.9 32.1 117.4 44.9 229 229 A H G <4 S+ 0 0 22 -3,-2.0 -1,-0.2 -4,-0.2 -2,-0.2 0.592 90.8 71.3-115.0 -15.1 31.4 121.0 46.0 230 230 A M S << S- 0 0 4 -3,-0.7 -43,-0.1 -4,-0.6 -95,-0.1 -0.727 93.1-108.6-102.6 151.5 34.6 121.5 48.1 231 231 A P - 0 0 19 0, 0.0 -1,-0.1 0, 0.0 401,-0.1 0.804 31.6-125.8 -39.0 -62.9 38.0 121.8 46.3 232 232 A F S > S+ 0 0 53 40,-0.0 4,-2.3 401,-0.0 5,-0.2 -0.504 101.1 65.4 137.4 -58.9 39.9 118.6 47.0 233 233 A G H > S+ 0 0 0 399,-0.9 4,-2.1 1,-0.2 400,-0.2 0.930 104.3 45.3 -50.3 -56.0 43.0 120.2 48.5 234 234 A W H > S+ 0 0 0 1,-0.2 4,-1.3 2,-0.2 -1,-0.2 0.866 111.1 52.1 -59.6 -43.7 41.1 121.5 51.5 235 235 A Q H > S+ 0 0 1 2,-0.2 4,-2.3 1,-0.2 -1,-0.2 0.853 108.5 50.6 -64.3 -41.1 39.3 118.3 52.1 236 236 A K H X S+ 0 0 18 -4,-2.3 4,-2.5 1,-0.2 -1,-0.2 0.911 109.8 51.4 -65.0 -40.4 42.5 116.2 52.1 237 237 A S H X S+ 0 0 0 -4,-2.1 4,-1.6 2,-0.2 -1,-0.2 0.795 108.3 51.9 -67.5 -27.1 43.9 118.7 54.6 238 238 A L H X S+ 0 0 1 -4,-1.3 4,-2.1 2,-0.2 -1,-0.2 0.907 108.4 50.3 -75.0 -38.5 40.8 118.3 56.8 239 239 A M H X S+ 0 0 3 -4,-2.3 4,-2.7 2,-0.2 -2,-0.2 0.873 107.6 53.9 -65.3 -35.9 41.3 114.5 56.7 240 240 A D H X S+ 0 0 2 -4,-2.5 4,-2.4 1,-0.2 -1,-0.2 0.922 108.7 52.3 -59.4 -41.2 44.9 115.1 57.7 241 241 A E H X S+ 0 0 27 -4,-1.6 4,-1.4 2,-0.2 -2,-0.2 0.876 110.3 43.7 -57.1 -50.0 43.5 117.1 60.6 242 242 A I H X S+ 0 0 0 -4,-2.1 4,-3.6 1,-0.2 -1,-0.2 0.903 113.6 52.0 -71.5 -36.0 41.1 114.4 61.8 243 243 A D H < S+ 0 0 8 -4,-2.7 -2,-0.2 1,-0.2 -1,-0.2 0.889 109.5 47.1 -64.0 -44.0 43.7 111.6 61.5 244 244 A N H < S+ 0 0 50 -4,-2.4 -1,-0.2 -5,-0.2 -2,-0.2 0.816 120.8 42.8 -61.9 -36.4 46.4 113.5 63.5 245 245 A Y H < S- 0 0 98 -4,-1.4 -2,-0.2 -5,-0.2 -1,-0.2 0.968 138.8 -39.3 -72.6 -63.4 43.6 114.2 66.1 246 246 A R < - 0 0 105 -4,-3.6 -2,-0.2 -5,-0.1 -1,-0.2 -0.576 65.0-119.1-174.8 100.2 41.7 111.0 66.5 247 247 A P + 0 0 24 0, 0.0 2,-0.3 0, 0.0 -241,-0.1 -0.212 36.1 175.9 -57.2 137.1 41.0 108.8 63.4 248 248 A V - 0 0 6 -241,-0.1 2,-0.3 -243,-0.0 -27,-0.2 -0.973 41.3 -97.0-138.9 142.6 37.3 108.3 62.7 249 249 A F E -e 221 0A 17 -29,-1.6 -27,-2.8 -243,-1.5 2,-0.4 -0.504 50.8-172.2 -68.7 121.9 35.7 106.5 59.7 250 250 A T E +e 222 0A 6 -2,-0.3 25,-2.4 -29,-0.2 2,-0.4 -0.952 12.8 174.6-126.0 138.1 34.8 109.2 57.2 251 251 A F E -ef 223 275A 2 -29,-2.9 -27,-2.9 -2,-0.4 25,-0.2 -0.997 14.6-147.0-146.2 142.2 32.9 109.1 54.0 252 252 A G E -ef 224 276A 0 23,-2.5 25,-2.2 -2,-0.4 2,-0.6 -0.601 15.4-126.9-101.4 159.8 31.7 111.7 51.4 253 253 A E + 0 0 16 -29,-1.5 -26,-1.4 -2,-0.2 2,-0.6 -0.962 27.4 170.8-116.8 106.2 28.7 111.9 49.2 254 254 A W - 0 0 10 -2,-0.6 25,-0.2 23,-0.3 -29,-0.0 -0.919 34.0-134.6-118.8 91.7 29.4 112.4 45.6 255 255 A F - 0 0 84 -2,-0.6 2,-0.4 23,-0.1 -2,-0.0 -0.243 24.2-170.1 -54.0 137.0 26.1 112.0 43.9 256 256 A L - 0 0 2 4,-0.0 27,-0.1 9,-0.0 2,-0.1 -0.991 16.0-125.9-131.0 137.6 26.2 109.8 40.7 257 257 A S > - 0 0 64 -2,-0.4 3,-2.5 1,-0.1 26,-0.1 -0.326 41.4 -81.0 -77.6 165.9 23.4 109.2 38.2 258 258 A E T 3 S+ 0 0 81 1,-0.3 29,-0.1 25,-0.1 -1,-0.1 0.735 126.6 15.2 -34.2 -54.5 22.0 105.9 37.0 259 259 A N T 3 S+ 0 0 114 2,-0.0 2,-0.3 24,-0.0 -1,-0.3 0.084 98.0 139.7-116.3 25.6 24.7 105.0 34.4 260 260 A E < + 0 0 67 -3,-2.5 2,-0.4 19,-0.1 23,-0.1 -0.565 24.6 173.4 -82.4 131.7 27.3 107.5 35.6 261 261 A V + 0 0 89 -2,-0.3 2,-0.4 -5,-0.0 -2,-0.0 -0.998 5.5 179.6-128.6 127.9 30.9 106.8 35.9 262 262 A D >> - 0 0 29 -2,-0.4 4,-1.6 1,-0.1 3,-0.8 -0.947 22.7-157.7-138.3 118.4 33.4 109.7 36.8 263 263 A A H 3> S+ 0 0 74 -2,-0.4 4,-2.3 1,-0.3 5,-0.1 0.719 96.3 62.2 -61.2 -27.5 37.1 109.2 37.1 264 264 A N H 3> S+ 0 0 85 2,-0.2 4,-2.2 1,-0.2 -1,-0.3 0.887 104.6 46.7 -65.8 -42.3 37.2 112.3 39.3 265 265 A N H <> S+ 0 0 2 -3,-0.8 4,-2.5 2,-0.2 -2,-0.2 0.820 110.0 54.7 -65.4 -36.8 35.0 110.6 41.8 266 266 A H H X S+ 0 0 26 -4,-1.6 4,-1.9 1,-0.2 -2,-0.2 0.929 110.1 46.0 -60.0 -45.9 37.3 107.5 41.5 267 267 A Y H X S+ 0 0 121 -4,-2.3 4,-2.5 2,-0.2 5,-0.4 0.844 108.7 56.4 -62.0 -44.8 40.2 109.7 42.4 268 268 A F H X S+ 0 0 4 -4,-2.2 4,-2.2 1,-0.2 6,-0.5 0.962 110.0 43.5 -58.7 -53.6 38.3 111.3 45.3 269 269 A A H < S+ 0 0 7 -4,-2.5 4,-0.3 1,-0.2 -1,-0.2 0.894 118.9 46.4 -58.2 -40.1 37.6 108.0 47.0 270 270 A N H < S+ 0 0 32 -4,-1.9 -1,-0.2 -5,-0.2 -2,-0.2 0.741 126.5 19.8 -72.4 -32.9 41.2 106.8 46.3 271 271 A E H < S+ 0 0 37 -4,-2.5 -3,-0.2 -3,-0.2 -2,-0.2 0.685 100.8 77.1-116.5 -23.8 43.2 109.8 47.4 272 272 A S S < S- 0 0 0 -4,-2.2 -33,-0.2 -5,-0.4 -3,-0.1 0.689 94.6-117.8 -67.7 -23.7 41.3 112.1 49.7 273 273 A G S S+ 0 0 30 1,-0.5 2,-0.3 -4,-0.3 -23,-0.2 0.429 90.2 92.5 95.8 1.2 41.6 110.0 52.9 274 274 A M - 0 0 5 -6,-0.5 -1,-0.5 -25,-0.1 -2,-0.3 -0.934 67.5-142.3-126.0 147.4 37.8 109.7 52.9 275 275 A S E -f 251 0A 8 -25,-2.4 -23,-2.5 -2,-0.3 2,-0.3 -0.262 23.7-119.9 -96.5-169.7 35.8 106.9 51.3 276 276 A L E -f 252 0A 0 -25,-0.2 41,-2.5 -2,-0.1 -23,-0.2 -0.975 16.1-100.4-146.7 152.7 32.4 107.3 49.5 277 277 A L B -n 317 0G 2 -25,-2.2 2,-1.4 -2,-0.3 -23,-0.3 -0.441 48.1-123.3 -59.5 134.3 28.7 106.4 49.2 278 278 A D > + 0 0 1 39,-4.3 4,-2.8 1,-0.2 41,-0.3 -0.550 44.7 162.0 -91.4 78.8 28.6 103.7 46.5 279 279 A F H > S+ 0 0 2 -2,-1.4 4,-3.7 -25,-0.2 5,-0.4 0.785 72.2 59.7 -60.3 -36.7 26.1 105.2 44.0 280 280 A R H > S+ 0 0 25 2,-0.2 4,-1.4 1,-0.2 -1,-0.2 0.893 112.7 39.3 -60.8 -46.9 27.3 103.0 41.1 281 281 A F H > S+ 0 0 0 -3,-0.3 4,-3.4 2,-0.2 5,-0.3 0.929 118.1 52.2 -65.7 -51.0 26.2 100.0 43.2 282 282 A G H X S+ 0 0 0 -4,-2.8 4,-1.7 1,-0.2 -2,-0.2 0.938 115.3 36.0 -42.8 -71.4 23.2 101.9 44.4 283 283 A Q H X S+ 0 0 17 -4,-3.7 4,-1.2 1,-0.2 -1,-0.2 0.771 116.8 56.4 -54.9 -38.7 21.8 103.0 41.0 284 284 A K H X S+ 0 0 19 -4,-1.4 4,-1.3 -5,-0.4 3,-0.5 0.928 106.3 46.9 -69.2 -43.0 22.9 99.7 39.5 285 285 A L H X S+ 0 0 0 -4,-3.4 4,-2.3 1,-0.2 5,-0.3 0.865 108.4 58.8 -64.3 -33.7 21.0 97.6 42.0 286 286 A R H X>S+ 0 0 10 -4,-1.7 5,-2.4 -5,-0.3 4,-1.5 0.800 101.6 55.2 -63.2 -32.6 18.0 99.8 41.4 287 287 A Q H <>S+ 0 0 1 -4,-1.2 6,-1.4 -3,-0.5 5,-1.3 0.894 114.8 35.5 -66.7 -49.5 18.0 99.0 37.7 288 288 A V H <5S+ 0 0 2 -4,-1.3 -2,-0.2 4,-0.2 -1,-0.2 0.799 128.0 32.0 -76.9 -36.5 17.8 95.2 38.0 289 289 A L H <5S+ 0 0 2 -4,-2.3 -3,-0.2 -5,-0.2 -2,-0.2 0.598 136.2 11.7-105.4 -16.0 15.6 94.9 41.1 290 290 A R T <5S+ 0 0 53 -4,-1.5 -3,-0.2 -5,-0.3 -4,-0.1 0.555 130.9 36.2-132.1 -30.1 13.2 98.0 41.0 291 291 A N T > - 0 0 45 -2,-0.3 4,-2.0 -3,-0.1 3,-0.5 -0.647 45.7 -76.3-126.3-173.4 20.0 92.9 34.3 296 296 A W H 3> S+ 0 0 0 116,-1.3 4,-3.3 115,-0.3 5,-0.2 0.789 122.9 64.9 -57.6 -34.5 22.6 90.8 36.2 297 297 A Y H 3> S+ 0 0 119 2,-0.2 4,-2.9 1,-0.2 -1,-0.2 0.946 106.2 43.3 -55.0 -48.3 25.1 91.2 33.3 298 298 A G H <> S+ 0 0 1 -3,-0.5 4,-3.5 2,-0.2 -2,-0.2 0.982 113.9 51.2 -59.3 -54.3 25.2 94.9 34.0 299 299 A F H X S+ 0 0 1 -4,-2.0 4,-2.7 1,-0.2 -2,-0.2 0.838 110.4 49.9 -50.7 -45.6 25.4 94.3 37.7 300 300 A N H X S+ 0 0 17 -4,-3.3 4,-2.8 2,-0.3 -1,-0.2 0.924 111.3 45.5 -63.0 -51.6 28.3 91.9 37.2 301 301 A Q H X S+ 0 0 105 -4,-2.9 4,-3.3 1,-0.2 5,-0.5 0.967 111.3 57.5 -58.4 -42.8 30.3 94.3 35.1 302 302 A M H X S+ 0 0 7 -4,-3.5 4,-2.0 -5,-0.2 -2,-0.3 0.905 109.0 43.3 -47.7 -56.1 29.4 96.8 37.8 303 303 A I H X S+ 0 0 9 -4,-2.7 4,-1.9 1,-0.2 -1,-0.2 0.917 116.1 47.9 -56.6 -50.3 31.0 94.7 40.5 304 304 A Q H X S+ 0 0 125 -4,-2.8 4,-0.8 1,-0.2 -2,-0.2 0.905 115.0 42.0 -60.5 -52.1 34.1 93.8 38.4 305 305 A D H X S+ 0 0 81 -4,-3.3 4,-2.2 1,-0.2 -1,-0.2 0.812 111.8 58.7 -63.6 -36.2 34.9 97.4 37.2 306 306 A T H X S+ 0 0 0 -4,-2.0 4,-2.7 -5,-0.5 -2,-0.2 0.918 101.0 52.5 -60.3 -45.7 34.1 98.7 40.7 307 307 A A H < S+ 0 0 58 -4,-1.9 -1,-0.2 1,-0.2 6,-0.2 0.797 116.0 42.5 -65.3 -23.4 36.8 96.5 42.4 308 308 A S H < S+ 0 0 98 -4,-0.8 -1,-0.2 -5,-0.2 -2,-0.2 0.767 110.8 54.7 -96.3 -22.0 39.3 97.9 39.9 309 309 A A H < S+ 0 0 15 -4,-2.2 2,-0.5 1,-0.1 -2,-0.2 0.906 107.6 54.8 -73.2 -41.9 38.1 101.5 40.1 310 310 A Y >< - 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