==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=8-JAN-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER OXIDOREDUCTASE 28-MAY-08 3DA1 . COMPND 2 MOLECULE: GLYCEROL-3-PHOSPHATE DEHYDROGENASE; . SOURCE 2 ORGANISM_SCIENTIFIC: BACILLUS HALODURANS . AUTHOR A.P.KUZIN,M.ABASHIDZE,J.SEETHARAMAN,D.WANG,H.JANJUA,L.OWENS, . 496 4 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 21480.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 358 72.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 23 4.6 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 70 14.1 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 1 0.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 1 0.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 2 0.4 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 . 34 6.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 50 10.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 153 30.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 11 2.2 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 1 0 3 1 1 0 2 2 0 2 2 0 1 0 1 1 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 2 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 . 0 1 4 2 1 0 0 1 1 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 ANTIPARALLEL BRIDGES PER LADDER . 0 1 0 0 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 LADDERS PER SHEET . # RESIDUE AA STRUCTURE BP1 BP2 ACC N-H-->O O-->H-N N-H-->O O-->H-N TCO KAPPA ALPHA PHI PSI X-CA Y-CA Z-CA 1 1 A X 0 0 124 0, 0.0 2,-1.3 0, 0.0 5,-0.1 0.000 360.0 360.0 360.0-111.3 41.5 59.8 70.9 2 2 A F + 0 0 9 428,-0.2 431,-1.4 2,-0.1 2,-0.3 -0.330 360.0 126.6 -86.7 52.8 39.4 57.5 73.0 3 3 A S > - 0 0 7 -2,-1.3 3,-0.9 428,-0.2 427,-0.3 -0.767 69.5-130.8-111.9 158.1 36.7 60.1 73.2 4 4 A A T 3 S+ 0 0 8 425,-1.8 426,-0.1 430,-0.3 3,-0.1 0.313 106.6 65.3 -87.2 8.6 33.0 59.8 72.3 5 5 A K T 3 S+ 0 0 96 424,-0.3 -1,-0.2 1,-0.1 3,-0.1 0.409 99.6 50.1-106.6 -3.4 33.4 62.9 70.2 6 6 A K X> + 0 0 52 -3,-0.9 4,-1.2 -5,-0.1 3,-0.8 0.130 67.7 122.6-120.1 17.8 35.7 61.3 67.7 7 7 A R H >> S+ 0 0 13 1,-0.3 4,-2.2 2,-0.2 3,-0.9 0.883 75.0 53.2 -46.8 -48.7 33.7 58.1 66.9 8 8 A D H 3> S+ 0 0 126 1,-0.3 4,-1.9 2,-0.2 -1,-0.3 0.873 110.3 47.9 -57.5 -36.6 33.6 58.9 63.2 9 9 A K H <4 S+ 0 0 139 -3,-0.8 -1,-0.3 1,-0.2 -2,-0.2 0.662 115.1 46.8 -77.4 -16.3 37.4 59.2 63.2 10 10 A C H X S+ 0 0 7 -4,-2.2 4,-1.0 -5,-0.2 3,-0.7 0.925 114.3 41.5 -80.1 -49.0 35.1 54.1 62.9 12 12 A G H 3< S+ 0 0 36 -4,-1.9 -1,-0.2 1,-0.2 -2,-0.1 0.355 107.5 67.8 -79.2 7.2 36.9 55.0 59.7 13 13 A E H 3> S+ 0 0 90 3,-0.1 4,-1.0 2,-0.1 -1,-0.2 0.742 109.6 30.5 -95.5 -28.9 40.2 54.3 61.5 14 14 A X H << S+ 0 0 2 -3,-0.7 166,-0.4 -4,-0.6 5,-0.2 0.481 114.2 61.3-105.9 -7.0 39.7 50.6 61.9 15 15 A S T < S+ 0 0 52 -4,-1.0 -1,-0.1 164,-0.1 3,-0.1 0.074 111.9 42.5-101.4 20.4 37.6 50.2 58.7 16 16 A E T 4 S+ 0 0 168 1,-0.3 2,-0.6 -3,-0.2 -2,-0.2 0.580 103.7 58.8-125.7 -63.3 40.8 51.5 56.9 17 17 A K S < S- 0 0 72 -4,-1.0 -1,-0.3 -5,-0.1 163,-0.1 -0.654 96.0-113.4 -76.4 119.5 43.8 49.8 58.4 18 18 A Q - 0 0 109 -2,-0.6 2,-0.3 -3,-0.1 163,-0.2 -0.318 32.9-134.8 -58.8 127.5 43.3 46.0 58.0 19 19 A L E -a 181 0A 0 161,-1.3 163,-2.8 -5,-0.2 25,-0.2 -0.652 14.8-157.7 -88.5 138.8 42.9 44.4 61.4 20 20 A D E S+ 0 0 37 23,-1.7 163,-2.4 -2,-0.3 2,-0.4 0.892 85.9 19.3 -77.4 -40.5 44.7 41.2 62.5 21 21 A L E -ab 183 44A 0 22,-2.0 24,-3.1 161,-0.2 2,-0.5 -0.994 59.3-172.9-138.2 136.8 42.0 40.6 65.1 22 22 A L E -ab 184 45A 0 161,-2.5 163,-2.3 -2,-0.4 2,-0.4 -0.994 12.9-164.5-126.6 121.2 38.5 41.8 65.7 23 23 A V E -ab 185 46A 0 22,-2.6 24,-2.3 -2,-0.5 2,-0.7 -0.920 11.7-144.4-112.4 134.1 36.7 40.9 68.9 24 24 A I E +ab 186 47A 10 161,-2.7 163,-1.6 -2,-0.4 24,-0.2 -0.849 66.7 52.5 -96.0 111.4 33.0 41.1 69.5 25 25 A G - 0 0 8 22,-2.1 23,-0.2 -2,-0.7 163,-0.1 0.032 55.1-147.2 128.8 122.2 32.2 42.2 73.1 26 26 A G + 0 0 1 25,-0.2 27,-1.5 4,-0.2 22,-0.1 0.065 64.1 119.1 -99.5 23.5 33.3 44.9 75.5 27 27 A G S > S- 0 0 19 160,-0.5 4,-2.4 25,-0.2 5,-0.3 0.020 89.3 -87.0 -75.1-171.9 33.0 42.6 78.5 28 28 A I H > S+ 0 0 4 1,-0.2 4,-2.0 2,-0.2 -1,-0.1 0.892 132.6 49.1 -65.7 -34.9 35.8 41.7 80.8 29 29 A T H > S+ 0 0 13 2,-0.2 4,-2.7 3,-0.2 5,-0.2 0.932 111.2 45.6 -68.8 -49.5 36.6 38.9 78.4 30 30 A G H > S+ 0 0 0 157,-0.4 4,-3.0 2,-0.2 -2,-0.2 0.948 117.3 44.5 -60.1 -48.1 36.5 41.0 75.2 31 31 A A H X S+ 0 0 0 -4,-2.4 4,-2.8 1,-0.2 -1,-0.2 0.902 111.9 56.3 -61.1 -40.0 38.7 43.7 76.8 32 32 A G H X S+ 0 0 3 -4,-2.0 4,-2.0 -5,-0.3 -2,-0.2 0.907 111.1 40.5 -58.7 -45.9 40.8 40.9 78.1 33 33 A I H X S+ 0 0 0 -4,-2.7 4,-3.2 2,-0.2 5,-0.4 0.937 112.9 57.1 -67.6 -47.4 41.5 39.5 74.7 34 34 A A H X S+ 0 0 0 -4,-3.0 4,-2.1 -5,-0.2 -2,-0.2 0.911 110.6 42.4 -49.1 -51.8 41.9 43.0 73.3 35 35 A L H X S+ 0 0 3 -4,-2.8 4,-2.3 2,-0.2 -1,-0.2 0.978 117.2 44.9 -62.8 -57.1 44.7 43.9 75.7 36 36 A D H < S+ 0 0 0 -4,-2.0 -2,-0.2 1,-0.2 6,-0.2 0.925 115.2 47.2 -54.2 -50.6 46.6 40.6 75.5 37 37 A A H ><>S+ 0 0 0 -4,-3.2 5,-2.0 1,-0.2 3,-1.6 0.929 111.9 51.7 -57.2 -46.3 46.4 40.3 71.8 38 38 A Q H ><5S+ 0 0 16 -4,-2.1 3,-1.4 -5,-0.4 -1,-0.2 0.866 104.5 55.7 -59.4 -39.8 47.5 44.0 71.4 39 39 A V T 3<5S+ 0 0 26 -4,-2.3 -1,-0.3 1,-0.3 -2,-0.2 0.227 105.2 54.3 -81.1 15.5 50.5 43.5 73.7 40 40 A R T < 5S- 0 0 13 -3,-1.6 -1,-0.3 -5,-0.1 -2,-0.2 0.235 124.3 -97.4-125.8 5.2 51.8 40.7 71.4 41 41 A G T < 5S+ 0 0 57 -3,-1.4 2,-1.1 1,-0.2 -3,-0.2 0.479 80.8 134.7 91.9 1.7 51.7 42.7 68.2 42 42 A I < - 0 0 2 -5,-2.0 2,-0.5 -6,-0.2 -1,-0.2 -0.744 57.5-133.9 -87.8 98.0 48.3 41.4 67.0 43 43 A Q - 0 0 72 -2,-1.1 -22,-2.0 -3,-0.1 -23,-1.7 -0.348 34.4-165.6 -55.0 104.9 46.6 44.7 65.8 44 44 A T E -b 21 0A 0 -2,-0.5 102,-1.8 -24,-0.2 2,-0.3 -0.730 21.4-166.2-106.6 148.2 43.2 44.3 67.4 45 45 A G E -bc 22 146A 1 -24,-3.1 -22,-2.6 -2,-0.3 2,-0.4 -0.916 11.3-158.2-121.0 149.0 39.9 46.0 67.0 46 46 A L E -bc 23 147A 1 100,-2.0 102,-1.6 -2,-0.3 2,-0.5 -0.995 5.4-164.8-135.4 135.1 36.9 45.7 69.4 47 47 A V E -bc 24 148A 1 -24,-2.3 -22,-2.1 -2,-0.4 2,-0.5 -0.959 4.2-172.8-122.6 119.7 33.2 46.3 68.9 48 48 A E E - c 0 149A 20 100,-3.0 103,-2.1 -2,-0.5 102,-1.0 -0.945 18.6-146.3-116.1 117.2 30.8 46.6 71.8 49 49 A X S S- 0 0 42 -2,-0.5 122,-0.2 101,-0.3 103,-0.2 0.790 84.4 -5.2 -46.5 -45.4 27.0 46.8 71.1 50 50 A N S S- 0 0 50 1,-0.4 100,-1.9 100,-0.2 2,-0.3 0.306 120.2 -22.3-119.9-110.3 26.1 49.2 73.9 51 51 A D S > S- 0 0 0 98,-0.2 3,-2.2 99,-0.1 -1,-0.4 -0.760 74.3 -91.7-107.3 155.9 28.6 50.4 76.6 52 52 A F T 3 S+ 0 0 2 -2,-0.3 -25,-0.2 1,-0.3 82,-0.1 -0.452 117.2 7.5 -61.9 137.1 31.8 48.8 77.6 53 53 A A T 3 S+ 0 0 3 -27,-1.5 -1,-0.3 1,-0.1 -26,-0.1 0.486 92.3 127.9 66.8 4.7 31.0 46.5 80.6 54 54 A S < + 0 0 11 -3,-2.2 -2,-0.1 3,-0.1 -1,-0.1 0.745 62.0 64.1 -63.2 -21.6 27.3 47.2 79.9 55 55 A G S > S- 0 0 15 -4,-0.3 3,-1.5 2,-0.1 4,-0.1 0.233 124.1 -46.1 -80.3-150.2 26.7 43.5 79.8 56 56 A T G > S+ 0 0 44 1,-0.3 3,-2.0 2,-0.2 -2,-0.1 0.684 122.6 79.5 -56.1 -21.1 27.1 40.9 82.7 57 57 A S G 3 S+ 0 0 16 1,-0.3 -1,-0.3 2,-0.1 76,-0.3 0.411 97.7 44.1 -70.5 4.0 30.5 42.4 83.6 58 58 A S G < S+ 0 0 4 -3,-1.5 -1,-0.3 71,-0.1 -2,-0.2 0.215 109.1 58.5-127.7 9.3 28.7 45.2 85.4 59 59 A R S < S+ 0 0 58 -3,-2.0 -2,-0.1 -4,-0.1 2,-0.1 -0.051 76.6 106.2-132.2 35.0 26.2 43.0 87.1 60 60 A S S S- 0 0 29 -3,-0.1 69,-0.1 1,-0.0 154,-0.0 -0.380 85.0-103.6-101.3-177.5 28.2 40.5 89.2 61 61 A T - 0 0 28 -2,-0.1 188,-0.1 2,-0.1 -1,-0.0 0.566 55.1-125.8 -83.6 -5.4 28.6 40.5 93.0 62 62 A K + 0 0 2 1,-0.2 65,-2.7 64,-0.1 2,-0.5 0.818 57.8 145.7 68.3 37.5 32.1 41.9 92.2 63 63 A L E -F 126 0B 10 63,-0.2 2,-1.3 20,-0.0 63,-0.2 -0.908 43.4-148.9-109.6 120.5 34.2 39.4 94.1 64 64 A V E -F 125 0B 3 61,-2.1 61,-0.6 -2,-0.5 8,-0.0 -0.718 31.4-142.3 -84.5 99.1 37.6 38.3 92.7 65 65 A H 0 0 94 -2,-1.3 7,-0.1 1,-0.1 59,-0.0 -0.277 360.0 360.0 -66.6 145.3 37.6 34.7 94.1 66 66 A G 0 0 50 6,-0.1 3,-0.2 5,-0.1 -1,-0.1 0.360 360.0 360.0-130.1 360.0 40.7 33.1 95.4 67 ! 0 0 0 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 360.0 0.0 0.0 0.0 68 82 A V > 0 0 105 0, 0.0 4,-1.4 0, 0.0 5,-0.1 0.000 360.0 360.0 360.0 -41.9 43.6 31.4 91.3 69 83 A G H > + 0 0 35 2,-0.2 4,-1.3 -3,-0.2 3,-0.1 0.948 360.0 43.2 -72.0 -48.7 45.2 32.7 94.4 70 84 A K H > S+ 0 0 143 1,-0.2 4,-2.2 2,-0.2 3,-0.4 0.909 113.4 52.6 -60.5 -43.9 48.2 33.9 92.4 71 85 A E H > S+ 0 0 17 1,-0.2 4,-1.7 2,-0.2 -1,-0.2 0.834 104.2 56.3 -62.9 -32.5 45.9 35.2 89.7 72 86 A R H X S+ 0 0 42 -4,-1.4 4,-1.9 2,-0.2 -1,-0.2 0.848 107.3 49.6 -67.5 -33.2 43.9 37.2 92.2 73 87 A A H X S+ 0 0 39 -4,-1.3 4,-2.9 -3,-0.4 5,-0.4 0.976 105.3 56.2 -66.6 -56.9 47.2 38.9 93.2 74 88 A I H X S+ 0 0 29 -4,-2.2 4,-1.7 1,-0.2 -2,-0.2 0.864 109.7 47.3 -40.3 -49.7 48.1 39.8 89.6 75 89 A V H X S+ 0 0 4 -4,-1.7 4,-1.0 2,-0.2 -1,-0.2 0.956 113.1 47.1 -60.6 -53.8 44.8 41.6 89.3 76 90 A Y H >< S+ 0 0 52 -4,-1.9 3,-1.2 1,-0.2 7,-0.2 0.948 113.0 47.8 -54.7 -55.1 45.2 43.5 92.5 77 91 A E H 3< S+ 0 0 64 -4,-2.9 -1,-0.2 1,-0.3 -2,-0.2 0.811 110.9 51.4 -59.0 -33.2 48.8 44.6 91.9 78 92 A N H 3< S+ 0 0 4 -4,-1.7 277,-2.1 -5,-0.4 -1,-0.3 0.649 131.1 12.6 -80.8 -14.2 48.0 45.8 88.4 79 93 A A XX + 0 0 0 -3,-1.2 3,-1.6 -4,-1.0 4,-1.5 -0.391 64.3 170.0-160.8 72.3 45.1 47.9 89.5 80 94 A P T 34 S+ 0 0 7 0, 0.0 -3,-0.1 0, 0.0 -4,-0.1 0.631 78.4 61.6 -63.0 -13.4 44.9 48.4 93.2 81 95 A H T 34 S+ 0 0 6 1,-0.1 314,-0.1 -5,-0.1 3,-0.1 0.633 105.3 46.0 -89.1 -13.1 42.1 51.1 92.8 82 96 A V T <4 S+ 0 0 5 -3,-1.6 2,-0.4 1,-0.2 50,-0.1 0.826 117.9 39.5 -93.6 -39.8 39.7 48.7 91.2 83 97 A T < + 0 0 1 -4,-1.5 44,-0.3 -7,-0.2 -1,-0.2 -0.910 62.4 176.7-116.7 142.2 40.2 45.8 93.7 84 98 A T E -G 126 0B 39 42,-2.7 42,-3.0 -2,-0.4 2,-0.2 -0.994 27.3-126.2-143.1 128.6 40.6 45.9 97.4 85 99 A P E +G 125 0B 42 0, 0.0 2,-0.3 0, 0.0 40,-0.3 -0.578 36.7 165.6 -77.8 143.1 40.9 43.1 99.9 86 100 A E E -G 124 0B 51 38,-2.6 38,-3.5 -2,-0.2 2,-0.2 -0.897 39.2 -84.7-144.3 170.4 38.4 43.1 102.8 87 101 A W E -G 123 0B 123 -2,-0.3 140,-0.9 36,-0.2 2,-0.4 -0.579 32.6-156.3 -85.8 145.4 37.3 40.6 105.5 88 102 A X E -Gh 122 227B 2 34,-3.5 34,-2.0 -2,-0.2 2,-0.6 -0.951 5.1-151.4-118.6 139.1 34.6 38.1 104.8 89 103 A L E -Gh 121 228B 0 138,-1.8 140,-2.4 -2,-0.4 32,-0.2 -0.938 8.7-171.8-118.1 111.5 32.6 36.6 107.7 90 104 A L E -G 120 0B 37 30,-2.2 30,-1.6 -2,-0.6 140,-0.2 -0.875 19.2-146.5-102.2 104.1 31.2 33.1 107.2 91 105 A P E -G 119 0B 12 0, 0.0 2,-0.4 0, 0.0 28,-0.3 -0.208 7.8-144.3 -64.8 162.6 28.8 32.3 110.2 92 106 A I E +G 118 0B 65 26,-2.5 25,-2.7 138,-0.0 26,-1.5 -0.998 19.3 175.9-133.1 132.2 28.6 28.8 111.5 93 107 A F 0 0 57 -2,-0.4 23,-0.2 23,-0.2 22,-0.1 -0.717 360.0 360.0-125.9 179.3 25.4 27.1 112.9 94 108 A K 0 0 189 21,-0.5 -1,-0.1 -2,-0.2 23,-0.0 -0.296 360.0 360.0 -83.9 360.0 24.5 23.6 114.2 95 ! 0 0 0 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 360.0 0.0 0.0 0.0 96 136 A R 0 0 189 0, 0.0 2,-0.4 0, 0.0 26,-0.2 0.000 360.0 360.0 360.0 152.1 42.0 32.5 108.1 97 137 A Y E -I 121 0B 138 24,-1.1 24,-1.6 2,-0.0 2,-0.6 -0.992 360.0-140.0-135.9 127.7 40.8 32.8 111.7 98 138 A X E -I 120 0B 184 -2,-0.4 2,-0.4 22,-0.2 22,-0.2 -0.760 29.0-170.1 -86.1 117.4 38.7 30.3 113.7 99 139 A L E -I 119 0B 29 20,-3.0 20,-2.4 -2,-0.6 -2,-0.0 -0.897 11.9-145.0-115.6 141.6 36.2 32.3 115.8 100 140 A N > - 0 0 77 -2,-0.4 4,-2.2 18,-0.2 18,-0.2 -0.080 41.2 -84.3 -85.2-168.3 33.9 31.1 118.5 101 141 A E H > S+ 0 0 81 16,-0.4 4,-3.0 2,-0.2 5,-0.3 0.972 125.7 43.9 -65.9 -57.3 30.3 32.4 119.2 102 142 A K H > S+ 0 0 156 1,-0.2 4,-1.5 2,-0.2 -1,-0.2 0.915 117.4 47.3 -54.9 -45.3 31.1 35.4 121.4 103 143 A Q H > S+ 0 0 76 2,-0.2 4,-2.0 1,-0.2 -1,-0.2 0.933 111.5 50.5 -61.9 -47.6 34.0 36.4 119.0 104 144 A T H X S+ 0 0 0 -4,-2.2 4,-2.3 1,-0.3 3,-0.5 0.950 110.9 48.6 -54.8 -51.5 31.7 35.9 115.9 105 145 A L H < S+ 0 0 29 -4,-3.0 -1,-0.3 1,-0.3 -2,-0.2 0.800 108.7 55.8 -59.9 -28.0 29.0 38.1 117.5 106 146 A E H < S+ 0 0 138 -4,-1.5 -1,-0.3 -5,-0.3 -2,-0.2 0.854 105.7 50.1 -74.6 -32.5 31.7 40.6 118.3 107 147 A K H < S+ 0 0 92 -4,-2.0 -2,-0.2 -3,-0.5 -1,-0.1 0.979 133.4 12.5 -67.8 -55.8 32.7 40.8 114.6 108 148 A E >< - 0 0 1 -4,-2.3 3,-1.6 -5,-0.1 -1,-0.3 -0.869 68.5-173.4-124.0 98.3 29.1 41.3 113.5 109 149 A P T 3 S+ 0 0 60 0, 0.0 -4,-0.1 0, 0.0 -3,-0.1 0.239 81.4 67.6 -73.4 16.6 26.9 42.1 116.5 110 150 A L T 3 S+ 0 0 28 2,-0.1 174,-0.5 113,-0.0 175,-0.2 0.525 75.4 117.2-111.1 -13.3 23.9 41.9 114.2 111 151 A L S < S- 0 0 6 -3,-1.6 2,-0.2 -6,-0.2 171,-0.2 -0.085 77.9 -90.0 -58.5 154.9 24.1 38.2 113.5 112 152 A R - 0 0 56 169,-0.9 -1,-0.1 1,-0.1 4,-0.1 -0.453 32.5-160.9 -66.6 128.3 21.4 35.7 114.5 113 153 A K > + 0 0 133 -2,-0.2 3,-2.3 -3,-0.1 -1,-0.1 0.905 59.1 102.8 -78.6 -43.7 22.1 34.4 118.0 114 154 A E T 3 S- 0 0 95 1,-0.3 3,-0.1 -21,-0.0 -2,-0.1 -0.197 105.9 -14.4 -49.5 111.0 20.0 31.2 117.8 115 155 A N T 3 S+ 0 0 64 1,-0.2 -21,-0.5 -22,-0.1 2,-0.4 0.426 86.1 158.3 73.2 3.2 22.4 28.2 117.2 116 156 A L < + 0 0 5 -3,-2.3 -23,-0.2 1,-0.2 -1,-0.2 -0.425 12.4 174.4 -60.8 114.6 25.4 30.4 116.3 117 157 A K - 0 0 141 -25,-2.7 -16,-0.4 -2,-0.4 2,-0.3 0.679 52.5 -89.3 -95.1 -22.4 28.3 28.1 117.0 118 158 A G E - G 0 92B 2 -26,-1.5 -26,-2.5 -18,-0.2 -1,-0.3 -0.999 41.5-125.0 152.2-147.2 30.8 30.5 115.6 119 159 A G E -IG 99 91B 8 -20,-2.4 -20,-3.0 -2,-0.3 2,-0.4 -0.985 12.1-110.2 178.4 176.7 32.5 31.4 112.3 120 160 A G E -IG 98 90B 6 -30,-1.6 -30,-2.2 -2,-0.3 2,-0.5 -0.998 22.8-156.9-130.4 131.8 35.6 31.9 110.3 121 161 A I E +IG 97 89B 6 -24,-1.6 -24,-1.1 -2,-0.4 2,-0.3 -0.943 21.7 163.2-114.3 128.6 36.8 35.2 109.0 122 162 A Y E - 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0 0 5 -277,-2.1 3,-3.0 1,-0.2 -219,-0.2 -0.304 47.0 -58.9 -82.7 172.7 46.0 48.3 83.9 356 406 A S T 3 S+ 0 0 11 -221,-2.1 -1,-0.2 1,-0.3 3,-0.1 -0.292 129.4 8.2 -54.7 122.2 44.7 51.8 83.2 357 407 A G T 3 S+ 0 0 8 1,-0.3 39,-2.2 -3,-0.1 -1,-0.3 0.299 95.3 144.2 88.9 -9.4 45.4 53.9 86.2 358 408 A G < - 0 0 14 -3,-3.0 -1,-0.3 -280,-0.2 2,-0.2 -0.344 50.1-119.0 -66.7 140.5 47.5 51.2 87.9 359 409 A L > - 0 0 9 -282,-0.1 3,-0.8 1,-0.1 -4,-0.1 -0.494 7.4-134.3 -79.4 149.8 50.5 52.3 89.9 360 410 A A T 3 S+ 0 0 84 1,-0.2 -1,-0.1 -2,-0.2 3,-0.1 0.896 108.4 56.5 -67.1 -39.7 54.0 51.2 88.9 361 411 A E T 3 S- 0 0 77 1,-0.2 -1,-0.2 4,-0.1 3,-0.2 0.545 105.5-141.5 -69.2 -7.6 54.7 50.4 92.6 362 412 A G < - 0 0 0 -3,-0.8 -1,-0.2 1,-0.2 -285,-0.1 -0.205 53.4 -27.2 73.3-171.1 51.7 48.1 92.5 363 413 A A S > S+ 0 0 5 2,-0.1 3,-2.2 1,-0.1 2,-0.8 0.910 128.3 65.2 -40.8 -69.1 49.4 47.8 95.5 364 414 A Q T 3 S+ 0 0 148 1,-0.3 -1,-0.1 -3,-0.2 -287,-0.0 -0.455 97.6 50.7 -64.0 104.6 51.9 48.7 98.2 365 415 A G T 3> S+ 0 0 6 -2,-0.8 4,-1.1 -5,-0.0 -1,-0.3 0.132 81.7 98.4 145.8 -5.3 52.6 52.3 97.2 366 416 A F H <> S+ 0 0 27 -3,-2.2 4,-2.2 2,-0.2 5,-0.2 0.796 76.4 55.7 -77.1 -34.2 48.9 53.2 97.1 367 417 A P H > S+ 0 0 84 0, 0.0 4,-2.6 0, 0.0 3,-0.3 0.985 111.1 43.7 -63.3 -51.9 48.7 54.8 100.5 368 418 A R H > S+ 0 0 133 1,-0.2 4,-2.3 2,-0.2 -2,-0.2 0.853 111.5 58.8 -57.0 -36.6 51.5 57.2 99.7 369 419 A F H X S+ 0 0 20 -4,-1.1 4,-3.1 2,-0.2 -1,-0.2 0.902 108.4 41.5 -60.9 -46.9 49.8 57.7 96.3 370 420 A L H X S+ 0 0 23 -4,-2.2 4,-2.2 -3,-0.3 -2,-0.2 0.897 113.5 53.3 -69.5 -40.1 46.5 58.9 97.9 371 421 A D H X S+ 0 0 69 -4,-2.6 4,-1.1 -5,-0.2 -2,-0.2 0.879 116.0 42.1 -60.6 -37.6 48.4 61.0 100.4 372 422 A E H X S+ 0 0 71 -4,-2.3 4,-2.2 -5,-0.2 3,-0.5 0.960 115.2 45.1 -73.4 -55.5 50.2 62.6 97.5 373 423 A A H X S+ 0 0 7 -4,-3.1 4,-1.9 1,-0.3 5,-0.2 0.786 109.7 59.6 -60.8 -26.9 47.3 63.0 95.1 374 424 A S H X S+ 0 0 12 -4,-2.2 4,-1.3 -5,-0.2 -1,-0.3 0.910 109.3 41.6 -68.1 -40.4 45.3 64.4 98.0 375 425 A R H X S+ 0 0 142 -4,-1.1 4,-1.7 -3,-0.5 -2,-0.2 0.813 113.3 52.4 -75.7 -33.2 47.8 67.2 98.5 376 426 A K H < S+ 0 0 97 -4,-2.2 4,-0.4 2,-0.2 -2,-0.2 0.863 110.3 48.0 -72.0 -34.9 48.2 67.9 94.8 377 427 A G H ><>S+ 0 0 0 -4,-1.9 5,-1.2 -5,-0.2 3,-0.8 0.851 108.8 55.4 -72.6 -34.3 44.5 68.2 94.3 378 428 A A H ><5S+ 0 0 38 -4,-1.3 3,-2.7 1,-0.3 4,-0.2 0.897 98.7 59.7 -65.0 -40.8 44.3 70.5 97.3 379 429 A K T 3<5S+ 0 0 178 -4,-1.7 -1,-0.3 1,-0.3 -2,-0.2 0.706 99.0 60.7 -61.7 -16.7 46.9 72.9 95.8 380 430 A L T < 5S- 0 0 62 -3,-0.8 -1,-0.3 -4,-0.4 -2,-0.2 0.295 129.8 -99.0 -91.4 9.4 44.5 73.3 93.0 381 431 A G T < 5S+ 0 0 68 -3,-2.7 2,-0.3 1,-0.3 -3,-0.2 0.809 82.3 130.7 79.4 31.3 42.0 74.6 95.5 382 432 A F < - 0 0 40 -5,-1.2 2,-0.5 -4,-0.2 -1,-0.3 -0.781 68.1 -88.7-114.8 161.5 40.0 71.4 95.9 383 433 A D > - 0 0 94 -2,-0.3 4,-2.7 1,-0.2 5,-0.3 -0.545 30.4-143.5 -70.8 119.2 38.9 69.5 99.0 384 434 A A H > S+ 0 0 42 -2,-0.5 4,-1.9 1,-0.2 -1,-0.2 0.858 101.3 46.3 -49.6 -42.7 41.7 67.1 100.1 385 435 A D H > S+ 0 0 73 2,-0.2 4,-2.0 1,-0.2 -1,-0.2 0.875 110.7 53.6 -70.8 -37.0 39.1 64.4 101.1 386 436 A E H > S+ 0 0 95 1,-0.2 4,-1.4 2,-0.2 -2,-0.2 0.960 112.4 41.8 -63.2 -50.2 37.1 64.9 98.0 387 437 A V H X S+ 0 0 1 -4,-2.7 4,-2.5 2,-0.2 5,-0.2 0.874 108.1 62.2 -66.3 -34.4 40.1 64.3 95.7 388 438 A R H >X S+ 0 0 82 -4,-1.9 4,-2.2 -5,-0.3 3,-0.6 0.974 105.2 46.2 -51.8 -56.7 41.3 61.4 97.9 389 439 A R H 3X S+ 0 0 153 -4,-2.0 4,-1.6 1,-0.3 -1,-0.2 0.795 112.3 51.7 -54.7 -33.2 38.1 59.5 97.1 390 440 A L H 3X S+ 0 0 14 -4,-1.4 4,-3.5 2,-0.2 -1,-0.3 0.828 106.5 53.5 -74.1 -32.1 38.5 60.4 93.4 391 441 A A H < S- 0 0 0 -4,-3.5 3,-1.3 1,-0.2 -3,-0.2 0.494 91.2-146.5 -83.4 -7.0 40.4 56.8 89.1 395 445 A G G >< S- 0 0 0 -4,-2.3 3,-1.7 1,-0.3 -1,-0.2 -0.264 71.4 -20.7 67.6-167.1 43.8 55.5 90.1 396 446 A S G > S+ 0 0 41 -39,-2.2 3,-1.3 1,-0.3 4,-0.3 0.662 125.3 83.8 -49.4 -16.4 46.8 57.6 88.9 397 447 A N G <> + 0 0 19 -3,-1.3 4,-1.3 1,-0.3 -1,-0.3 0.419 60.5 97.3 -69.1 4.5 44.4 59.0 86.3 398 448 A V H <> S+ 0 0 0 -3,-1.7 4,-2.9 1,-0.2 5,-0.3 0.873 72.2 64.2 -60.7 -37.6 43.2 61.5 88.9 399 449 A D H <> S+ 0 0 84 -3,-1.3 4,-1.8 1,-0.3 -1,-0.2 0.951 101.4 51.2 -50.8 -49.9 45.6 64.0 87.5 400 450 A H H > S+ 0 0 64 -4,-0.3 4,-1.8 1,-0.3 -1,-0.3 0.862 113.4 42.8 -55.8 -40.7 43.5 63.9 84.3 401 451 A V H X S+ 0 0 0 -4,-1.3 4,-1.8 1,-0.2 -1,-0.3 0.779 112.4 54.6 -78.3 -23.7 40.3 64.5 86.1 402 452 A L H X S+ 0 0 6 -4,-2.9 4,-1.3 -5,-0.2 -2,-0.2 0.730 107.8 51.2 -78.7 -22.1 42.0 67.1 88.3 403 453 A N H X S+ 0 0 76 -4,-1.8 4,-3.1 -5,-0.3 5,-0.2 0.936 113.0 41.9 -77.3 -51.6 43.1 69.0 85.1 404 454 A Y H X S+ 0 0 32 -4,-1.8 4,-2.2 1,-0.2 -2,-0.2 0.912 116.5 50.6 -59.4 -46.9 39.6 69.0 83.4 405 455 A A H < S+ 0 0 0 -4,-1.8 -1,-0.2 2,-0.2 -2,-0.2 0.906 113.0 46.3 -58.3 -44.1 38.1 69.9 86.8 406 456 A Y H >< S+ 0 0 133 -4,-1.3 3,-1.4 1,-0.2 -2,-0.2 0.999 114.1 46.5 -61.4 -64.1 40.6 72.7 87.2 407 457 A E H 3< S+ 0 0 135 -4,-3.1 3,-0.4 1,-0.3 4,-0.2 0.744 111.2 53.8 -49.6 -32.2 40.2 74.1 83.7 408 458 A G T 3X + 0 0 3 -4,-2.2 4,-2.8 -5,-0.2 -1,-0.3 0.006 63.5 116.6-100.2 32.0 36.4 74.0 83.9 409 459 A K H <> S+ 0 0 119 -3,-1.4 4,-1.3 1,-0.2 -1,-0.2 0.866 86.1 42.3 -64.2 -34.2 35.6 76.0 87.1 410 460 A E H > S+ 0 0 132 -3,-0.4 4,-2.4 2,-0.2 5,-0.2 0.918 114.8 49.1 -76.1 -46.3 33.8 78.6 85.0 411 461 A E H > S+ 0 0 63 -4,-0.2 4,-1.5 1,-0.2 -2,-0.2 0.927 110.4 52.2 -57.9 -47.0 32.0 76.1 82.8 412 462 A A H <>S+ 0 0 2 -4,-2.8 5,-2.4 1,-0.2 -1,-0.2 0.875 109.2 48.6 -58.1 -43.1 30.9 74.2 85.8 413 463 A E H ><5S+ 0 0 158 -4,-1.3 3,-2.3 1,-0.2 -1,-0.2 0.936 109.5 52.1 -63.4 -47.8 29.4 77.2 87.5 414 464 A H H 3<5S+ 0 0 150 -4,-2.4 -1,-0.2 1,-0.3 -2,-0.2 0.798 114.5 44.2 -59.1 -28.3 27.6 78.2 84.3 415 465 A Y T 3<5S- 0 0 41 -4,-1.5 -1,-0.3 2,-0.2 -2,-0.2 0.127 111.8-124.1-102.6 17.0 26.2 74.7 84.3 416 466 A G T < 5S+ 0 0 48 -3,-2.3 -3,-0.2 1,-0.1 45,-0.1 0.810 70.6 114.7 42.0 47.6 25.4 74.7 88.0 417 467 A L S > - 0 0 61 0, 0.0 4,-1.9 0, 0.0 3,-1.8 -0.164 32.7-126.6 -50.0 132.0 30.6 71.1 91.0 419 469 A A H 3> S+ 0 0 22 1,-0.3 4,-1.8 2,-0.2 -11,-0.1 0.837 109.9 56.9 -48.2 -42.3 33.9 71.5 89.2 420 470 A L H 3> S+ 0 0 23 1,-0.2 4,-1.1 2,-0.2 -1,-0.3 0.766 107.6 48.7 -63.0 -27.2 35.1 68.1 90.4 421 471 A L H <> S+ 0 0 15 -3,-1.8 4,-1.2 2,-0.2 -1,-0.2 0.858 107.7 53.7 -80.6 -36.7 32.0 66.5 88.8 422 472 A L H X S+ 0 0 1 -4,-1.9 4,-2.0 1,-0.2 5,-0.2 0.836 105.9 55.5 -64.4 -32.7 32.6 68.4 85.6 423 473 A G H X S+ 0 0 0 -4,-1.8 4,-2.0 -5,-0.2 -1,-0.2 0.906 104.1 52.2 -66.9 -41.2 36.1 66.9 85.6 424 474 A Q H X S+ 0 0 24 -4,-1.1 4,-1.6 1,-0.2 -1,-0.2 0.772 111.0 49.8 -64.3 -28.5 34.8 63.4 85.8 425 475 A L H X S+ 0 0 0 -4,-1.2 4,-3.1 2,-0.2 5,-0.2 0.903 109.3 46.6 -78.2 -48.2 32.6 64.0 82.8 426 476 A Q H X S+ 0 0 26 -4,-2.0 4,-3.2 2,-0.2 5,-0.3 0.896 115.7 48.1 -62.5 -39.7 35.1 65.5 80.4 427 477 A Y H X>S+ 0 0 1 -4,-2.0 4,-3.1 -5,-0.2 5,-0.8 0.951 112.4 50.3 -64.0 -47.3 37.4 62.6 81.4 428 478 A G H X5S+ 0 0 0 -4,-1.6 6,-2.2 3,-0.2 4,-0.9 0.905 119.1 35.6 -57.6 -45.2 34.6 60.3 80.8 429 479 A V H <5S+ 0 0 0 -4,-3.1 -425,-1.8 4,-0.3 4,-0.4 0.968 126.8 36.4 -75.1 -52.0 33.7 61.7 77.4 430 480 A E H <5S+ 0 0 60 -4,-3.2 -428,-0.2 -427,-0.3 -3,-0.2 0.703 137.9 12.3 -76.0 -22.0 37.3 62.5 76.2 431 481 A Q H <5S+ 0 0 32 -4,-3.1 -3,-0.2 -5,-0.3 -1,-0.2 0.391 128.6 46.2-136.5 3.1 39.2 59.5 77.7 432 482 A E S < S- 0 0 1 1,-0.1 4,-1.5 48,-0.0 5,-0.1 -0.932 74.4-128.4-136.6 153.7 25.4 58.4 77.3 437 487 A P H > S+ 0 0 0 0, 0.0 4,-2.7 0, 0.0 5,-0.3 0.860 116.1 55.7 -68.7 -32.2 24.2 59.6 80.7 438 488 A L H >>S+ 0 0 19 1,-0.2 4,-2.0 2,-0.2 5,-0.9 0.884 100.7 58.7 -64.4 -38.0 23.8 56.0 81.5 439 489 A D H >>S+ 0 0 0 3,-0.2 5,-1.6 1,-0.2 4,-1.2 0.947 114.5 35.9 -55.9 -50.1 27.4 55.4 80.7 440 490 A F H <>S+ 0 0 1 -4,-1.5 5,-1.2 3,-0.2 6,-0.4 0.947 119.4 44.7 -69.6 -54.2 28.5 57.9 83.3 441 491 A F H <5S+ 0 0 1 -4,-2.7 7,-3.0 3,-0.2 8,-0.2 0.745 127.8 24.5 -67.2 -26.2 26.0 57.4 86.1 442 492 A V H <5S+ 0 0 13 -4,-2.0 -3,-0.2 -5,-0.3 7,-0.2 0.771 132.8 24.2-109.2 -35.0 26.1 53.6 86.1 443 493 A R T <> + 0 0 6 -6,-0.4 4,-2.6 3,-0.1 3,-0.9 0.594 57.0 140.3 78.3 11.8 28.4 53.2 89.6 447 497 A A H 3> + 0 0 5 -7,-0.4 4,-3.0 1,-0.2 -5,-0.2 0.861 55.9 68.0 -56.7 -38.7 26.3 55.9 91.1 448 498 A L H 34 S+ 0 0 9 -7,-3.0 4,-0.3 1,-0.2 -1,-0.2 0.904 115.3 28.3 -50.8 -41.2 23.0 54.4 89.8 449 499 A F H <4 S+ 0 0 18 -3,-0.9 3,-0.3 -8,-0.2 -2,-0.2 0.923 132.9 31.1 -85.1 -47.8 23.6 51.5 92.2 450 500 A F H < S+ 0 0 3 -4,-2.6 -3,-0.2 1,-0.2 -2,-0.2 0.504 136.0 15.7 -96.3 -2.2 25.6 53.0 95.0 451 501 A N >X + 0 0 58 -4,-3.0 3,-2.6 -5,-0.3 4,-1.0 -0.100 66.5 158.9-162.3 47.4 24.4 56.6 95.2 452 502 A I H 3> S+ 0 0 9 -4,-0.3 4,-1.6 1,-0.3 5,-0.1 0.708 74.8 61.0 -50.0 -27.2 21.2 56.7 93.2 453 503 A S H 3> S+ 0 0 55 1,-0.2 4,-2.3 2,-0.2 -1,-0.3 0.806 98.6 59.4 -72.9 -25.4 20.1 59.9 94.9 454 504 A L H <> S+ 0 0 49 -3,-2.6 4,-2.1 2,-0.2 -2,-0.2 0.908 105.5 46.5 -67.6 -43.3 23.2 61.6 93.5 455 505 A V H X S+ 0 0 0 -4,-1.0 4,-1.4 2,-0.2 -1,-0.2 0.874 110.5 53.3 -68.6 -32.1 22.1 60.8 90.0 456 506 A H H < S+ 0 0 84 -4,-1.6 3,-0.4 1,-0.2 4,-0.4 0.947 110.3 49.7 -64.3 -42.2 18.6 62.2 90.8 457 507 A Q H < S+ 0 0 139 -4,-2.3 4,-0.3 1,-0.2 -2,-0.2 0.870 123.4 28.3 -62.9 -39.4 20.3 65.3 92.1 458 508 A W H X S+ 0 0 70 -4,-2.1 4,-2.4 1,-0.1 5,-0.2 0.340 86.7 99.7-110.7 11.3 22.4 65.9 89.0 459 509 A K H X S+ 0 0 34 -4,-1.4 4,-2.0 -3,-0.4 5,-0.2 0.846 87.4 49.2 -65.4 -32.0 20.4 64.3 86.1 460 510 A E H > S+ 0 0 133 -4,-0.4 4,-2.5 -3,-0.2 5,-0.2 0.999 115.0 41.3 -67.3 -65.1 19.1 67.7 85.0 461 511 A A H > S+ 0 0 19 -4,-0.3 4,-1.6 1,-0.2 -2,-0.2 0.812 117.0 49.9 -51.7 -37.7 22.4 69.5 85.0 462 512 A V H X S+ 0 0 0 -4,-2.4 4,-2.8 2,-0.2 5,-0.2 0.931 111.2 46.3 -70.9 -46.2 24.3 66.6 83.5 463 513 A L H X S+ 0 0 4 -4,-2.0 4,-2.4 -5,-0.2 -2,-0.2 0.880 110.4 55.6 -62.7 -37.0 21.8 66.0 80.6 464 514 A R H X S+ 0 0 137 -4,-2.5 4,-1.1 -5,-0.2 -1,-0.2 0.903 111.8 43.1 -61.8 -42.7 21.8 69.8 79.9 465 515 A W H >X S+ 0 0 16 -4,-1.6 4,-3.2 -5,-0.2 3,-0.6 0.953 113.5 48.8 -69.0 -52.9 25.7 69.7 79.5 466 516 A X H 3X S+ 0 0 0 -4,-2.8 4,-2.6 1,-0.3 5,-0.2 0.902 105.2 59.9 -54.5 -41.5 25.9 66.6 77.5 467 517 A A H 3<>S+ 0 0 12 -4,-2.4 5,-2.2 -5,-0.2 4,-0.4 0.905 114.1 37.9 -52.9 -40.4 23.2 68.0 75.2 468 518 A E H X<5S+ 0 0 113 -4,-1.1 3,-0.8 -3,-0.6 -2,-0.2 0.913 112.7 54.4 -78.7 -44.8 25.6 70.8 74.6 469 519 A E H 3<5S+ 0 0 35 -4,-3.2 -2,-0.2 1,-0.2 -3,-0.2 0.796 119.8 33.7 -60.6 -30.3 28.8 68.8 74.5 470 520 A F T 3<5S- 0 0 37 -4,-2.6 -1,-0.2 -5,-0.2 -2,-0.2 0.368 103.9-119.3-109.5 4.4 27.5 66.5 71.8 471 521 A S T < 5 - 0 0 100 -3,-0.8 -3,-0.2 -4,-0.4 2,-0.2 0.973 45.0-168.6 55.1 56.8 25.2 68.8 69.7 472 522 A W < - 0 0 33 -5,-2.2 -1,-0.1 -6,-0.2 2,-0.1 -0.509 13.7-133.5 -78.5 147.5 22.2 66.6 70.5 473 523 A T > - 0 0 55 -2,-0.2 4,-2.5 1,-0.1 5,-0.2 -0.229 33.6 -97.5 -86.3-178.5 18.9 67.1 68.7 474 524 A E H > S+ 0 0 161 2,-0.2 4,-3.0 1,-0.2 5,-0.2 0.905 127.3 51.5 -68.3 -39.8 15.6 67.3 70.4 475 525 A E H > S+ 0 0 136 2,-0.2 4,-2.3 1,-0.2 -1,-0.2 0.861 112.8 45.3 -64.6 -36.6 15.0 63.6 69.7 476 526 A E H > S+ 0 0 43 2,-0.2 4,-3.0 3,-0.2 5,-0.2 0.907 114.3 47.3 -72.6 -45.0 18.4 62.7 71.2 477 527 A K H X S+ 0 0 60 -4,-2.5 4,-0.8 2,-0.2 -2,-0.2 0.942 117.4 42.9 -62.8 -45.6 18.0 64.9 74.2 478 528 A T H X S+ 0 0 68 -4,-3.0 4,-1.5 -5,-0.2 3,-0.3 0.927 117.7 45.6 -67.1 -44.1 14.5 63.5 74.8 479 529 A R H >X S+ 0 0 87 -4,-2.3 4,-2.7 -5,-0.2 3,-0.6 0.959 110.9 51.2 -62.1 -55.9 15.5 59.9 74.1 480 530 A F H 3X S+ 0 0 4 -4,-3.0 4,-1.0 1,-0.3 -1,-0.2 0.695 110.7 52.3 -57.9 -17.4 18.7 60.0 76.2 481 531 A Q H 3X S+ 0 0 64 -4,-0.8 4,-2.1 -3,-0.3 -1,-0.3 0.805 109.3 46.5 -87.2 -32.9 16.6 61.4 79.0 482 532 A N H X S+ 0 0 81 -4,-1.3 4,-3.0 -3,-0.3 3,-0.5 0.898 112.7 46.3 -78.2 -42.5 12.6 53.5 87.7 490 540 A X H 3< S+ 0 0 16 -4,-2.2 -2,-0.2 1,-0.2 -224,-0.2 0.809 101.3 68.9 -71.1 -25.5 13.5 49.9 87.2 491 541 A A H 3< S+ 0 0 4 -4,-2.6 -1,-0.2 -5,-0.2 -2,-0.2 0.873 121.3 13.1 -59.7 -37.1 16.3 50.2 89.8 492 542 A V H << S+ 0 0 67 -4,-0.7 -2,-0.2 -3,-0.5 -1,-0.2 0.779 121.0 61.0-109.3 -36.7 13.7 50.6 92.5 493 543 A D >< - 0 0 57 -4,-3.0 3,-0.8 -5,-0.2 -1,-0.2 -0.854 49.4-174.2-104.4 114.2 10.3 49.7 91.2 494 544 A P T 3 S+ 0 0 18 0, 0.0 -226,-0.2 0, 0.0 -1,-0.1 0.505 87.5 56.5 -79.8 -4.5 9.8 46.1 89.9 495 545 A L T 3 S+ 0 0 103 -228,-0.1 2,-0.5 2,-0.1 -5,-0.1 0.491 71.6 123.7-103.5 -5.5 6.3 46.9 88.7 496 546 A F < - 0 0 46 -3,-0.8 2,-0.5 -7,-0.2 -7,-0.0 -0.415 55.2-146.3 -60.1 110.1 7.4 49.8 86.4 497 547 A Q - 0 0 167 -2,-0.5 -1,-0.1 1,-0.1 -2,-0.1 -0.701 8.8-141.9 -88.9 127.0 6.0 48.8 83.0 498 548 A V 0 0 89 -2,-0.5 -1,-0.1 1,-0.1 0, 0.0 0.070 360.0 360.0 -71.5-176.6 8.0 49.8 79.9 499 549 A E 0 0 223 0, 0.0 -1,-0.1 0, 0.0 -2,-0.0 -0.356 360.0 360.0 64.8 360.0 6.8 50.9 76.5