==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=20-JUL-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE 24-DEC-03 1V7W . COMPND 2 MOLECULE: CHITOBIOSE PHOSPHORYLASE; . SOURCE 2 ORGANISM_SCIENTIFIC: VIBRIO PROTEOLYTICUS; . AUTHOR M.HIDAKA,Y.HONDA,S.NIRASAWA,M.KITAOKA,K.HAYASHI,T.WAKAGI,H.S . 779 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 27114.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 586 75.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 10 1.3 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 186 23.9 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 4 0.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 6 0.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 8 1.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-3), SAME NUMBER PER 100 RESIDUES . 1 0.1 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 . 80 10.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 79 10.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 186 23.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 13 1.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+5), SAME NUMBER PER 100 RESIDUES . 1 2 3 4 5 6 7 8 9 10 11 12 13 14 15 16 17 18 19 20 21 22 23 24 25 26 27 28 29 30 *** HISTOGRAMS OF *** . 0 0 0 2 3 0 2 1 1 1 2 2 1 1 1 0 0 0 1 0 2 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 1 0 0 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 PARALLEL BRIDGES PER LADDER . 12 9 5 4 4 3 0 4 1 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 . 6 1 1 1 2 0 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 LADDERS PER SHEET . # RESIDUE AA STRUCTURE BP1 BP2 ACC N-H-->O O-->H-N N-H-->O O-->H-N TCO KAPPA ALPHA PHI PSI X-CA Y-CA Z-CA 1 1 A M 0 0 79 0, 0.0 656,-2.2 0, 0.0 657,-0.3 0.000 360.0 360.0 360.0 141.9 89.3 24.9 28.2 2 2 A K - 0 0 119 653,-0.2 653,-0.1 654,-0.2 3,-0.1 -0.942 360.0-167.5-134.0 155.2 87.0 25.9 25.3 3 3 A Y S S- 0 0 31 651,-0.4 13,-1.8 -2,-0.3 14,-1.2 0.314 73.4 -14.1-122.4 2.7 83.3 25.7 24.7 4 4 A G E -A 15 0A 2 650,-0.3 2,-0.3 11,-0.3 11,-0.2 -0.943 60.0-122.1-175.4-164.5 83.2 26.4 21.0 5 5 A Y E -A 14 0A 99 9,-2.1 9,-2.9 -2,-0.3 2,-0.4 -0.984 30.0 -94.1-159.9 161.5 85.1 27.7 17.9 6 6 A F E -A 13 0A 21 -2,-0.3 2,-0.9 7,-0.2 7,-0.2 -0.701 24.4-157.4 -84.9 128.9 85.0 30.2 15.1 7 7 A D E >> -A 12 0A 19 5,-3.0 5,-1.9 -2,-0.4 4,-0.8 -0.851 13.3-179.8-105.4 92.3 83.4 29.1 11.9 8 8 A N T >45S+ 0 0 77 -2,-0.9 3,-0.6 1,-0.2 -1,-0.2 0.876 75.6 58.4 -61.8 -40.3 85.0 31.6 9.4 9 9 A D T 345S+ 0 0 155 1,-0.2 -1,-0.2 -3,-0.1 -2,-0.0 0.858 118.1 30.3 -58.8 -38.9 83.1 30.2 6.4 10 10 A N T 345S- 0 0 80 -3,-0.3 -1,-0.2 2,-0.2 -2,-0.2 0.378 103.9-124.2-103.7 3.9 79.7 30.8 7.9 11 11 A R T <<5S+ 0 0 55 -4,-0.8 93,-0.5 -3,-0.6 2,-0.3 0.928 70.1 122.9 52.6 50.5 80.6 33.9 9.9 12 12 A E E < -A 7 0A 3 -5,-1.9 -5,-3.0 91,-0.2 2,-0.6 -0.953 62.9-130.6-138.7 154.4 79.3 32.2 13.1 13 13 A Y E -AB 6 102A 0 89,-2.5 89,-2.3 -2,-0.3 2,-0.6 -0.955 28.2-147.7-106.6 122.4 80.7 31.3 16.5 14 14 A V E -AB 5 101A 0 -9,-2.9 -9,-2.1 -2,-0.6 2,-0.7 -0.818 7.7-161.1 -97.7 117.7 79.8 27.7 17.3 15 15 A I E -AB 4 100A 0 85,-3.5 85,-2.2 -2,-0.6 -11,-0.3 -0.877 8.5-178.1 -97.9 115.9 79.2 26.8 20.9 16 16 A T S S+ 0 0 71 -13,-1.8 82,-0.3 -2,-0.7 -12,-0.2 0.583 70.8 35.5 -91.0 -15.2 79.5 23.0 21.2 17 17 A R - 0 0 99 -14,-1.2 -1,-0.2 80,-0.1 3,-0.1 -0.970 66.5-153.3-142.3 124.7 78.6 22.6 24.9 18 18 A P S S+ 0 0 2 0, 0.0 2,-0.8 0, 0.0 69,-0.1 0.476 75.1 91.4 -75.5 -7.2 76.0 24.8 26.7 19 19 A D + 0 0 51 2,-0.1 21,-0.0 67,-0.0 74,-0.0 -0.158 56.7 158.7 -85.9 44.3 77.4 24.6 30.2 20 20 A V - 0 0 15 -2,-0.8 4,-0.0 -3,-0.1 -18,-0.0 -0.323 54.1-115.4 -62.8 145.8 79.5 27.8 29.6 21 21 A P S S+ 0 0 61 0, 0.0 -1,-0.1 0, 0.0 641,-0.1 0.519 95.5 13.8 -66.0 -1.7 80.6 29.5 32.9 22 22 A A S S- 0 0 25 639,-0.2 2,-0.3 640,-0.0 -2,-0.1 -0.974 98.0 -78.1-161.3 164.0 78.5 32.6 31.9 23 23 A P - 0 0 51 0, 0.0 2,-0.7 0, 0.0 640,-0.2 -0.567 38.4-153.8 -72.6 128.1 75.8 33.6 29.4 24 24 A W - 0 0 0 -2,-0.3 15,-0.9 638,-0.1 2,-0.1 -0.921 25.1-162.3-103.6 113.0 77.4 34.2 26.0 25 25 A T E -K 38 0B 6 -2,-0.7 2,-0.3 13,-0.2 13,-0.2 -0.437 20.5-168.6-100.6 169.0 75.0 36.6 24.2 26 26 A N E -K 37 0B 0 11,-2.1 11,-2.3 -2,-0.1 2,-0.5 -0.945 23.2-119.9-146.5 160.0 74.2 37.9 20.8 27 27 A Y E -K 36 0B 2 -2,-0.3 78,-0.4 9,-0.2 2,-0.4 -0.932 18.9-164.2-113.6 125.3 72.1 40.8 19.5 28 28 A L E +K 35 0B 0 7,-2.6 7,-2.0 -2,-0.5 78,-0.1 -0.848 52.6 48.6-103.8 141.3 69.1 40.4 17.2 29 29 A G - 0 0 3 -2,-0.4 5,-0.1 76,-0.4 97,-0.1 0.051 43.5-160.0 108.3 143.4 67.8 43.4 15.3 30 30 A T S S+ 0 0 19 3,-0.2 4,-0.1 94,-0.1 -1,-0.1 0.348 83.2 33.3-134.8 -2.0 69.1 46.2 13.1 31 31 A E S S- 0 0 79 2,-0.4 3,-0.1 97,-0.1 98,-0.1 0.617 122.9 -41.1-121.6 -85.8 66.4 48.8 13.3 32 32 A K S S+ 0 0 80 96,-0.2 16,-3.0 1,-0.2 2,-0.5 0.654 111.8 73.5-124.2 -31.9 64.2 49.4 16.3 33 33 A F E - L 0 47B 2 95,-0.3 -2,-0.4 14,-0.2 2,-0.3 -0.788 64.4-179.6 -89.8 124.8 63.2 46.0 17.8 34 34 A C E - L 0 46B 0 12,-2.7 12,-2.3 -2,-0.5 2,-0.4 -0.950 17.1-164.5-129.6 146.0 66.2 44.4 19.6 35 35 A T E -KL 28 45B 0 -7,-2.0 -7,-2.6 -2,-0.3 2,-0.8 -0.997 9.5-157.2-130.7 130.3 66.8 41.2 21.5 36 36 A V E +KL 27 44B 0 8,-2.8 8,-1.4 -2,-0.4 2,-0.4 -0.935 30.9 177.6-103.9 108.5 69.7 40.4 23.8 37 37 A I E -KL 26 43B 0 -11,-2.3 -11,-2.1 -2,-0.8 6,-0.2 -0.926 18.4-148.7-121.4 140.7 69.8 36.6 23.7 38 38 A S E > -K 25 0B 0 4,-2.7 3,-1.9 -2,-0.4 -13,-0.2 -0.450 36.9-100.3 -98.1 174.7 72.1 34.1 25.3 39 39 A H T 3 S+ 0 0 1 -15,-0.9 47,-0.4 1,-0.3 -14,-0.1 0.575 126.8 53.9 -70.5 -8.5 73.3 30.7 24.2 40 40 A N T 3 S- 0 0 13 45,-0.1 -1,-0.3 2,-0.1 45,-0.1 0.054 121.3-109.8-109.7 21.9 70.7 29.3 26.6 41 41 A A S < S+ 0 0 0 -3,-1.9 28,-2.1 1,-0.2 2,-0.2 0.641 74.6 139.8 59.6 16.9 67.9 31.4 25.0 42 42 A G B +N 68 0C 0 26,-0.2 -4,-2.7 24,-0.1 2,-0.3 -0.510 29.8 72.6 -83.2 159.3 67.8 33.6 28.1 43 43 A G E -L 37 0B 0 24,-2.0 2,-0.3 -6,-0.2 -6,-0.2 -0.862 63.3-102.0 133.9-168.3 67.4 37.3 27.6 44 44 A Y E -L 36 0B 1 -8,-1.4 -8,-2.8 -2,-0.3 2,-0.3 -0.950 13.0-128.3-154.7 168.7 64.8 39.9 26.5 45 45 A S E +L 35 0B 0 -2,-0.3 10,-3.2 -10,-0.2 11,-1.2 -0.853 20.9 178.3-122.0 157.7 63.6 42.1 23.8 46 46 A F E -LM 34 54B 2 -12,-2.3 -12,-2.7 -2,-0.3 2,-0.5 -0.967 25.0-126.1-152.3 162.6 62.8 45.9 23.7 47 47 A Y E S-L 33 0B 35 6,-2.0 2,-3.1 2,-0.5 -14,-0.2 -0.953 72.7 -48.5-121.2 113.4 61.6 48.4 21.2 48 48 A N S S+ 0 0 48 -16,-3.0 -15,-0.1 -2,-0.5 6,-0.0 -0.283 131.3 51.6 64.8 -62.3 63.7 51.6 20.7 49 49 A S > - 0 0 9 -2,-3.1 4,-2.0 1,-0.1 -2,-0.5 -0.918 62.7-164.9-108.9 117.0 64.0 52.4 24.4 50 50 A P T 4 S+ 0 0 15 0, 0.0 4,-0.2 0, 0.0 110,-0.2 0.885 91.9 49.4 -66.7 -32.1 65.2 49.6 26.7 51 51 A E T 4 S+ 0 0 8 1,-0.2 109,-2.3 2,-0.1 110,-0.3 0.872 124.8 23.1 -73.0 -39.1 64.0 51.6 29.7 52 52 A Y T 4 S+ 0 0 110 107,-0.2 -1,-0.2 1,-0.1 107,-0.1 0.505 126.1 41.8-110.8 -5.3 60.5 52.4 28.6 53 53 A N < + 0 0 18 -4,-2.0 -6,-2.0 106,-0.0 106,-0.2 -0.171 65.3 156.0-136.0 43.8 59.6 49.8 26.0 54 54 A R B -M 46 0B 2 104,-2.7 -8,-0.3 -8,-0.2 104,-0.3 -0.513 22.3-166.4 -68.7 139.8 60.9 46.4 27.2 55 55 A V + 0 0 0 -10,-3.2 101,-2.5 1,-0.3 2,-0.3 0.832 67.0 22.5 -98.0 -43.1 58.9 43.7 25.6 56 56 A T B S-O 155 0D 2 -11,-1.2 -1,-0.3 99,-0.3 99,-0.2 -0.944 87.8-103.2-127.0 151.1 59.7 40.5 27.6 57 57 A K - 0 0 19 97,-2.5 2,-0.3 -2,-0.3 97,-0.2 -0.158 25.6-165.5 -73.4 163.8 61.0 40.3 31.2 58 58 A F - 0 0 9 282,-0.1 10,-0.1 -14,-0.1 -14,-0.1 -0.942 14.1-156.9-151.8 126.0 64.5 39.6 32.5 59 59 A R B -P 66 0E 109 7,-3.0 7,-0.6 -2,-0.3 3,-0.4 -0.901 35.4-157.7-102.7 101.5 65.6 38.7 36.1 60 60 A P + 0 0 44 0, 0.0 3,-0.1 0, 0.0 278,-0.1 -0.212 55.9 25.5 -81.0 168.1 69.3 39.8 36.0 61 61 A N S S+ 0 0 170 276,-0.5 2,-0.2 1,-0.2 4,-0.1 0.787 90.1 125.7 52.4 37.0 72.4 39.0 37.9 62 62 A A S S- 0 0 66 -3,-0.4 -1,-0.2 2,-0.3 -3,-0.0 -0.691 77.6-102.9-118.6 172.7 71.2 35.5 38.9 63 63 A T S S+ 0 0 138 -2,-0.2 2,-0.3 -3,-0.1 -2,-0.1 0.751 111.7 42.3 -66.2 -24.3 72.6 32.0 38.5 64 64 A F S S- 0 0 91 -5,-0.1 2,-1.0 -4,-0.1 -2,-0.3 -0.917 83.3-131.2-119.7 148.8 70.2 31.4 35.6 65 65 A D - 0 0 11 -2,-0.3 -22,-0.2 -4,-0.1 -27,-0.1 -0.729 50.4-155.2-102.3 84.4 69.5 33.9 32.9 66 66 A R B +P 59 0E 7 -2,-1.0 -7,-3.0 -7,-0.6 2,-0.2 -0.852 44.6 22.8-127.3 159.3 65.6 33.9 32.9 67 67 A P S S+ 0 0 1 0, 0.0 -24,-2.0 0, 0.0 2,-0.2 0.648 73.3 150.1 -79.4-164.7 63.1 34.2 31.5 68 68 A G B -N 42 0C 2 -26,-0.3 2,-0.8 -2,-0.2 86,-0.3 -0.800 55.7 -65.6-159.7-159.3 63.8 33.9 27.8 69 69 A H + 0 0 0 -28,-2.1 2,-0.3 -2,-0.2 84,-0.2 -0.833 65.8 177.5-111.2 89.5 62.4 32.9 24.5 70 70 A Y E -Q 152 0F 0 82,-1.8 82,-1.4 -2,-0.8 2,-0.5 -0.708 29.4-163.8-105.0 148.5 61.9 29.2 24.9 71 71 A V E -Q 151 0F 0 -2,-0.3 13,-2.0 80,-0.2 2,-0.4 -0.990 15.3-161.2-126.1 117.7 60.5 26.3 22.9 72 72 A Y E -QR 150 83F 0 78,-2.9 78,-2.4 -2,-0.5 2,-0.4 -0.837 2.0-158.4-100.1 137.0 59.7 23.2 24.9 73 73 A L E -QR 149 82F 0 9,-3.6 9,-2.4 -2,-0.4 2,-0.4 -0.912 8.3-168.7-114.2 143.9 59.4 19.8 23.2 74 74 A R E -QR 148 81F 34 74,-2.2 74,-2.6 -2,-0.4 2,-0.9 -0.998 22.9-137.9-137.1 133.6 57.4 16.9 24.7 75 75 A D E >> -Q 147 0F 8 5,-3.0 4,-3.2 -2,-0.4 3,-0.5 -0.819 18.4-160.1 -87.5 110.5 57.2 13.3 23.7 76 76 A D T 34 S+ 0 0 33 70,-2.5 -1,-0.1 -2,-0.9 71,-0.1 0.515 85.5 58.7 -73.5 -3.0 53.5 12.7 24.1 77 77 A D T 34 S+ 0 0 113 69,-0.4 -1,-0.2 3,-0.1 70,-0.1 0.786 123.6 18.8 -91.1 -32.0 54.0 8.9 24.4 78 78 A S T <4 S- 0 0 78 -3,-0.5 -2,-0.2 2,-0.2 3,-0.1 0.650 95.3-124.9-110.4 -23.6 56.3 9.0 27.4 79 79 A G < + 0 0 23 -4,-3.2 -3,-0.1 1,-0.3 153,-0.1 0.405 60.5 144.8 90.4 -2.8 55.7 12.5 28.8 80 80 A D - 0 0 43 -5,-0.4 -5,-3.0 -6,-0.1 2,-0.3 -0.395 26.5-174.2 -68.6 144.3 59.4 13.3 28.6 81 81 A Y E +R 74 0F 36 -7,-0.2 2,-0.3 -3,-0.1 -7,-0.2 -0.986 14.2 164.8-143.8 154.7 60.2 16.9 27.8 82 82 A W E -R 73 0F 1 -9,-2.4 -9,-3.6 -2,-0.3 2,-0.3 -0.954 31.3-112.7-156.9 166.3 63.2 19.1 27.0 83 83 A S E -R 72 0F 0 3,-0.4 -11,-0.2 -2,-0.3 8,-0.1 -0.770 19.8-127.5-107.8 156.7 63.9 22.5 25.5 84 84 A I S S+ 0 0 1 -13,-2.0 2,-0.3 -2,-0.3 26,-0.1 0.873 105.5 57.0 -68.7 -35.9 65.7 23.3 22.2 85 85 A S S S- 0 0 2 -14,-0.3 4,-0.3 2,-0.1 -2,-0.3 -0.656 102.3-118.5 -85.3 151.3 68.0 25.5 24.2 86 86 A W S >>S+ 0 0 42 -47,-0.4 4,-2.6 -2,-0.3 5,-0.5 0.988 83.7 77.9 -56.6 -63.3 69.7 23.5 26.9 87 87 A Q T 45S+ 0 0 16 1,-0.2 -2,-0.1 2,-0.2 137,-0.0 -0.531 76.0 37.6 -76.3 157.5 68.3 25.6 29.8 88 88 A P T 45S+ 0 0 1 0, 0.0 -1,-0.2 0, 0.0 -2,-0.1 -0.990 129.8 30.6 -85.8 -15.9 65.7 25.9 31.2 89 89 A V T 45S- 0 0 25 -4,-0.3 -2,-0.2 -3,-0.2 -3,-0.1 0.865 86.6-159.1 -69.4 -33.0 64.9 22.2 31.2 90 90 A A T <5 - 0 0 38 -4,-2.6 -3,-0.2 -5,-0.2 3,-0.1 0.913 6.3-161.8 56.1 52.0 68.6 21.3 31.3 91 91 A K < - 0 0 36 -5,-0.5 -1,-0.1 1,-0.1 5,-0.1 -0.369 40.3 -78.8 -61.6 141.5 68.3 17.7 30.0 92 92 A S >> - 0 0 45 1,-0.2 4,-2.6 2,-0.1 3,-1.7 -0.099 30.5-138.5 -45.9 132.5 71.5 15.8 30.9 93 93 A L T 34 S+ 0 0 60 1,-0.3 -1,-0.2 2,-0.2 5,-0.1 0.497 104.3 64.4 -72.9 -2.9 74.5 16.5 28.6 94 94 A D T 34 S+ 0 0 158 1,-0.1 -1,-0.3 3,-0.1 -2,-0.1 0.530 114.7 30.8 -92.6 -9.4 75.2 12.8 28.6 95 95 A E T <4 S+ 0 0 121 -3,-1.7 19,-0.6 1,-0.2 2,-0.4 0.698 119.5 47.5-115.3 -36.8 71.9 12.2 26.9 96 96 A A E < - C 0 113A 4 -4,-2.6 2,-0.5 17,-0.2 -1,-0.2 -0.893 64.7-147.8-115.5 142.9 71.3 15.3 24.7 97 97 A Q E - C 0 112A 117 15,-2.6 15,-2.4 -2,-0.4 2,-0.3 -0.940 19.5-170.2-110.4 122.2 73.7 17.1 22.4 98 98 A Y E + C 0 111A 6 -2,-0.5 2,-0.3 -82,-0.3 13,-0.2 -0.835 9.0 179.8-113.9 149.4 73.3 20.9 22.0 99 99 A Q E - C 0 110A 38 11,-2.0 11,-2.4 -2,-0.3 2,-0.4 -0.990 6.4-167.0-146.2 138.4 74.9 23.4 19.6 100 100 A I E -BC 15 109A 5 -85,-2.2 -85,-3.5 -2,-0.3 2,-0.6 -0.997 2.7-165.0-129.1 130.9 74.4 27.1 19.3 101 101 A R E -BC 14 108A 43 7,-2.9 7,-2.8 -2,-0.4 2,-0.6 -0.934 5.7-162.2-117.5 106.3 75.5 29.2 16.4 102 102 A H E +BC 13 107A 0 -89,-2.3 -89,-2.5 -2,-0.6 5,-0.2 -0.796 21.1 171.4 -86.9 124.2 75.7 32.9 17.1 103 103 A G E > - C 0 106A 0 3,-3.2 2,-1.0 -2,-0.6 3,-0.9 -0.554 47.7 -62.7-119.5-173.0 75.7 34.7 13.8 104 104 A L T 3 S- 0 0 6 -93,-0.5 193,-0.2 1,-0.3 3,-0.1 -0.650 120.5 -16.0 -80.6 104.1 75.4 38.4 12.7 105 105 A S T 3 S+ 0 0 2 -2,-1.0 19,-0.5 -78,-0.4 -76,-0.4 0.731 129.9 69.0 73.8 27.8 71.9 39.4 13.8 106 106 A Y E < -CD 103 123A 3 -3,-0.9 -3,-3.2 17,-0.1 2,-0.4 -0.963 59.8-153.1-165.8 153.0 70.7 35.8 14.3 107 107 A S E -CD 102 122A 0 15,-2.1 15,-2.8 -2,-0.3 2,-0.5 -0.999 7.8-153.3-136.7 133.0 71.2 32.8 16.6 108 108 A K E -CD 101 121A 65 -7,-2.8 -7,-2.9 -2,-0.4 2,-0.4 -0.926 9.6-166.8-109.7 122.9 70.7 29.1 15.7 109 109 A F E -CD 100 120A 2 11,-3.2 11,-2.8 -2,-0.5 2,-0.4 -0.893 7.8-176.2-109.1 137.1 69.9 26.7 18.5 110 110 A Q E -CD 99 119A 41 -11,-2.4 -11,-2.0 -2,-0.4 2,-0.4 -0.995 8.6-178.6-137.1 141.3 70.1 22.9 17.9 111 111 A C E -CD 98 118A 0 7,-2.6 7,-2.7 -2,-0.4 2,-0.6 -0.984 7.7-171.2-141.9 126.9 69.2 19.9 20.1 112 112 A D E +CD 97 117A 47 -15,-2.4 -15,-2.6 -2,-0.4 2,-0.3 -0.978 26.0 157.1-116.4 115.4 69.6 16.2 19.3 113 113 A Y E > -CD 96 116A 17 3,-2.5 3,-1.8 -2,-0.6 -17,-0.2 -0.938 58.6 -29.0-151.0 124.3 68.0 14.1 21.9 114 114 A N T 3 S- 0 0 101 -19,-0.6 27,-0.1 -2,-0.3 3,-0.1 0.834 126.6 -36.4 41.2 52.3 66.6 10.5 22.1 115 115 A G T 3 S+ 0 0 22 1,-0.2 25,-2.1 25,-0.1 26,-1.0 0.443 116.7 104.1 89.4 -1.6 65.6 10.3 18.4 116 116 A I E < -DE 113 139A 1 -3,-1.8 -3,-2.5 23,-0.2 2,-0.5 -0.968 49.1-163.9-120.9 126.6 64.4 13.9 17.9 117 117 A H E -DE 112 138A 23 21,-3.1 21,-3.4 -2,-0.5 2,-0.4 -0.920 16.9-179.6-104.9 126.2 66.4 16.5 16.0 118 118 A A E -DE 111 137A 0 -7,-2.7 -7,-2.6 -2,-0.5 2,-0.4 -0.991 11.0-174.5-134.2 139.4 65.3 20.1 16.7 119 119 A R E -DE 110 136A 90 17,-2.7 17,-2.7 -2,-0.4 2,-0.4 -0.981 1.5-175.3-130.8 142.2 66.5 23.4 15.4 120 120 A K E -DE 109 135A 0 -11,-2.8 -11,-3.2 -2,-0.4 2,-0.6 -0.957 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4,-1.1 0.913 111.3 44.0 -57.8 -44.7 51.6 23.0 31.0 229 229 A V H 45S+ 0 0 0 -13,-0.4 3,-0.3 2,-0.2 -2,-0.2 0.922 113.0 51.0 -68.6 -43.2 54.6 21.2 29.5 230 230 A E H <5S+ 0 0 83 -4,-2.7 -2,-0.2 1,-0.2 -1,-0.2 0.927 115.7 41.1 -60.5 -44.8 54.6 18.4 32.1 231 231 A Q H <5S- 0 0 98 -4,-2.8 -1,-0.2 -5,-0.2 -2,-0.2 0.626 111.6-119.9 -79.9 -13.5 50.9 17.7 31.6 232 232 A G T <5S+ 0 0 13 -4,-1.1 2,-0.3 -3,-0.3 -3,-0.2 0.640 80.6 63.3 86.8 16.4 51.1 18.0 27.9 233 233 A R S - 0 0 100 -2,-0.5 3,-2.4 -111,-0.2 -116,-0.3 -0.357 54.0 -68.7 -75.2 162.3 56.9 9.3 10.7 256 256 A P T 3 S+ 0 0 63 0, 0.0 -1,-0.2 0, 0.0 -116,-0.2 -0.320 125.0 8.0 -55.4 130.3 60.5 8.0 10.9 257 257 A G T 3 S+ 0 0 43 -118,-2.5 2,-0.2 -116,-0.4 -117,-0.1 0.312 98.9 133.2 82.1 -9.6 62.7 10.5 9.1 258 258 A E < - 0 0 79 -3,-2.4 -119,-2.8 -120,-0.1 2,-0.3 -0.471 35.2-166.8 -77.8 145.0 59.9 13.0 8.7 259 259 A E E -F 138 0A 100 -121,-0.2 2,-0.3 -2,-0.2 -121,-0.2 -0.969 6.1-162.8-133.6 149.1 60.4 16.7 9.6 260 260 A I E -F 137 0A 34 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77.7 -82.4 94.4 135.0 51.5 46.4 17.5 270 270 A K T 34 S+ 0 0 82 -77,-2.5 2,-0.1 1,-0.2 -2,-0.1 -0.331 112.0 20.9 -64.6 148.6 47.9 45.5 16.8 271 271 A G T 3> S+ 0 0 37 1,-0.1 4,-1.3 4,-0.0 -1,-0.2 0.007 101.6 88.7 83.6 -30.0 47.3 43.9 13.4 272 272 A N H <> S+ 0 0 33 -3,-0.9 4,-3.2 2,-0.2 5,-0.3 0.882 81.9 54.6 -70.2 -38.9 50.9 42.7 12.9 273 273 A G H X S+ 0 0 0 -4,-0.7 4,-2.4 1,-0.2 5,-0.2 0.933 109.2 46.1 -60.8 -48.6 50.6 39.4 14.6 274 274 A E H > S+ 0 0 63 1,-0.2 4,-0.9 2,-0.2 -1,-0.2 0.861 116.5 47.9 -62.4 -36.1 47.7 38.2 12.5 275 275 A R H X S+ 0 0 103 -4,-1.3 4,-2.5 2,-0.2 3,-0.2 0.946 114.2 43.0 -70.5 -50.1 49.5 39.4 9.4 276 276 A L H X S+ 0 0 0 -4,-3.2 4,-2.7 1,-0.2 -2,-0.2 0.833 107.4 58.1 -69.6 -32.6 52.9 37.8 10.1 277 277 A R H < S+ 0 0 27 -4,-2.4 -1,-0.2 -5,-0.3 -2,-0.2 0.867 114.0 41.4 -65.5 -31.0 51.6 34.5 11.3 278 278 A E H >< S+ 0 0 137 -4,-0.9 3,-1.2 -5,-0.2 4,-0.4 0.903 113.1 53.1 -78.7 -43.6 49.9 34.2 7.9 279 279 A H H >< S+ 0 0 85 -4,-2.5 3,-1.1 1,-0.3 6,-0.3 0.914 110.7 46.5 -58.0 -45.7 52.8 35.6 6.0 280 280 A Y T 3< S+ 0 0 8 -4,-2.7 -1,-0.3 1,-0.2 6,-0.2 0.428 85.2 87.8 -81.5 2.7 55.3 33.1 7.5 281 281 A Q T < S+ 0 0 96 -3,-1.2 2,-1.0 1,-0.2 -1,-0.2 0.778 82.9 67.7 -68.0 -23.5 53.0 30.1 7.0 282 282 A D S X> S- 0 0 89 -3,-1.1 3,-2.3 -4,-0.4 4,-0.6 -0.868 83.3-157.1 -94.2 102.7 54.8 30.1 3.6 283 283 A V H >> S+ 0 0 51 -2,-1.0 4,-2.4 1,-0.3 3,-0.6 0.711 85.7 74.6 -57.2 -20.7 58.3 29.2 4.8 284 284 A A H 3> S+ 0 0 51 1,-0.3 4,-1.9 2,-0.2 -1,-0.3 0.824 92.4 55.4 -61.9 -29.3 59.7 30.8 1.7 285 285 A N H <> S+ 0 0 47 -3,-2.3 4,-1.6 -6,-0.3 -1,-0.3 0.788 106.2 50.1 -73.6 -26.6 59.0 34.1 3.3 286 286 A I H < S+ 0 0 30 -4,-1.0 3,-1.2 -5,-0.3 4,-0.3 0.930 113.2 49.1 -71.3 -47.3 78.9 45.8 5.3 301 301 A C H >< S+ 0 0 1 -4,-3.1 3,-1.6 1,-0.2 -2,-0.2 0.878 103.2 62.8 -60.3 -38.9 81.7 43.2 5.7 302 302 A A T 3< S+ 0 0 58 -4,-2.2 3,-0.3 -5,-0.3 -1,-0.2 0.676 87.9 71.5 -62.2 -18.5 82.6 43.5 2.0 303 303 A K T < S+ 0 0 70 -3,-1.2 427,-2.4 -4,-0.4 -1,-0.3 0.628 113.1 20.0 -76.9 -12.2 83.5 47.2 2.4 304 304 A F E < S+W 729 0H 4 -3,-1.6 2,-0.4 -4,-0.3 -1,-0.3 -0.745 73.6 160.7-157.5 104.8 86.7 46.3 4.4 305 305 A Q E -W 728 0H 52 423,-1.8 423,-2.5 -3,-0.3 2,-0.4 -0.986 16.1-163.0-128.5 138.4 88.2 42.9 4.2 306 306 A V E -W 727 0H 6 -2,-0.4 2,-0.5 421,-0.2 421,-0.2 -0.938 12.8-167.4-125.3 145.8 91.8 42.0 5.2 307 307 A K E +W 726 0H 142 419,-2.5 419,-2.4 -2,-0.4 4,-0.1 -0.967 33.1 146.2-129.3 110.2 94.0 39.0 4.5 308 308 A S - 0 0 20 -2,-0.5 417,-0.1 417,-0.2 6,-0.1 -0.771 63.2 -95.5-136.2 179.8 97.1 39.0 6.7 309 309 A P S S+ 0 0 74 0, 0.0 2,-0.8 0, 0.0 416,-0.1 0.652 104.2 81.4 -73.3 -15.1 99.5 36.6 8.4 310 310 A N > - 0 0 23 1,-0.2 4,-2.3 2,-0.1 -2,-0.2 -0.810 58.0-173.7 -99.0 103.0 97.5 37.0 11.7 311 311 A Q H > S+ 0 0 101 -2,-0.8 4,-2.9 1,-0.2 5,-0.2 0.870 85.0 54.5 -62.3 -40.0 94.4 34.8 11.6 312 312 A G H > S+ 0 0 2 2,-0.2 4,-2.0 1,-0.2 -1,-0.2 0.913 110.3 46.8 -60.9 -42.7 93.0 36.2 14.8 313 313 A L H > S+ 0 0 0 2,-0.2 4,-3.0 1,-0.2 5,-0.3 0.946 114.0 47.4 -64.0 -49.5 93.1 39.7 13.4 314 314 A D H X S+ 0 0 12 -4,-2.3 4,-2.6 1,-0.2 -8,-0.2 0.937 111.2 50.7 -57.3 -50.4 91.5 38.7 10.1 315 315 A T H <>S+ 0 0 7 -4,-2.9 5,-0.9 1,-0.2 4,-0.4 0.901 117.3 39.3 -56.0 -44.7 88.7 36.8 11.8 316 316 A M H ><>S+ 0 0 0 -4,-2.0 5,-3.0 -5,-0.2 6,-0.9 0.924 118.2 44.8 -75.1 -46.1 87.8 39.7 14.1 317 317 A I H 3<5S+ 0 0 2 -4,-3.0 -2,-0.2 1,-0.2 -3,-0.2 0.886 111.2 53.9 -67.1 -37.3 88.2 42.6 11.7 318 318 A N T 3<5S- 0 0 24 -4,-2.6 -1,-0.2 -5,-0.3 -2,-0.2 0.591 136.8 -20.6 -74.5 -8.7 86.4 40.8 8.8 319 319 A A T <>5S+ 0 0 4 -3,-0.8 4,-2.8 -4,-0.4 5,-0.2 0.219 123.2 52.5-155.9 -74.5 83.4 40.2 11.0 320 320 A W H > S+ 0 0 0 -6,-0.9 4,-2.7 2,-0.2 5,-0.2 0.941 113.2 48.8 -63.8 -46.4 83.0 45.3 12.9 323 323 A Y H X S+ 0 0 2 -4,-2.8 4,-2.0 -7,-0.3 -2,-0.2 0.913 112.2 46.4 -58.3 -49.2 79.8 43.7 14.2 324 324 A Q H X S+ 0 0 3 -4,-2.4 4,-1.6 2,-0.2 -1,-0.2 0.916 113.3 49.7 -63.5 -43.8 80.4 44.7 17.8 325 325 A A H X S+ 0 0 0 -4,-2.4 4,-1.9 366,-0.3 -2,-0.2 0.935 112.8 45.2 -61.7 -48.6 81.3 48.2 16.8 326 326 A E H X S+ 0 0 2 -4,-2.7 4,-2.6 1,-0.2 5,-0.3 0.840 107.3 59.5 -66.9 -30.6 78.2 48.8 14.7 327 327 A T H X S+ 0 0 7 -4,-2.0 4,-2.8 -5,-0.2 5,-0.3 0.901 106.5 48.6 -62.8 -37.6 76.1 47.2 17.4 328 328 A C H X S+ 0 0 0 -4,-1.6 4,-1.6 2,-0.2 -2,-0.2 0.910 111.0 49.3 -67.1 -42.8 77.3 50.0 19.7 329 329 A V H < S+ 0 0 0 -4,-1.9 -2,-0.2 2,-0.2 -1,-0.2 0.912 120.3 36.2 -63.5 -42.1 76.5 52.7 17.1 330 330 A V H < S+ 0 0 12 -4,-2.6 -2,-0.2 1,-0.1 -3,-0.2 0.938 130.1 27.1 -77.7 -49.3 73.0 51.4 16.5 331 331 A W H < S- 0 0 25 -4,-2.8 3,-0.5 -5,-0.3 -3,-0.2 0.425 93.7-145.3 -98.2 0.6 71.9 50.2 19.9 332 332 A S < - 0 0 7 -4,-1.6 -1,-0.3 -5,-0.3 3,-0.2 -0.278 37.9 -66.9 67.9-152.7 74.0 52.4 22.2 333 333 A R S S+ 0 0 23 12,-0.4 -1,-0.2 1,-0.1 354,-0.1 0.327 106.6 80.4-121.7 10.5 75.3 51.1 25.5 334 334 A F S S+ 0 0 9 -3,-0.5 2,-0.3 11,-0.3 7,-0.2 0.060 73.8 71.5-114.1 29.6 72.4 50.5 27.8 335 335 A A + 0 0 1 -3,-0.2 2,-0.2 5,-0.1 5,-0.2 -0.748 64.6 96.1-144.4 92.4 70.9 47.1 26.9 336 336 A S S S- 0 0 10 3,-2.4 -300,-0.1 -2,-0.3 350,-0.1 -0.638 89.2 -79.5-147.8-156.0 72.9 44.0 27.7 337 337 A F S S+ 0 0 35 -2,-0.2 -276,-0.5 348,-0.1 3,-0.1 0.516 133.6 40.7 -94.5 -7.4 72.9 41.5 30.6 338 338 A I S S+ 0 0 83 1,-0.2 2,-1.0 347,-0.1 -1,-0.1 0.762 110.5 56.4-103.4 -43.5 74.9 44.0 32.6 339 339 A E + 0 0 45 1,-0.1 -3,-2.4 -6,-0.0 -1,-0.2 -0.831 65.3 144.6 -93.4 104.2 73.0 47.2 31.6 340 340 A V - 0 0 28 -2,-1.0 2,-0.2 1,-0.4 -1,-0.1 0.064 59.4 -10.9-131.8 23.9 69.5 46.3 32.6 341 341 A G S S+ 0 0 31 2,-0.2 2,-0.9 -7,-0.2 -1,-0.4 -0.603 98.8 43.9 151.1 148.9 67.8 49.5 33.9 342 342 A G S S+ 0 0 45 -2,-0.2 -291,-0.1 -3,-0.1 -181,-0.1 -0.839 93.6 63.6 101.8 -99.1 68.2 53.0 35.0 343 343 A R + 0 0 116 -2,-0.9 2,-0.3 -292,-0.0 -2,-0.2 -0.335 64.8 157.1 -62.9 139.0 70.6 54.7 32.5 344 344 A T + 0 0 22 2,-0.1 2,-0.4 -294,-0.1 -295,-0.1 -0.971 33.0 39.9-157.1 162.1 69.2 54.9 28.9 345 345 A G S S- 0 0 14 -2,-0.3 -12,-0.4 43,-0.1 2,-0.4 -0.827 99.8 -24.0 100.7-133.0 69.7 56.9 25.8 346 346 A L E -B 387 0I 2 41,-3.4 41,-2.0 -2,-0.4 2,-0.6 -0.970 44.1-143.1-125.7 137.2 73.1 58.0 24.7 347 347 A G E > -B 386 0I 2 -2,-0.4 4,-2.5 39,-0.2 5,-0.4 -0.862 25.0-137.3 -92.0 127.5 76.3 58.5 26.7 348 348 A Y H > S+ 0 0 1 37,-2.3 4,-2.1 -2,-0.6 5,-0.2 0.938 97.5 35.5 -54.2 -60.3 78.0 61.5 25.1 349 349 A R H > S+ 0 0 6 36,-0.2 4,-1.9 1,-0.2 -1,-0.2 0.833 116.5 58.5 -64.9 -30.4 81.7 60.4 24.9 350 350 A D H > S+ 0 0 32 2,-0.2 4,-2.6 1,-0.2 -2,-0.2 0.962 113.3 33.4 -64.6 -55.0 80.6 56.8 24.2 351 351 A T H X S+ 0 0 0 -4,-2.5 4,-2.5 2,-0.2 -1,-0.2 0.833 113.8 61.5 -73.0 -30.4 78.6 57.4 21.1 352 352 A A H < S+ 0 0 0 -4,-2.1 -1,-0.2 -5,-0.4 -2,-0.2 0.923 113.7 36.1 -60.8 -42.4 81.0 60.3 20.0 353 353 A Q H >< S+ 0 0 3 -4,-1.9 3,-1.9 -5,-0.2 4,-0.4 0.922 113.8 55.9 -76.3 -44.7 83.8 57.8 19.9 354 354 A D H >< S+ 0 0 2 -4,-2.6 3,-1.9 1,-0.3 4,-0.5 0.893 99.3 63.5 -52.5 -43.1 81.8 54.8 18.6 355 355 A A T 3< S+ 0 0 1 -4,-2.5 -1,-0.3 1,-0.3 -2,-0.2 0.557 91.5 63.8 -62.3 -9.9 80.7 56.9 15.6 356 356 A I T < S+ 0 0 6 -3,-1.9 -1,-0.3 -4,-0.1 -2,-0.2 0.679 94.4 66.5 -86.7 -15.3 84.3 57.2 14.3 357 357 A S S < S+ 0 0 5 -3,-1.9 -2,-0.2 -4,-0.4 3,-0.2 0.813 105.6 22.0 -79.3 -37.0 84.5 53.5 13.7 358 358 A V >> + 0 0 0 -4,-0.5 4,-2.7 -33,-0.1 3,-1.0 -0.017 66.5 125.6-128.5 38.0 82.1 52.4 11.0 359 359 A P T 34 S+ 0 0 7 0, 0.0 -1,-0.1 0, 0.0 8,-0.1 0.760 78.3 60.5 -65.3 -19.3 81.2 55.3 8.7 360 360 A H T 34 S+ 0 0 16 -3,-0.2 -2,-0.1 2,-0.2 372,-0.0 0.765 115.6 31.2 -75.6 -27.0 82.4 53.2 5.7 361 361 A A T <4 S+ 0 0 4 -3,-1.0 -1,-0.1 1,-0.2 3,-0.1 0.774 136.2 19.0-101.2 -36.7 79.8 50.5 6.5 362 362 A N X + 0 0 11 -4,-2.7 4,-1.8 1,-0.1 -2,-0.2 -0.552 63.8 158.0-137.0 71.3 76.8 52.4 8.0 363 363 A P H > S+ 0 0 33 0, 0.0 4,-2.6 0, 0.0 5,-0.2 0.850 73.9 59.3 -63.2 -33.7 77.1 56.1 7.1 364 364 A E H > S+ 0 0 137 1,-0.2 4,-2.1 2,-0.2 5,-0.1 0.940 110.4 39.0 -62.3 -48.8 73.4 56.7 7.6 365 365 A M H > S+ 0 0 45 2,-0.2 4,-2.4 1,-0.2 -1,-0.2 0.839 114.0 56.0 -71.2 -32.2 73.4 55.6 11.3 366 366 A T H X S+ 0 0 0 -4,-1.8 4,-2.0 2,-0.2 -2,-0.2 0.935 109.9 45.6 -63.4 -44.9 76.8 57.3 11.8 367 367 A R H X S+ 0 0 63 -4,-2.6 4,-2.6 2,-0.2 5,-0.2 0.916 110.9 53.5 -63.3 -44.0 75.3 60.6 10.6 368 368 A K H X S+ 0 0 61 -4,-2.1 4,-2.2 1,-0.2 -2,-0.2 0.917 110.6 46.2 -58.4 -45.4 72.2 60.1 12.7 369 369 A R H X S+ 0 0 25 -4,-2.4 4,-2.3 2,-0.2 -1,-0.2 0.867 110.6 52.7 -66.9 -36.2 74.3 59.6 15.8 370 370 A I H X S+ 0 0 0 -4,-2.0 4,-2.1 2,-0.2 -2,-0.2 0.920 110.4 47.7 -65.3 -42.3 76.5 62.6 15.1 371 371 A V H X S+ 0 0 8 -4,-2.6 4,-2.3 1,-0.2 -2,-0.2 0.905 109.1 54.8 -64.9 -39.3 73.4 64.8 14.6 372 372 A D H X S+ 0 0 1 -4,-2.2 4,-1.0 1,-0.2 -2,-0.2 0.931 110.0 46.8 -57.1 -46.5 72.1 63.4 17.9 373 373 A L H < S+ 0 0 0 -4,-2.3 -1,-0.2 1,-0.2 -2,-0.2 0.847 110.1 51.5 -65.3 -37.0 75.3 64.5 19.7 374 374 A L H >< S+ 0 0 1 -4,-2.1 3,-1.3 1,-0.2 60,-0.3 0.877 109.9 49.8 -68.6 -36.4 75.3 67.9 18.1 375 375 A R H 3< S+ 0 0 43 -4,-2.3 -1,-0.2 1,-0.3 -2,-0.2 0.736 107.9 56.5 -71.3 -22.4 71.7 68.4 19.3 376 376 A G T 3< S+ 0 0 0 -4,-1.0 8,-2.3 -5,-0.2 2,-0.4 0.241 89.2 95.6 -93.1 12.0 72.9 67.3 22.7 377 377 A Q B < -C 383 0J 3 -3,-1.3 57,-2.8 55,-0.3 58,-0.3 -0.829 68.3-137.0-103.1 141.4 75.5 70.0 22.9 378 378 A V > - 0 0 0 4,-2.5 3,-2.1 -2,-0.4 -2,-0.1 -0.555 26.9-105.7 -94.3 163.2 74.9 73.2 24.7 379 379 A K T 3 S+ 0 0 99 1,-0.3 -1,-0.1 57,-0.2 58,-0.0 0.826 117.4 67.3 -54.6 -34.9 75.8 76.7 23.6 380 380 A A T 3 S- 0 0 53 1,-0.1 -1,-0.3 2,-0.1 3,-0.1 0.750 117.6-112.8 -58.9 -23.8 78.6 76.8 26.1 381 381 A G S < S+ 0 0 0 -3,-2.1 -2,-0.1 1,-0.4 -1,-0.1 0.127 79.2 109.3 114.7 -22.2 80.3 74.1 24.1 382 382 A Y - 0 0 23 -5,-0.1 -4,-2.5 1,-0.1 -1,-0.4 -0.330 62.4-117.1 -84.6 168.5 80.1 71.1 26.4 383 383 A G B -C 377 0J 0 20,-0.3 2,-0.6 -6,-0.2 20,-0.3 -0.745 23.6-104.5-108.6 156.5 77.9 68.0 25.9 384 384 A L - 0 0 4 -8,-2.3 -36,-0.3 -2,-0.3 3,-0.2 -0.674 32.0-142.5 -75.1 118.7 75.1 66.6 28.0 385 385 A H S S+ 0 0 45 -2,-0.6 -37,-2.3 1,-0.2 2,-0.4 0.853 83.6 11.3 -51.8 -44.3 76.8 63.6 29.6 386 386 A L E S+B 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A H H X S+ 0 0 2 -4,-2.6 4,-2.6 1,-0.2 -2,-0.2 0.928 108.1 50.0 -60.6 -43.8 92.2 68.8 23.0 488 509 A F H X S+ 0 0 12 -4,-2.2 4,-2.6 2,-0.2 -1,-0.2 0.913 110.8 49.1 -61.0 -43.7 95.4 68.8 21.0 489 510 A W H X S+ 0 0 10 -4,-2.2 4,-2.3 2,-0.2 -2,-0.2 0.943 112.1 47.7 -61.5 -47.7 94.2 65.8 18.9 490 511 A A H X S+ 0 0 0 -4,-2.8 4,-2.5 1,-0.2 -1,-0.2 0.892 111.9 51.3 -60.1 -40.0 90.8 67.5 18.2 491 512 A L H X S+ 0 0 0 -4,-2.6 4,-2.8 -5,-0.2 -1,-0.2 0.911 107.7 51.3 -64.9 -42.6 92.7 70.8 17.3 492 513 A Q H X S+ 0 0 66 -4,-2.6 4,-1.9 1,-0.2 -1,-0.2 0.925 112.3 47.4 -60.4 -43.0 95.0 69.0 14.9 493 514 A E H X S+ 0 0 36 -4,-2.3 4,-1.5 1,-0.2 -2,-0.2 0.918 113.8 46.8 -63.7 -43.8 91.9 67.4 13.2 494 515 A F H X S+ 0 0 0 -4,-2.5 4,-3.1 2,-0.2 -2,-0.2 0.865 107.9 55.8 -67.2 -38.1 90.1 70.8 13.1 495 516 A I H X S+ 0 0 8 -4,-2.8 4,-2.4 1,-0.2 -1,-0.2 0.924 107.3 49.5 -60.8 -44.1 93.1 72.6 11.7 496 517 A D H X S+ 0 0 76 -4,-1.9 4,-2.2 1,-0.2 -1,-0.2 0.875 112.3 49.1 -62.1 -37.1 93.3 70.2 8.8 497 518 A L H 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K E -G 537 0K 86 -2,-0.5 2,-0.6 -6,-0.2 3,-0.3 -0.377 18.4-146.6 -67.4 141.8 101.1 66.0 40.4 544 565 A I E S+G 536 0K 2 -8,-3.2 -9,-2.6 1,-0.2 -8,-1.3 -0.953 77.0 25.8-112.5 116.9 99.3 62.7 39.9 545 566 A G S S+ 0 0 0 -2,-0.6 2,-0.2 6,-0.3 -1,-0.2 0.877 78.5 151.7 99.7 52.2 101.4 60.0 38.4 546 567 A T > - 0 0 20 -3,-0.3 3,-1.0 6,-0.1 -1,-0.2 -0.719 56.3-112.9-111.8 164.0 105.1 60.7 39.3 547 568 A A T 3 S+ 0 0 25 -2,-0.2 6,-0.1 1,-0.2 7,-0.1 0.700 113.3 55.1 -66.6 -20.2 108.1 58.4 39.7 548 569 A Q T 3 S+ 0 0 141 5,-0.1 -1,-0.2 2,-0.0 2,-0.1 0.589 86.2 97.9 -91.1 -11.8 108.3 59.3 43.5 549 570 A Q < - 0 0 47 -3,-1.0 4,-0.1 1,-0.1 3,-0.1 -0.386 65.1-143.4 -78.4 156.2 104.8 58.3 44.4 550 571 A Q S S+ 0 0 165 1,-0.1 2,-0.4 -2,-0.1 3,-0.2 0.688 83.9 42.7 -89.9 -21.2 103.8 55.0 46.0 551 572 A E S S+ 0 0 38 1,-0.2 -6,-0.3 43,-0.1 46,-0.2 -0.971 115.5 5.1-130.3 143.2 100.5 54.6 44.2 552 573 A G + 0 0 0 43,-1.9 -17,-0.2 -2,-0.4 -1,-0.2 0.942 68.5 152.2 53.6 59.6 99.4 55.3 40.7 553 574 A R + 0 0 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X<5S+ 0 0 7 -4,-0.8 3,-0.9 -3,-0.6 -2,-0.2 0.890 116.9 54.4 -87.1 -45.1 101.4 60.0 21.4 564 585 A L H 3<5S+ 0 0 0 -4,-3.0 -3,-0.2 1,-0.3 -2,-0.2 0.887 107.1 52.8 -56.8 -40.5 98.1 59.4 19.7 565 586 A S T 3<5S- 0 0 4 -4,-2.4 -1,-0.3 -5,-0.2 -2,-0.2 0.729 111.3-122.2 -68.2 -23.4 97.3 63.1 19.6 566 587 A G T < 5S+ 0 0 43 -3,-0.9 -3,-0.2 -4,-0.3 -2,-0.1 0.461 82.0 114.2 92.7 3.6 100.6 63.8 18.0 567 588 A L < + 0 0 0 -5,-0.6 -4,-0.2 -6,-0.4 -5,-0.1 0.948 55.2 75.9 -71.8 -50.6 101.6 66.2 20.8 568 589 A A S S- 0 0 15 -6,-2.7 2,-0.1 -7,-0.1 -50,-0.0 -0.255 83.8-115.0 -66.2 148.2 104.6 64.2 22.2 569 590 A S > - 0 0 30 1,-0.1 4,-2.8 4,-0.0 5,-0.2 -0.332 30.2-107.5 -75.0 163.6 107.9 64.1 20.4 570 591 A Q H > S+ 0 0 84 1,-0.2 4,-2.6 2,-0.2 5,-0.2 0.912 120.2 51.2 -57.9 -43.0 109.2 60.7 19.0 571 592 A E H > S+ 0 0 139 2,-0.2 4,-1.9 1,-0.2 -1,-0.2 0.946 115.3 37.6 -61.7 -53.6 111.7 60.6 21.9 572 593 A R H > S+ 0 0 71 1,-0.2 4,-2.8 2,-0.2 5,-0.2 0.867 115.2 57.2 -68.5 -34.1 109.3 61.2 24.8 573 594 A G H X S+ 0 0 0 -4,-2.8 4,-2.6 2,-0.2 -2,-0.2 0.934 107.4 46.3 -60.9 -48.0 106.7 59.1 23.0 574 595 A E H X S+ 0 0 73 -4,-2.6 4,-1.5 -5,-0.2 -1,-0.2 0.919 115.4 45.7 -61.7 -45.4 108.9 56.1 22.8 575 596 A Q H X S+ 0 0 106 -4,-1.9 4,-1.6 2,-0.2 -2,-0.2 0.918 113.3 49.2 -66.5 -41.8 110.1 56.4 26.4 576 597 A A H X S+ 0 0 0 -4,-2.8 4,-1.8 1,-0.2 3,-0.2 0.930 113.9 45.8 -62.3 -45.7 106.5 57.0 27.8 577 598 A M H X S+ 0 0 0 -4,-2.6 4,-2.2 -5,-0.2 -1,-0.2 0.750 107.5 58.2 -70.2 -22.5 105.2 54.0 25.8 578 599 A D H X S+ 0 0 60 -4,-1.5 4,-2.7 2,-0.2 -1,-0.2 0.836 105.3 50.8 -73.3 -30.6 108.2 51.9 27.0 579 600 A A H X S+ 0 0 5 -4,-1.6 4,-2.7 -48,-0.3 5,-0.4 0.902 108.9 51.8 -69.5 -40.5 107.0 52.7 30.6 580 601 A V H X>S+ 0 0 0 -4,-1.8 4,-2.3 2,-0.2 5,-0.9 0.935 113.4 44.0 -60.2 -47.0 103.5 51.5 29.5 581 602 A D H X5S+ 0 0 34 -4,-2.2 4,-1.0 3,-0.2 -2,-0.2 0.955 117.1 44.4 -64.1 -50.8 105.0 48.3 28.2 582 603 A E H <5S+ 0 0 143 -4,-2.7 -2,-0.2 1,-0.2 -1,-0.2 0.877 128.5 23.8 -63.8 -40.1 107.3 47.6 31.1 583 604 A H H <5S+ 0 0 86 -4,-2.7 -3,-0.2 -5,-0.2 -2,-0.2 0.666 130.2 33.8-104.5 -18.0 104.8 48.5 33.9 584 605 A L H <5S+ 0 0 0 -4,-2.3 7,-2.9 -5,-0.4 -3,-0.2 0.655 87.5 103.5-112.3 -19.5 101.3 48.0 32.5 585 606 A F E << +L 590 0P 58 -4,-1.0 5,-0.2 -5,-0.9 59,-0.0 -0.385 38.0 161.9 -71.1 142.3 101.6 45.1 30.1 586 607 A S E > -L 589 0P 9 3,-0.8 3,-2.1 -2,-0.1 -2,-0.0 -0.937 55.8 -96.6-148.2 163.1 100.3 41.6 31.0 587 608 A P T 3 S+ 0 0 103 0, 0.0 3,-0.1 0, 0.0 -2,-0.0 0.675 125.7 50.3 -59.4 -15.1 99.4 38.5 29.0 588 609 A Y T 3 S- 0 0 27 1,-0.4 2,-0.2 60,-0.0 -3,-0.0 0.411 124.8 -82.7-102.4 -1.2 95.7 39.7 29.1 589 610 A G E < -L 586 0P 0 -3,-2.1 -3,-0.8 36,-0.0 2,-0.5 -0.773 65.5 -33.8 129.4-174.7 96.4 43.3 28.0 590 611 A L E -L 585 0P 0 -2,-0.2 31,-0.3 -5,-0.2 -5,-0.2 -0.721 52.3-130.8 -91.2 126.9 97.5 46.7 29.4 591 612 A H - 0 0 18 -7,-2.9 29,-0.3 -2,-0.5 3,-0.1 -0.349 14.8-129.8 -68.6 152.7 96.6 47.8 32.9 592 613 A L S S- 0 0 0 27,-2.6 -36,-2.9 1,-0.2 -35,-0.4 0.816 82.1 -8.0 -74.6 -32.2 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