==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=2-SEP-2012 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER OXIDOREDUCTASE 16-SEP-99 1QLU . COMPND 2 MOLECULE: VANILLYL-ALCOHOL OXIDASE; . SOURCE 2 ORGANISM_SCIENTIFIC: PENICILLIUM SIMPLICISSIMUM; . AUTHOR A.MATTEVI . 1100 4 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 37042.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 759 69.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 22 2.0 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 158 14.4 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 4 0.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 4 0.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 4 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 . 73 6.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 144 13.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 286 26.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 21 1.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+5), SAME NUMBER PER 100 RESIDUES . 1 2 3 4 5 6 7 8 9 10 11 12 13 14 15 16 17 18 19 20 21 22 23 24 25 26 27 28 29 30 *** HISTOGRAMS OF *** . 0 0 0 3 0 2 2 4 0 2 2 0 0 4 4 0 4 0 0 2 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 2 0 2 2 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 0 PARALLEL BRIDGES PER LADDER . 10 2 10 6 4 2 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 0 0 4 0 0 2 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 6 A E 0 0 45 0, 0.0 19,-0.1 0, 0.0 20,-0.1 0.000 360.0 360.0 360.0 155.9 80.9 57.5 92.2 2 7 A F + 0 0 125 1,-0.2 15,-0.1 32,-0.1 18,-0.1 0.818 360.0 34.1 -91.0 -45.9 79.8 61.1 91.7 3 8 A R - 0 0 163 13,-0.1 -1,-0.2 31,-0.1 2,-0.1 -0.790 56.9-163.8-137.3 101.9 82.4 63.6 90.3 4 9 A P - 0 0 18 0, 0.0 32,-0.3 0, 0.0 3,-0.1 -0.358 29.2-123.7 -77.8 151.3 85.2 62.9 87.8 5 10 A L S S+ 0 0 110 30,-2.5 2,-0.4 1,-0.2 31,-0.1 0.882 100.2 20.0 -56.1 -40.8 88.2 65.1 87.1 6 11 A T - 0 0 48 29,-0.4 -1,-0.2 56,-0.2 102,-0.1 -1.000 69.9-153.8-136.7 137.9 87.2 65.2 83.4 7 12 A L - 0 0 62 -2,-0.4 102,-0.2 -3,-0.1 3,-0.1 -0.805 31.2-106.3-104.8 143.8 84.0 64.4 81.6 8 13 A P > - 0 0 3 0, 0.0 3,-1.6 0, 0.0 100,-0.2 -0.310 60.9 -62.1 -62.3 160.2 83.8 63.2 78.0 9 14 A P T 3 S- 0 0 34 0, 0.0 3,-0.1 0, 0.0 97,-0.0 -0.064 114.8 -4.6 -52.5 133.3 82.7 65.7 75.4 10 15 A K T 3 S+ 0 0 183 1,-0.2 2,-0.4 -3,-0.1 0, 0.0 0.575 97.6 128.6 61.0 13.5 79.2 67.1 75.6 11 16 A L < - 0 0 19 -3,-1.6 2,-0.2 4,-0.0 -1,-0.2 -0.842 50.1-138.7-102.6 136.6 78.2 64.9 78.6 12 17 A S > - 0 0 52 -2,-0.4 4,-3.0 -3,-0.1 5,-0.1 -0.570 23.6-113.1 -88.0 165.8 76.7 66.4 81.7 13 18 A L H > S+ 0 0 81 1,-0.2 4,-2.2 2,-0.2 5,-0.1 0.785 118.8 53.3 -65.5 -32.4 77.5 65.4 85.3 14 19 A S H > S+ 0 0 91 2,-0.2 4,-3.1 3,-0.2 -1,-0.2 0.907 109.1 46.5 -73.8 -40.6 74.0 64.0 85.7 15 20 A D H > S+ 0 0 64 1,-0.2 4,-3.1 2,-0.2 5,-0.3 0.977 112.8 51.4 -67.2 -44.4 74.3 61.8 82.5 16 21 A F H X S+ 0 0 0 -4,-3.0 4,-2.7 1,-0.2 -2,-0.2 0.897 112.2 46.9 -52.4 -49.7 77.7 60.7 83.8 17 22 A N H X S+ 0 0 44 -4,-2.2 4,-2.6 2,-0.2 5,-0.2 0.952 112.9 47.7 -62.5 -45.7 76.1 59.9 87.1 18 23 A E H X S+ 0 0 91 -4,-3.1 4,-2.0 1,-0.2 -2,-0.2 0.932 113.9 48.6 -56.8 -49.0 73.2 58.0 85.5 19 24 A F H X S+ 0 0 0 -4,-3.1 4,-2.4 2,-0.2 5,-0.2 0.933 110.2 49.1 -57.2 -52.8 75.6 56.1 83.3 20 25 A I H X S+ 0 0 0 -4,-2.7 4,-2.6 -5,-0.3 -1,-0.2 0.925 110.7 50.8 -62.6 -35.6 78.0 55.1 86.0 21 26 A Q H X S+ 0 0 88 -4,-2.6 4,-2.1 1,-0.2 -1,-0.2 0.892 109.8 52.6 -66.7 -32.7 75.1 53.8 88.2 22 27 A D H X S+ 0 0 40 -4,-2.0 4,-1.2 -5,-0.2 -2,-0.2 0.902 111.6 44.5 -65.6 -40.3 73.9 51.9 85.1 23 28 A I H X>S+ 0 0 0 -4,-2.4 4,-3.2 2,-0.2 5,-0.5 0.898 108.4 57.4 -71.1 -41.4 77.3 50.2 84.7 24 29 A I H X5S+ 0 0 30 -4,-2.6 4,-3.0 1,-0.3 -2,-0.2 0.930 105.9 50.0 -57.3 -45.3 77.7 49.5 88.4 25 30 A R H <5S+ 0 0 176 -4,-2.1 -1,-0.3 1,-0.2 -2,-0.2 0.832 114.7 45.5 -67.8 -28.5 74.4 47.5 88.4 26 31 A I H <5S+ 0 0 47 -4,-1.2 -2,-0.2 -5,-0.2 -1,-0.2 0.957 133.1 13.5 -76.1 -48.1 75.7 45.5 85.3 27 32 A V H <5S- 0 0 7 -4,-3.2 -3,-0.2 1,-0.2 -2,-0.2 0.614 107.2-111.6-103.5 -14.8 79.2 44.7 86.5 28 33 A G ><< - 0 0 29 -4,-3.0 3,-0.8 -5,-0.5 -1,-0.2 -0.131 31.3 -83.4 101.8 161.9 79.2 45.6 90.2 29 34 A S G > S+ 0 0 73 1,-0.2 3,-1.4 2,-0.2 -1,-0.1 0.871 126.2 63.4 -71.1 -29.2 81.0 48.3 92.2 30 35 A E G 3 S+ 0 0 158 1,-0.3 -1,-0.2 -6,-0.1 -2,-0.1 0.718 104.4 47.7 -66.0 -22.2 84.1 46.2 92.3 31 36 A N G < S+ 0 0 20 -3,-0.8 36,-3.4 -7,-0.1 2,-0.3 0.335 104.3 65.0-104.2 12.8 84.4 46.4 88.5 32 37 A V E < -A 66 0A 17 -3,-1.4 2,-0.4 34,-0.2 34,-0.2 -0.998 57.8-173.3-129.8 142.7 83.9 50.1 88.0 33 38 A E E -A 65 0A 111 32,-2.4 32,-2.3 -2,-0.3 2,-0.4 -0.985 11.2-153.0-138.9 119.4 86.2 53.0 89.2 34 39 A V E -A 64 0A 18 -2,-0.4 2,-0.9 30,-0.2 30,-0.3 -0.732 14.5-139.6 -91.0 138.6 85.6 56.8 89.0 35 40 A I 0 0 21 28,-2.6 -30,-2.5 -2,-0.4 -29,-0.4 -0.831 360.0 360.0 -96.6 97.2 88.6 59.0 88.8 36 41 A S 0 0 89 -2,-0.9 28,-0.0 -32,-0.3 27,-0.0 -0.482 360.0 360.0 -97.4 360.0 87.7 61.9 91.1 37 ! 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 38 47 A V 0 0 146 0, 0.0 10,-0.2 0, 0.0 11,-0.1 0.000 360.0 360.0 360.0 111.5 99.7 57.5 90.2 39 48 A D - 0 0 27 1,-0.1 7,-0.6 12,-0.1 10,-0.1 0.830 360.0-175.3 -65.8 -31.2 102.0 56.3 87.5 40 49 A G B -E 45 0B 51 5,-0.1 2,-0.2 11,-0.0 -1,-0.1 -0.249 22.7 -69.5 71.5-157.2 102.3 52.8 89.1 41 50 A S - 0 0 58 3,-1.2 5,-0.1 1,-0.1 0, 0.0 -0.749 30.6-107.1-128.5 177.2 104.5 50.0 87.9 42 51 A Y S S+ 0 0 31 -2,-0.2 -1,-0.1 1,-0.2 55,-0.0 0.882 122.0 57.6 -70.4 -34.5 105.0 47.6 85.1 43 52 A M S S+ 0 0 138 1,-0.3 -1,-0.2 -3,-0.0 -3,-0.0 0.909 124.1 17.5 -60.0 -48.7 103.8 45.0 87.7 44 53 A K S S- 0 0 172 0, 0.0 -3,-1.2 0, 0.0 -1,-0.3 -0.770 91.6-154.9-127.9 78.7 100.5 46.8 88.4 45 54 A P B -E 40 0B 27 0, 0.0 2,-0.1 0, 0.0 -5,-0.1 -0.208 16.9-113.9 -55.5 147.1 100.0 49.1 85.4 46 55 A T - 0 0 19 -7,-0.6 56,-0.4 -5,-0.1 57,-0.1 -0.489 20.6-166.3 -77.5 157.7 97.8 52.2 85.7 47 56 A H S S+ 0 0 45 -2,-0.1 64,-0.1 54,-0.1 3,-0.1 -0.038 75.9 66.9-131.0 19.5 94.6 52.4 83.7 48 57 A T S S- 0 0 24 1,-0.4 14,-2.4 -10,-0.2 2,-0.3 0.554 108.6 -13.4-114.5 -25.2 93.9 56.1 84.1 49 58 A H B S-F 61 0C 5 12,-0.2 53,-0.5 -11,-0.1 -1,-0.4 -0.981 84.1 -62.2-166.4 176.7 96.6 57.8 82.2 50 59 A D > - 0 0 4 10,-0.6 3,-0.7 7,-0.4 51,-0.2 -0.626 32.2-165.2 -79.6 114.1 100.0 57.5 80.5 51 60 A P T 3 S+ 0 0 18 0, 0.0 -1,-0.2 0, 0.0 -12,-0.1 0.655 92.2 51.7 -75.6 -19.5 102.7 56.5 83.0 52 61 A H T 3 S- 0 0 21 360,-0.1 2,-0.2 361,-0.1 360,-0.1 -0.418 90.5-175.8-109.7 43.7 105.4 57.5 80.5 53 62 A H < + 0 0 12 -3,-0.7 4,-0.2 1,-0.2 5,-0.1 -0.295 26.4 173.0 -54.7 117.9 103.8 60.8 80.1 54 63 A V S S+ 0 0 1 -2,-0.2 422,-0.2 2,-0.1 -1,-0.2 0.777 79.4 44.7 -93.2 -34.6 105.4 63.1 77.4 55 64 A M S S- 0 0 29 1,-0.2 5,-0.1 2,-0.1 4,-0.0 -0.303 127.0 -52.5 -89.3-175.5 102.6 65.6 77.8 56 65 A D > - 0 0 117 1,-0.1 3,-2.5 -2,-0.1 4,-0.4 -0.293 61.1-110.0 -61.4 144.0 101.4 66.6 81.3 57 66 A Q T 3 S+ 0 0 84 1,-0.3 3,-0.4 -4,-0.2 -7,-0.4 0.848 117.5 42.5 -41.2 -48.5 100.6 63.4 83.4 58 67 A D T 3 S+ 0 0 103 1,-0.2 -1,-0.3 -9,-0.1 3,-0.2 0.149 84.6 103.7 -90.5 19.3 96.8 64.1 83.4 59 68 A Y S < S+ 0 0 88 -3,-2.5 2,-0.7 1,-0.3 48,-0.2 0.940 87.3 35.2 -70.0 -45.3 96.7 65.1 79.7 60 69 A F S S+ 0 0 5 -3,-0.4 -10,-0.6 -4,-0.4 2,-0.4 -0.952 90.7 165.7-107.7 105.2 95.2 61.9 78.5 61 70 A L B -F 49 0C 8 -2,-0.7 47,-2.6 -3,-0.2 48,-0.3 -0.976 34.1-134.3-135.7 135.2 92.9 60.9 81.4 62 71 A A - 0 0 1 -14,-2.4 -56,-0.2 -2,-0.4 48,-0.2 -0.429 5.8-151.1 -72.7 156.2 90.0 58.4 81.9 63 72 A S S S- 0 0 0 46,-2.4 -28,-2.6 1,-0.4 2,-0.3 0.758 82.6 -10.6 -89.7 -29.8 86.9 59.6 83.7 64 73 A A E -Ab 34 110A 0 45,-0.8 47,-2.9 -30,-0.3 -1,-0.4 -0.974 62.5-128.2-158.6 159.9 86.3 56.0 84.9 65 74 A I E -Ab 33 111A 15 -32,-2.3 -32,-2.4 -2,-0.3 2,-0.4 -0.931 24.7-168.1-113.5 130.3 87.7 52.5 84.5 66 75 A V E -Ab 32 112A 0 45,-2.7 47,-2.9 -2,-0.4 -34,-0.2 -0.992 7.7-161.0-123.0 131.8 85.1 49.7 83.8 67 76 A A - 0 0 3 -36,-3.4 47,-0.1 -2,-0.4 45,-0.1 -0.924 13.9-147.4-113.4 101.1 85.9 46.0 83.9 68 77 A P - 0 0 0 0, 0.0 49,-0.5 0, 0.0 50,-0.2 -0.410 6.4-144.1 -62.0 148.3 83.4 43.9 82.0 69 78 A R S S- 0 0 116 1,-0.2 2,-0.3 48,-0.1 3,-0.1 0.709 74.0 -26.7 -82.1 -30.4 82.9 40.5 83.5 70 79 A N S >> S- 0 0 58 1,-0.1 4,-1.4 48,-0.1 3,-0.5 -0.948 84.1 -67.1-165.0-173.9 82.4 38.8 80.2 71 80 A V H 3> S+ 0 0 4 -2,-0.3 4,-2.4 1,-0.3 3,-0.2 0.927 125.0 59.2 -62.8 -39.9 81.3 39.5 76.5 72 81 A A H 3> S+ 0 0 17 1,-0.2 4,-1.8 2,-0.2 -1,-0.3 0.904 104.3 52.9 -53.8 -43.6 77.6 40.1 77.5 73 82 A D H <> S+ 0 0 7 -3,-0.5 4,-3.4 2,-0.2 -1,-0.2 0.875 105.9 51.2 -59.5 -42.5 78.9 42.9 79.7 74 83 A V H X S+ 0 0 0 -4,-1.4 4,-3.4 -3,-0.2 5,-0.2 0.946 108.7 54.0 -59.0 -43.9 80.8 44.6 76.9 75 84 A Q H X S+ 0 0 59 -4,-2.4 4,-1.9 2,-0.2 -2,-0.2 0.892 112.5 42.3 -56.0 -45.2 77.6 44.4 74.8 76 85 A S H X S+ 0 0 52 -4,-1.8 4,-2.8 2,-0.2 -1,-0.2 0.902 112.9 52.5 -70.9 -44.2 75.6 46.2 77.5 77 86 A I H X S+ 0 0 0 -4,-3.4 4,-2.8 1,-0.2 -2,-0.2 0.978 109.6 50.3 -57.9 -46.0 78.4 48.7 78.1 78 87 A V H X S+ 0 0 0 -4,-3.4 4,-2.5 1,-0.2 -2,-0.2 0.875 108.6 52.0 -55.3 -42.7 78.3 49.4 74.4 79 88 A G H X S+ 0 0 39 -4,-1.9 4,-2.4 -5,-0.2 -1,-0.2 0.953 111.0 47.4 -60.6 -50.7 74.6 49.9 74.4 80 89 A L H >X S+ 0 0 25 -4,-2.8 4,-2.4 1,-0.2 3,-0.5 0.991 110.8 50.8 -56.3 -55.4 74.9 52.4 77.3 81 90 A A H 3X>S+ 0 0 0 -4,-2.8 5,-1.8 1,-0.3 4,-1.5 0.875 111.7 48.2 -49.1 -46.8 77.8 54.3 75.6 82 91 A N H 3<5S+ 0 0 31 -4,-2.5 -1,-0.3 3,-0.2 -2,-0.2 0.871 111.7 51.3 -60.3 -37.0 75.6 54.6 72.4 83 92 A K H <<5S+ 0 0 144 -4,-2.4 -2,-0.2 -3,-0.5 -3,-0.2 0.998 125.1 25.9 -62.5 -57.9 72.6 55.7 74.6 84 93 A F H <5S- 0 0 21 -4,-2.4 -2,-0.2 -5,-0.1 -1,-0.2 0.432 104.4-120.6 -85.9 -2.2 74.7 58.5 76.3 85 94 A S T <5 + 0 0 62 -4,-1.5 -3,-0.2 -5,-0.4 -4,-0.1 0.915 53.9 164.8 62.6 40.9 77.3 59.0 73.5 86 95 A F < - 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0 0 0 -4,-0.6 3,-1.5 397,-0.2 -3,-0.2 0.238 57.6-130.4 120.0 -6.9 100.5 55.9 75.8 101 110 A G T 3 S- 0 0 0 428,-0.3 3,-1.4 -46,-0.1 -1,-0.2 -0.812 91.7-132.3 -87.2 122.1 90.0 61.5 74.3 107 116 A S T 3 S+ 0 0 28 -2,-0.6 -45,-0.2 1,-0.2 3,-0.1 -0.364 91.7 43.1 -71.2 148.4 90.0 62.5 78.0 108 117 A G T 3 S+ 0 0 0 -47,-2.6 -1,-0.2 1,-0.4 -46,-0.1 0.167 84.9 132.6 99.6 -14.3 86.8 61.8 79.8 109 118 A S < - 0 0 0 -3,-1.4 -46,-2.4 -48,-0.3 -45,-0.8 -0.291 64.4-115.1 -70.1 154.2 86.5 58.3 78.1 110 119 A V E -bc 64 88A 0 -23,-2.0 -21,-2.4 -48,-0.2 2,-0.7 -0.718 28.6-132.9 -78.2 134.2 85.7 55.3 80.1 111 120 A V E -bc 65 89A 0 -47,-2.9 -45,-2.7 -2,-0.4 2,-1.1 -0.820 17.8-143.0 -87.3 120.7 88.8 53.0 80.0 112 121 A L E -bc 66 90A 0 -23,-2.5 -21,-2.4 -2,-0.7 2,-1.5 -0.713 9.7-159.0 -88.7 105.6 87.4 49.6 79.1 113 122 A D E + c 0 91A 11 -47,-2.9 4,-0.5 -2,-1.1 3,-0.4 -0.575 21.8 166.0 -83.4 89.9 89.5 47.1 81.0 114 123 A M > + 0 0 3 -23,-1.9 4,-1.8 -2,-1.5 22,-0.4 0.837 68.0 60.8 -67.1 -35.0 88.9 43.8 79.1 115 124 A G T 4 S+ 0 0 4 -23,-0.5 -1,-0.2 -24,-0.4 -22,-0.1 0.744 84.4 71.1 -71.3 -29.1 91.8 41.9 80.8 116 125 A K T 4 S+ 0 0 92 -3,-0.4 -1,-0.2 1,-0.2 3,-0.2 0.980 122.2 8.9 -56.0 -57.1 90.9 42.0 84.5 117 126 A N T 4 S+ 0 0 53 -4,-0.5 2,-0.9 -49,-0.5 -2,-0.2 0.716 118.9 69.3-101.3 -20.5 88.0 39.5 84.1 118 127 A M < + 0 0 2 -4,-1.8 18,-3.3 -5,-0.2 19,-0.3 -0.593 64.5 130.9-104.7 73.7 88.3 38.2 80.5 119 128 A N + 0 0 84 -2,-0.9 2,-0.3 17,-0.2 -1,-0.2 0.186 25.9 133.9 -96.5 -10.8 91.5 36.3 81.2 120 129 A R - 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0 0 4 -4,-1.1 -28,-0.6 -3,-0.2 -1,-0.5 -0.887 64.1-164.5-136.9 115.1 92.6 29.2 57.7 234 243 A P S S+ 0 0 10 0, 0.0 -44,-0.2 0, 0.0 8,-0.2 0.540 73.4 71.9 -76.2 -23.3 92.1 33.0 58.4 235 244 A Y + 0 0 5 1,-0.2 -31,-0.2 -31,-0.1 6,-0.1 0.816 60.8 173.8 -71.2 -34.0 90.5 34.0 55.1 236 245 A G - 0 0 0 -3,-0.3 2,-0.3 -7,-0.1 -1,-0.2 -0.372 53.2 -50.1 60.7-139.4 87.0 32.4 55.3 237 246 A F S S+ 0 0 4 -33,-0.3 -33,-0.1 2,-0.2 810,-0.1 -0.945 99.3 5.1-136.3 152.0 85.0 33.6 52.2 238 247 A G S S+ 0 0 0 -2,-0.3 562,-0.2 808,-0.3 851,-0.1 -0.207 112.0 10.7 72.5-164.1 84.4 37.1 50.7 239 248 A P - 0 0 3 0, 0.0 2,-1.2 0, 0.0 557,-0.2 -0.243 69.5-135.3 -50.3 133.7 86.0 40.3 51.9 240 249 A Y + 0 0 19 555,-1.7 3,-0.4 558,-0.6 557,-0.2 -0.724 34.2 168.6 -98.1 91.7 88.8 39.7 54.4 241 250 A I > + 0 0 0 -2,-1.2 3,-1.2 1,-0.2 4,-0.2 0.371 43.4 102.8 -89.8 -0.3 87.8 42.3 57.0 242 251 A D G > S+ 0 0 1 1,-0.3 3,-2.1 2,-0.2 -1,-0.2 0.858 75.2 57.9 -53.4 -46.4 90.2 41.2 59.7 243 252 A G G > S+ 0 0 5 -3,-0.4 3,-2.2 1,-0.3 549,-1.5 0.817 89.1 74.5 -61.0 -21.4 92.8 43.9 59.1 244 253 A L G < S+ 0 0 2 -3,-1.2 6,-0.4 1,-0.3 -1,-0.3 0.666 95.4 54.9 -64.3 -12.7 90.0 46.6 59.7 245 254 A F G < S+ 0 0 7 -3,-2.1 2,-0.5 -4,-0.2 3,-0.4 0.328 87.2 89.4-101.4 1.8 90.4 45.6 63.4 246 255 A S S < S- 0 0 0 -3,-2.2 546,-0.6 1,-0.3 -73,-0.2 -0.876 107.0 -6.5-107.4 132.7 94.2 46.1 63.8 247 256 A Q S S+ 0 0 5 -75,-1.0 2,-0.3 -2,-0.5 -1,-0.3 0.944 116.5 109.5 55.1 50.9 95.4 49.6 64.9 248 257 A S S S- 0 0 19 -3,-0.4 -1,-0.2 542,-0.2 289,-0.1 -0.895 74.4-133.2-144.4 176.3 91.8 50.8 64.5 249 258 A N S S+ 0 0 3 -2,-0.3 283,-0.2 287,-0.2 -4,-0.1 -0.158 74.3 109.4-120.6 29.1 88.7 51.9 66.4 250 259 A M S S- 0 0 7 -6,-0.4 -54,-0.5 1,-0.1 2,-0.3 0.472 84.5 -16.0 -88.4 -1.7 86.3 49.7 64.4 251 260 A G - 0 0 11 -56,-0.2 2,-0.5 -3,-0.1 -56,-0.2 -0.991 63.1 -97.4 176.9 173.2 85.5 47.2 67.2 252 261 A I E - I 0 194D 2 -58,-2.1 -58,-3.3 -2,-0.3 2,-0.5 -0.989 36.9-140.9-118.2 109.7 86.3 45.7 70.6 253 262 A V E + I 0 193D 20 -2,-0.5 -60,-0.2 -60,-0.2 3,-0.1 -0.731 26.6 170.6 -79.1 118.9 88.2 42.4 70.3 254 263 A T E + 0 0 0 -62,-2.7 2,-0.3 -2,-0.5 -61,-0.2 0.653 64.4 6.1-102.7 -23.4 87.0 39.9 72.8 255 264 A K E - I 0 192D 7 -63,-1.1 -63,-2.7 -121,-0.2 -1,-0.4 -0.942 61.1-175.5-155.0 150.3 88.9 36.6 71.7 256 265 A I E -HI 133 191D 0 -123,-2.3 -123,-3.2 -2,-0.3 2,-0.5 -0.990 20.9-132.3-150.9 152.6 91.5 35.7 69.1 257 266 A G E -H 132 0D 0 -67,-0.9 -68,-2.2 -2,-0.3 2,-0.4 -0.895 22.2-170.3-104.4 134.2 93.2 32.6 67.7 258 267 A I E -HI 131 188D 18 -127,-2.6 -127,-1.5 -2,-0.5 -70,-0.2 -0.986 21.9-124.6-130.2 121.6 97.0 32.7 67.4 259 268 A W E -H 130 0D 32 -72,-2.7 2,-0.4 -2,-0.4 -129,-0.3 -0.325 25.7-148.9 -60.9 133.9 99.0 30.0 65.6 260 269 A L - 0 0 6 -131,-2.8 -103,-0.2 -132,-0.2 -1,-0.0 -0.952 12.6-119.4-117.2 139.3 101.8 28.4 67.7 261 270 A M E -L 156 0F 11 -105,-0.8 -105,-3.5 -2,-0.4 584,-0.1 -0.538 28.4-119.9 -78.2 132.5 105.1 27.0 66.5 262 271 A P E -L 155 0F 27 0, 0.0 -107,-0.3 0, 0.0 -108,-0.1 -0.368 45.7 -83.4 -63.6 146.1 105.8 23.3 67.0 263 272 A N - 0 0 55 -109,-2.5 -110,-0.1 1,-0.2 -111,-0.0 -0.315 44.6-141.3 -48.7 124.4 108.8 22.5 69.2 264 273 A P - 0 0 29 0, 0.0 -1,-0.2 0, 0.0 -110,-0.0 0.605 23.0-122.7 -78.1 -10.6 111.5 22.7 66.4 265 274 A G S S+ 0 0 53 85,-0.1 87,-0.3 -112,-0.1 2,-0.2 0.845 87.7 36.4 73.8 35.3 113.6 19.8 67.7 266 275 A G + 0 0 16 85,-0.1 84,-3.0 86,-0.1 2,-0.3 -0.462 62.0 178.7 149.3 130.4 116.7 21.9 68.0 267 276 A Y E +N 349 0H 39 82,-0.2 2,-0.3 -2,-0.2 82,-0.2 -0.958 7.2 170.9-151.7 140.3 117.6 25.5 69.0 268 277 A Q E -N 348 0H 48 80,-1.7 80,-2.1 -2,-0.3 2,-0.0 -0.872 15.4-157.4-150.5 111.3 120.7 27.6 69.4 269 278 A S E -N 347 0H 0 -2,-0.3 2,-0.3 78,-0.2 78,-0.2 -0.277 18.1-175.3 -79.4 172.5 120.8 31.4 70.0 270 279 A Y E -N 346 0H 1 76,-1.5 76,-2.0 106,-0.2 2,-0.4 -0.985 21.6-143.2-167.7 156.6 123.8 33.5 69.2 271 280 A L E -NO 345 375H 3 104,-2.0 104,-2.8 -2,-0.3 2,-0.5 -0.997 7.9-167.1-131.2 126.3 125.4 37.0 69.3 272 281 A I E -NO 344 374H 0 72,-2.3 72,-2.9 -2,-0.4 2,-0.4 -0.974 15.2-151.1-119.5 107.7 127.6 38.6 66.6 273 282 A T E -NO 343 373H 8 100,-2.0 100,-1.0 -2,-0.5 70,-0.2 -0.620 2.1-156.1 -84.1 133.2 129.4 41.7 67.8 274 283 A L E -N 342 0H 1 68,-2.6 67,-1.7 -2,-0.4 68,-1.5 -0.969 7.2-151.7-110.8 110.5 130.2 44.4 65.2 275 284 A P + 0 0 50 0, 0.0 66,-0.4 0, 0.0 2,-0.3 0.885 67.7 55.4 -51.7 -53.1 133.1 46.5 66.4 276 285 A K S > S- 0 0 136 64,-0.1 3,-2.6 65,-0.1 4,-0.4 -0.683 71.9-130.9 -96.7 145.3 132.4 49.8 64.7 277 286 A D T > S+ 0 0 24 -2,-0.3 3,-1.0 1,-0.3 -1,-0.1 0.872 112.9 54.1 -48.9 -44.4 129.5 52.3 64.6 278 287 A G T >> S+ 0 0 46 1,-0.2 3,-0.6 2,-0.1 4,-0.6 0.477 84.3 85.4 -71.6 -6.1 129.8 52.3 60.8 279 288 A D H <> + 0 0 21 -3,-2.6 4,-2.8 1,-0.2 -1,-0.2 0.708 66.6 84.3 -73.1 -13.4 129.5 48.5 60.6 280 289 A L H <> S+ 0 0 0 -3,-1.0 4,-2.8 -4,-0.4 5,-0.3 0.949 88.6 53.2 -48.2 -53.6 125.7 48.8 60.5 281 290 A K H <> S+ 0 0 90 -3,-0.6 4,-1.8 1,-0.2 143,-0.3 0.900 111.0 41.9 -53.9 -49.4 125.9 49.3 56.8 282 291 A Q H X S+ 0 0 75 -4,-0.6 4,-1.6 2,-0.2 -1,-0.2 0.943 114.7 53.3 -67.1 -41.3 128.0 46.2 56.0 283 292 A A H X S+ 0 0 0 -4,-2.8 4,-3.5 2,-0.2 3,-0.5 0.929 109.2 46.3 -56.7 -48.5 125.9 44.1 58.4 284 293 A V H X S+ 0 0 0 -4,-2.8 4,-2.4 1,-0.3 -1,-0.2 0.903 110.6 53.1 -64.2 -37.5 122.5 45.0 56.9 285 294 A D H < S+ 0 0 59 -4,-1.8 -1,-0.3 -5,-0.3 -2,-0.2 0.860 113.7 44.9 -64.2 -32.4 123.8 44.4 53.4 286 295 A I H X S+ 0 0 22 -4,-1.6 4,-1.0 -3,-0.5 -2,-0.2 0.942 110.7 53.4 -76.1 -44.1 124.9 41.0 54.7 287 296 A I H X S+ 0 0 0 -4,-3.5 4,-2.5 1,-0.2 5,-0.3 0.819 94.7 73.7 -61.2 -34.2 121.6 40.4 56.5 288 297 A R H X S+ 0 0 62 -4,-2.4 4,-2.1 1,-0.2 -1,-0.2 0.863 100.9 35.0 -47.1 -64.3 119.5 41.1 53.4 289 298 A P H > S+ 0 0 60 0, 0.0 4,-2.0 0, 0.0 -1,-0.2 0.859 117.9 54.3 -64.8 -35.9 120.1 37.9 51.2 290 299 A L H <>S+ 0 0 18 -4,-1.0 5,-2.0 2,-0.2 6,-1.8 0.848 110.1 44.9 -65.2 -42.6 120.3 35.7 54.3 291 300 A R H ><5S+ 0 0 21 -4,-2.5 3,-1.1 3,-0.2 -1,-0.2 0.946 114.6 49.8 -67.5 -44.7 116.9 36.9 55.6 292 301 A L H 3<5S+ 0 0 9 -4,-2.1 -2,-0.2 -5,-0.3 -1,-0.2 0.769 115.4 41.9 -63.1 -34.2 115.4 36.5 52.1 293 302 A G T 3<5S- 0 0 47 -4,-2.0 -1,-0.3 -5,-0.1 -2,-0.2 0.294 114.9-116.6 -97.4 6.5 116.7 33.0 51.6 294 303 A M T < 5S+ 0 0 83 -3,-1.1 -3,-0.2 2,-0.2 -4,-0.1 0.666 79.1 125.4 67.8 27.3 115.9 32.0 55.1 295 304 A A S > -P 342 0H 2 143,-2.4 3,-1.2 -2,-0.4 4,-1.1 -0.501 32.7-108.4 -70.2 146.8 122.8 49.6 69.4 305 314 A I H 3> S+ 0 0 0 36,-1.9 4,-3.1 1,-0.2 5,-0.2 0.865 115.1 57.6 -57.4 -38.0 125.4 49.5 72.2 306 315 A L H 3> S+ 0 0 1 2,-0.2 4,-3.2 1,-0.2 -1,-0.2 0.814 99.4 60.7 -64.0 -23.8 123.4 51.8 74.7 307 316 A L H <> S+ 0 0 2 -3,-1.2 4,-2.1 140,-0.3 -1,-0.2 0.993 112.2 37.0 -64.5 -51.7 120.4 49.4 74.6 308 317 A D H X S+ 0 0 0 -4,-1.1 4,-1.6 1,-0.2 3,-0.3 0.964 117.7 53.1 -64.1 -44.4 122.4 46.5 75.9 309 318 A A H X S+ 0 0 0 -4,-3.1 4,-1.4 1,-0.2 3,-0.2 0.897 108.1 49.7 -57.4 -41.8 124.3 49.0 78.2 310 319 A A H < S+ 0 0 1 -4,-3.2 -1,-0.2 1,-0.2 -2,-0.2 0.845 104.3 58.6 -69.4 -31.3 121.0 50.4 79.6 311 320 A V H < S+ 0 0 14 -4,-2.1 -1,-0.2 -3,-0.3 -2,-0.2 0.937 110.9 43.9 -59.3 -41.6 119.7 46.9 80.3 312 321 A L H < S- 0 0 54 -4,-1.6 2,-0.3 -3,-0.2 -2,-0.2 0.732 129.7 -17.3 -79.0 -22.6 122.8 46.3 82.6 313 322 A G < - 0 0 16 -4,-1.4 -1,-0.2 -3,-0.1 5,-0.1 -0.901 69.6 -92.5-178.4 152.0 122.9 49.7 84.4 314 323 A D - 0 0 64 -2,-0.3 4,-0.5 -3,-0.1 3,-0.4 0.047 47.6 -98.6 -63.5 173.5 121.6 53.2 84.4 315 324 A K S >> S+ 0 0 12 92,-2.4 4,-2.0 91,-0.3 3,-1.9 0.911 121.1 64.4 -66.0 -36.9 123.5 56.2 82.9 316 325 A R T 34 S+ 0 0 196 91,-0.4 -1,-0.2 1,-0.3 5,-0.1 0.854 96.4 59.4 -55.0 -35.1 124.9 57.2 86.3 317 326 A S T 34 S+ 0 0 73 -3,-0.4 -1,-0.3 1,-0.2 -2,-0.2 0.711 114.9 32.8 -69.6 -20.3 126.7 53.9 86.4 318 327 A Y T <4 S- 0 0 46 -3,-1.9 2,-0.3 -4,-0.5 -1,-0.2 0.627 132.6 -3.9-108.4 -22.1 128.7 54.6 83.2 319 328 A S < - 0 0 25 -4,-2.0 -1,-0.4 2,-0.1 6,-0.0 -0.970 47.4-139.5-163.4 158.0 129.2 58.4 83.3 320 329 A S + 0 0 113 -2,-0.3 -4,-0.1 -3,-0.1 -3,-0.1 0.345 67.0 124.2-107.5 6.4 128.1 61.3 85.5 321 330 A R - 0 0 101 -6,-0.2 -2,-0.1 1,-0.1 4,-0.1 -0.180 50.4-160.7 -60.9 152.0 127.5 63.4 82.4 322 331 A T S S+ 0 0 129 2,-0.1 -1,-0.1 121,-0.0 3,-0.1 0.520 75.2 69.6-110.7 -19.4 124.1 65.0 81.8 323 332 A E S S- 0 0 106 1,-0.2 3,-0.1 120,-0.1 120,-0.1 -0.432 105.5 -66.8 -94.6 169.5 124.8 65.5 78.1 324 333 A P - 0 0 13 0, 0.0 -1,-0.2 0, 0.0 -2,-0.1 -0.323 55.9-107.4 -58.3 138.6 124.9 62.7 75.5 325 334 A L - 0 0 11 1,-0.1 2,-0.1 -4,-0.1 -6,-0.0 -0.309 39.6-114.1 -61.2 145.9 127.9 60.3 75.8 326 335 A S > - 0 0 28 1,-0.1 4,-2.3 -3,-0.1 -1,-0.1 -0.276 21.0-107.7 -77.1 173.4 130.5 60.7 73.2 327 336 A D H > S+ 0 0 64 2,-0.2 4,-2.0 1,-0.2 5,-0.1 0.893 122.3 54.1 -63.0 -42.6 131.4 58.3 70.5 328 337 A E H > S+ 0 0 127 2,-0.2 4,-1.8 1,-0.2 -1,-0.2 0.865 107.4 51.1 -65.9 -35.4 134.7 57.6 72.3 329 338 A E H > S+ 0 0 19 2,-0.2 4,-2.8 1,-0.2 5,-0.3 0.948 105.9 54.3 -68.3 -41.6 132.7 56.8 75.4 330 339 A L H X S+ 0 0 16 -4,-2.3 4,-2.3 1,-0.2 -2,-0.2 0.903 107.2 51.5 -60.1 -39.3 130.4 54.4 73.5 331 340 A D H X S+ 0 0 63 -4,-2.0 4,-2.4 1,-0.2 -1,-0.2 0.916 110.0 49.7 -63.9 -38.2 133.6 52.5 72.3 332 341 A K H X S+ 0 0 92 -4,-1.8 4,-2.8 1,-0.2 -2,-0.2 0.904 111.0 48.4 -65.2 -41.7 134.7 52.3 76.0 333 342 A I H X S+ 0 0 6 -4,-2.8 4,-1.7 2,-0.2 6,-0.2 0.893 110.7 52.3 -65.8 -39.5 131.3 50.9 77.1 334 343 A A H >X>S+ 0 0 6 -4,-2.3 5,-1.9 -5,-0.3 4,-1.3 0.984 112.1 44.7 -55.2 -58.1 131.4 48.4 74.3 335 344 A K H ><5S+ 0 0 143 -4,-2.4 3,-0.6 1,-0.3 -2,-0.2 0.899 110.5 55.3 -55.0 -46.3 134.9 47.2 75.3 336 345 A Q H 3<5S+ 0 0 108 -4,-2.8 -1,-0.3 1,-0.2 -2,-0.2 0.824 116.5 36.4 -55.6 -39.0 133.9 47.1 79.0 337 346 A L H <<5S- 0 0 36 -4,-1.7 -1,-0.2 -3,-0.8 -2,-0.2 0.456 109.4-116.0 -95.8 -9.7 130.9 44.8 78.2 338 347 A N T <<5S+ 0 0 103 -4,-1.3 2,-0.2 -3,-0.6 -3,-0.2 0.740 76.2 118.8 79.9 25.4 132.5 42.7 75.5 339 348 A L < - 0 0 29 -5,-1.9 -1,-0.3 -6,-0.2 -2,-0.1 -0.703 61.0-119.2-114.9 165.5 130.1 43.9 72.9 340 349 A G - 0 0 5 2,-0.4 -64,-0.1 -2,-0.2 -1,-0.1 -0.226 39.9 -95.4 -91.0-168.2 130.5 45.8 69.6 341 350 A R S S+ 0 0 0 -67,-1.7 -36,-1.9 -66,-0.4 2,-0.3 0.735 120.8 29.2 -77.1 -23.7 129.0 49.2 68.7 342 351 A W E S-NP 274 304H 0 -68,-1.5 -68,-2.6 -38,-0.2 2,-0.4 -0.969 79.0-158.8-135.3 138.2 126.2 47.2 67.1 343 352 A N E -NP 273 303H 0 -40,-2.3 -40,-3.4 -2,-0.3 2,-0.6 -0.987 4.4-152.4-130.9 118.1 125.2 43.7 68.3 344 353 A F E -NP 272 302H 0 -72,-2.9 -72,-2.3 -2,-0.4 2,-0.4 -0.856 12.1-168.4 -99.0 117.0 123.3 41.2 66.2 345 354 A Y E +NP 271 301H 3 -44,-2.6 -44,-1.9 -2,-0.6 2,-0.2 -0.894 21.4 138.8-107.8 136.7 121.1 38.7 68.0 346 355 A G E -N 270 0H 0 -76,-2.0 -76,-1.5 -2,-0.4 2,-0.3 -0.834 32.3-134.6-157.9-170.6 119.6 35.6 66.3 347 356 A A E -N 269 0H 1 -78,-0.2 -50,-0.5 -2,-0.2 -49,-0.5 -0.978 8.6-138.0-161.6 143.6 118.7 31.9 66.6 348 357 A L E -N 268 0H 5 -80,-2.1 -80,-1.7 -2,-0.3 2,-0.4 -0.920 24.3-161.9-107.7 135.0 119.0 28.7 64.6 349 358 A Y E +N 267 0H 8 -2,-0.4 -82,-0.2 -82,-0.2 -84,-0.0 -0.966 39.8 27.9-120.2 143.5 116.0 26.3 64.6 350 359 A G S S- 0 0 7 -84,-3.0 -85,-0.1 -2,-0.4 2,-0.1 -0.699 92.9 -8.5 116.9-173.6 115.6 22.6 63.7 351 360 A P >> - 0 0 61 0, 0.0 4,-2.1 0, 0.0 3,-2.0 -0.330 68.1-110.5 -66.9 145.0 117.7 19.5 63.6 352 361 A E H 3> S+ 0 0 101 1,-0.3 4,-3.2 -87,-0.3 5,-0.2 0.846 115.2 57.0 -41.1 -54.5 121.5 19.8 64.1 353 362 A P H 3> S+ 0 0 59 0, 0.0 4,-1.2 0, 0.0 -1,-0.3 0.820 112.9 42.5 -51.5 -38.3 122.4 18.9 60.6 354 363 A I H <> S+ 0 0 18 -3,-2.0 4,-1.9 2,-0.2 5,-0.2 0.929 113.3 50.8 -77.1 -40.3 120.3 21.8 59.4 355 364 A R H X S+ 0 0 49 -4,-2.1 4,-2.8 1,-0.2 5,-0.2 0.906 108.2 55.5 -60.8 -40.7 121.5 24.2 62.1 356 365 A R H X S+ 0 0 152 -4,-3.2 4,-2.3 1,-0.2 -1,-0.2 0.911 107.5 46.5 -57.6 -56.1 125.1 23.4 61.3 357 366 A V H X S+ 0 0 27 -4,-1.2 4,-1.8 -5,-0.2 -1,-0.2 0.869 116.4 43.1 -59.2 -42.2 124.8 24.3 57.6 358 367 A L H X S+ 0 0 18 -4,-1.9 4,-3.2 2,-0.2 -1,-0.2 0.889 110.8 56.0 -72.0 -38.9 123.0 27.6 58.2 359 368 A W H X S+ 0 0 20 -4,-2.8 4,-2.9 -5,-0.2 5,-0.2 0.899 108.0 48.0 -61.5 -37.7 125.3 28.5 61.0 360 369 A E H X S+ 0 0 99 -4,-2.3 4,-2.4 2,-0.2 5,-0.2 0.913 111.9 51.0 -68.9 -39.8 128.3 28.1 58.8 361 370 A T H X S+ 0 0 65 -4,-1.8 4,-1.4 -5,-0.2 -2,-0.2 0.957 113.3 44.4 -62.1 -44.8 126.6 30.3 56.1 362 371 A I H X S+ 0 0 0 -4,-3.2 4,-2.4 2,-0.2 3,-0.5 0.979 115.2 48.0 -61.5 -52.5 125.8 33.0 58.7 363 372 A K H X S+ 0 0 84 -4,-2.9 4,-1.6 1,-0.2 -2,-0.2 0.939 111.9 49.3 -49.7 -56.6 129.4 32.9 60.2 364 373 A D H < S+ 0 0 124 -4,-2.4 -1,-0.2 -5,-0.2 -2,-0.2 0.800 112.1 47.3 -56.9 -35.3 131.1 33.0 56.8 365 374 A A H >< S+ 0 0 31 -4,-1.4 3,-1.1 -3,-0.5 -1,-0.2 0.902 111.7 49.0 -81.4 -38.0 129.0 35.9 55.6 366 375 A F H >< S+ 0 0 0 -4,-2.4 3,-1.6 1,-0.2 -2,-0.2 0.680 94.0 80.0 -72.4 -15.5 129.5 38.0 58.8 367 376 A S T 3< S+ 0 0 67 -4,-1.6 -1,-0.2 1,-0.3 -2,-0.2 0.608 72.9 76.1 -65.1 -13.2 133.2 37.2 58.5 368 377 A A T < S+ 0 0 62 -3,-1.1 -1,-0.3 -4,-0.2 -2,-0.1 0.548 80.5 82.9 -75.5 -8.3 133.7 40.0 55.9 369 378 A I S X S- 0 0 1 -3,-1.6 3,-1.5 -4,-0.0 -90,-0.0 -0.902 91.3-117.5 -97.6 119.5 133.4 42.5 58.7 370 379 A P T 3 S+ 0 0 99 0, 0.0 -2,-0.1 0, 0.0 -3,-0.0 -0.266 91.8 11.0 -60.2 139.1 136.8 43.0 60.5 371 380 A G T 3 S+ 0 0 53 1,-0.2 -98,-0.1 -4,-0.1 -4,-0.1 0.492 81.3 159.7 77.0 5.2 136.8 42.1 64.2 372 381 A V < - 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0 0 17 -4,-1.5 -1,-0.3 -5,-0.2 5,-0.1 -0.843 69.7 -97.6-177.8 144.9 93.5 11.5 28.0 866 323 B D > - 0 0 64 -2,-0.2 4,-0.5 -3,-0.1 3,-0.4 0.123 46.5 -99.1 -58.0 173.5 89.7 12.0 28.0 867 324 B K H >> S+ 0 0 11 92,-1.7 4,-2.1 91,-0.3 3,-1.5 0.897 121.4 63.9 -66.2 -35.8 87.2 9.5 29.5 868 325 B R H 34 S+ 0 0 197 91,-0.3 -1,-0.2 1,-0.3 5,-0.1 0.868 97.0 58.5 -55.8 -34.9 86.6 7.9 26.1 869 326 B S H 34 S+ 0 0 75 -3,-0.4 -1,-0.3 1,-0.2 -2,-0.2 0.694 115.1 34.0 -69.8 -19.2 90.2 6.8 26.1 870 327 B Y H << S- 0 0 44 -3,-1.5 2,-0.3 -4,-0.5 -1,-0.2 0.624 132.3 -4.5-109.1 -22.1 89.9 4.9 29.3 871 328 B S < - 0 0 24 -4,-2.1 -1,-0.4 2,-0.1 6,-0.0 -0.966 46.9-139.6-165.9 155.0 86.4 3.5 29.1 872 329 B S + 0 0 112 -2,-0.3 -4,-0.1 -3,-0.1 -3,-0.1 0.348 67.4 123.7-104.7 6.7 83.3 3.8 26.9 873 330 B R - 0 0 104 -6,-0.2 -2,-0.1 1,-0.1 4,-0.1 -0.225 50.7-160.2 -62.3 148.2 81.1 3.9 30.0 874 331 B T S S+ 0 0 130 2,-0.1 -1,-0.1 -7,-0.0 3,-0.1 0.583 74.8 67.1-104.9 -24.0 78.7 6.9 30.5 875 332 B E S S- 0 0 108 1,-0.2 120,-0.1 120,-0.1 3,-0.1 -0.356 106.1 -62.8 -88.7 171.9 78.4 6.3 34.3 876 333 B P - 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