==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=30-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE 31-JAN-06 2FVV . COMPND 2 MOLECULE: DIPHOSPHOINOSITOL POLYPHOSPHATE PHOSPHOHYDROLASE . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR B.M.HALLBERG,P.KURSULA,D.OGG,C.ARROWSMITH,H.BERGLUND, . 135 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 7765.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 91 67.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 10 7.4 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 32 23.7 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 1 0.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 1 0.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 1 0.7 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 . 8 5.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 10 7.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 27 20.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 2 1.5 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 0 2 0 1 0 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 0 0 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 PARALLEL BRIDGES PER LADDER . 2 1 1 0 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 ANTIPARALLEL BRIDGES PER LADDER . 0 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 LADDERS PER SHEET . # RESIDUE AA STRUCTURE BP1 BP2 ACC N-H-->O O-->H-N N-H-->O O-->H-N TCO KAPPA ALPHA PHI PSI X-CA Y-CA Z-CA 1 8 A Q 0 0 171 0, 0.0 2,-0.4 0, 0.0 45,-0.0 0.000 360.0 360.0 360.0 152.3 17.2 10.5 26.1 2 9 A T - 0 0 93 1,-0.1 2,-0.2 43,-0.0 0, 0.0 -0.668 360.0-129.4 -85.0 126.0 17.7 7.3 27.9 3 10 A R - 0 0 150 -2,-0.4 2,-0.3 44,-0.1 44,-0.1 -0.499 23.6-158.1 -77.0 146.5 16.9 4.1 26.0 4 11 A T - 0 0 21 8,-0.4 8,-2.7 42,-0.4 2,-0.3 -0.862 5.6-162.9-124.7 159.4 14.6 1.5 27.6 5 12 A Y B -A 11 0A 125 -2,-0.3 6,-0.2 6,-0.3 2,-0.1 -0.973 19.8-119.0-141.9 146.2 14.0 -2.1 27.0 6 13 A D > - 0 0 39 4,-2.7 3,-2.3 -2,-0.3 6,-0.0 -0.289 50.2 -91.9 -76.3 171.9 11.6 -4.9 27.7 7 14 A G T 3 S+ 0 0 95 1,-0.3 -1,-0.1 2,-0.1 -2,-0.0 0.734 126.5 58.0 -62.3 -20.6 12.7 -7.9 29.8 8 15 A D T 3 S- 0 0 78 2,-0.1 -1,-0.3 1,-0.0 -2,-0.0 0.333 121.1-105.0 -90.7 7.6 13.7 -9.7 26.6 9 16 A G S < S+ 0 0 35 -3,-2.3 2,-0.2 1,-0.3 -2,-0.1 0.474 72.9 141.3 90.0 -4.1 16.1 -7.0 25.6 10 17 A Y - 0 0 29 1,-0.1 -4,-2.7 74,-0.1 -1,-0.3 -0.533 58.2-109.9 -75.1 141.5 13.9 -5.5 22.8 11 18 A K E -Ab 5 84A 54 72,-3.1 74,-2.8 -6,-0.2 2,-0.5 -0.531 29.6-125.8 -70.0 132.8 14.0 -1.7 22.6 12 19 A K E + b 0 85A 35 -8,-2.7 34,-2.2 -2,-0.2 -8,-0.4 -0.749 40.7 165.3 -85.5 125.8 10.8 -0.0 23.7 13 20 A R E -Cb 45 86A 26 72,-2.2 74,-2.4 -2,-0.5 2,-0.3 -0.885 23.7-157.9-137.2 161.3 9.4 2.4 21.2 14 21 A A E +Cb 44 87A 0 30,-2.6 30,-2.7 -2,-0.3 2,-0.3 -0.987 13.4 175.3-140.2 150.3 6.2 4.2 20.3 15 22 A A E -Cb 43 88A 0 72,-2.7 74,-2.3 -2,-0.3 2,-0.4 -0.952 16.0-142.3-148.2 157.2 4.9 5.7 17.0 16 23 A C E - b 0 89A 1 26,-1.9 2,-0.9 -2,-0.3 74,-0.2 -0.997 14.4-138.0-131.0 140.5 1.8 7.4 15.7 17 24 A L E - b 0 90A 6 72,-2.8 74,-2.9 -2,-0.4 2,-0.9 -0.850 31.5-156.8 -84.0 102.9 -0.1 7.2 12.4 18 25 A C E - b 0 91A 0 -2,-0.9 10,-2.2 10,-0.5 2,-0.3 -0.818 10.9-166.2 -92.6 103.2 -0.7 10.9 12.1 19 26 A F E -Db 27 92A 9 72,-2.7 74,-2.8 -2,-0.9 8,-0.2 -0.658 25.7-134.7 -94.0 149.0 -3.8 11.4 9.9 20 27 A R S S- 0 0 116 6,-2.1 2,-0.3 -2,-0.3 -1,-0.1 0.801 86.2 -4.4 -70.1 -27.7 -4.8 14.6 8.3 21 28 A S S > S- 0 0 52 5,-0.4 3,-2.3 71,-0.0 5,-0.2 -0.946 84.5 -85.3-153.2 176.5 -8.4 14.0 9.3 22 29 A E T 3 S+ 0 0 163 1,-0.3 -2,-0.0 -2,-0.3 70,-0.0 0.679 116.5 72.6 -63.4 -15.8 -10.8 11.5 10.8 23 30 A S T 3 S- 0 0 64 1,-0.1 -1,-0.3 3,-0.0 -3,-0.0 0.697 93.5-143.3 -77.7 -8.6 -11.2 9.8 7.4 24 31 A E < + 0 0 81 -3,-2.3 -2,-0.1 2,-0.1 91,-0.1 0.825 58.7 128.8 55.7 39.7 -7.6 8.4 7.8 25 32 A E + 0 0 130 1,-0.2 90,-1.6 -4,-0.1 2,-0.4 0.739 65.0 39.3 -95.0 -24.9 -6.8 8.9 4.1 26 33 A E E - E 0 114A 54 88,-0.2 -6,-2.1 -5,-0.2 -5,-0.4 -0.988 68.3-166.9-129.6 137.2 -3.5 10.9 4.3 27 34 A V E -DE 19 113A 2 86,-2.7 86,-2.5 -2,-0.4 2,-0.6 -0.915 21.5-119.8-127.3 150.8 -0.7 10.2 6.9 28 35 A L E - E 0 112A 3 -10,-2.2 -10,-0.5 -2,-0.3 2,-0.3 -0.798 29.3-176.3 -96.1 118.9 2.3 12.3 7.9 29 36 A L E - E 0 111A 0 82,-2.5 82,-2.1 -2,-0.6 2,-0.3 -0.738 10.0-150.5-104.3 158.1 5.7 10.7 7.3 30 37 A V E -FE 40 110A 0 10,-2.6 10,-2.8 -2,-0.3 80,-0.2 -0.886 23.4 -99.5-124.7 159.2 9.1 12.3 8.4 31 38 A S E -F 39 0A 3 78,-2.2 8,-0.2 -2,-0.3 2,-0.2 -0.463 39.7-104.9 -77.8 152.6 12.5 11.9 6.9 32 39 A S - 0 0 19 6,-2.3 6,-0.2 3,-0.7 -1,-0.1 -0.512 22.0-138.5 -72.3 139.5 15.2 9.7 8.5 33 40 A S S S+ 0 0 61 1,-0.2 -1,-0.1 -2,-0.2 -2,-0.0 0.955 101.7 34.4 -63.2 -51.2 17.9 11.4 10.4 34 41 A R S S+ 0 0 212 1,-0.3 -1,-0.2 2,-0.1 -2,-0.1 0.841 132.2 33.0 -79.6 -20.0 20.8 9.4 9.2 35 42 A H > - 0 0 79 1,-0.1 3,-2.4 3,-0.1 -3,-0.7 -0.701 67.4-178.4-132.8 83.3 19.3 9.0 5.8 36 43 A P T 3 S+ 0 0 94 0, 0.0 73,-0.1 0, 0.0 -1,-0.1 0.592 76.9 68.6 -65.2 -11.3 17.3 12.0 4.8 37 44 A D T 3 S+ 0 0 130 -6,-0.1 2,-0.3 2,-0.0 -6,-0.0 0.447 92.6 75.8 -82.1 -2.4 16.2 10.6 1.4 38 45 A R S < S- 0 0 70 -3,-2.4 -6,-2.3 -6,-0.2 2,-0.3 -0.793 72.6-137.7-108.4 153.9 14.1 8.0 3.2 39 46 A W E +F 31 0A 52 82,-0.3 2,-0.3 -2,-0.3 -8,-0.2 -0.849 22.4 175.4-107.6 147.6 10.7 8.3 4.9 40 47 A I E -F 30 0A 24 -10,-2.8 -10,-2.6 -2,-0.3 82,-0.0 -0.933 39.1 -97.9-139.6 163.5 9.7 6.7 8.2 41 48 A V - 0 0 0 -2,-0.3 -12,-0.1 -12,-0.2 -24,-0.1 -0.683 52.9-106.8 -79.2 130.7 6.7 6.8 10.5 42 49 A P S S+ 0 0 0 0, 0.0 -26,-1.9 0, 0.0 2,-0.3 -0.291 72.1 101.0 -65.0 139.1 7.4 9.3 13.3 43 50 A G E +C 15 0A 3 16,-0.3 2,-0.3 -28,-0.2 -28,-0.3 -0.973 34.4 173.7 168.4-179.2 8.2 7.7 16.7 44 51 A G E -C 14 0A 10 -30,-2.7 -30,-2.6 -2,-0.3 15,-0.1 -0.991 40.4 -22.5 172.5-165.9 11.0 6.8 18.9 45 52 A G E -C 13 0A 31 -2,-0.3 2,-0.3 -32,-0.2 -32,-0.3 -0.313 51.5-124.6 -71.6 146.3 12.2 5.4 22.2 46 53 A M - 0 0 8 -34,-2.2 -42,-0.4 -42,-0.2 -34,-0.2 -0.686 27.4-130.5 -78.8 138.3 10.1 5.4 25.4 47 54 A E > - 0 0 46 -2,-0.3 3,-2.3 1,-0.2 -44,-0.1 -0.395 45.3 -66.5 -83.5 166.5 11.8 7.1 28.3 48 55 A P T 3 S- 0 0 73 0, 0.0 -1,-0.2 0, 0.0 3,-0.1 -0.298 121.0 -2.0 -54.4 131.3 12.0 5.4 31.7 49 56 A E T 3 S+ 0 0 206 1,-0.2 2,-0.4 -3,-0.1 -2,-0.0 0.549 97.7 143.7 67.9 10.1 8.6 5.0 33.3 50 57 A E < - 0 0 29 -3,-2.3 -1,-0.2 1,-0.1 -4,-0.0 -0.665 53.7-121.4 -86.0 131.5 7.0 6.8 30.4 51 58 A E >> - 0 0 131 -2,-0.4 4,-2.4 1,-0.1 3,-0.5 -0.373 21.9-123.3 -66.1 143.9 3.5 5.6 29.2 52 59 A P H 3> S+ 0 0 16 0, 0.0 4,-2.4 0, 0.0 5,-0.1 0.853 110.7 52.9 -60.2 -36.5 3.6 4.5 25.6 53 60 A S H 3> S+ 0 0 34 2,-0.2 4,-1.7 1,-0.2 5,-0.1 0.829 111.2 48.3 -69.2 -31.4 0.8 6.9 24.5 54 61 A V H <> S+ 0 0 80 -3,-0.5 4,-2.4 2,-0.2 -1,-0.2 0.884 111.4 49.5 -68.0 -44.8 2.8 9.8 26.1 55 62 A A H X S+ 0 0 0 -4,-2.4 4,-2.8 2,-0.2 5,-0.2 0.921 110.1 51.7 -57.9 -45.6 5.9 8.7 24.4 56 63 A A H X S+ 0 0 0 -4,-2.4 4,-2.2 -5,-0.2 -2,-0.2 0.944 112.5 43.8 -62.3 -48.3 4.1 8.5 21.0 57 64 A V H X S+ 0 0 64 -4,-1.7 4,-2.0 2,-0.2 -1,-0.2 0.886 113.7 51.5 -63.9 -38.0 2.7 12.0 21.3 58 65 A R H X S+ 0 0 55 -4,-2.4 4,-2.6 2,-0.2 5,-0.2 0.930 111.0 47.5 -64.5 -46.4 6.0 13.4 22.5 59 66 A E H X S+ 0 0 16 -4,-2.8 4,-3.2 1,-0.2 5,-0.4 0.893 109.8 52.6 -66.6 -36.6 7.9 11.8 19.6 60 67 A V H X>S+ 0 0 2 -4,-2.2 4,-2.3 -5,-0.2 5,-0.9 0.900 110.9 48.3 -65.4 -38.3 5.4 13.1 17.0 61 68 A C H X5S+ 0 0 37 -4,-2.0 4,-1.3 3,-0.2 40,-0.3 0.960 117.3 41.3 -64.9 -45.3 5.8 16.6 18.4 62 69 A E H <5S+ 0 0 42 -4,-2.6 40,-2.2 1,-0.2 41,-0.2 0.916 126.6 30.8 -70.6 -42.5 9.5 16.5 18.3 63 70 A E H <5S+ 0 0 18 -4,-3.2 -3,-0.2 -5,-0.2 -2,-0.2 0.883 133.7 23.4 -87.6 -34.9 9.9 14.7 15.0 64 71 A A H <5S- 0 0 0 -4,-2.3 -3,-0.2 -5,-0.4 -2,-0.2 0.537 89.1-129.4-113.7 -12.1 6.9 15.9 13.0 65 72 A G << + 0 0 0 -4,-1.3 32,-3.0 -5,-0.9 2,-0.3 0.818 65.6 118.7 68.5 31.8 5.9 19.2 14.5 66 73 A V E -G 96 0A 2 -6,-0.8 2,-0.3 30,-0.2 -1,-0.2 -0.910 41.1-169.0-131.2 157.0 2.2 18.3 14.9 67 74 A K E +G 95 0A 85 28,-2.1 27,-2.4 -2,-0.3 28,-2.2 -0.922 24.0 132.1-133.3 159.1 -0.3 17.9 17.7 68 75 A G E -G 93 0A 31 -2,-0.3 2,-0.6 25,-0.3 25,-0.2 -0.927 55.8 -42.4-175.0-156.8 -3.8 16.4 17.7 69 76 A T E -G 92 0A 87 23,-2.3 23,-2.4 -2,-0.3 2,-0.2 -0.809 53.3-132.4-101.4 115.1 -6.3 14.1 19.2 70 77 A L E -G 91 0A 66 -2,-0.6 21,-0.2 21,-0.2 2,-0.1 -0.527 30.9-177.8 -70.1 132.0 -4.9 10.8 20.3 71 78 A G E - 0 0 34 19,-3.6 -1,-0.1 1,-0.3 20,-0.0 -0.080 33.8 -28.2-111.5-146.5 -6.9 7.9 19.1 72 79 A R E - 0 0 139 17,-0.1 18,-2.4 1,-0.1 2,-0.6 -0.162 55.5-108.7 -74.4 155.5 -6.8 4.2 19.5 73 80 A L E -G 89 0A 69 16,-0.2 16,-0.3 1,-0.2 -1,-0.1 -0.760 27.0-164.1 -71.2 122.3 -3.8 1.8 20.0 74 81 A V E - 0 0 24 14,-3.0 2,-0.3 -2,-0.6 15,-0.2 0.893 53.8 -73.5 -75.8 -43.4 -3.5 -0.0 16.6 75 82 A G E -G 88 0A 20 13,-1.2 13,-2.5 -3,-0.1 2,-0.5 -0.969 42.4 -82.0 167.9 179.0 -1.3 -2.7 18.1 76 83 A I E -G 87 0A 83 -2,-0.3 2,-0.5 11,-0.2 11,-0.2 -0.989 43.7-163.9-114.5 119.2 2.2 -3.6 19.4 77 84 A F E -G 86 0A 27 9,-2.8 9,-2.8 -2,-0.5 2,-0.4 -0.933 5.0-153.8-114.0 126.1 4.6 -4.5 16.5 78 85 A E E -G 85 0A 98 -2,-0.5 2,-0.7 7,-0.2 7,-0.2 -0.738 6.1-155.0 -94.3 141.1 7.9 -6.3 17.0 79 86 A N E >> -G 84 0A 25 5,-2.7 5,-1.7 -2,-0.4 4,-1.4 -0.938 12.2-173.0-106.2 104.7 10.8 -5.8 14.6 80 87 A Q T 45S+ 0 0 157 -2,-0.7 -1,-0.1 1,-0.2 5,-0.0 0.894 80.0 54.4 -67.6 -36.4 12.6 -9.1 15.1 81 88 A E T 45S+ 0 0 157 1,-0.2 -1,-0.2 -3,-0.1 -2,-0.0 0.917 121.7 27.8 -69.9 -39.6 15.6 -8.1 13.0 82 89 A R T 45S- 0 0 163 2,-0.1 -1,-0.2 -71,-0.0 -71,-0.2 0.432 105.7-121.2-102.1 -1.9 16.3 -4.9 14.9 83 90 A K T <5 + 0 0 95 -4,-1.4 -72,-3.1 1,-0.2 2,-0.4 0.958 59.7 147.1 61.6 55.9 14.9 -6.1 18.3 84 91 A H E < -bG 11 79A 25 -5,-1.7 -5,-2.7 -74,-0.3 2,-0.4 -0.929 35.6-164.9-113.9 146.3 12.3 -3.3 18.6 85 92 A R E -bG 12 78A 34 -74,-2.8 -72,-2.2 -2,-0.4 2,-0.5 -0.951 20.8-172.9-129.7 110.6 8.9 -3.5 20.2 86 93 A T E -bG 13 77A 3 -9,-2.8 -9,-2.8 -2,-0.4 2,-0.5 -0.899 22.3-146.4-115.4 128.0 6.7 -0.5 19.2 87 94 A Y E -bG 14 76A 57 -74,-2.4 -72,-2.7 -2,-0.5 2,-0.5 -0.801 23.0-157.4 -82.0 127.6 3.3 0.7 20.4 88 95 A V E +bG 15 75A 0 -13,-2.5 -14,-3.0 -2,-0.5 -13,-1.2 -0.959 13.5 179.8-116.0 122.7 1.5 2.2 17.4 89 96 A Y E -bG 16 73A 22 -74,-2.3 -72,-2.8 -2,-0.5 2,-0.4 -0.793 27.6-119.7-114.9 157.3 -1.3 4.8 17.9 90 97 A V E -b 17 0A 5 -18,-2.4 -19,-3.6 -2,-0.3 2,-0.4 -0.790 27.8-172.5 -87.5 141.9 -3.6 6.8 15.7 91 98 A L E -bG 18 70A 4 -74,-2.9 -72,-2.7 -2,-0.4 2,-0.7 -0.991 16.6-147.2-129.3 131.2 -3.4 10.5 16.0 92 99 A I E -bG 19 69A 22 -23,-2.4 -23,-2.3 -2,-0.4 2,-0.2 -0.876 28.4-129.6 -97.6 114.8 -5.8 12.9 14.2 93 100 A V E + G 0 68A 14 -74,-2.8 -25,-0.3 -2,-0.7 3,-0.1 -0.444 42.3 157.1 -68.9 128.5 -3.7 16.0 13.5 94 101 A T E + 0 0 89 -27,-2.4 2,-0.4 1,-0.3 -26,-0.2 0.477 65.1 45.2-123.4 -7.1 -5.3 19.3 14.5 95 102 A E E - G 0 67A 115 -28,-2.2 -28,-2.1 2,-0.0 2,-0.6 -0.987 58.5-169.2-140.2 124.8 -2.3 21.6 14.9 96 103 A V E - G 0 66A 64 -2,-0.4 2,-0.3 -30,-0.2 -30,-0.2 -0.968 15.3-157.3-115.3 112.3 0.7 21.9 12.3 97 104 A L - 0 0 72 -32,-3.0 3,-0.3 -2,-0.6 -2,-0.0 -0.697 8.5-147.6 -90.9 143.3 3.5 23.9 13.7 98 105 A E S S+ 0 0 119 -2,-0.3 2,-0.2 1,-0.2 -1,-0.1 0.789 85.2 34.1 -91.7 -20.3 6.0 25.5 11.4 99 106 A D S S+ 0 0 135 -34,-0.1 -1,-0.2 4,-0.1 -34,-0.1 -0.284 77.9 169.0-133.6 74.2 9.3 25.5 13.3 100 107 A W >> - 0 0 29 -3,-0.3 4,-2.6 -2,-0.2 3,-0.5 -0.091 47.2 -92.2 -87.1 169.0 9.5 22.3 15.4 101 108 A E H 3> S+ 0 0 99 -40,-0.3 4,-2.7 1,-0.3 5,-0.2 0.859 120.9 39.8 -54.4 -53.4 12.4 20.7 17.3 102 109 A D H 3> S+ 0 0 5 -40,-2.2 6,-2.0 -41,-0.2 4,-1.9 0.742 113.7 55.3 -74.2 -22.4 13.8 18.3 14.7 103 110 A S H <> S+ 0 0 37 -3,-0.5 4,-1.6 4,-0.3 -2,-0.2 0.950 116.7 36.5 -67.0 -51.2 13.3 20.8 11.9 104 111 A V H < S+ 0 0 99 -4,-2.6 -2,-0.2 2,-0.2 -3,-0.2 0.909 124.4 41.9 -66.3 -39.1 15.3 23.4 13.7 105 112 A N H < S+ 0 0 111 -4,-2.7 -3,-0.2 -5,-0.3 -2,-0.2 0.974 136.5 1.9 -80.2 -49.3 17.8 21.0 15.2 106 113 A I H < S- 0 0 92 -4,-1.9 -3,-0.2 -5,-0.2 -2,-0.2 0.340 92.9-107.5-126.7 11.4 18.5 18.6 12.3 107 114 A G < + 0 0 36 -4,-1.6 -4,-0.3 -5,-0.4 -3,-0.1 0.761 52.2 176.5 69.6 24.1 16.6 19.7 9.2 108 115 A R - 0 0 18 -6,-2.0 2,-0.2 -7,-0.1 -1,-0.2 -0.432 15.9-146.9 -60.9 141.3 14.1 16.8 9.5 109 116 A K - 0 0 130 -73,-0.1 -78,-2.2 -2,-0.1 2,-0.3 -0.662 10.1-160.0-105.2 160.7 11.4 17.0 6.8 110 117 A R E +E 30 0A 50 -80,-0.2 2,-0.3 -2,-0.2 -80,-0.2 -0.967 11.2 175.0-138.0 152.7 7.7 16.0 6.9 111 118 A E E -E 29 0A 99 -82,-2.1 -82,-2.5 -2,-0.3 2,-0.3 -0.963 29.2-117.0-158.0 144.0 5.2 15.2 4.1 112 119 A W E -E 28 0A 67 -2,-0.3 2,-0.4 -84,-0.2 -84,-0.2 -0.659 32.5-173.9 -81.1 136.7 1.6 14.0 3.7 113 120 A F E -E 27 0A 20 -86,-2.5 -86,-2.7 -2,-0.3 2,-0.1 -0.993 30.1-117.3-130.9 137.4 1.1 10.7 1.9 114 121 A K E >> -E 26 0A 133 -2,-0.4 4,-2.2 -88,-0.2 3,-0.7 -0.477 44.0-109.3 -58.6 146.9 -2.0 8.8 0.8 115 122 A I H 3> S+ 0 0 41 -90,-1.6 4,-2.5 1,-0.3 5,-0.2 0.879 118.2 55.7 -48.9 -46.7 -2.0 5.6 2.7 116 123 A E H 3> S+ 0 0 123 1,-0.2 4,-2.0 2,-0.2 -1,-0.3 0.882 111.2 44.2 -51.4 -44.1 -1.2 3.5 -0.4 117 124 A D H <> S+ 0 0 47 -3,-0.7 4,-2.4 2,-0.2 -1,-0.2 0.856 108.4 55.9 -77.5 -31.1 1.9 5.7 -1.1 118 125 A A H X S+ 0 0 0 -4,-2.2 4,-2.0 2,-0.2 5,-0.2 0.936 108.3 49.9 -62.2 -47.1 3.1 5.7 2.5 119 126 A I H X S+ 0 0 51 -4,-2.5 4,-1.4 -5,-0.2 -2,-0.2 0.959 110.4 52.0 -54.0 -48.0 3.1 1.9 2.4 120 127 A K H < S+ 0 0 129 -4,-2.0 4,-0.5 1,-0.2 3,-0.5 0.926 111.3 43.3 -57.7 -47.3 5.1 2.0 -0.8 121 128 A V H < S+ 0 0 64 -4,-2.4 4,-0.3 1,-0.2 -82,-0.3 0.773 115.1 50.2 -80.2 -15.6 7.8 4.3 0.4 122 129 A L H X S+ 0 0 1 -4,-2.0 4,-2.5 -3,-0.2 8,-0.3 0.702 90.8 82.1 -84.3 -19.3 8.2 2.4 3.7 123 130 A Q T < S+ 0 0 100 -4,-1.4 -1,-0.2 -3,-0.5 -2,-0.1 0.848 85.4 51.6 -63.5 -38.5 8.5 -1.1 2.3 124 131 A Y T 4 S+ 0 0 200 -4,-0.5 -1,-0.2 -3,-0.2 -2,-0.1 0.943 130.6 9.1 -72.4 -45.0 12.1 -1.3 1.3 125 132 A H T 4 S+ 0 0 90 -4,-0.3 -2,-0.2 1,-0.2 -1,-0.2 0.659 137.0 39.0-103.6 -23.8 13.8 -0.2 4.6 126 133 A K X + 0 0 53 -4,-2.5 4,-2.6 1,-0.1 3,-0.2 -0.438 59.8 152.0-126.4 53.6 10.8 -0.2 7.0 127 134 A P H > S+ 0 0 61 0, 0.0 4,-1.8 0, 0.0 -1,-0.1 0.846 76.5 55.0 -60.1 -30.0 8.7 -3.2 6.1 128 135 A V H > S+ 0 0 36 2,-0.2 4,-0.7 1,-0.2 -2,-0.1 0.915 108.4 48.9 -71.2 -34.1 7.4 -3.5 9.7 129 136 A Q H >> S+ 0 0 4 -3,-0.2 3,-1.1 1,-0.2 4,-0.5 0.906 106.6 55.4 -67.8 -37.7 6.3 0.1 9.6 130 137 A A H >< S+ 0 0 5 -4,-2.6 3,-1.6 -8,-0.3 -1,-0.2 0.934 103.6 57.0 -57.5 -37.7 4.5 -0.6 6.3 131 138 A S H >< S+ 0 0 32 -4,-1.8 3,-1.4 1,-0.3 4,-0.4 0.697 86.7 78.3 -68.4 -15.6 2.7 -3.4 8.2 132 139 A Y H << S+ 0 0 7 -3,-1.1 3,-0.4 -4,-0.7 -1,-0.3 0.831 97.0 46.9 -57.3 -28.3 1.4 -0.8 10.7 133 140 A F T << S+ 0 0 18 -3,-1.6 -1,-0.3 -4,-0.5 -2,-0.2 0.489 82.1 98.3 -92.6 -1.9 -1.1 0.2 8.0 134 141 A E < 0 0 133 -3,-1.4 -1,-0.2 -4,-0.2 -2,-0.1 0.853 360.0 360.0 -62.7 -35.4 -2.3 -3.3 7.1 135 142 A T 0 0 126 -4,-0.4 -61,-0.0 -3,-0.4 0, 0.0 -0.285 360.0 360.0 -79.1 360.0 -5.4 -3.2 9.2