==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=4-JAN-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE 03-AUG-07 2QU3 . COMPND 2 MOLECULE: BETA-SECRETASE 1; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR R.CHOPRA . 368 4 3 0 3 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 16082.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 255 69.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 18 4.9 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 112 30.4 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 4 1.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 1 0.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 2 0.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-3), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-2), SAME NUMBER PER 100 RESIDUES . 1 0.3 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 . 49 13.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 37 10.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 28 7.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 4 1.1 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 4 0 0 0 1 0 0 0 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 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 . 1 6 2 2 2 5 0 1 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 1 0 2 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 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 61 A F >> 0 0 103 0, 0.0 3,-1.9 0, 0.0 4,-0.8 0.000 360.0 360.0 360.0 -19.5 14.3 -3.9 -10.3 2 62 A V G >4 + 0 0 117 1,-0.3 3,-1.0 2,-0.2 175,-0.0 0.884 360.0 58.5 -52.7 -38.3 11.0 -2.5 -11.5 3 63 A E G 34 S+ 0 0 151 1,-0.2 -1,-0.3 89,-0.0 0, 0.0 0.721 105.0 51.3 -64.5 -21.8 9.5 -5.7 -10.3 4 64 A M G X4 S+ 0 0 14 -3,-1.9 3,-1.7 2,-0.1 167,-0.7 0.584 78.9 113.8 -94.9 -9.8 10.8 -4.9 -6.8 5 65 A V T << S+ 0 0 61 -3,-1.0 165,-0.1 -4,-0.8 -3,-0.0 -0.378 90.1 6.5 -63.0 138.8 9.5 -1.4 -6.4 6 66 A D T 3 S+ 0 0 81 149,-0.1 -1,-0.3 1,-0.1 164,-0.2 0.697 83.9 137.1 61.3 22.9 6.8 -1.1 -3.7 7 67 A N < + 0 0 17 -3,-1.7 12,-0.6 84,-0.1 2,-0.3 0.427 53.6 82.0 -79.0 6.4 7.4 -4.7 -2.6 8 68 A L E +AB 18 169A 0 161,-2.5 161,-1.3 10,-0.1 2,-0.3 -0.856 51.3 164.0-115.1 148.4 7.3 -3.6 1.0 9 69 A R E +AB 17 168A 99 8,-2.2 8,-4.1 -2,-0.3 2,-0.3 -0.965 4.9 141.8-151.6 164.2 4.3 -2.8 3.3 10 70 A G E -AB 16 167A 3 157,-1.3 157,-2.7 -2,-0.3 2,-0.4 -0.965 47.0 -95.5 177.3-179.4 3.6 -2.4 7.0 11 71 A K E > - B 0 166A 52 4,-0.6 3,-3.1 -2,-0.3 4,-0.3 -0.975 61.0 -85.2-118.1 133.9 1.5 -0.4 9.5 12 72 A S T 3 S+ 0 0 10 153,-3.7 217,-0.0 -2,-0.4 153,-0.0 -0.071 115.3 8.8 -43.1 127.6 3.3 2.6 11.0 13 73 A G T 3 S+ 0 0 31 1,-0.1 -1,-0.3 216,-0.1 216,-0.2 0.433 112.5 84.0 80.9 -1.2 5.4 1.6 14.0 14 74 A Q S < S- 0 0 29 -3,-3.1 -2,-0.2 1,-0.2 98,-0.1 0.243 96.8-109.7-116.5 12.5 4.9 -2.2 13.3 15 75 A G - 0 0 15 -4,-0.3 -4,-0.6 -5,-0.1 2,-0.4 0.147 29.3 -77.2 84.2 162.6 7.7 -2.5 10.8 16 76 A Y E -A 10 0A 7 210,-0.4 17,-3.0 17,-0.3 2,-0.3 -0.799 43.9-169.7-100.1 141.2 8.0 -3.1 7.1 17 77 A Y E -AC 9 32A 30 -8,-4.1 -8,-2.2 -2,-0.4 2,-0.3 -0.939 12.7-154.0-132.4 153.2 7.5 -6.6 5.6 18 78 A V E -AC 8 31A 2 13,-2.3 13,-3.0 -2,-0.3 2,-0.3 -0.904 32.1-107.1-119.9 149.8 8.0 -8.2 2.2 19 79 A E E + C 0 30A 66 -12,-0.6 72,-0.4 -2,-0.3 2,-0.3 -0.595 44.8 171.1 -77.8 137.9 6.1 -11.2 0.9 20 80 A M E - C 0 29A 0 9,-3.3 9,-3.2 -2,-0.3 2,-0.4 -0.920 23.0-141.1-140.3 164.1 8.0 -14.4 0.9 21 81 A T E -DC 88 28A 17 67,-2.3 67,-2.1 -2,-0.3 2,-0.4 -0.975 13.9-168.9-128.9 143.6 7.2 -18.1 0.3 22 82 A V E > +DC 87 27A 0 5,-1.8 5,-1.9 -2,-0.4 65,-0.2 -0.989 46.7 3.2-132.5 142.4 8.7 -21.0 2.1 23 83 A G T 5S- 0 0 7 63,-2.2 4,-0.1 -2,-0.4 36,-0.1 -0.130 90.2 -43.3 83.6-178.7 8.4 -24.7 1.3 24 84 A S T 5S+ 0 0 29 2,-0.1 36,-2.5 -3,-0.0 37,-0.3 -0.978 128.5 33.7-138.3 118.0 6.9 -26.8 -1.5 25 85 A P T 5S- 0 0 98 0, 0.0 2,-0.2 0, 0.0 -3,-0.1 0.628 121.2 -96.8 -63.0 168.6 4.2 -26.0 -2.5 26 86 A P T 5 - 0 0 92 0, 0.0 2,-0.7 0, 0.0 -3,-0.2 -0.389 34.3-154.0 -62.3 123.1 5.0 -22.3 -1.8 27 87 A Q E < -C 22 0A 27 -5,-1.9 -5,-1.8 -2,-0.2 2,-0.3 -0.903 16.6-137.2-102.6 113.4 3.7 -21.2 1.6 28 88 A T E +C 21 0A 58 -2,-0.7 2,-0.3 -7,-0.2 -7,-0.2 -0.529 32.9 163.0 -74.0 130.6 3.0 -17.4 1.4 29 89 A L E -C 20 0A 3 -9,-3.2 -9,-3.3 -2,-0.3 2,-0.5 -0.991 37.2-124.9-147.3 151.0 4.1 -15.4 4.4 30 90 A N E -C 19 0A 13 -2,-0.3 88,-3.3 -11,-0.2 89,-0.9 -0.870 32.0-162.1 -98.5 125.9 4.8 -11.7 5.2 31 91 A I E -Ce 18 119A 0 -13,-3.0 -13,-2.3 -2,-0.5 89,-0.2 -0.930 19.2-122.3-120.5 127.6 8.2 -11.2 6.6 32 92 A L E -Ce 17 120A 15 87,-3.2 89,-3.3 -2,-0.5 2,-0.9 -0.393 25.1-133.8 -61.9 127.6 9.6 -8.3 8.6 33 93 A V E + e 0 121A 2 -17,-3.0 2,-0.5 87,-0.2 -17,-0.3 -0.776 33.9 177.7 -87.2 108.5 12.6 -6.8 6.8 34 94 A D E > + e 0 122A 15 87,-2.3 89,-2.6 -2,-0.9 3,-1.1 -0.888 27.9 175.8-123.4 105.5 15.1 -6.4 9.7 35 95 A T T 3 S+ 0 0 0 -2,-0.5 161,-0.6 1,-0.2 189,-0.2 0.454 81.9 70.2 -81.7 2.4 18.6 -5.1 9.1 36 96 A G T 3 S+ 0 0 12 159,-0.1 2,-0.3 88,-0.1 -1,-0.2 0.340 101.8 37.5-100.3 5.0 19.0 -5.3 12.9 37 97 A S < - 0 0 29 -3,-1.1 87,-3.5 84,-0.2 92,-0.1 -0.923 63.5-143.5-146.5 171.0 19.1 -9.0 13.2 38 98 A S + 0 0 2 90,-0.4 2,-0.3 -2,-0.3 100,-0.3 0.299 61.8 96.6-126.3 11.2 20.4 -12.0 11.3 39 99 A N - 0 0 13 98,-0.1 83,-2.4 89,-0.1 2,-1.0 -0.794 60.7-141.1-106.3 148.1 17.9 -14.9 11.5 40 100 A F E +F 121 0A 8 -2,-0.3 62,-2.8 81,-0.2 2,-0.4 -0.904 41.0 169.4-100.6 100.7 15.2 -15.9 9.1 41 101 A A E +Fg 120 102A 0 79,-2.2 79,-4.0 -2,-1.0 2,-0.4 -0.971 11.8 178.9-121.8 132.0 12.6 -16.8 11.7 42 102 A V E -Fg 119 103A 0 60,-2.2 62,-2.5 -2,-0.4 77,-0.3 -0.985 38.4-102.2-133.7 140.8 9.0 -17.5 11.0 43 103 A G E + g 0 104A 0 75,-3.1 11,-2.7 -2,-0.4 62,-0.2 -0.344 38.8 175.2 -55.6 139.0 6.1 -18.5 13.2 44 104 A A + 0 0 7 60,-3.0 12,-0.2 9,-0.2 -1,-0.1 0.040 59.4 49.0-137.4 24.3 5.7 -22.2 12.7 45 105 A A S S- 0 0 23 59,-0.3 -1,-0.1 7,-0.1 9,-0.1 -0.968 99.0 -76.2-158.7 151.4 2.9 -22.9 15.3 46 106 A P + 0 0 97 0, 0.0 -2,-0.1 0, 0.0 5,-0.1 -0.103 50.8 172.6 -51.1 150.8 -0.4 -21.3 16.1 47 107 A H > - 0 0 41 3,-0.4 3,-1.6 -4,-0.1 5,-0.1 -0.941 43.5-114.6-160.4 142.4 -0.3 -18.0 17.9 48 108 A P T 3 S+ 0 0 111 0, 0.0 -1,-0.0 0, 0.0 0, 0.0 0.754 118.0 43.2 -50.5 -29.8 -3.1 -15.5 18.8 49 109 A F T 3 S+ 0 0 90 64,-0.1 2,-0.5 -3,-0.0 65,-0.3 0.548 98.0 88.0 -96.7 -7.7 -1.5 -12.8 16.6 50 110 A L < - 0 0 18 -3,-1.6 -3,-0.4 1,-0.1 3,-0.1 -0.799 44.8-179.5 -95.9 128.1 -0.7 -15.1 13.7 51 111 A H S S+ 0 0 178 -2,-0.5 2,-0.3 1,-0.3 -1,-0.1 0.523 81.1 10.4 -96.7 -10.6 -3.4 -15.6 11.0 52 112 A R - 0 0 78 -7,-0.1 -1,-0.3 -5,-0.1 2,-0.3 -0.971 69.5-178.5-160.8 155.4 -1.1 -18.0 9.2 53 113 A Y - 0 0 64 -2,-0.3 2,-0.3 -3,-0.1 -9,-0.2 -0.956 38.9 -76.7-153.5 168.4 2.2 -19.7 9.9 54 114 A Y - 0 0 1 -11,-2.7 2,-0.7 -2,-0.3 -31,-0.1 -0.568 37.0-162.0 -74.3 125.9 4.9 -22.0 8.4 55 115 A Q > - 0 0 63 -2,-0.3 3,-1.3 1,-0.2 4,-0.2 -0.878 7.0-172.4-114.6 97.0 3.8 -25.6 8.3 56 116 A R G > S+ 0 0 42 -2,-0.7 3,-2.2 1,-0.3 6,-0.3 0.858 82.6 63.5 -54.4 -40.5 6.8 -27.8 7.9 57 117 A Q G 3 S+ 0 0 134 1,-0.3 -1,-0.3 3,-0.0 -2,-0.0 0.768 101.0 53.8 -57.9 -27.2 4.7 -31.0 7.5 58 118 A L G < S+ 0 0 88 -3,-1.3 2,-0.6 2,-0.0 -1,-0.3 0.459 92.0 88.1 -86.5 -3.9 3.2 -29.5 4.3 59 119 A S X - 0 0 10 -3,-2.2 3,-0.9 -4,-0.2 -36,-0.1 -0.880 55.0-168.1-103.2 118.9 6.6 -28.8 2.7 60 120 A S T 3 S+ 0 0 103 -36,-2.5 -1,-0.1 -2,-0.6 -3,-0.0 0.642 91.7 50.5 -74.9 -16.0 8.1 -31.6 0.7 61 121 A T T 3 S+ 0 0 31 -37,-0.3 -1,-0.2 -36,-0.1 2,-0.1 0.338 80.7 121.5-104.8 5.7 11.4 -29.8 0.6 62 122 A Y < - 0 0 48 -3,-0.9 2,-0.4 -6,-0.3 23,-0.2 -0.437 40.5-170.5 -68.4 141.0 11.7 -29.2 4.4 63 123 A R E -H 84 0A 151 21,-2.4 21,-2.5 -2,-0.1 2,-0.1 -0.974 17.7-133.7-137.6 119.7 14.8 -30.7 6.0 64 124 A D E -H 83 0A 77 -2,-0.4 19,-0.3 19,-0.2 18,-0.0 -0.419 7.1-159.8 -71.3 145.9 15.1 -30.7 9.8 65 125 A L E - 0 0 63 17,-2.3 18,-0.2 2,-0.2 -1,-0.1 0.432 31.6-133.5-102.4 -1.3 18.4 -29.6 11.2 66 126 A R E + 0 0 192 16,-0.5 2,-0.2 1,-0.2 17,-0.1 0.964 68.7 107.7 43.2 79.1 17.6 -31.4 14.5 67 127 A K E - 0 0 129 15,-0.3 15,-3.9 2,-0.0 -2,-0.2 -0.785 57.2-139.8 178.2 130.6 18.7 -28.4 16.5 68 128 A G E -H 81 0A 49 13,-0.2 2,-0.4 -2,-0.2 13,-0.2 -0.496 4.9-154.8-100.8 170.7 16.9 -25.9 18.6 69 129 A V E -H 80 0A 6 11,-2.5 11,-3.0 -2,-0.2 2,-0.4 -0.993 4.8-168.4-144.3 136.3 17.2 -22.1 19.1 70 130 A Y E -H 79 0A 133 -2,-0.4 9,-0.2 9,-0.2 -2,-0.0 -0.997 3.5-175.5-128.8 128.4 16.2 -20.1 22.1 71 131 A V E +H 78 0A 11 7,-3.2 7,-1.9 -2,-0.4 2,-0.3 -0.818 6.0 174.9-130.2 93.9 16.1 -16.3 22.0 72 132 A P E +H 77 0A 62 0, 0.0 2,-0.3 0, 0.0 5,-0.2 -0.695 5.1 164.8 -96.0 153.5 15.2 -14.5 25.2 73 133 A Y E > -H 76 0A 85 3,-2.3 3,-0.9 -2,-0.3 -2,-0.0 -0.921 54.4 -75.3-153.1 171.9 15.4 -10.7 25.5 74 134 A T T 3 S+ 0 0 152 -2,-0.3 3,-0.0 1,-0.2 -1,-0.0 0.831 124.0 40.0 -47.4 -48.6 14.0 -8.3 28.0 75 135 A Q T 3 S- 0 0 121 34,-0.1 2,-0.3 -3,-0.0 -1,-0.2 0.714 127.7 -62.6 -76.2 -21.0 10.3 -8.3 27.0 76 136 A G E < -H 73 0A 12 -3,-0.9 -3,-2.3 33,-0.1 2,-0.3 -0.816 58.4-108.4 174.5-132.0 9.9 -11.9 26.4 77 137 A K E -HI 72 108A 58 31,-2.1 31,-2.8 -2,-0.3 2,-0.3 -0.993 3.7-132.7-178.3 169.2 11.3 -14.5 24.0 78 138 A W E -HI 71 107A 17 -7,-1.9 -7,-3.2 -2,-0.3 2,-0.4 -0.968 17.1-167.3-138.6 157.0 11.0 -16.8 21.0 79 139 A E E +HI 70 106A 67 27,-2.1 26,-2.2 -2,-0.3 27,-1.6 -0.997 15.3 162.0-147.8 133.6 12.0 -20.4 20.6 80 140 A G E -HI 69 104A 4 -11,-3.0 -11,-2.5 -2,-0.4 2,-0.5 -0.879 36.2-107.9-148.7-178.5 12.3 -22.5 17.6 81 141 A E E -HI 68 103A 87 22,-1.7 22,-2.6 -2,-0.3 -13,-0.2 -0.951 37.5-122.2-117.3 130.2 13.6 -25.5 15.7 82 142 A L E + I 0 102A 3 -15,-3.9 -17,-2.3 -2,-0.5 -16,-0.5 -0.495 45.1 146.6 -75.0 140.6 16.3 -25.2 13.1 83 143 A G E -HI 64 101A 0 18,-1.5 18,-3.3 -19,-0.3 2,-0.3 -0.945 36.6-126.9-159.3 176.1 15.5 -26.4 9.6 84 144 A T E +HI 63 100A 19 -21,-2.5 -21,-2.4 -2,-0.3 2,-0.3 -0.959 31.8 152.0-134.1 148.2 16.1 -25.7 6.0 85 145 A D E - I 0 99A 0 14,-1.7 14,-2.5 -2,-0.3 2,-0.3 -0.976 49.1 -74.9-166.3 169.1 13.7 -25.2 3.1 86 146 A L E - I 0 98A 51 -2,-0.3 -63,-2.2 12,-0.2 2,-0.4 -0.557 49.1-169.6 -76.3 137.0 13.3 -23.5 -0.2 87 147 A V E +DI 22 97A 2 10,-3.1 10,-2.6 -2,-0.3 2,-0.3 -0.992 10.2 171.6-134.3 137.0 12.7 -19.8 0.0 88 148 A S E -D 21 0A 24 -67,-2.1 -67,-2.3 -2,-0.4 8,-0.1 -0.920 27.8-142.1-137.8 163.9 11.6 -17.2 -2.5 89 149 A I > - 0 0 8 6,-0.5 3,-1.1 4,-0.5 -69,-0.2 -0.908 14.7-157.5-128.6 98.5 10.6 -13.6 -2.7 90 150 A P T 3 S+ 0 0 64 0, 0.0 2,-0.4 0, 0.0 -1,-0.1 0.821 93.5 41.8 -44.9 -42.9 7.8 -13.2 -5.3 91 151 A H T 3 S+ 0 0 97 -72,-0.4 -84,-0.1 -84,-0.1 3,-0.1 -0.440 114.5 58.4-107.5 57.6 8.5 -9.5 -5.8 92 152 A G S < S- 0 0 11 -3,-1.1 80,-0.1 -2,-0.4 -87,-0.0 -0.696 104.4 -17.5-153.5-155.5 12.2 -9.8 -5.7 93 153 A P - 0 0 23 0, 0.0 2,-2.0 0, 0.0 -4,-0.5 -0.280 66.9-116.2 -59.8 145.6 14.9 -11.7 -7.7 94 154 A N S S+ 0 0 167 -6,-0.1 2,-0.3 -3,-0.1 -6,-0.0 -0.475 79.6 103.7 -83.5 68.5 13.5 -14.5 -9.7 95 155 A V - 0 0 47 -2,-2.0 -6,-0.5 -6,-0.2 2,-0.4 -0.935 59.2-141.8-142.2 164.1 15.4 -17.2 -7.8 96 156 A T - 0 0 80 -2,-0.3 2,-0.3 -8,-0.1 -8,-0.2 -0.999 20.6-169.7-132.1 132.2 14.8 -19.8 -5.1 97 157 A V E - I 0 87A 2 -10,-2.6 -10,-3.1 -2,-0.4 2,-0.7 -0.923 26.3-125.7-125.9 147.1 17.3 -20.5 -2.4 98 158 A R E + I 0 86A 42 -2,-0.3 2,-0.3 -12,-0.2 -12,-0.2 -0.830 46.9 173.2 -88.8 117.1 17.6 -23.2 0.2 99 159 A A E - I 0 85A 1 -14,-2.5 -14,-1.7 -2,-0.7 2,-0.1 -0.886 37.3 -97.7-128.8 160.1 17.9 -21.2 3.4 100 160 A N E - I 0 84A 32 36,-0.5 2,-0.4 -2,-0.3 -16,-0.3 -0.456 39.2-164.8 -70.9 145.7 18.0 -21.8 7.1 101 161 A I E - I 0 83A 1 -18,-3.3 -18,-1.5 -2,-0.1 2,-0.9 -0.986 16.8-149.8-138.9 124.6 14.7 -21.3 8.8 102 162 A A E -gI 41 82A 1 -62,-2.8 -60,-2.2 -2,-0.4 2,-1.0 -0.852 19.8-150.0 -93.7 107.8 14.1 -20.9 12.5 103 163 A A E -gI 42 81A 2 -22,-2.6 -22,-1.7 -2,-0.9 2,-0.5 -0.712 11.6-140.6 -83.4 102.5 10.6 -22.4 13.0 104 164 A I E +gI 43 80A 3 -62,-2.5 -60,-3.0 -2,-1.0 -24,-0.3 -0.508 31.5 166.5 -67.5 112.6 9.1 -20.5 15.9 105 165 A T E + 0 0 29 -26,-2.2 2,-0.3 -2,-0.5 -25,-0.2 0.730 67.2 15.1 -98.7 -29.9 7.1 -22.9 18.0 106 166 A E E + I 0 79A 117 -27,-1.6 -27,-2.1 2,-0.0 -1,-0.3 -0.996 69.4 150.9-146.5 147.7 6.7 -20.8 21.2 107 167 A S E - I 0 78A 24 -2,-0.3 2,-0.3 -29,-0.2 -29,-0.2 -0.987 25.6-152.6-165.3 165.7 7.1 -17.1 21.9 108 168 A D E S- I 0 77A 63 -31,-2.8 -31,-2.1 -2,-0.3 -2,-0.0 -0.946 83.9 -2.0-153.4 130.5 5.9 -14.2 24.0 109 169 A K S S+ 0 0 121 -2,-0.3 -34,-0.1 -33,-0.2 -33,-0.1 0.842 103.0 104.5 58.0 36.3 6.0 -10.5 23.0 110 170 A F + 0 0 31 1,-0.1 -32,-0.1 -33,-0.1 -1,-0.1 0.754 69.6 51.1-102.9 -64.9 7.6 -11.5 19.7 111 171 A F S S- 0 0 8 7,-0.1 2,-0.5 1,-0.1 -1,-0.1 -0.304 80.2-132.6 -71.6 155.4 4.8 -11.1 17.2 112 172 A I > - 0 0 69 5,-0.3 3,-1.8 -63,-0.1 4,-0.4 -0.942 20.1-113.6-117.4 127.9 2.7 -8.0 17.1 113 173 A N T 3 S- 0 0 110 -2,-0.5 -64,-0.1 1,-0.3 -63,-0.1 -0.364 99.7 -0.3 -58.7 124.0 -1.1 -7.9 17.0 114 174 A G T 3 S+ 0 0 47 -65,-0.3 -1,-0.3 -2,-0.1 -100,-0.1 0.397 92.2 119.2 78.1 -1.9 -2.3 -6.6 13.6 115 175 A S < - 0 0 2 -3,-1.8 -104,-0.2 2,-0.1 -2,-0.1 0.725 68.5-140.2 -67.2 -21.6 1.2 -6.0 12.2 116 176 A N + 0 0 80 -4,-0.4 2,-0.4 -67,-0.2 -1,-0.1 0.655 61.7 112.8 69.7 18.8 0.4 -8.5 9.4 117 177 A W - 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