==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=3-JAN-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE 22-MAR-07 2P8H . COMPND 2 MOLECULE: BETA-SECRETASE 1; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR S.MUNSHI . 379 2 3 2 1 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 16701.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 260 68.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 18 4.7 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 109 28.8 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 . 3 0.8 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 . 50 13.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 40 10.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 27 7.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 5 1.3 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 1 0 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 . 2 5 2 2 2 5 1 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 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 43PA R 0 0 234 0, 0.0 174,-0.0 0, 0.0 176,-0.0 0.000 360.0 360.0 360.0 -19.2 33.1 42.2 35.4 2 44PA R - 0 0 199 174,-0.1 174,-0.3 175,-0.0 175,-0.3 0.232 360.0-133.0 -71.8-160.5 36.8 41.3 35.5 3 45PA G > + 0 0 27 172,-0.1 3,-1.2 173,-0.1 4,-0.1 -0.346 37.6 158.2-166.6 82.0 39.0 40.6 32.5 4 46PA S T 3 S+ 0 0 118 1,-0.2 3,-0.4 2,-0.1 171,-0.1 0.745 88.8 59.1 -73.7 -20.5 41.4 37.7 32.1 5 47PA F T >> + 0 0 52 1,-0.2 3,-2.6 169,-0.2 4,-0.6 0.209 68.4 125.3 -90.3 14.7 41.0 38.2 28.2 6 48PA V G X4 + 0 0 98 -3,-1.2 3,-1.0 1,-0.3 -1,-0.2 0.752 64.0 61.5 -44.0 -37.5 42.2 41.9 28.5 7 1 A E G 34 S+ 0 0 134 -3,-0.4 -1,-0.3 1,-0.2 -2,-0.1 0.661 102.3 51.7 -69.6 -15.6 44.9 41.4 25.8 8 2 A M G X4 S+ 0 0 22 -3,-2.6 3,-1.2 160,-0.0 161,-0.7 0.569 85.3 106.9 -94.1 -11.1 42.4 40.5 23.2 9 3 A V T << S+ 0 0 37 -3,-1.0 159,-0.1 -4,-0.6 -3,-0.0 -0.464 88.7 11.0 -69.3 137.2 40.2 43.7 23.9 10 4 A D T 3 S+ 0 0 96 -2,-0.1 -1,-0.3 149,-0.1 158,-0.2 0.804 83.9 134.8 65.3 32.0 40.5 46.3 21.1 11 5 A N < + 0 0 15 -3,-1.2 12,-0.5 84,-0.1 2,-0.3 0.406 50.7 81.2 -90.9 3.3 42.3 43.9 18.8 12 6 A L E -AB 22 167A 0 155,-2.4 155,-0.9 10,-0.1 2,-0.3 -0.839 55.6-178.2-110.8 148.1 40.1 44.9 15.8 13 7 A R E -AB 21 166A 130 8,-1.9 8,-2.7 -2,-0.3 2,-0.3 -0.917 6.8-164.3-138.2 163.2 40.5 47.9 13.5 14 8 A G - 0 0 13 151,-1.7 2,-0.6 -2,-0.3 6,-0.1 -0.992 13.7-142.6-151.5 145.5 38.7 49.4 10.5 15 9 A K S > S- 0 0 113 4,-0.5 3,-0.5 104,-0.4 106,-0.1 -0.914 83.5 -28.7-114.6 105.5 39.5 52.0 7.9 16 10 A S T 3 S- 0 0 61 -2,-0.6 289,-0.3 1,-0.2 -1,-0.2 0.884 115.6 -63.5 58.3 40.3 36.6 54.2 6.9 17 11 A G T 3 S+ 0 0 25 1,-0.1 -1,-0.2 2,-0.1 3,-0.1 0.873 101.3 132.0 52.8 42.8 34.1 51.5 7.7 18 12 A Q S < S- 0 0 57 -3,-0.5 -1,-0.1 1,-0.4 98,-0.1 0.031 75.6 -40.8-112.3 26.4 35.4 49.1 5.0 19 13 A G - 0 0 19 101,-0.0 2,-0.5 2,-0.0 -4,-0.5 -0.046 55.5-104.9 123.8 135.6 35.8 46.0 7.1 20 14 A Y - 0 0 11 204,-0.3 17,-2.9 17,-0.3 2,-0.3 -0.785 44.0-176.8 -90.9 123.9 36.9 44.9 10.6 21 15 A Y E -AC 13 36A 19 -8,-2.7 -8,-1.9 -2,-0.5 2,-0.3 -0.886 18.0-158.6-127.1 155.4 40.3 43.2 10.6 22 16 A V E -AC 12 35A 0 13,-2.6 13,-3.0 -2,-0.3 2,-0.3 -0.913 31.5-104.9-125.6 150.5 42.6 41.5 13.1 23 17 A E E - C 0 34A 66 -12,-0.5 72,-0.4 -2,-0.3 2,-0.4 -0.599 37.1-178.8 -78.6 135.8 46.4 40.9 12.8 24 18 A M E - C 0 33A 0 9,-2.3 9,-2.5 -2,-0.3 2,-0.6 -1.000 15.8-147.6-136.7 134.0 47.5 37.4 12.0 25 19 A T E -DC 92 32A 25 67,-2.9 67,-2.0 -2,-0.4 2,-0.3 -0.903 20.8-177.3-108.3 121.2 51.1 36.3 11.7 26 20 A V E > +DC 91 31A 1 5,-2.9 5,-1.2 -2,-0.6 65,-0.2 -0.847 37.6 3.3-120.0 153.6 51.8 33.5 9.2 27 21 A G T 5S- 0 0 11 63,-2.3 4,-0.3 -2,-0.3 36,-0.1 -0.032 85.6 -52.0 73.3-178.3 54.9 31.5 8.2 28 22 A S T 5S+ 0 0 28 2,-0.2 36,-2.4 1,-0.0 37,-0.4 -0.952 122.1 35.3-151.4 126.3 58.5 31.6 9.6 29 23 A P T 5S- 0 0 95 0, 0.0 36,-0.1 0, 0.0 -3,-0.1 0.608 123.0 -87.6 -58.6 164.9 60.2 33.9 9.9 30 24 A P T 5 - 0 0 108 0, 0.0 2,-0.4 0, 0.0 -3,-0.2 -0.137 42.2-174.9 -55.2 133.9 57.0 35.9 10.9 31 25 A Q E < -C 26 0A 26 -5,-1.2 -5,-2.9 -4,-0.3 2,-0.3 -0.907 12.1-161.5-131.4 101.5 54.8 37.6 8.3 32 26 A T E +C 25 0A 43 -2,-0.4 2,-0.3 -7,-0.3 -7,-0.2 -0.681 13.1 175.4 -90.2 136.4 52.1 39.7 9.9 33 27 A L E -C 24 0A 3 -9,-2.5 -9,-2.3 -2,-0.3 2,-0.6 -0.949 35.6-111.2-137.3 155.5 49.0 40.7 7.8 34 28 A N E -C 23 0A 10 -2,-0.3 88,-3.2 -11,-0.2 89,-0.8 -0.813 39.0-163.7 -90.1 119.0 45.7 42.5 8.4 35 29 A I E -Ce 22 123A 0 -13,-3.0 -13,-2.6 -2,-0.6 89,-0.2 -0.910 16.8-127.3-115.3 124.4 42.9 40.0 8.0 36 30 A L E -Ce 21 124A 16 87,-2.5 89,-3.3 -2,-0.5 2,-0.7 -0.430 23.7-129.2 -65.9 129.6 39.2 40.7 7.6 37 31 A V E + e 0 125A 2 -17,-2.9 2,-0.5 -2,-0.2 -17,-0.3 -0.724 33.5 177.0 -84.0 117.0 36.9 38.9 10.1 38 32 A D E > + e 0 126A 8 87,-2.2 89,-2.5 -2,-0.7 3,-1.0 -0.867 25.0 174.9-129.8 101.5 34.2 37.1 8.1 39 33 A T T 3 S+ 0 0 0 -2,-0.5 155,-0.4 1,-0.2 183,-0.2 0.474 79.6 73.3 -78.9 0.3 31.6 34.9 9.8 40 34 A G T 3 S+ 0 0 14 153,-0.1 2,-0.3 88,-0.1 -1,-0.2 0.324 101.1 32.0 -95.6 6.0 29.9 34.7 6.4 41 35 A S < - 0 0 11 -3,-1.0 87,-2.9 84,-0.2 92,-0.1 -0.925 64.4-138.6-150.4 174.5 32.5 32.3 4.8 42 36 A S + 0 0 2 90,-0.3 2,-0.4 -2,-0.3 100,-0.2 0.293 63.9 98.2-128.3 14.3 34.9 29.5 5.7 43 37 A N - 0 0 6 98,-0.1 83,-1.1 89,-0.1 2,-0.6 -0.878 56.4-146.9-108.9 136.9 38.2 30.0 3.9 44 38 A F E +F 125 0A 9 -2,-0.4 62,-2.0 81,-0.2 2,-0.3 -0.901 36.0 163.2 -96.4 119.0 41.3 31.6 5.4 45 39 A A E -Fg 124 106A 0 79,-2.5 79,-3.1 -2,-0.6 2,-0.4 -0.997 20.6-166.5-142.7 145.9 43.0 33.4 2.5 46 40 A V E -Fg 123 107A 0 60,-2.5 62,-3.0 -2,-0.3 77,-0.3 -0.981 34.5-101.7-134.5 143.3 45.7 36.1 2.1 47 41 A G E + g 0 108A 0 75,-3.1 11,-2.8 -2,-0.4 62,-0.2 -0.386 38.5 177.0 -57.1 135.0 46.9 38.2 -0.8 48 42 A A + 0 0 13 60,-2.7 12,-0.2 9,-0.2 -1,-0.1 0.150 57.4 46.4-130.3 18.1 50.1 36.6 -2.0 49 43 A A S S- 0 0 30 59,-0.3 9,-0.1 7,-0.1 -1,-0.1 -0.978 97.5 -76.4-154.3 155.0 51.0 38.8 -4.9 50 44 A P + 0 0 101 0, 0.0 -2,-0.1 0, 0.0 5,-0.1 -0.233 50.4 172.7 -58.5 143.6 51.2 42.5 -5.6 51 45 A H > - 0 0 54 3,-0.4 3,-2.1 -4,-0.1 59,-0.0 -0.979 43.1-114.6-151.8 141.9 47.9 44.3 -6.1 52 46 A P T 3 S+ 0 0 116 0, 0.0 -1,-0.0 0, 0.0 0, 0.0 0.761 117.3 43.3 -48.1 -32.9 47.1 48.1 -6.4 53 47 A F T 3 S+ 0 0 85 64,-0.1 2,-0.5 65,-0.0 67,-0.3 0.437 97.5 91.9 -97.2 -0.2 45.1 48.0 -3.2 54 48 A L < - 0 0 21 -3,-2.1 -3,-0.4 1,-0.1 3,-0.1 -0.837 47.0-173.9-102.9 130.4 47.5 45.9 -1.1 55 49 A H S S+ 0 0 146 -2,-0.5 2,-0.3 1,-0.2 -1,-0.1 0.817 78.8 2.3 -83.4 -36.3 50.3 47.5 1.0 56 50 A R - 0 0 91 -7,-0.1 2,-0.3 -6,-0.0 -1,-0.2 -0.932 66.3-167.7-145.7 167.4 51.8 44.0 1.8 57 51 A Y - 0 0 76 -2,-0.3 2,-0.3 -9,-0.1 -9,-0.2 -0.992 34.5 -82.8-158.2 161.3 51.3 40.4 1.0 58 52 A Y - 0 0 1 -11,-2.8 2,-0.7 -2,-0.3 -31,-0.0 -0.496 33.4-161.4 -69.9 126.4 52.2 36.8 1.9 59 53 A Q > - 0 0 66 -2,-0.3 3,-1.3 1,-0.2 4,-0.3 -0.850 5.9-174.0-115.0 92.6 55.5 35.7 0.4 60 54 A R G > S+ 0 0 50 -2,-0.7 3,-1.5 1,-0.3 6,-0.3 0.791 78.9 63.7 -57.3 -35.4 55.6 31.9 0.5 61 55 A Q G 3 S+ 0 0 150 1,-0.3 -1,-0.3 3,-0.0 -2,-0.0 0.786 100.9 54.7 -62.2 -26.9 59.1 31.5 -0.7 62 56 A L G < S+ 0 0 92 -3,-1.3 2,-0.7 1,-0.1 -1,-0.3 0.519 92.0 84.6 -84.0 -6.4 60.3 33.3 2.4 63 57 A S X - 0 0 7 -3,-1.5 3,-1.2 -4,-0.3 -36,-0.1 -0.867 57.0-168.4-103.0 112.2 58.5 30.9 4.8 64 58 A S T 3 S+ 0 0 108 -36,-2.4 -1,-0.1 -2,-0.7 -4,-0.0 0.748 88.6 53.4 -67.2 -24.7 60.5 27.8 5.6 65 59 A T T 3 S+ 0 0 33 -37,-0.4 -1,-0.2 -36,-0.1 2,-0.2 0.427 79.0 120.7 -91.4 -0.6 57.4 26.1 7.1 66 60 A Y < - 0 0 40 -3,-1.2 2,-0.5 -6,-0.3 23,-0.2 -0.445 45.7-162.6 -66.0 133.0 55.1 26.7 4.1 67 61 A R E -H 88 0A 149 21,-2.9 21,-2.1 -2,-0.2 2,-0.3 -0.958 12.1-138.5-123.6 114.4 53.8 23.4 2.7 68 62 A D E -H 87 0A 93 -2,-0.5 19,-0.3 19,-0.2 18,-0.0 -0.519 10.0-165.6 -72.3 126.8 52.3 23.4 -0.8 69 63 A L E - 0 0 75 17,-2.1 18,-0.2 -2,-0.3 -1,-0.1 0.497 30.9-132.6 -90.1 -4.8 49.1 21.4 -1.2 70 64 A R E + 0 0 221 16,-0.5 2,-0.3 1,-0.2 17,-0.1 0.934 66.3 113.1 52.8 53.2 49.3 21.4 -5.0 71 65 A K E - 0 0 86 15,-0.4 15,-2.9 2,-0.0 -2,-0.2 -0.961 59.7-132.6-155.6 134.1 45.7 22.4 -5.5 72 66 A G E -H 85 0A 51 -2,-0.3 2,-0.3 13,-0.2 13,-0.2 -0.393 19.5-161.6 -81.9 164.1 44.0 25.5 -6.8 73 67 A V E -H 84 0A 8 11,-1.8 11,-2.5 34,-0.1 2,-0.4 -0.981 7.3-170.4-149.9 136.4 41.1 27.2 -5.0 74 68 A Y E -H 83 0A 142 -2,-0.3 9,-0.2 9,-0.2 -2,-0.0 -0.996 3.2-172.7-128.8 131.6 38.4 29.6 -6.2 75 69 A V E -H 82 0A 7 7,-2.2 7,-1.4 -2,-0.4 2,-0.4 -0.937 3.5-166.4-132.1 112.5 36.0 31.5 -4.0 76 70 A P E -H 81 0A 52 0, 0.0 5,-0.2 0, 0.0 2,-0.2 -0.774 11.1-172.4 -95.5 139.8 33.1 33.6 -5.3 77 71 A Y - 0 0 51 3,-2.9 3,-0.3 -2,-0.4 -36,-0.0 -0.604 43.2 -98.9-118.7-179.3 31.3 36.0 -2.9 78 72 A T S S+ 0 0 109 1,-0.3 2,-0.6 -2,-0.2 -1,-0.1 0.929 123.5 33.6 -63.9 -43.6 28.2 38.1 -3.2 79 73 A Q S S- 0 0 134 -3,-0.0 -1,-0.3 35,-0.0 2,-0.1 -0.917 128.4 -29.7-116.6 103.3 30.7 40.9 -3.8 80 74 A G - 0 0 20 -2,-0.6 -3,-2.9 -3,-0.3 2,-0.3 -0.221 57.6-134.4 89.4-178.1 33.8 39.9 -5.7 81 75 A A E -HI 76 112A 10 31,-1.5 31,-2.7 -5,-0.2 2,-0.3 -0.966 9.3-155.9-170.6 164.1 35.8 36.7 -6.1 82 76 A W E -HI 75 111A 2 -7,-1.4 -7,-2.2 -2,-0.3 2,-0.4 -0.990 8.4-144.1-151.9 158.9 39.5 35.5 -6.1 83 77 A A E +HI 74 110A 33 27,-2.9 26,-1.8 -2,-0.3 27,-1.7 -0.947 33.6 143.0-122.8 145.0 41.6 32.7 -7.3 84 78 A G E -HI 73 108A 8 -11,-2.5 -11,-1.8 -2,-0.4 2,-0.4 -0.871 42.7 -91.0-159.6-165.3 44.6 31.2 -5.4 85 79 A E E -HI 72 107A 82 22,-1.8 22,-3.0 -2,-0.3 -13,-0.2 -0.987 34.0-128.5-130.2 133.8 46.7 28.2 -4.4 86 80 A L E + I 0 106A 1 -15,-2.9 -17,-2.1 -2,-0.4 -16,-0.5 -0.479 41.2 130.8 -84.4 150.5 46.3 26.1 -1.3 87 81 A G E -HI 68 105A 0 18,-1.2 18,-2.8 -19,-0.3 2,-0.3 -0.932 43.4-110.5-171.6-175.2 48.9 25.2 1.2 88 82 A T E +HI 67 104A 20 -21,-2.1 -21,-2.9 -2,-0.3 2,-0.3 -0.960 33.9 158.2-134.8 154.1 49.5 25.1 5.0 89 83 A D E - I 0 103A 0 14,-1.6 14,-2.2 -2,-0.3 2,-0.2 -0.967 46.9 -74.1-163.2 169.6 51.6 27.1 7.3 90 84 A L E - I 0 102A 57 -2,-0.3 -63,-2.3 12,-0.2 2,-0.4 -0.555 49.3-173.4 -75.2 136.9 52.1 28.2 10.9 91 85 A V E +DI 26 101A 2 10,-2.6 10,-2.3 -2,-0.2 2,-0.3 -0.998 11.5 167.5-137.7 136.8 49.6 30.8 12.0 92 86 A S E -D 25 0A 25 -67,-2.0 -67,-2.9 -2,-0.4 8,-0.1 -0.947 29.5-135.8-141.6 158.4 49.2 32.8 15.2 93 87 A I > - 0 0 5 4,-0.6 3,-2.5 6,-0.5 -69,-0.2 -0.947 13.2-154.9-120.7 104.5 47.1 35.8 16.2 94 88 A P T 3 S+ 0 0 51 0, 0.0 -1,-0.1 0, 0.0 -70,-0.1 0.846 97.2 32.7 -44.4 -46.0 49.4 38.3 18.2 95 89 A H T 3 S+ 0 0 75 -72,-0.4 -84,-0.1 -84,-0.1 3,-0.1 -0.028 118.4 64.4-106.4 30.3 46.4 39.8 20.0 96 90 A G S < S- 0 0 6 -3,-2.5 74,-0.0 1,-0.4 -89,-0.0 -0.208 102.0 -17.6-123.6-145.4 44.4 36.6 20.1 97 91 A P - 0 0 9 0, 0.0 2,-1.8 0, 0.0 -4,-0.6 -0.281 63.3-116.5 -65.0 150.2 45.0 33.2 21.8 98 92 A N S S+ 0 0 171 -3,-0.1 2,-0.3 -6,-0.1 -6,-0.0 -0.519 82.4 92.5 -87.8 69.3 48.5 32.4 23.0 99 93 A V - 0 0 44 -2,-1.8 -6,-0.5 -6,-0.2 2,-0.4 -0.927 61.1-141.8-150.3 169.2 48.9 29.4 20.7 100 94 A T + 0 0 84 -2,-0.3 2,-0.3 -8,-0.1 -8,-0.2 -0.993 22.1 180.0-139.4 130.6 50.2 28.6 17.2 101 95 A V E - I 0 91A 3 -10,-2.3 -10,-2.6 -2,-0.4 2,-0.7 -0.872 32.3-118.3-130.1 163.3 48.6 26.1 14.8 102 96 A R E + I 0 90A 48 -2,-0.3 2,-0.3 -12,-0.2 -12,-0.2 -0.915 47.6 171.8 -99.9 117.6 49.2 24.7 11.3 103 97 A A E - I 0 89A 1 -14,-2.2 -14,-1.6 -2,-0.7 2,-0.1 -0.840 38.4 -93.9-126.3 163.4 46.2 25.8 9.2 104 98 A N E - I 0 88A 34 36,-0.5 2,-0.4 -2,-0.3 -16,-0.2 -0.484 43.0-171.2 -71.7 143.8 45.1 25.7 5.6 105 99 A I E - I 0 87A 1 -18,-2.8 -18,-1.2 -2,-0.1 2,-0.7 -0.987 17.5-147.7-143.0 130.7 45.9 28.9 3.8 106 100 A A E -gI 45 86A 1 -62,-2.0 -60,-2.5 -2,-0.4 2,-0.8 -0.873 14.6-146.2 -99.3 118.1 44.8 30.1 0.4 107 101 A A E -gI 46 85A 1 -22,-3.0 -22,-1.8 -2,-0.7 2,-0.6 -0.766 16.9-139.4 -84.3 110.4 47.4 32.2 -1.3 108 102 A I E +gI 47 84A 4 -62,-3.0 -60,-2.7 -2,-0.8 -59,-0.3 -0.598 33.2 164.1 -76.1 115.2 45.4 34.8 -3.4 109 103 A T E + 0 0 34 -26,-1.8 2,-0.3 -2,-0.6 -25,-0.2 0.647 66.0 16.2-104.3 -20.2 47.1 35.3 -6.7 110 104 A E E + I 0 83A 133 -27,-1.7 -27,-2.9 2,-0.0 -1,-0.3 -0.982 67.1 171.6-151.8 149.4 44.4 37.0 -8.7 111 105 A S E - I 0 82A 34 -2,-0.3 2,-0.4 -29,-0.3 -29,-0.2 -0.994 22.6-144.9-159.7 160.3 41.1 38.7 -7.8 112 106 A D E S- I 0 81A 98 -31,-2.7 -31,-1.5 -2,-0.3 -2,-0.0 -0.960 81.3 -25.7-135.8 115.8 38.2 40.7 -9.0 113 107 A K S S+ 0 0 163 -2,-0.4 -31,-0.1 -33,-0.2 -1,-0.1 0.823 105.8 109.4 52.9 36.4 36.5 43.4 -7.0 114 108 A F + 0 0 13 -33,-0.2 -1,-0.1 -34,-0.2 -32,-0.1 0.834 58.8 61.4-101.8 -64.2 37.5 41.7 -3.7 115 109 A F S S- 0 0 13 1,-0.1 2,-0.5 7,-0.1 7,-0.1 -0.348 79.0-137.2 -66.3 147.0 40.1 43.8 -2.1 116 110 A I > - 0 0 48 5,-0.3 3,-2.1 -63,-0.1 4,-0.3 -0.937 17.7-113.9-115.1 124.3 38.9 47.3 -1.2 117 111 A N T 3 S+ 0 0 104 -2,-0.5 -64,-0.1 1,-0.3 -63,-0.1 -0.272 99.3 4.0 -54.6 128.0 41.0 50.4 -1.8 118 112 A G T 3 S+ 0 0 38 -65,-0.3 -1,-0.3 1,-0.1 -100,-0.1 0.517 92.7 117.0 74.5 7.0 42.0 52.0 1.5 119 113 A S < - 0 0 2 -3,-2.1 -104,-0.4 2,-0.2 -101,-0.1 0.699 67.8-141.2 -77.8 -21.1 40.6 49.3 3.7 120 114 A N + 0 0 46 -4,-0.3 2,-0.4 -67,-0.3 -86,-0.2 0.462 61.9 116.2 72.7 2.6 44.0 48.3 5.1 121 115 A W - 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