==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=1-JAN-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE 16-OCT-06 2IRZ . 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) . 16695.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 262 69.1 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 . 48 12.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 42 11.1 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 3 1 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 0 237 0, 0.0 176,-0.0 0, 0.0 174,-0.0 0.000 360.0 360.0 360.0 -44.7 33.8 43.4 35.7 2 44PA R - 0 0 195 174,-0.1 174,-0.4 175,-0.0 175,-0.3 -0.007 360.0-136.1 -74.1-173.5 37.5 42.2 35.7 3 45PA G > + 0 0 25 172,-0.1 3,-1.0 1,-0.1 4,-0.1 -0.637 33.9 165.3-157.5 96.6 39.2 41.0 32.6 4 46PA S T 3 S+ 0 0 111 1,-0.2 3,-0.4 -2,-0.2 -1,-0.1 0.771 92.4 54.8 -76.0 -24.7 41.5 38.0 32.1 5 47PA F T >> S+ 0 0 52 1,-0.2 3,-2.3 169,-0.1 4,-0.5 0.160 72.1 124.9 -92.1 18.2 41.0 38.5 28.3 6 48PA V G X4 + 0 0 94 -3,-1.0 3,-1.1 1,-0.3 -1,-0.2 0.780 62.9 62.3 -47.6 -38.4 42.2 42.1 28.6 7 1 A E G 34 S+ 0 0 130 -3,-0.4 -1,-0.3 1,-0.2 -2,-0.1 0.647 101.3 53.3 -68.1 -13.7 45.0 41.7 26.0 8 2 A M G X4 S+ 0 0 22 -3,-2.3 3,-1.1 160,-0.0 161,-0.7 0.578 83.9 107.5 -94.5 -11.4 42.4 40.8 23.3 9 3 A V T << S+ 0 0 35 -3,-1.1 159,-0.1 -4,-0.5 -3,-0.0 -0.451 87.6 12.0 -68.8 136.3 40.4 44.0 23.9 10 4 A D T 3 S+ 0 0 119 -2,-0.1 -1,-0.3 149,-0.1 158,-0.2 0.809 83.9 134.1 67.2 32.4 40.7 46.6 21.1 11 5 A N < + 0 0 13 -3,-1.1 12,-0.5 84,-0.1 2,-0.3 0.359 51.4 78.7 -93.5 6.1 42.4 44.1 18.8 12 6 A L E +AB 22 167A 2 155,-2.2 155,-1.0 10,-0.1 2,-0.3 -0.883 54.5 175.5-115.2 147.2 40.3 45.1 15.8 13 7 A R E -AB 21 166A 116 8,-1.9 8,-2.7 -2,-0.3 2,-0.3 -0.879 6.3-168.5-140.0 170.8 40.6 48.1 13.6 14 8 A G - 0 0 12 151,-1.3 2,-1.1 -2,-0.3 6,-0.1 -0.964 33.2-122.3-164.0 146.7 38.9 49.5 10.4 15 9 A K S S- 0 0 98 104,-0.6 105,-0.1 4,-0.5 5,-0.1 -0.299 78.5 -76.8 -86.9 50.3 39.4 52.2 7.8 16 10 A S S S- 0 0 70 -2,-1.1 289,-0.2 1,-0.1 -1,-0.1 0.955 108.2 -8.2 54.1 95.8 36.0 53.6 8.6 17 11 A G S S+ 0 0 34 1,-0.1 -1,-0.1 287,-0.1 3,-0.1 0.688 109.7 94.3 67.5 23.3 33.2 51.6 7.1 18 12 A Q S S- 0 0 70 1,-0.3 98,-0.1 101,-0.1 2,-0.1 0.284 95.0 -50.5-128.5 13.4 35.2 49.2 5.0 19 13 A G - 0 0 20 101,-0.0 -4,-0.5 207,-0.0 2,-0.5 -0.094 46.0-110.1 125.7 135.6 35.8 46.1 7.2 20 14 A Y - 0 0 12 204,-0.3 17,-2.6 17,-0.3 2,-0.3 -0.817 41.8-175.9 -94.8 130.0 36.9 45.1 10.7 21 15 A Y E -AC 13 36A 3 -8,-2.7 -8,-1.9 -2,-0.5 2,-0.3 -0.910 19.0-154.7-131.4 157.2 40.3 43.4 10.7 22 16 A V E -AC 12 35A 2 13,-2.7 13,-2.7 -2,-0.3 2,-0.3 -0.926 32.8-104.9-125.1 146.9 42.7 41.7 13.2 23 17 A E E - C 0 34A 61 -12,-0.5 2,-0.4 -2,-0.3 72,-0.4 -0.562 38.7-175.9 -74.7 134.6 46.4 41.2 12.9 24 18 A M E - C 0 33A 1 9,-2.7 9,-2.7 -2,-0.3 2,-0.6 -0.997 14.1-148.7-132.0 137.1 47.5 37.7 12.0 25 19 A T E -DC 92 32A 25 67,-3.0 67,-2.2 -2,-0.4 2,-0.3 -0.922 19.4-179.0-111.8 121.3 51.0 36.4 11.7 26 20 A V E > +DC 91 31A 2 5,-2.9 5,-1.4 -2,-0.6 65,-0.2 -0.871 37.2 4.4-120.3 151.2 51.8 33.6 9.3 27 21 A G T 5S- 0 0 11 63,-2.1 4,-0.2 -2,-0.3 36,-0.1 -0.029 84.5 -49.7 78.9-178.9 55.0 31.7 8.4 28 22 A S T 5S+ 0 0 27 2,-0.1 36,-2.8 3,-0.0 37,-0.4 -0.961 123.5 32.5-146.1 119.7 58.5 31.6 9.6 29 23 A P T 5S- 0 0 92 0, 0.0 36,-0.1 0, 0.0 -3,-0.1 0.628 123.1 -86.9 -62.6 169.5 60.1 34.1 10.0 30 24 A P T 5 - 0 0 107 0, 0.0 2,-0.5 0, 0.0 -3,-0.2 -0.223 42.3-174.8 -55.5 130.4 57.0 36.1 11.0 31 25 A Q E < -C 26 0A 27 -5,-1.4 -5,-2.9 -4,-0.2 2,-0.4 -0.925 11.9-162.3-128.7 102.2 54.8 37.8 8.3 32 26 A T E +C 25 0A 45 -2,-0.5 2,-0.3 -7,-0.3 -7,-0.2 -0.709 13.1 172.9 -92.2 136.1 52.0 39.9 9.8 33 27 A L E -C 24 0A 4 -9,-2.7 -9,-2.7 -2,-0.4 2,-0.6 -0.941 37.2-108.9-137.3 157.6 49.0 40.9 7.8 34 28 A N E -C 23 0A 4 -2,-0.3 88,-3.0 -11,-0.2 89,-0.7 -0.799 40.1-163.5 -88.6 121.5 45.7 42.7 8.5 35 29 A I E -Ce 22 123A 1 -13,-2.7 -13,-2.7 -2,-0.6 89,-0.2 -0.931 17.7-124.5-118.0 127.4 42.9 40.1 8.2 36 30 A L E -Ce 21 124A 8 87,-2.6 89,-3.3 -2,-0.5 2,-0.7 -0.446 23.4-129.3 -66.6 127.1 39.2 40.8 7.8 37 31 A V E + e 0 125A 2 -17,-2.6 2,-0.5 -2,-0.2 -17,-0.3 -0.706 35.7 179.6 -79.9 115.0 37.1 39.0 10.5 38 32 A D E > + e 0 126A 13 87,-2.1 89,-2.9 -2,-0.7 3,-0.7 -0.895 26.1 173.0-128.2 105.9 34.4 37.2 8.4 39 33 A T T 3 S+ 0 0 0 -2,-0.5 155,-0.5 1,-0.2 183,-0.2 0.470 77.0 71.0 -86.8 -0.5 31.6 35.1 10.0 40 34 A G T 3 S+ 0 0 12 153,-0.1 2,-0.3 88,-0.1 -1,-0.2 0.380 102.2 35.8 -95.7 4.9 29.9 34.7 6.7 41 35 A S < - 0 0 8 -3,-0.7 87,-3.3 84,-0.2 92,-0.1 -0.880 63.6-140.7-145.4 176.6 32.5 32.3 5.1 42 36 A S + 0 0 2 90,-0.4 2,-0.4 -2,-0.3 100,-0.2 0.234 63.3 97.6-132.2 16.4 34.9 29.5 6.1 43 37 A N - 0 0 6 98,-0.1 83,-1.5 89,-0.1 2,-0.7 -0.869 57.9-144.0-110.0 142.4 38.2 30.0 4.3 44 38 A F E +F 125 0A 9 -2,-0.4 62,-2.1 81,-0.2 2,-0.3 -0.922 36.5 165.3-100.1 117.5 41.3 31.6 5.6 45 39 A A E -Fg 124 106A 0 79,-2.3 79,-3.2 -2,-0.7 2,-0.4 -0.998 18.5-170.4-139.7 143.1 42.9 33.5 2.6 46 40 A V E -Fg 123 107A 0 60,-2.5 62,-3.0 -2,-0.3 77,-0.3 -0.984 35.4-102.9-134.1 141.5 45.5 36.1 2.2 47 41 A G E + g 0 108A 0 75,-3.2 11,-2.9 -2,-0.4 62,-0.2 -0.412 38.4 177.5 -58.3 135.2 46.7 38.2 -0.7 48 42 A A + 0 0 10 60,-3.0 12,-0.2 9,-0.2 -1,-0.1 0.099 57.9 46.3-130.9 21.9 49.9 36.6 -1.9 49 43 A A S S- 0 0 28 59,-0.4 9,-0.1 7,-0.1 -1,-0.1 -0.972 99.4 -73.2-157.4 153.0 50.8 38.7 -4.9 50 44 A P + 0 0 101 0, 0.0 -2,-0.1 0, 0.0 5,-0.1 -0.173 51.1 173.5 -53.7 142.6 51.0 42.5 -5.6 51 45 A H > - 0 0 51 3,-0.4 3,-2.5 1,-0.1 59,-0.0 -0.974 41.5-118.1-152.2 137.6 47.6 44.2 -6.0 52 46 A P T 3 S+ 0 0 116 0, 0.0 -1,-0.1 0, 0.0 0, 0.0 0.802 116.1 43.8 -44.5 -39.3 46.7 48.0 -6.3 53 47 A F T 3 S+ 0 0 77 64,-0.1 2,-0.5 -3,-0.0 67,-0.3 0.389 97.7 91.6 -91.9 2.5 44.7 48.0 -3.1 54 48 A L < - 0 0 19 -3,-2.5 -3,-0.4 1,-0.1 3,-0.1 -0.876 48.1-173.4-105.9 127.2 47.3 45.9 -1.1 55 49 A H S S+ 0 0 138 -2,-0.5 2,-0.3 1,-0.3 -1,-0.1 0.758 79.7 1.9 -82.6 -27.7 50.0 47.5 1.0 56 50 A R - 0 0 91 -7,-0.1 2,-0.3 -5,-0.0 -1,-0.3 -0.984 66.7-165.1-155.4 160.1 51.6 44.1 1.7 57 51 A Y - 0 0 77 -2,-0.3 2,-0.3 -3,-0.1 -9,-0.2 -0.958 34.2 -83.2-148.8 164.4 51.1 40.5 0.9 58 52 A Y - 0 0 1 -11,-2.9 2,-0.7 -2,-0.3 -31,-0.0 -0.524 33.8-159.9 -71.2 126.6 52.1 36.9 1.9 59 53 A Q > - 0 0 67 -2,-0.3 3,-1.5 1,-0.2 4,-0.4 -0.848 6.6-173.4-114.4 92.5 55.4 35.8 0.4 60 54 A R G > S+ 0 0 45 -2,-0.7 3,-1.5 1,-0.3 6,-0.3 0.800 79.5 63.4 -54.4 -37.9 55.5 32.0 0.5 61 55 A Q G 3 S+ 0 0 150 1,-0.3 -1,-0.3 3,-0.0 -2,-0.0 0.740 101.6 53.5 -63.1 -22.2 59.1 31.7 -0.7 62 56 A L G < S+ 0 0 93 -3,-1.5 2,-0.7 1,-0.1 -1,-0.3 0.542 91.9 84.1 -89.7 -7.4 60.2 33.5 2.5 63 57 A S X - 0 0 8 -3,-1.5 3,-1.1 -4,-0.4 -36,-0.1 -0.855 57.1-168.2-101.7 111.9 58.4 31.1 4.9 64 58 A S T 3 S+ 0 0 105 -36,-2.8 -1,-0.1 -2,-0.7 -4,-0.0 0.694 88.3 53.1 -68.5 -19.9 60.4 28.0 5.6 65 59 A T T 3 S+ 0 0 33 -37,-0.4 -1,-0.2 -36,-0.1 2,-0.1 0.435 79.8 117.6 -96.0 -1.4 57.3 26.4 7.2 66 60 A Y < - 0 0 39 -3,-1.1 2,-0.4 -6,-0.3 23,-0.2 -0.451 46.0-164.1 -68.7 138.0 55.0 26.9 4.3 67 61 A R E -H 88 0A 150 21,-2.6 21,-2.3 -2,-0.1 2,-0.4 -0.988 13.9-136.5-127.7 122.4 53.7 23.6 2.7 68 62 A D E -H 87 0A 84 -2,-0.4 19,-0.3 19,-0.2 18,-0.0 -0.620 6.6-161.0 -78.6 129.3 52.1 23.6 -0.7 69 63 A L E - 0 0 74 17,-2.4 18,-0.2 -2,-0.4 -1,-0.1 0.473 32.3-130.3 -87.6 -3.1 48.9 21.5 -0.9 70 64 A R E S+ 0 0 226 16,-0.5 2,-0.3 1,-0.2 17,-0.1 0.893 71.2 105.0 55.7 46.1 49.2 21.3 -4.7 71 65 A K E - 0 0 86 15,-0.5 15,-3.1 2,-0.0 -2,-0.2 -0.972 60.5-137.0-154.7 136.9 45.6 22.3 -5.3 72 66 A G E -H 85 0A 50 -2,-0.3 2,-0.3 13,-0.2 13,-0.2 -0.457 15.3-156.1 -91.0 168.4 43.9 25.5 -6.4 73 67 A V E -H 84 0A 10 11,-2.2 11,-2.7 -2,-0.1 2,-0.4 -0.992 7.8-164.5-149.0 138.5 40.8 27.2 -5.0 74 68 A Y E -H 83 0A 143 -2,-0.3 9,-0.2 9,-0.2 -2,-0.0 -0.990 8.7-172.6-124.2 128.1 38.2 29.6 -6.3 75 69 A V E -H 82 0A 5 7,-2.8 7,-1.7 -2,-0.4 2,-0.4 -0.925 2.0-174.2-130.0 110.3 35.9 31.4 -4.0 76 70 A P E -H 81 0A 51 0, 0.0 5,-0.2 0, 0.0 2,-0.2 -0.834 7.8-175.4-101.9 136.7 33.0 33.6 -5.3 77 71 A Y - 0 0 64 3,-2.9 3,-0.2 -2,-0.4 -36,-0.0 -0.638 47.2 -94.4-117.9 179.1 30.9 35.7 -2.8 78 72 A T S S+ 0 0 106 1,-0.3 2,-0.4 -2,-0.2 3,-0.1 0.847 124.9 31.0 -59.9 -38.2 27.8 37.8 -3.2 79 73 A Q S S- 0 0 142 1,-0.1 -1,-0.3 35,-0.0 34,-0.0 -0.983 125.6 -14.9-123.9 118.2 30.3 40.6 -3.6 80 74 A G - 0 0 19 -2,-0.4 -3,-2.9 -3,-0.2 2,-0.3 0.058 57.0-139.8 82.1 169.0 33.7 39.8 -5.1 81 75 A A E -HI 76 112A 13 31,-1.4 31,-2.8 -5,-0.2 2,-0.3 -0.970 11.2-168.3-163.8 155.0 35.7 36.7 -5.9 82 76 A W E -HI 75 111A 2 -7,-1.7 -7,-2.8 -2,-0.3 2,-0.4 -0.988 10.2-148.4-150.4 157.6 39.3 35.4 -5.7 83 77 A A E +HI 74 110A 33 27,-2.8 26,-1.9 -2,-0.3 27,-1.7 -0.968 29.1 149.3-127.0 143.2 41.5 32.5 -6.9 84 78 A G E -HI 73 108A 7 -11,-2.7 -11,-2.2 -2,-0.4 2,-0.4 -0.880 42.9 -92.4-156.2-172.2 44.4 31.1 -5.1 85 79 A E E -HI 72 107A 77 22,-1.5 22,-3.0 -2,-0.3 2,-0.2 -0.934 38.7-127.7-114.9 136.9 46.7 28.2 -4.3 86 80 A L E + I 0 106A 0 -15,-3.1 -17,-2.4 -2,-0.4 -16,-0.5 -0.591 44.2 130.6 -87.3 146.9 46.1 26.0 -1.2 87 81 A G E -HI 68 105A 0 18,-1.4 18,-2.9 -19,-0.3 2,-0.3 -0.922 42.9-112.3-168.8-172.2 48.7 25.3 1.4 88 82 A T E +HI 67 104A 16 -21,-2.3 -21,-2.6 -2,-0.3 2,-0.3 -0.971 31.3 158.6-139.3 154.9 49.4 25.3 5.1 89 83 A D E - I 0 103A 0 14,-1.7 14,-2.3 -2,-0.3 2,-0.2 -0.963 47.6 -74.7-163.2 170.6 51.6 27.3 7.4 90 84 A L E - I 0 102A 57 -2,-0.3 -63,-2.1 12,-0.2 2,-0.4 -0.564 49.4-170.0 -76.3 140.6 52.0 28.3 11.1 91 85 A V E +DI 26 101A 1 10,-2.8 10,-2.4 -2,-0.2 2,-0.3 -0.998 12.1 170.2-139.7 133.3 49.5 31.0 12.2 92 86 A S E -D 25 0A 25 -67,-2.2 -67,-3.0 -2,-0.4 8,-0.1 -0.930 27.9-138.8-136.3 158.6 49.2 33.1 15.3 93 87 A I > - 0 0 5 4,-0.6 3,-2.3 6,-0.5 6,-0.2 -0.941 14.4-155.8-122.5 102.1 47.1 36.0 16.3 94 88 A P T 3 S+ 0 0 50 0, 0.0 -1,-0.1 0, 0.0 -70,-0.1 0.835 96.0 31.9 -43.4 -48.2 49.4 38.5 18.3 95 89 A H T 3 S+ 0 0 80 -72,-0.4 -84,-0.1 -84,-0.1 3,-0.1 -0.093 119.2 64.6-106.5 32.9 46.5 40.1 20.2 96 90 A G S < S- 0 0 6 -3,-2.3 -87,-0.1 1,-0.4 74,-0.1 -0.252 101.9 -16.7-126.6-146.1 44.5 36.9 20.3 97 91 A P - 0 0 7 0, 0.0 2,-1.8 0, 0.0 -4,-0.6 -0.281 64.4-116.4 -64.4 149.5 45.0 33.5 21.9 98 92 A N S S+ 0 0 169 -3,-0.1 2,-0.3 -6,-0.1 -6,-0.0 -0.522 81.6 94.3 -87.0 69.9 48.5 32.6 23.1 99 93 A V - 0 0 39 -2,-1.8 -6,-0.5 -6,-0.2 2,-0.4 -0.941 60.6-142.7-150.2 167.4 48.9 29.7 20.7 100 94 A T - 0 0 83 -2,-0.3 2,-0.3 -8,-0.1 -8,-0.2 -0.996 23.5-178.6-137.8 129.6 50.3 28.9 17.2 101 95 A V E - I 0 91A 2 -10,-2.4 -10,-2.8 -2,-0.4 2,-0.8 -0.886 32.5-118.5-129.4 159.8 48.6 26.4 14.9 102 96 A R E + I 0 90A 52 -2,-0.3 2,-0.3 -12,-0.2 -12,-0.2 -0.896 47.3 175.4 -96.3 115.4 49.2 25.0 11.5 103 97 A A E - I 0 89A 2 -14,-2.3 -14,-1.7 -2,-0.8 2,-0.2 -0.807 36.8 -99.3-121.2 161.4 46.2 26.1 9.4 104 98 A N E - I 0 88A 32 36,-0.5 2,-0.4 -2,-0.3 -16,-0.3 -0.560 42.4-171.0 -74.3 142.6 45.1 25.9 5.8 105 99 A I E - I 0 87A 1 -18,-2.9 -18,-1.4 -2,-0.2 2,-0.6 -0.995 17.5-147.8-140.5 132.3 45.8 29.1 4.0 106 100 A A E -gI 45 86A 1 -62,-2.1 -60,-2.5 -2,-0.4 2,-0.9 -0.890 15.7-144.1-100.1 121.1 44.7 30.1 0.5 107 101 A A E -gI 46 85A 1 -22,-3.0 -22,-1.5 -2,-0.6 2,-0.6 -0.778 16.7-140.7 -87.8 107.4 47.3 32.3 -1.2 108 102 A I E +gI 47 84A 4 -62,-3.0 -60,-3.0 -2,-0.9 -59,-0.4 -0.560 34.5 161.0 -73.5 114.7 45.3 34.8 -3.3 109 103 A T E + 0 0 46 -26,-1.9 2,-0.3 -2,-0.6 -25,-0.2 0.678 67.0 21.7-104.9 -24.8 47.0 35.5 -6.6 110 104 A E E + I 0 83A 137 -27,-1.7 -27,-2.8 2,-0.0 -1,-0.3 -0.993 66.2 165.0-144.5 149.0 44.0 36.9 -8.5 111 105 A S E - I 0 82A 31 -2,-0.3 2,-0.4 -29,-0.3 -29,-0.2 -0.989 24.0-145.5-159.6 163.1 40.8 38.6 -7.6 112 106 A D E S- I 0 81A 101 -31,-2.8 -31,-1.4 -2,-0.3 -2,-0.0 -0.945 80.6 -24.1-140.9 115.4 37.9 40.7 -8.8 113 107 A K S S+ 0 0 165 -2,-0.4 -31,-0.1 -33,-0.2 3,-0.1 0.779 105.8 106.3 55.5 33.5 36.1 43.3 -6.7 114 108 A F + 0 0 14 -33,-0.2 -1,-0.1 -34,-0.2 -32,-0.1 0.844 61.6 60.8-101.9 -63.3 37.1 41.6 -3.4 115 109 A F S S- 0 0 11 7,-0.1 2,-0.5 1,-0.1 7,-0.1 -0.389 79.3-138.4 -67.3 146.1 39.9 43.8 -1.9 116 110 A I > - 0 0 49 5,-0.3 3,-2.2 -63,-0.1 4,-0.4 -0.941 17.4-113.3-115.1 126.2 38.7 47.3 -1.1 117 111 A N T 3 S+ 0 0 107 -2,-0.5 -64,-0.1 1,-0.3 -63,-0.1 -0.325 100.7 4.6 -57.4 124.0 40.8 50.4 -1.8 118 112 A G T 3 S+ 0 0 32 -65,-0.3 -1,-0.3 -2,-0.1 -100,-0.1 0.526 93.5 115.6 79.3 6.4 41.9 52.0 1.5 119 113 A S < - 0 0 1 -3,-2.2 -104,-0.6 -66,-0.2 -2,-0.1 0.714 68.0-143.1 -78.0 -22.3 40.4 49.3 3.7 120 114 A N + 0 0 22 -4,-0.4 2,-0.4 -67,-0.3 -86,-0.2 0.471 59.6 117.2 72.3 4.3 43.8 48.3 5.0 121 115 A W - 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