==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=19-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER ISOMERASE 18-AUG-04 1W6J . COMPND 2 MOLECULE: LANOSTEROL SYNTHASE; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR R.THOMA,T.SCHULZ-GASCH,B.D'ARCY,J.BENZ,J.AEBI,H.DEHMLOW, . 727 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 25850.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 477 65.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 32 4.4 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 6 0.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 3 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 . 1 0.1 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 . 27 3.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 93 12.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 281 38.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 13 1.8 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 1 0 1 1 2 1 1 3 3 4 3 1 2 1 0 0 0 1 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 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 0 0 0 0 PARALLEL BRIDGES PER LADDER . 8 0 1 1 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 0 ANTIPARALLEL BRIDGES PER LADDER . 2 1 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 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 C 0 0 133 0, 0.0 132,-0.3 0, 0.0 3,-0.1 0.000 360.0 360.0 360.0 -47.0 48.6 74.8 -12.2 2 7 A L + 0 0 97 1,-0.1 142,-0.4 130,-0.1 2,-0.4 0.581 360.0 42.9 -75.4 -10.9 44.8 74.4 -12.6 3 8 A R S S- 0 0 50 140,-0.1 2,-0.8 128,-0.0 -1,-0.1 -1.000 70.0-149.9-144.0 128.3 44.7 73.6 -8.9 4 9 A R - 0 0 77 138,-0.4 3,-0.4 136,-0.4 2,-0.2 -0.863 23.1-179.6-105.5 100.3 46.4 75.2 -5.9 5 10 A R + 0 0 60 -2,-0.8 681,-0.1 1,-0.2 136,-0.1 -0.595 55.0 42.1 -87.5 155.8 46.9 72.6 -3.1 6 11 A G S S+ 0 0 5 -2,-0.2 -1,-0.2 1,-0.2 680,-0.1 0.427 86.4 175.8 95.3 2.2 48.5 73.3 0.3 7 12 A G + 0 0 12 -3,-0.4 -1,-0.2 133,-0.1 2,-0.1 -0.063 49.9 84.2 -73.6-180.0 47.1 76.6 1.3 8 13 A P - 0 0 5 0, 0.0 2,-0.3 0, 0.0 676,-0.1 0.567 66.2-175.8 -59.0 143.1 46.7 78.9 3.1 9 14 A Y - 0 0 115 -2,-0.1 2,-0.3 119,-0.0 -2,-0.1 -0.856 32.8-102.6-106.2 147.2 49.9 80.5 1.9 10 15 A K + 0 0 140 -2,-0.3 2,-0.3 359,-0.1 359,-0.2 -0.532 49.3 174.6 -62.3 127.0 51.5 83.7 3.2 11 16 A T - 0 0 48 357,-1.4 359,-0.1 -2,-0.3 114,-0.0 -0.871 42.7 -73.1-129.5 170.0 50.8 86.5 0.7 12 17 A E - 0 0 174 -2,-0.3 116,-0.1 1,-0.1 2,-0.0 -0.439 56.1-129.4 -66.2 126.1 51.5 90.3 0.7 13 18 A P - 0 0 49 0, 0.0 -1,-0.1 0, 0.0 108,-0.1 -0.261 8.9-145.1 -76.4 164.1 49.1 92.0 3.2 14 19 A A S S+ 0 0 54 103,-0.1 2,-0.3 -2,-0.0 107,-0.1 0.334 84.4 33.3-107.0 2.9 46.9 95.0 2.6 15 20 A T S S- 0 0 24 105,-0.1 2,-1.0 106,-0.1 3,-0.1 -0.856 102.5 -76.5-144.3 175.9 47.2 96.4 6.1 16 21 A D > - 0 0 89 -2,-0.3 3,-2.4 1,-0.2 4,-0.3 -0.721 37.3-161.6 -82.6 102.0 49.9 96.5 8.9 17 22 A L G > S+ 0 0 16 -2,-1.0 3,-1.1 1,-0.3 -1,-0.2 0.740 85.3 71.0 -60.5 -23.5 49.7 93.0 10.3 18 23 A G G 3 S+ 0 0 29 1,-0.2 -1,-0.3 -3,-0.1 25,-0.2 0.646 96.3 53.7 -63.5 -17.7 51.5 94.3 13.5 19 24 A R G < S+ 0 0 78 -3,-2.4 15,-2.7 15,-0.1 2,-0.3 0.478 82.7 104.6 -97.0 -6.5 48.2 96.1 14.4 20 25 A W E < -A 33 0A 0 -3,-1.1 2,-0.4 -4,-0.3 13,-0.2 -0.614 49.8-168.9 -80.2 137.3 45.8 93.1 14.2 21 26 A R E -A 32 0A 23 11,-2.9 11,-2.6 -2,-0.3 2,-0.5 -0.978 14.1-146.7-126.4 139.3 44.5 91.7 17.5 22 27 A L E -A 31 0A 7 -2,-0.4 2,-0.4 9,-0.2 9,-0.2 -0.912 15.6-165.7-102.7 127.2 42.6 88.5 18.3 23 28 A N E -A 30 0A 70 7,-2.6 7,-2.0 -2,-0.5 2,-0.4 -0.950 3.4-170.7-117.5 136.1 40.2 88.6 21.1 24 29 A C E +A 29 0A 13 -2,-0.4 2,-0.3 5,-0.2 5,-0.2 -0.986 11.9 166.9-129.4 126.4 38.7 85.5 22.7 25 30 A E E > S-A 28 0A 142 3,-1.3 3,-1.7 -2,-0.4 -2,-0.0 -0.919 79.0 -19.8-142.5 118.2 35.9 85.2 25.3 26 31 A R T 3 S- 0 0 131 -2,-0.3 416,-0.5 1,-0.3 417,-0.3 0.832 130.2 -49.2 52.0 36.1 34.2 81.9 26.1 27 32 A G T 3 S+ 0 0 0 1,-0.3 -1,-0.3 414,-0.1 2,-0.1 -0.007 104.3 135.0 97.9 -28.6 35.5 80.5 22.8 28 33 A R E < -A 25 0A 76 -3,-1.7 -3,-1.3 1,-0.1 2,-0.5 -0.342 39.7-158.2 -58.5 127.3 34.3 83.5 20.7 29 34 A Q E +A 24 0A 4 348,-0.4 2,-0.3 333,-0.3 335,-0.2 -0.937 20.2 160.7-114.8 116.9 37.0 84.6 18.2 30 35 A T E -A 23 0A 27 -7,-2.0 -7,-2.6 -2,-0.5 2,-0.3 -0.999 26.6-139.2-134.5 143.2 36.9 88.2 16.7 31 36 A W E -A 22 0A 2 -2,-0.3 2,-0.4 333,-0.3 -9,-0.2 -0.783 14.3-168.0-103.2 143.0 39.7 90.2 15.1 32 37 A T E -A 21 0A 62 -11,-2.6 -11,-2.9 -2,-0.3 2,-0.8 -0.989 16.2-143.8-128.7 136.1 40.3 93.9 15.6 33 38 A Y E -A 20 0A 41 83,-0.5 -13,-0.2 -2,-0.4 83,-0.1 -0.891 26.2-135.3 -98.9 105.5 42.6 96.3 13.6 34 39 A L + 0 0 27 -15,-2.7 6,-0.1 -2,-0.8 -15,-0.1 -0.378 24.8 179.5 -60.7 135.2 44.2 98.8 16.1 35 40 A Q S S+ 0 0 137 4,-0.2 -1,-0.1 -2,-0.1 3,-0.1 0.722 81.7 42.6-105.8 -37.9 44.1 102.4 14.8 36 41 A D S S+ 0 0 116 3,-0.3 2,-2.3 1,-0.2 4,-0.1 0.892 74.6 179.2 -75.5 -45.3 45.8 104.1 17.8 37 42 A E S S+ 0 0 28 2,-0.5 2,-2.9 1,-0.2 -1,-0.2 -0.468 72.9 68.1 76.4 -72.8 48.5 101.4 18.3 38 43 A R S S+ 0 0 76 -2,-2.3 -1,-0.2 1,-0.2 2,-0.0 -0.402 99.6 60.6 -69.4 65.4 50.1 103.3 21.2 39 44 A A S S+ 0 0 45 -2,-2.9 -2,-0.5 2,-0.1 -3,-0.3 -0.245 94.4 41.1 160.1 83.2 46.9 102.4 23.0 40 45 A G S S- 0 0 66 -4,-0.1 2,-0.3 -6,-0.1 -2,-0.1 -0.837 92.8 -63.1 165.5-125.4 46.1 98.7 23.5 41 46 A R - 0 0 102 -2,-0.2 -2,-0.1 -4,-0.1 2,-0.1 -0.953 54.8 -78.9-148.1 170.1 48.4 95.8 24.3 42 47 A E - 0 0 179 -2,-0.3 2,-0.1 1,-0.1 0, 0.0 -0.387 52.4-102.2 -69.7 144.8 51.4 94.1 22.8 43 48 A Q - 0 0 24 -25,-0.2 2,-0.1 -2,-0.1 -1,-0.1 -0.453 40.4-134.3 -67.0 138.5 50.9 91.6 20.0 44 49 A T > - 0 0 53 -2,-0.1 4,-2.4 -22,-0.1 5,-0.1 -0.376 18.1-111.7 -92.6 169.6 51.1 88.0 21.1 45 50 A G H > S+ 0 0 8 2,-0.2 4,-2.7 1,-0.2 5,-0.1 0.834 118.4 55.6 -66.0 -36.5 52.9 84.9 19.6 46 51 A L H > S+ 0 0 19 2,-0.2 4,-2.8 35,-0.2 -1,-0.2 0.928 109.0 46.9 -59.8 -47.6 49.5 83.3 18.8 47 52 A E H > S+ 0 0 1 2,-0.2 4,-2.2 1,-0.2 6,-0.2 0.947 112.4 49.4 -61.8 -49.5 48.6 86.4 16.8 48 53 A A H X>S+ 0 0 1 -4,-2.4 5,-2.5 1,-0.2 4,-1.1 0.911 113.0 48.4 -53.5 -45.9 51.9 86.5 15.0 49 54 A Y H <5S+ 0 0 38 -4,-2.7 3,-0.4 1,-0.2 -2,-0.2 0.924 112.0 47.7 -62.7 -46.4 51.5 82.8 14.2 50 55 A A H <5S+ 0 0 8 -4,-2.8 -1,-0.2 1,-0.2 -2,-0.2 0.850 116.1 43.7 -64.1 -34.5 47.9 83.2 12.9 51 56 A L H <5S- 0 0 3 -4,-2.2 -1,-0.2 -5,-0.2 -2,-0.2 0.578 114.6-114.4 -87.2 -13.6 48.8 86.2 10.7 52 57 A G T <5 + 0 0 14 -4,-1.1 -3,-0.2 -3,-0.4 2,-0.1 0.737 63.5 148.0 82.7 24.2 52.0 84.6 9.4 53 58 A L < - 0 0 54 -5,-2.5 -1,-0.2 -6,-0.2 2,-0.2 -0.481 62.7 -78.6 -79.3 161.1 54.4 87.0 11.0 54 59 A D - 0 0 103 -2,-0.1 3,-0.2 1,-0.1 -1,-0.1 -0.430 43.5-174.0 -58.8 125.9 57.9 85.9 12.1 55 60 A T >> + 0 0 23 -2,-0.2 3,-2.7 1,-0.1 4,-2.7 0.369 50.2 110.9-105.3 3.9 57.5 84.0 15.5 56 61 A K T 34 S+ 0 0 136 1,-0.3 -1,-0.1 2,-0.2 5,-0.1 0.799 78.3 53.9 -51.9 -32.6 61.2 83.5 16.3 57 62 A N T 34 S+ 0 0 155 -3,-0.2 -1,-0.3 1,-0.1 3,-0.1 0.578 118.4 35.6 -76.9 -10.7 61.1 86.0 19.2 58 63 A Y T <4 S+ 0 0 105 -3,-2.7 2,-0.6 1,-0.2 -2,-0.2 0.788 123.0 36.5-102.9 -46.4 58.1 84.1 20.8 59 64 A F S < S- 0 0 33 -4,-2.7 -1,-0.2 -14,-0.1 -4,-0.1 -0.913 78.6-154.2-121.4 102.4 58.8 80.4 20.0 60 65 A K - 0 0 161 -2,-0.6 2,-0.2 -3,-0.1 -3,-0.1 -0.206 29.0 -89.1 -74.5 160.9 62.5 79.4 20.2 61 66 A D - 0 0 92 -5,-0.1 618,-0.3 619,-0.1 -1,-0.1 -0.491 44.1-152.4 -65.4 137.7 64.2 76.6 18.5 62 67 A L - 0 0 27 616,-3.2 618,-0.1 -2,-0.2 3,-0.1 -0.749 33.1 -78.2-108.6 160.5 64.1 73.4 20.5 63 68 A P - 0 0 105 0, 0.0 11,-0.1 0, 0.0 -1,-0.1 -0.361 60.1 -96.3 -59.9 135.9 66.7 70.5 20.4 64 69 A K - 0 0 143 1,-0.1 2,-0.4 2,-0.1 7,-0.1 -0.288 40.1-127.3 -59.3 133.0 66.1 68.2 17.4 65 70 A A + 0 0 6 608,-0.2 -1,-0.1 1,-0.1 611,-0.1 -0.673 33.9 168.7 -89.6 130.7 64.0 65.2 18.2 66 71 A H + 0 0 129 -2,-0.4 2,-0.3 659,-0.0 -1,-0.1 0.376 66.2 49.8-117.6 -1.2 65.3 61.7 17.3 67 72 A T S > S- 0 0 22 657,-0.1 4,-2.3 658,-0.1 657,-0.2 -0.887 87.8-109.4-131.9 166.2 62.8 59.7 19.3 68 73 A A H > S+ 0 0 0 655,-2.9 4,-2.7 -2,-0.3 5,-0.2 0.884 118.0 54.1 -61.8 -40.9 59.0 59.6 19.5 69 74 A F H > S+ 0 0 66 655,-1.8 4,-2.6 654,-0.3 -1,-0.2 0.926 110.6 44.6 -59.4 -48.9 59.2 61.0 23.1 70 75 A E H > S+ 0 0 78 2,-0.2 4,-2.6 1,-0.2 5,-0.2 0.872 113.4 51.0 -65.7 -38.5 61.3 64.0 22.0 71 76 A G H X S+ 0 0 0 -4,-2.3 4,-2.3 2,-0.2 -2,-0.2 0.940 113.3 44.6 -64.0 -47.3 59.1 64.7 19.0 72 77 A A H X S+ 0 0 2 -4,-2.7 4,-2.3 2,-0.2 -2,-0.2 0.903 113.8 50.1 -61.7 -43.6 55.9 64.6 21.1 73 78 A L H X S+ 0 0 28 -4,-2.6 4,-2.7 2,-0.2 -2,-0.2 0.935 112.4 46.4 -61.5 -50.0 57.5 66.8 23.8 74 79 A N H X S+ 0 0 17 -4,-2.6 4,-2.3 1,-0.2 -1,-0.2 0.884 111.8 53.2 -56.9 -41.6 58.7 69.4 21.3 75 80 A G H X S+ 0 0 0 -4,-2.3 4,-2.8 -5,-0.2 -2,-0.2 0.898 111.2 44.7 -61.3 -43.2 55.3 69.3 19.7 76 81 A M H X S+ 0 0 4 -4,-2.3 4,-2.8 2,-0.2 5,-0.3 0.877 109.2 56.3 -70.3 -39.9 53.5 70.0 23.0 77 82 A T H X S+ 0 0 58 -4,-2.7 4,-0.8 -5,-0.2 -2,-0.2 0.942 115.2 38.7 -58.4 -45.8 56.0 72.7 23.9 78 83 A F H >< S+ 0 0 4 -4,-2.3 3,-1.0 -5,-0.2 4,-0.3 0.987 118.9 45.7 -64.2 -56.4 55.1 74.5 20.6 79 84 A Y H >< S+ 0 0 2 -4,-2.8 3,-2.1 1,-0.3 4,-0.3 0.849 104.8 59.7 -64.5 -36.4 51.4 73.8 20.6 80 85 A V H >< S+ 0 0 27 -4,-2.8 3,-1.5 1,-0.3 -1,-0.3 0.857 97.4 64.0 -58.0 -32.4 50.8 74.7 24.3 81 86 A G T << S+ 0 0 38 -3,-1.0 -1,-0.3 -4,-0.8 -2,-0.2 0.595 96.5 57.7 -67.2 -12.1 52.1 78.2 23.4 82 87 A L T < S+ 0 0 7 -3,-2.1 8,-0.6 -4,-0.3 -1,-0.3 0.401 75.8 121.7 -97.6 -1.0 49.1 78.7 21.0 83 88 A Q B < -B 89 0B 35 -3,-1.5 6,-0.2 -4,-0.3 -37,-0.1 -0.395 63.1-124.3 -62.1 136.8 46.4 78.1 23.7 84 89 A A > - 0 0 10 4,-2.9 3,-1.7 1,-0.1 -1,-0.1 -0.326 26.8-102.6 -76.9 169.6 44.1 81.2 24.0 85 90 A E T 3 S+ 0 0 115 1,-0.3 -1,-0.1 2,-0.1 -2,-0.1 0.705 120.9 55.4 -74.0 -20.8 43.6 82.9 27.4 86 91 A D T 3 S- 0 0 19 2,-0.1 -1,-0.3 325,-0.0 3,-0.1 0.327 122.5-103.7 -89.9 6.1 40.2 81.2 28.0 87 92 A G S < S+ 0 0 0 -3,-1.7 2,-0.2 1,-0.3 -2,-0.1 0.268 84.1 109.6 96.4 -10.1 41.8 77.8 27.5 88 93 A H - 0 0 0 324,-0.1 -4,-2.9 -5,-0.1 2,-0.4 -0.514 65.6-117.8 -90.6 165.9 40.7 76.8 24.0 89 94 A W B -B 83 0B 2 291,-0.5 295,-0.2 -6,-0.2 294,-0.2 -0.876 28.0-149.1-104.2 140.2 42.8 76.5 20.8 90 95 A T + 0 0 12 -8,-0.6 2,-0.2 -2,-0.4 288,-0.1 -0.344 20.3 162.5 -97.6 175.3 42.0 78.7 17.8 91 96 A G - 0 0 4 -2,-0.1 288,-0.2 609,-0.1 2,-0.2 -0.780 44.5 -86.7 172.2 153.6 42.4 78.3 14.1 92 97 A D + 0 0 12 -2,-0.2 608,-0.9 1,-0.1 609,-0.1 -0.469 37.6 176.6 -55.7 122.8 41.7 79.1 10.5 93 98 A Y + 0 0 14 -2,-0.2 282,-2.5 606,-0.1 283,-0.2 -0.184 38.4 113.5-128.8 39.7 38.6 77.1 9.6 94 99 A G + 0 0 1 280,-0.2 604,-3.0 1,-0.1 280,-0.1 -0.125 9.8 119.3 -93.3-164.1 38.1 78.4 6.0 95 100 A G + 0 0 0 1,-0.6 45,-2.0 278,-0.2 602,-0.2 -0.339 52.7 94.6 137.7 -54.7 38.4 76.5 2.7 96 101 A P B -C 139 0C 8 0, 0.0 -1,-0.6 0, 0.0 43,-0.3 -0.393 56.0-157.2 -65.4 148.5 35.0 76.8 1.1 97 102 A L S S+ 0 0 9 41,-2.5 42,-0.2 1,-0.1 41,-0.0 0.225 77.6 72.3-118.0 16.7 34.6 79.7 -1.4 98 103 A F S S+ 0 0 10 40,-0.4 4,-0.5 2,-0.1 -1,-0.1 0.214 82.6 73.7-113.9 13.8 30.8 80.2 -1.4 99 104 A L S > S+ 0 0 10 -3,-0.2 4,-1.8 2,-0.1 3,-0.2 0.916 90.5 48.8 -92.4 -56.1 30.6 81.8 2.1 100 105 A L H > S+ 0 0 8 1,-0.2 4,-2.7 2,-0.2 5,-0.3 0.868 106.0 59.4 -54.2 -42.7 32.0 85.3 1.7 101 106 A P H > S+ 0 0 0 0, 0.0 4,-2.5 0, 0.0 5,-0.3 0.934 105.5 48.3 -55.0 -46.3 29.8 86.0 -1.4 102 107 A G H > S+ 0 0 2 -4,-0.5 4,-1.9 -3,-0.2 -2,-0.2 0.910 113.4 48.5 -57.0 -45.8 26.6 85.5 0.5 103 108 A L H X S+ 0 0 1 -4,-1.8 4,-2.5 2,-0.2 -1,-0.2 0.905 113.6 45.5 -58.2 -48.3 27.9 87.7 3.3 104 109 A L H X S+ 0 0 4 -4,-2.7 4,-2.1 2,-0.2 -2,-0.2 0.851 110.9 51.2 -73.0 -36.8 28.9 90.5 0.9 105 110 A I H X S+ 0 0 0 -4,-2.5 4,-2.7 -5,-0.3 -1,-0.2 0.923 113.0 47.7 -63.0 -40.8 25.7 90.5 -1.1 106 111 A T H X S+ 0 0 0 -4,-1.9 4,-3.0 -5,-0.3 -2,-0.2 0.917 110.4 51.6 -66.9 -42.3 23.8 90.7 2.2 107 112 A C H <>S+ 0 0 11 -4,-2.5 5,-2.0 2,-0.2 4,-0.4 0.852 110.9 48.8 -59.7 -37.9 26.0 93.5 3.3 108 113 A H H ><5S+ 0 0 45 -4,-2.1 3,-0.9 3,-0.2 -2,-0.2 0.970 114.8 43.7 -67.5 -51.4 25.3 95.3 0.0 109 114 A V H 3<5S+ 0 0 17 -4,-2.7 -2,-0.2 1,-0.2 -3,-0.2 0.917 122.5 37.1 -58.7 -48.5 21.5 94.9 0.3 110 115 A A T 3<5S- 0 0 6 -4,-3.0 -1,-0.2 -5,-0.2 -2,-0.2 0.299 108.2-121.3 -92.7 8.8 21.3 95.8 4.0 111 116 A R T < 5 + 0 0 214 -3,-0.9 -3,-0.2 -4,-0.4 -4,-0.1 0.851 49.1 168.0 59.2 41.4 24.0 98.5 3.8 112 117 A I < - 0 0 15 -5,-2.0 -1,-0.2 -6,-0.2 2,-0.2 -0.781 21.6-155.8 -90.8 115.8 26.3 96.9 6.4 113 118 A P - 0 0 111 0, 0.0 -5,-0.0 0, 0.0 0, 0.0 -0.560 15.9-130.7 -81.6 151.5 29.8 98.4 6.6 114 119 A L - 0 0 40 -2,-0.2 5,-0.2 1,-0.1 3,-0.1 -0.742 31.8 -91.0 -99.8 153.5 32.5 96.1 8.0 115 120 A P >> - 0 0 66 0, 0.0 3,-1.8 0, 0.0 4,-0.5 -0.109 62.8 -64.3 -58.4 163.9 34.9 97.3 10.7 116 121 A A T 34 S+ 0 0 46 1,-0.2 -83,-0.5 2,-0.1 -81,-0.0 -0.193 122.3 15.9 -55.2 133.2 38.3 98.9 10.0 117 122 A G T 3> S+ 0 0 3 -3,-0.1 4,-2.1 -85,-0.1 -1,-0.2 -0.077 100.3 97.5 95.9 -28.6 40.7 96.7 8.1 118 123 A Y H <> S+ 0 0 6 -3,-1.8 4,-2.7 1,-0.2 5,-0.2 0.915 80.9 46.8 -64.4 -50.1 38.1 94.1 7.1 119 124 A R H X S+ 0 0 109 -4,-0.5 4,-2.3 1,-0.2 5,-0.2 0.942 113.5 49.9 -57.7 -49.2 37.4 95.3 3.5 120 125 A E H > S+ 0 0 76 1,-0.2 4,-1.7 2,-0.2 -1,-0.2 0.899 115.5 42.6 -52.8 -46.8 41.1 95.6 2.7 121 126 A E H X S+ 0 0 0 -4,-2.1 4,-2.2 2,-0.2 250,-1.0 0.832 110.7 53.1 -81.2 -31.3 41.9 92.1 4.0 122 127 A I H X S+ 0 0 0 -4,-2.7 4,-2.6 2,-0.2 5,-0.2 0.944 110.8 48.9 -63.4 -49.4 38.8 90.3 2.5 123 128 A V H X S+ 0 0 15 -4,-2.3 4,-2.3 -5,-0.2 5,-0.2 0.919 110.4 52.1 -50.1 -47.3 39.8 91.8 -0.9 124 129 A R H X S+ 0 0 14 -4,-1.7 4,-2.2 -5,-0.2 -2,-0.2 0.898 109.4 49.1 -64.1 -39.4 43.4 90.6 -0.3 125 130 A Y H X S+ 0 0 2 -4,-2.2 4,-2.3 246,-0.2 5,-0.3 0.955 110.5 49.2 -58.9 -54.4 42.2 87.0 0.5 126 131 A L H X S+ 0 0 0 -4,-2.6 4,-1.1 1,-0.2 -2,-0.2 0.882 113.8 46.7 -58.5 -38.5 40.0 86.7 -2.6 127 132 A R H < S+ 0 0 77 -4,-2.3 -1,-0.2 -5,-0.2 -2,-0.2 0.897 110.9 53.8 -64.6 -42.5 42.9 88.0 -4.7 128 133 A S H < S+ 0 0 24 -4,-2.2 -2,-0.2 241,-0.3 -1,-0.2 0.845 113.0 41.0 -62.2 -37.0 45.3 85.5 -3.0 129 134 A V H < S+ 0 0 11 -4,-2.3 -1,-0.2 240,-0.1 -2,-0.2 0.609 83.5 117.6 -93.2 -11.7 43.1 82.5 -3.7 130 135 A Q < - 0 0 8 -4,-1.1 6,-0.2 -5,-0.3 5,-0.1 -0.309 69.6-119.1 -47.8 135.1 42.2 83.4 -7.3 131 136 A L > - 0 0 6 4,-3.0 3,-2.4 1,-0.1 -129,-0.1 -0.402 19.4-106.4 -78.7 158.3 43.6 80.6 -9.5 132 137 A P T 3 S+ 0 0 74 0, 0.0 -130,-0.1 0, 0.0 -1,-0.1 0.840 121.2 59.5 -50.9 -34.5 46.2 81.2 -12.3 133 138 A D T 3 S- 0 0 52 -132,-0.3 41,-0.1 1,-0.1 3,-0.1 0.541 122.3-107.7 -75.6 -3.2 43.5 80.8 -14.9 134 139 A G S < S+ 0 0 0 -3,-2.4 41,-0.1 1,-0.3 2,-0.1 0.258 84.0 95.3 101.2 -10.2 41.6 83.7 -13.3 135 140 A G - 0 0 0 -5,-0.1 -4,-3.0 39,-0.1 2,-0.3 -0.224 59.4-134.6-104.3-172.0 38.8 81.8 -11.7 136 141 A W B -D 145 0D 1 9,-0.5 9,-2.6 -6,-0.2 13,-0.7 -0.984 15.9-151.6-142.0 151.5 37.8 80.3 -8.3 137 142 A G - 0 0 1 2,-0.4 7,-0.2 5,-0.3 3,-0.1 -0.135 43.9 -75.8-105.3-158.7 36.2 76.9 -7.5 138 143 A L S S- 0 0 12 5,-0.4 -41,-2.5 1,-0.1 -40,-0.4 0.799 112.6 -1.9 -71.9 -29.2 34.0 75.5 -4.8 139 144 A H B > S-C 96 0C 1 -43,-0.3 3,-2.0 4,-0.2 -2,-0.4 -0.914 90.1 -81.9-155.8 174.2 36.9 75.4 -2.3 140 145 A I T 3 S+ 0 0 19 -45,-2.0 -136,-0.4 1,-0.3 -133,-0.1 0.674 124.8 46.2 -66.1 -19.9 40.6 76.3 -2.1 141 146 A E T 3 S+ 0 0 3 -46,-0.1 -1,-0.3 -138,-0.1 2,-0.2 0.266 96.5 101.0-100.6 13.0 41.8 72.9 -3.6 142 147 A D S < S- 0 0 23 -3,-2.0 -138,-0.4 -138,-0.1 -5,-0.3 -0.580 74.1-114.9 -96.9 154.8 39.3 73.0 -6.5 143 148 A K - 0 0 100 -2,-0.2 -5,-0.4 1,-0.2 -4,-0.2 -0.356 56.1 -71.3 -70.1 168.2 39.7 74.0 -10.1 144 149 A S + 0 0 13 -142,-0.4 -7,-0.3 -7,-0.2 2,-0.3 -0.321 58.2 177.0 -67.5 142.2 37.8 77.1 -11.4 145 150 A T B > -D 136 0D 14 -9,-2.6 4,-2.4 -3,-0.1 -9,-0.5 -0.897 43.5-111.1-136.4 169.0 34.0 76.8 -11.7 146 151 A V H > S+ 0 0 0 -2,-0.3 4,-2.3 2,-0.2 5,-0.4 0.888 117.1 55.5 -66.6 -41.1 31.1 79.1 -12.6 147 152 A F H > S+ 0 0 4 1,-0.2 4,-1.3 2,-0.2 -1,-0.2 0.935 115.9 35.9 -56.1 -51.0 29.9 79.0 -9.0 148 153 A G H > S+ 0 0 2 -12,-0.4 4,-1.8 2,-0.2 -11,-0.3 0.901 120.1 46.8 -72.7 -41.3 33.2 80.2 -7.6 149 154 A T H X S+ 0 0 0 -4,-2.4 4,-2.3 -13,-0.7 5,-0.2 0.961 114.1 44.5 -71.2 -50.8 34.2 82.6 -10.3 150 155 A A H X S+ 0 0 0 -4,-2.3 4,-2.2 -5,-0.2 -1,-0.2 0.905 116.8 45.9 -59.5 -44.9 30.9 84.4 -10.7 151 156 A L H X S+ 0 0 1 -4,-1.3 4,-1.6 -5,-0.4 -1,-0.2 0.804 115.4 44.3 -74.7 -31.8 30.3 84.8 -7.0 152 157 A N H X S+ 0 0 0 -4,-1.8 4,-2.1 2,-0.2 -1,-0.2 0.806 110.9 54.9 -83.0 -27.9 33.8 86.0 -6.1 153 158 A Y H X S+ 0 0 1 -4,-2.3 4,-2.2 -5,-0.2 -2,-0.2 0.974 111.7 44.8 -57.4 -56.0 33.9 88.3 -9.1 154 159 A V H X S+ 0 0 0 -4,-2.2 4,-2.8 1,-0.2 -2,-0.2 0.888 109.8 57.0 -55.7 -43.2 30.7 89.9 -7.7 155 160 A S H X S+ 0 0 0 -4,-1.6 4,-1.6 1,-0.2 -1,-0.2 0.913 108.8 44.8 -54.7 -48.7 32.2 89.9 -4.2 156 161 A L H <>S+ 0 0 0 -4,-2.1 5,-2.4 2,-0.2 -1,-0.2 0.867 111.9 52.4 -67.1 -36.8 35.2 92.0 -5.3 157 162 A R H ><5S+ 0 0 23 -4,-2.2 3,-1.5 1,-0.2 -2,-0.2 0.931 109.3 50.0 -64.3 -44.8 33.0 94.4 -7.3 158 163 A I H 3<5S+ 0 0 29 -4,-2.8 -1,-0.2 1,-0.3 -2,-0.2 0.841 104.8 58.4 -58.2 -36.6 30.8 94.9 -4.2 159 164 A L T 3<5S- 0 0 13 -4,-1.6 -1,-0.3 -5,-0.2 -2,-0.2 0.457 130.6 -94.7 -77.2 -2.7 34.0 95.6 -2.2 160 165 A G T < 5S+ 0 0 58 -3,-1.5 2,-0.3 1,-0.3 -3,-0.2 0.501 77.4 140.5 109.8 7.5 34.7 98.4 -4.6 161 166 A V < - 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