==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=8-MAY-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER OXIDOREDUCTASE/OXIDOREDUCTASE INHIBITOR 01-MAR-10 3LZ6 . COMPND 2 MOLECULE: CORTICOSTEROID 11-BETA-DEHYDROGENASE ISOZYME 1; . SOURCE 2 ORGANISM_SCIENTIFIC: CAVIA PORCELLUS; . AUTHOR T.A.PAULY . 1052 4 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 42092.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 797 75.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 144 13.7 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 8 0.8 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 . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 0 0.0 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 . 2 0.2 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 . 75 7.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 84 8.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 431 41.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 32 3.0 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 4 0 4 0 0 1 7 4 5 3 4 0 4 0 0 0 0 0 3 1 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 4 0 4 12 0 4 4 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 . 4 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 ANTIPARALLEL BRIDGES PER LADDER . 0 0 0 0 0 4 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 1 A K 0 0 212 0, 0.0 2,-0.2 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 138.9 20.6 -4.3 39.2 2 2 A F - 0 0 30 3,-0.0 220,-0.1 2,-0.0 221,-0.0 -0.549 360.0-177.2 -74.3 139.2 21.3 -2.4 42.4 3 3 A R > - 0 0 124 -2,-0.2 3,-2.7 219,-0.1 4,-0.2 -0.998 31.8-134.7-131.0 136.6 22.8 -4.2 45.4 4 4 A P G > S+ 0 0 57 0, 0.0 3,-1.9 0, 0.0 4,-0.4 0.760 102.9 76.0 -62.6 -21.4 23.4 -2.6 48.8 5 5 A E G > S+ 0 0 122 1,-0.3 3,-0.5 2,-0.2 -3,-0.0 0.690 79.0 73.2 -55.3 -23.4 26.8 -4.3 48.7 6 6 A M G < S+ 0 0 50 -3,-2.7 -1,-0.3 1,-0.2 26,-0.0 0.621 100.3 42.2 -70.2 -14.6 27.8 -1.7 46.2 7 7 A L G X S+ 0 0 2 -3,-1.9 3,-2.1 -4,-0.2 2,-0.3 0.462 82.9 121.1-109.3 -2.0 28.0 1.0 49.0 8 8 A Q T < S- 0 0 135 -3,-0.5 26,-0.2 -4,-0.4 25,-0.2 -0.442 91.7 -0.5 -68.8 121.8 29.8 -1.2 51.6 9 9 A G T 3 S+ 0 0 34 24,-2.3 -1,-0.3 1,-0.3 25,-0.2 0.425 99.8 139.5 81.1 -0.3 33.0 0.4 52.5 10 10 A K < - 0 0 84 -3,-2.1 25,-2.7 1,-0.1 2,-0.6 -0.487 54.3-124.0 -81.2 153.4 32.4 3.3 50.1 11 11 A K E +a 35 0A 55 23,-0.2 78,-3.0 -2,-0.1 79,-1.7 -0.864 36.9 179.6-106.3 114.8 33.3 6.8 51.1 12 12 A V E -ab 36 90A 0 23,-2.3 25,-2.1 -2,-0.6 2,-0.4 -0.948 23.4-157.7-132.1 128.0 30.4 9.2 50.9 13 13 A I E -ab 37 91A 0 77,-2.6 79,-2.5 -2,-0.4 2,-0.5 -0.869 13.6-170.5 -96.2 136.6 29.7 12.8 51.6 14 14 A V E -ab 38 92A 0 23,-2.2 25,-1.6 -2,-0.4 3,-0.3 -0.985 5.1-161.2-127.4 118.8 26.1 13.9 52.3 15 15 A T S S+ 0 0 0 77,-2.3 25,-0.2 -2,-0.5 23,-0.0 -0.621 73.4 27.6 -95.8 163.8 25.2 17.6 52.4 16 16 A G S S+ 0 0 16 23,-0.2 6,-0.5 -2,-0.2 3,-0.4 0.934 80.8 146.8 51.4 49.5 22.0 19.0 54.0 17 17 A A + 0 0 0 22,-2.9 23,-0.2 -3,-0.3 -1,-0.1 0.303 35.7 88.4-103.1 8.8 22.1 15.9 56.2 18 18 A S S S- 0 0 14 21,-0.3 2,-0.3 1,-0.1 -1,-0.2 0.601 104.0 -13.9 -86.6 -15.2 20.6 17.3 59.5 19 19 A K S >> S+ 0 0 115 -3,-0.4 4,-1.6 27,-0.0 3,-0.6 -0.943 105.8 30.3-165.4-176.1 16.9 16.6 58.5 20 20 A G H 3> S- 0 0 11 -2,-0.3 4,-1.8 1,-0.2 5,-0.1 -0.105 117.3 -16.8 59.2-143.5 14.7 15.7 55.6 21 21 A I H 3> S+ 0 0 24 1,-0.2 4,-2.3 2,-0.2 -1,-0.2 0.865 134.8 57.9 -67.2 -40.5 15.9 13.7 52.7 22 22 A G H <> S+ 0 0 0 -3,-0.6 4,-2.2 -6,-0.5 -5,-0.2 0.903 105.7 49.7 -57.5 -47.3 19.6 14.2 53.5 23 23 A R H X S+ 0 0 77 -4,-1.6 4,-2.2 -7,-0.3 -1,-0.2 0.944 111.7 48.7 -56.0 -46.5 19.2 12.7 56.9 24 24 A E H X S+ 0 0 27 -4,-1.8 4,-2.4 1,-0.2 -2,-0.2 0.845 108.1 54.4 -65.2 -33.3 17.4 9.7 55.4 25 25 A I H X S+ 0 0 0 -4,-2.3 4,-2.5 2,-0.2 -1,-0.2 0.956 107.2 51.3 -65.1 -48.8 20.2 9.3 52.8 26 26 A A H X S+ 0 0 0 -4,-2.2 4,-2.4 1,-0.2 -2,-0.2 0.923 110.2 49.8 -50.3 -50.0 22.7 9.2 55.6 27 27 A Y H X S+ 0 0 37 -4,-2.2 4,-2.5 1,-0.2 -1,-0.2 0.907 109.5 49.7 -59.8 -48.1 20.7 6.4 57.4 28 28 A H H X S+ 0 0 36 -4,-2.4 4,-1.1 1,-0.2 -1,-0.2 0.916 111.5 48.6 -57.9 -42.8 20.4 4.3 54.3 29 29 A L H <>S+ 0 0 0 -4,-2.5 5,-2.6 1,-0.2 4,-0.4 0.865 108.7 54.9 -64.5 -38.0 24.1 4.5 53.6 30 30 A A H ><5S+ 0 0 0 -4,-2.4 3,-1.6 1,-0.2 -2,-0.2 0.922 105.8 51.9 -57.8 -49.3 24.9 3.6 57.3 31 31 A K H 3<5S+ 0 0 112 -4,-2.5 -1,-0.2 1,-0.3 -2,-0.2 0.794 107.8 52.1 -58.7 -31.0 22.8 0.5 56.9 32 32 A M T 3<5S- 0 0 25 -4,-1.1 -1,-0.3 -5,-0.2 -2,-0.2 0.490 120.3-110.0 -83.9 -6.2 24.7 -0.5 53.8 33 33 A G T < 5 + 0 0 14 -3,-1.6 -24,-2.3 -4,-0.4 -3,-0.2 0.706 63.0 152.8 81.0 29.5 28.0 -0.0 55.7 34 34 A A < - 0 0 0 -5,-2.6 25,-1.6 -26,-0.2 26,-1.0 -0.373 49.3-117.6 -73.2 159.7 29.4 3.1 54.0 35 35 A H E -ac 11 60A 48 -25,-2.7 -23,-2.3 24,-0.2 2,-0.4 -0.902 41.7-167.2 -86.4 137.0 31.7 5.5 55.6 36 36 A V E -ac 12 61A 0 24,-2.1 26,-2.0 -2,-0.5 2,-0.4 -0.975 25.9-169.3-130.6 140.8 29.8 8.8 55.8 37 37 A V E -ac 13 62A 0 -25,-2.1 -23,-2.2 -2,-0.4 2,-0.3 -0.995 24.1-166.8-116.2 126.8 30.7 12.4 56.5 38 38 A V E -ac 14 63A 0 24,-2.7 26,-1.9 -2,-0.4 2,-0.3 -0.717 5.7-172.6-115.8 156.5 27.6 14.6 56.8 39 39 A T E + c 0 64A 0 -25,-1.6 -22,-2.9 -2,-0.3 -21,-0.3 -0.983 24.1 119.7-154.2 160.6 27.1 18.3 56.9 40 40 A A E - c 0 65A 17 24,-0.6 26,-1.7 -2,-0.3 24,-0.0 -0.849 65.0 -89.7 170.2-173.9 24.7 21.1 57.5 41 41 A R S S+ 0 0 170 -2,-0.3 2,-1.0 24,-0.2 26,-0.1 0.716 95.8 89.3 -93.1 -28.0 24.8 24.0 59.9 42 42 A S > - 0 0 52 1,-0.2 4,-1.8 24,-0.1 5,-0.1 -0.672 55.0-171.3 -79.9 104.5 22.9 22.6 63.0 43 43 A K H > S+ 0 0 129 -2,-1.0 4,-2.5 2,-0.2 5,-0.2 0.934 81.8 49.6 -57.1 -50.7 25.6 20.9 65.1 44 44 A E H > S+ 0 0 121 1,-0.2 4,-2.2 2,-0.2 -1,-0.2 0.911 111.1 48.7 -62.2 -45.4 23.3 19.2 67.5 45 45 A A H > S+ 0 0 26 1,-0.2 4,-1.6 2,-0.2 -1,-0.2 0.906 111.7 51.1 -60.1 -37.7 21.1 17.7 64.8 46 46 A L H X S+ 0 0 0 -4,-1.8 4,-2.5 2,-0.2 -2,-0.2 0.886 106.4 53.4 -70.2 -36.5 24.3 16.5 63.0 47 47 A Q H X S+ 0 0 104 -4,-2.5 4,-1.9 1,-0.2 -1,-0.2 0.924 109.0 50.2 -65.2 -41.9 25.6 14.8 66.2 48 48 A K H X S+ 0 0 162 -4,-2.2 4,-1.8 1,-0.2 -1,-0.2 0.865 110.6 49.3 -63.4 -37.1 22.3 12.9 66.5 49 49 A V H X S+ 0 0 1 -4,-1.6 4,-2.8 2,-0.2 -2,-0.2 0.923 109.7 51.0 -68.3 -44.9 22.5 11.7 62.9 50 50 A V H X S+ 0 0 19 -4,-2.5 4,-2.4 2,-0.2 -2,-0.2 0.905 110.6 49.3 -60.2 -40.0 26.1 10.5 63.2 51 51 A A H X S+ 0 0 58 -4,-1.9 4,-2.3 1,-0.2 -1,-0.2 0.898 112.1 47.3 -67.9 -44.3 25.2 8.5 66.4 52 52 A R H X S+ 0 0 106 -4,-1.8 4,-2.6 2,-0.2 -1,-0.2 0.897 108.6 55.4 -66.8 -40.2 22.3 6.9 64.7 53 53 A C H X>S+ 0 0 0 -4,-2.8 5,-2.0 2,-0.2 4,-0.8 0.936 109.3 47.4 -56.1 -44.5 24.5 6.1 61.6 54 54 A L H ><5S+ 0 0 90 -4,-2.4 3,-1.1 3,-0.2 -2,-0.2 0.948 111.6 49.9 -63.6 -43.8 26.9 4.2 63.9 55 55 A E H 3<5S+ 0 0 147 -4,-2.3 -1,-0.2 1,-0.3 -2,-0.2 0.920 109.4 52.9 -60.0 -39.9 24.1 2.4 65.6 56 56 A L H 3<5S- 0 0 42 -4,-2.6 -1,-0.3 -5,-0.1 -2,-0.2 0.602 129.3 -90.4 -74.7 -12.5 22.7 1.4 62.1 57 57 A G T <<5 + 0 0 41 -3,-1.1 -3,-0.2 -4,-0.8 -2,-0.1 0.656 60.7 165.7 114.7 17.6 26.1 -0.0 60.9 58 58 A A < - 0 0 14 -5,-2.0 -23,-0.2 1,-0.1 -1,-0.2 -0.341 41.6-133.6 -61.4 144.0 28.2 2.7 59.2 59 59 A A S S- 0 0 55 -25,-1.6 2,-0.3 1,-0.3 -24,-0.2 0.848 90.9 -19.0 -63.5 -35.5 31.9 1.7 58.7 60 60 A S E -c 35 0A 22 -26,-1.0 -24,-2.1 2,-0.0 2,-0.3 -0.971 64.7-159.6-161.7 162.2 32.4 5.2 60.1 61 61 A A E +c 36 0A 8 -2,-0.3 2,-0.3 -26,-0.2 -24,-0.2 -0.947 15.9 161.3-150.8 124.9 30.5 8.4 60.6 62 62 A H E -c 37 0A 72 -26,-2.0 -24,-2.7 -2,-0.3 2,-0.4 -0.972 18.0-152.6-135.7 154.4 31.6 12.0 61.1 63 63 A Y E -c 38 0A 77 -2,-0.3 2,-0.4 -26,-0.2 -24,-0.2 -0.954 5.1-167.5-120.7 150.5 30.0 15.5 60.8 64 64 A I E -c 39 0A 19 -26,-1.9 -24,-0.6 -2,-0.4 2,-0.4 -0.992 19.3-144.9-129.9 131.7 31.4 18.9 60.1 65 65 A A E +c 40 0A 30 -2,-0.4 2,-0.3 -26,-0.2 -24,-0.2 -0.768 40.1 109.3-102.6 136.7 29.1 22.0 60.7 66 66 A G - 0 0 19 -26,-1.7 2,-0.5 -2,-0.4 -26,-0.1 -0.949 60.5 -84.7 176.4 174.5 29.1 25.2 58.6 67 67 A S > - 0 0 36 -2,-0.3 3,-2.1 1,-0.1 7,-0.3 -0.877 16.8-148.0-106.0 128.1 27.1 27.2 56.0 68 68 A M T 3 S+ 0 0 15 -2,-0.5 53,-0.1 1,-0.3 -1,-0.1 0.406 95.0 80.2 -71.5 2.6 27.3 26.6 52.3 69 69 A E T 3 S+ 0 0 86 1,-0.1 2,-0.8 51,-0.1 -1,-0.3 0.694 83.2 74.2 -66.8 -23.7 26.8 30.3 51.9 70 70 A D <> - 0 0 86 -3,-2.1 4,-2.3 1,-0.2 3,-0.2 -0.808 68.0-166.5-101.4 104.5 30.5 30.4 52.7 71 71 A M H > S+ 0 0 36 -2,-0.8 4,-1.7 1,-0.2 -1,-0.2 0.809 89.7 54.8 -65.0 -30.4 32.5 29.2 49.7 72 72 A T H > S+ 0 0 82 2,-0.2 4,-2.4 1,-0.2 -1,-0.2 0.888 107.0 50.6 -69.0 -38.3 35.7 28.8 51.8 73 73 A F H > S+ 0 0 28 -6,-0.2 4,-2.9 1,-0.2 5,-0.2 0.967 108.4 53.7 -59.2 -48.7 33.8 26.5 54.2 74 74 A A H X S+ 0 0 0 -4,-2.3 4,-1.8 -7,-0.3 -2,-0.2 0.910 112.2 43.3 -53.9 -43.6 32.7 24.5 51.2 75 75 A E H X S+ 0 0 114 -4,-1.7 4,-1.5 1,-0.2 -1,-0.2 0.926 116.9 44.6 -72.0 -41.6 36.2 24.0 50.0 76 76 A E H X S+ 0 0 124 -4,-2.4 4,-2.4 1,-0.2 -1,-0.2 0.812 108.2 59.8 -72.6 -35.2 37.8 23.2 53.3 77 77 A F H X S+ 0 0 2 -4,-2.9 4,-2.6 -5,-0.2 5,-0.2 0.933 104.3 49.5 -54.2 -53.8 34.9 20.9 54.2 78 78 A V H X S+ 0 0 1 -4,-1.8 4,-2.2 -5,-0.2 5,-0.2 0.906 111.1 48.9 -55.2 -47.2 35.7 18.7 51.2 79 79 A A H X S+ 0 0 55 -4,-1.5 4,-2.3 2,-0.2 -1,-0.2 0.937 113.5 46.5 -59.8 -48.5 39.4 18.5 52.1 80 80 A E H X S+ 0 0 102 -4,-2.4 4,-3.2 1,-0.2 -2,-0.2 0.901 111.7 51.8 -61.6 -39.0 38.7 17.6 55.8 81 81 A A H X S+ 0 0 0 -4,-2.6 4,-2.1 2,-0.2 -1,-0.2 0.899 111.0 46.2 -69.2 -40.7 36.1 15.0 54.8 82 82 A G H X>S+ 0 0 3 -4,-2.2 4,-1.9 -5,-0.2 5,-1.8 0.892 112.4 52.2 -66.8 -41.4 38.4 13.2 52.4 83 83 A N H <5S+ 0 0 138 -4,-2.3 3,-0.2 3,-0.2 -2,-0.2 0.958 108.4 51.4 -56.7 -48.4 41.1 13.4 55.2 84 84 A L H <5S+ 0 0 66 -4,-3.2 -2,-0.2 1,-0.2 -1,-0.2 0.919 122.9 29.4 -54.5 -46.1 38.6 11.8 57.7 85 85 A M H <5S- 0 0 13 -4,-2.1 -1,-0.2 2,-0.3 -2,-0.2 0.544 104.7-118.8 -96.6 -8.2 37.8 8.9 55.3 86 86 A G T <5S- 0 0 60 -4,-1.9 2,-0.3 -3,-0.2 -3,-0.2 0.862 84.6 -5.6 71.8 34.0 41.1 8.6 53.3 87 87 A G S + 0 0 75 1,-0.2 4,-1.6 2,-0.1 3,-0.5 -0.376 5.6 164.3 -72.9 72.5 13.5 40.5 46.6 108 108 A I H > + 0 0 26 -2,-2.6 4,-2.3 1,-0.2 -1,-0.2 0.862 69.6 59.0 -55.3 -43.0 16.9 40.7 44.8 109 109 A D H > S+ 0 0 131 1,-0.2 4,-2.0 -3,-0.2 -1,-0.2 0.878 105.5 49.8 -58.6 -36.9 18.9 39.7 47.9 110 110 A N H > S+ 0 0 60 -3,-0.5 4,-2.6 2,-0.2 -1,-0.2 0.889 106.3 54.4 -70.7 -37.0 17.0 36.5 48.1 111 111 A V H X S+ 0 0 2 -4,-1.6 4,-1.8 1,-0.2 -2,-0.2 0.937 112.2 47.5 -56.4 -42.4 17.7 35.7 44.4 112 112 A R H X S+ 0 0 67 -4,-2.3 4,-2.1 1,-0.2 -2,-0.2 0.927 113.0 44.7 -63.9 -45.9 21.4 36.2 45.2 113 113 A K H X S+ 0 0 81 -4,-2.0 4,-2.6 1,-0.2 5,-0.3 0.885 110.0 54.7 -77.3 -34.3 21.5 34.1 48.3 114 114 A S H X S+ 0 0 4 -4,-2.6 4,-2.6 1,-0.2 5,-0.4 0.923 110.0 48.0 -63.3 -37.5 19.5 31.3 46.7 115 115 A M H X>S+ 0 0 1 -4,-1.8 5,-2.5 -5,-0.2 4,-1.3 0.864 112.7 49.3 -69.6 -36.2 22.0 31.1 43.8 116 116 A E H <>S+ 0 0 20 -4,-2.1 5,-2.1 3,-0.2 6,-0.2 0.977 120.8 33.3 -64.9 -55.5 25.0 31.1 46.3 117 117 A V H <5S+ 0 0 14 -4,-2.6 -2,-0.2 1,-0.2 -3,-0.2 0.877 126.9 36.4 -69.0 -47.6 23.6 28.3 48.5 118 118 A N H <5S+ 0 0 1 -4,-2.6 -1,-0.2 -5,-0.3 -3,-0.2 0.725 134.3 11.1 -83.8 -22.8 21.8 26.2 46.0 119 119 A F T X5S+ 0 0 0 -4,-1.3 4,-1.8 -5,-0.4 3,-0.4 0.717 120.5 49.3-122.4 -65.9 24.2 26.5 42.9 120 120 A H H > S+ 0 0 0 -3,-0.4 4,-2.0 -6,-0.2 -1,-0.2 0.879 110.3 46.2 -63.3 -41.3 27.5 22.8 44.5 123 123 A V H X S+ 0 0 1 -4,-1.8 4,-2.4 2,-0.2 -2,-0.2 0.903 114.4 47.5 -64.8 -41.2 30.1 23.9 41.9 124 124 A V H X S+ 0 0 6 -4,-2.2 4,-2.5 2,-0.2 -2,-0.2 0.945 111.7 49.4 -70.9 -45.7 32.7 24.6 44.5 125 125 A L H X S+ 0 0 0 -4,-3.4 4,-2.1 1,-0.2 -1,-0.2 0.935 112.7 48.6 -52.4 -48.7 32.1 21.4 46.4 126 126 A S H X S+ 0 0 3 -4,-2.0 4,-0.9 -5,-0.2 -1,-0.2 0.869 109.6 51.2 -61.0 -44.4 32.4 19.5 43.1 127 127 A V H < S+ 0 0 37 -4,-2.4 3,-0.5 1,-0.2 -1,-0.2 0.903 111.8 47.8 -57.9 -47.1 35.6 21.2 42.1 128 128 A A H < S+ 0 0 32 -4,-2.5 4,-0.4 1,-0.2 -2,-0.2 0.862 115.5 45.4 -61.0 -36.8 37.2 20.4 45.5 129 129 A A H X S+ 0 0 0 -4,-2.1 4,-2.3 -5,-0.2 -1,-0.2 0.634 88.8 92.3 -80.9 -13.9 36.1 16.8 45.3 130 130 A M H X S+ 0 0 21 -4,-0.9 4,-3.1 -3,-0.5 5,-0.2 0.850 80.7 49.4 -64.2 -46.3 37.2 16.3 41.8 131 131 A P H > S+ 0 0 80 0, 0.0 4,-2.4 0, 0.0 -1,-0.2 0.945 116.1 45.7 -50.7 -50.7 40.8 15.0 42.2 132 132 A M H > S+ 0 0 34 -4,-0.4 4,-1.9 1,-0.2 -44,-0.3 0.893 113.2 50.0 -58.0 -43.3 39.5 12.4 44.7 133 133 A L H X>S+ 0 0 0 -4,-2.3 5,-2.2 2,-0.2 4,-0.9 0.876 109.9 49.6 -65.8 -40.1 36.6 11.5 42.5 134 134 A M H ><5S+ 0 0 91 -4,-3.1 3,-0.6 -5,-0.2 -2,-0.2 0.921 109.4 53.1 -65.0 -39.2 38.8 11.0 39.5 135 135 A Q H 3<5S+ 0 0 155 -4,-2.4 -2,-0.2 -5,-0.2 -1,-0.2 0.898 119.1 35.0 -62.0 -39.9 41.2 8.8 41.6 136 136 A S H 3<5S- 0 0 39 -4,-1.9 -1,-0.2 -48,-0.3 -2,-0.2 0.482 102.4-126.0 -92.1 -1.7 38.2 6.6 42.7 137 137 A Q T <<5 + 0 0 111 -4,-0.9 -3,-0.2 -3,-0.6 46,-0.1 0.958 61.1 161.8 47.6 52.7 36.2 6.8 39.4 138 138 A G < - 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0 0 9 1,-0.1 -2,-0.1 311,-0.1 311,-0.0 -0.431 68.3 -91.1 -74.4 159.3 -0.5 18.0 45.1 209 209 A P - 0 0 115 0, 0.0 2,-0.4 0, 0.0 -17,-0.3 -0.277 38.9-136.2 -73.2 149.1 0.3 14.6 46.7 210 210 A A - 0 0 42 -3,-0.1 -17,-0.3 -19,-0.1 24,-0.1 -0.870 6.4-136.5-111.3 139.0 3.7 14.0 48.4 211 211 A S B -g 193 0B 17 -19,-2.7 -17,-3.0 -2,-0.4 2,-0.2 -0.605 38.6 -88.2 -89.1 154.3 5.9 10.9 48.1 212 212 A P > - 0 0 55 0, 0.0 4,-2.0 0, 0.0 3,-0.2 -0.450 25.5-141.3 -69.5 133.1 7.7 9.3 51.2 213 213 A K H > S+ 0 0 41 1,-0.2 4,-2.5 -2,-0.2 5,-0.2 0.814 96.4 60.8 -61.8 -32.3 11.1 10.7 52.1 214 214 A E H > S+ 0 0 85 2,-0.2 4,-1.6 1,-0.2 -1,-0.2 0.931 109.7 39.3 -66.7 -48.0 12.6 7.3 53.0 215 215 A E H > S+ 0 0 104 2,-0.2 4,-2.5 1,-0.2 -1,-0.2 0.893 112.8 57.7 -65.6 -43.5 12.1 5.8 49.6 216 216 A C H X S+ 0 0 0 -4,-2.0 4,-2.1 1,-0.2 -2,-0.2 0.926 106.6 49.4 -49.8 -49.5 13.1 9.1 47.9 217 217 A A H X S+ 0 0 0 -4,-2.5 4,-1.8 1,-0.2 -1,-0.2 0.899 111.0 49.0 -58.9 -46.7 16.4 8.9 49.7 218 218 A L H X S+ 0 0 36 -4,-1.6 4,-2.6 2,-0.2 -1,-0.2 0.853 108.8 53.4 -61.0 -37.8 17.0 5.3 48.7 219 219 A E H X S+ 0 0 62 -4,-2.5 4,-2.3 2,-0.2 5,-0.2 0.878 105.9 52.8 -70.5 -34.2 16.2 6.1 45.1 220 220 A I H X S+ 0 0 0 -4,-2.1 4,-2.0 -5,-0.2 5,-0.2 0.933 112.1 46.6 -62.5 -46.1 18.8 8.9 45.0 221 221 A I H X S+ 0 0 0 -4,-1.8 4,-2.5 1,-0.2 -2,-0.2 0.943 114.2 46.2 -61.6 -50.3 21.4 6.4 46.3 222 222 A K H X S+ 0 0 64 -4,-2.6 4,-2.6 1,-0.2 -2,-0.2 0.915 113.5 47.8 -62.8 -45.7 20.5 3.6 43.8 223 223 A G H <>S+ 0 0 2 -4,-2.3 5,-2.5 1,-0.2 -1,-0.2 0.857 115.2 45.7 -64.0 -38.7 20.4 5.9 40.8 224 224 A T H ><5S+ 0 0 0 -4,-2.0 3,-1.0 -5,-0.2 -1,-0.2 0.897 113.1 49.1 -70.3 -42.9 23.7 7.5 41.6 225 225 A A H 3<5S+ 0 0 23 -4,-2.5 -2,-0.2 1,-0.3 -1,-0.2 0.846 108.8 53.2 -64.9 -37.9 25.3 4.2 42.4 226 226 A L T 3<5S- 0 0 70 -4,-2.6 -1,-0.3 -5,-0.2 -2,-0.2 0.490 113.8-124.2 -74.6 -3.5 24.0 2.8 39.1 227 227 A R T < 5 + 0 0 83 -3,-1.0 -3,-0.2 1,-0.2 -42,-0.2 0.850 46.5 172.3 67.0 39.7 25.7 5.8 37.5 228 228 A Q < - 0 0 79 -5,-2.5 -1,-0.2 1,-0.1 3,-0.1 -0.466 39.3-134.8 -76.2 148.2 22.5 7.1 35.7 229 229 A D S S+ 0 0 96 1,-0.2 -42,-2.7 -43,-0.2 2,-0.3 0.934 91.2 10.8 -63.8 -44.1 22.5 10.4 34.0 230 230 A E E -f 187 0A 28 -44,-0.2 2,-0.4 -42,-0.0 -1,-0.2 -0.968 60.7-160.8-139.5 151.4 19.2 11.2 35.6 231 231 A M E -f 188 0A 5 -44,-2.1 -42,-2.7 -2,-0.3 2,-0.5 -0.974 13.0-159.1-135.4 114.3 17.0 9.7 38.4 232 232 A Y E +f 189 0A 47 -2,-0.4 2,-0.3 -44,-0.2 -42,-0.2 -0.869 18.2 168.9 -98.5 125.5 13.3 10.7 38.5 233 233 A Y E +f 190 0A 21 -44,-2.5 -42,-2.8 -2,-0.5 -22,-0.1 -0.800 29.5 129.6-131.1 87.2 11.3 10.3 41.8 234 234 A V S S- 0 0 25 2,-0.3 -42,-0.2 -2,-0.3 -1,-0.1 0.215 77.0-103.5-128.8 10.4 8.0 12.1 41.1 235 235 A G S S+ 0 0 62 1,-0.1 2,-0.3 -44,-0.1 -2,-0.0 0.699 92.2 89.5 76.3 19.4 5.3 9.7 42.1 236 236 A S - 0 0 32 1,-0.1 -2,-0.3 2,-0.0 -1,-0.1 -0.989 62.6-151.1-149.5 140.1 4.4 8.8 38.6 237 237 A R S S+ 0 0 104 -2,-0.3 4,-0.1 2,-0.1 -1,-0.1 0.702 103.2 38.0 -74.2 -25.8 5.5 6.1 36.1 238 238 A W S >> S+ 0 0 33 2,-0.1 3,-2.1 1,-0.1 4,-0.8 0.787 96.9 74.6-100.4 -33.0 4.7 8.4 33.2 239 239 A V H >> S+ 0 0 8 1,-0.3 3,-1.0 2,-0.2 4,-0.6 0.834 82.6 69.0 -59.0 -35.9 5.7 11.9 34.3 240 240 A P H 3> S+ 0 0 24 0, 0.0 4,-1.7 0, 0.0 3,-0.4 0.780 98.8 54.1 -52.4 -28.4 9.4 11.4 33.9 241 241 A Y H <4 S+ 0 0 72 -3,-2.1 4,-0.2 1,-0.2 -2,-0.2 0.726 104.3 51.2 -82.3 -25.2 8.8 11.3 30.1 242 242 A L H << S+ 0 0 13 -3,-1.0 273,-0.2 -4,-0.8 -1,-0.2 0.472 117.9 42.1 -80.4 -2.5 7.0 14.6 30.0 243 243 A L H < S+ 0 0 4 -4,-0.6 -2,-0.2 -3,-0.4 -1,-0.1 0.680 100.5 65.2-110.5 -33.1 10.0 16.1 32.0 244 244 A G S < S- 0 0 16 -4,-1.7 5,-0.2 -5,-0.2 -3,-0.1 0.379 93.5-139.2 -83.1 -3.9 13.1 14.5 30.3 245 245 A N > - 0 0 21 -4,-0.2 4,-1.7 1,-0.1 3,-0.4 0.906 17.3-158.4 59.5 76.6 12.4 16.3 27.1 246 246 A P H > S+ 0 0 46 0, 0.0 4,-2.9 0, 0.0 5,-0.2 0.820 92.6 63.9 -56.4 -33.6 13.0 14.1 24.0 247 247 A G H > S+ 0 0 12 2,-0.2 4,-2.6 1,-0.2 5,-0.1 0.929 103.8 46.3 -56.3 -47.2 13.4 17.2 21.9 248 248 A R H > S+ 0 0 10 -3,-0.4 4,-2.8 2,-0.2 5,-0.2 0.918 110.8 52.4 -59.8 -45.2 16.5 18.2 23.9 249 249 A K H X S+ 0 0 76 -4,-1.7 4,-2.2 -5,-0.2 -2,-0.2 0.941 110.7 48.0 -61.1 -44.5 17.9 14.7 23.7 250 250 A I H X S+ 0 0 24 -4,-2.9 4,-2.6 1,-0.2 5,-0.2 0.958 113.3 47.6 -59.2 -50.8 17.5 14.7 19.9 251 251 A M H X S+ 0 0 5 -4,-2.6 4,-2.4 1,-0.2 -2,-0.2 0.864 110.9 49.7 -60.4 -39.7 19.1 18.2 19.6 252 252 A E H X S+ 0 0 37 -4,-2.8 4,-0.8 2,-0.2 -1,-0.2 0.887 111.9 50.1 -67.5 -39.9 22.0 17.4 21.8 253 253 A F H >X S+ 0 0 147 -4,-2.2 3,-0.8 -5,-0.2 4,-0.6 0.945 114.2 43.1 -59.5 -49.9 22.6 14.2 19.7 254 254 A L H >< S+ 0 0 14 -4,-2.6 3,-0.8 1,-0.2 4,-0.3 0.885 110.3 56.1 -69.5 -36.8 22.5 16.0 16.4 255 255 A S H >< S+ 0 0 7 -4,-2.4 3,-1.3 1,-0.2 4,-0.3 0.690 89.9 73.7 -68.7 -18.7 24.6 18.9 17.5 256 256 A A H X< S+ 0 0 42 -4,-0.8 3,-1.4 -3,-0.8 -1,-0.2 0.908 91.7 56.6 -69.0 -32.6 27.5 16.7 18.6 257 257 A A T << S+ 0 0 74 -3,-0.8 -1,-0.3 -4,-0.6 -2,-0.2 0.623 93.3 70.8 -68.6 -13.1 28.4 16.1 14.9 258 258 A E T < S+ 0 0 66 -3,-1.3 213,-3.3 -4,-0.3 214,-0.3 0.592 83.6 88.8 -81.1 -9.4 28.7 20.0 14.5 259 259 A Y B < S-I 470 0D 19 -3,-1.4 2,-1.2 -4,-0.3 211,-0.2 -0.657 81.9-128.5 -84.5 154.3 31.9 19.9 16.6 260 260 A N + 0 0 51 209,-2.6 3,-0.5 -2,-0.2 -2,-0.1 -0.737 33.5 177.9-100.8 76.5 35.3 19.4 15.0 261 261 A W S S+ 0 0 106 -2,-1.2 -1,-0.2 1,-0.2 -4,-0.0 0.850 71.7 61.9 -62.4 -33.2 36.3 16.6 17.3 262 262 A D 0 0 164 -3,-0.1 -1,-0.2 0, 0.0 -2,-0.1 0.939 360.0 360.0 -54.4 -48.7 39.7 16.0 15.7 263 263 A N 0 0 147 -3,-0.5 -3,-0.1 205,-0.2 205,-0.0 -0.563 360.0 360.0 -66.2 360.0 40.6 19.5 16.6 264 !* 0 0 0 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 360.0 0.0 0.0 0.0 265 264 B K 0 0 185 0, 0.0 2,-0.1 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 114.9 0.9 41.0 12.5 266 265 B F - 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