==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=11-DEC-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER ISOMERASE 19-JAN-11 2Y62 . COMPND 2 MOLECULE: TRIOSEPHOSPHATE ISOMERASE SYNONYM TRIOSE-PHOSPHAT . SOURCE 2 ORGANISM_SCIENTIFIC: LEISHMANIA MEXICANA; . AUTHOR R.VENKATESAN,M.ALAHUHTA,P.M.PIHKO,R.K.WIERENGA . 249 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 11016.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 176 70.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 38 15.3 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 0 0.0 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 . 0 0.0 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 . 20 8.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 27 10.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 80 32.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 5 2.0 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 2 3 2 0 0 0 0 0 3 0 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 1 2 2 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 PARALLEL BRIDGES PER LADDER . 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 ANTIPARALLEL BRIDGES PER LADDER . 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 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 1002 A A 0 0 153 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 8.4 -0.7 4.0 -9.8 2 1003 A K - 0 0 68 1,-0.1 202,-0.1 225,-0.0 204,-0.1 -0.437 360.0-111.0 -61.7 149.7 -4.3 3.1 -10.3 3 1004 A P - 0 0 28 0, 0.0 -1,-0.1 0, 0.0 201,-0.1 -0.175 56.7 -60.3 -69.8 173.1 -5.8 4.3 -13.5 4 1005 A Q - 0 0 59 200,-0.1 32,-0.1 1,-0.1 224,-0.0 -0.325 63.6-124.7 -57.0 128.9 -8.5 7.0 -13.5 5 1006 A P - 0 0 10 0, 0.0 32,-2.7 0, 0.0 2,-0.4 -0.272 17.3-145.7 -75.4 164.0 -11.5 5.8 -11.5 6 1007 A I E -ab 37 229A 0 222,-1.9 224,-1.8 30,-0.2 2,-0.5 -0.991 10.7-168.1-128.0 135.7 -15.1 5.6 -12.7 7 1008 A A E -ab 38 230A 0 30,-2.0 32,-2.2 -2,-0.4 2,-0.5 -0.971 21.3-172.7-121.8 108.4 -18.3 6.2 -10.8 8 1009 A A E -ab 39 231A 1 222,-2.8 224,-3.1 -2,-0.5 2,-0.7 -0.921 16.2-152.3-115.6 129.2 -21.2 5.1 -13.0 9 1010 A A E -ab 40 232A 1 30,-3.1 32,-2.8 -2,-0.5 2,-0.9 -0.868 5.9-169.8 -99.7 110.0 -24.9 5.5 -12.3 10 1011 A N E -a 41 0A 6 222,-3.0 226,-0.2 -2,-0.7 227,-0.1 -0.875 3.3-176.4 -95.9 97.5 -27.1 2.9 -13.9 11 1012 A W - 0 0 1 30,-1.7 -1,-0.1 -2,-0.9 32,-0.1 0.610 19.8-165.0 -70.1 -11.5 -30.5 4.4 -13.3 12 1013 A K - 0 0 48 29,-0.4 2,-1.5 1,-0.2 -1,-0.2 -0.217 59.4 -22.7 53.7-149.4 -32.1 1.3 -14.9 13 1014 A C S S+ 0 0 115 29,-0.1 2,-0.3 30,-0.1 -1,-0.2 -0.523 110.1 110.4 -95.0 70.0 -35.8 1.7 -15.8 14 1015 A N + 0 0 79 -2,-1.5 29,-0.4 -3,-0.0 2,-0.1 -1.000 33.6 70.4-146.5 143.6 -36.5 4.5 -13.4 15 1016 A G - 0 0 34 -2,-0.3 2,-0.3 27,-0.1 3,-0.1 -0.342 39.6-138.7 135.2 152.8 -37.3 8.2 -13.4 16 1017 A T > - 0 0 81 -2,-0.1 4,-2.7 1,-0.1 5,-0.3 -0.888 39.7-108.4-122.1 167.8 -39.7 11.0 -14.1 17 1018 A T H > S+ 0 0 85 -2,-0.3 4,-2.4 1,-0.2 5,-0.2 0.932 121.4 50.2 -64.5 -34.9 -38.8 14.3 -15.7 18 1019 A A H > S+ 0 0 60 1,-0.2 4,-1.9 2,-0.2 -1,-0.2 0.902 113.0 44.6 -65.3 -41.9 -39.4 16.0 -12.3 19 1020 A S H > S+ 0 0 55 2,-0.2 4,-2.5 1,-0.2 -1,-0.2 0.901 114.0 50.2 -73.1 -39.8 -37.2 13.5 -10.3 20 1021 A I H X S+ 0 0 4 -4,-2.7 4,-3.2 2,-0.2 5,-0.3 0.903 108.3 51.8 -66.4 -43.7 -34.5 13.6 -12.9 21 1022 A E H X S+ 0 0 85 -4,-2.4 4,-1.9 -5,-0.3 -2,-0.2 0.934 112.5 46.8 -60.0 -40.4 -34.4 17.4 -12.9 22 1023 A K H X S+ 0 0 146 -4,-1.9 4,-1.8 2,-0.2 -2,-0.2 0.925 114.9 44.9 -66.2 -44.9 -34.0 17.3 -9.1 23 1024 A L H X S+ 0 0 17 -4,-2.5 4,-2.4 2,-0.2 -2,-0.2 0.911 110.8 53.0 -69.1 -38.4 -31.3 14.6 -9.1 24 1025 A V H X S+ 0 0 2 -4,-3.2 4,-2.8 1,-0.2 31,-0.2 0.900 106.5 55.0 -63.1 -36.4 -29.3 16.2 -11.9 25 1026 A Q H X S+ 0 0 99 -4,-1.9 4,-2.2 -5,-0.3 -1,-0.2 0.928 107.4 49.7 -57.6 -45.9 -29.4 19.5 -9.9 26 1027 A V H X S+ 0 0 32 -4,-1.8 4,-0.6 1,-0.2 -2,-0.2 0.924 111.7 47.7 -57.3 -47.1 -27.9 17.6 -7.0 27 1028 A F H >< S+ 0 0 0 -4,-2.4 3,-0.7 1,-0.2 -2,-0.2 0.897 112.1 50.5 -61.4 -40.6 -25.2 16.2 -9.3 28 1029 A N H 3< S+ 0 0 51 -4,-2.8 -1,-0.2 1,-0.2 -2,-0.2 0.842 108.0 51.6 -65.1 -37.5 -24.5 19.6 -10.8 29 1030 A E H 3< S+ 0 0 135 -4,-2.2 2,-0.8 -5,-0.2 -1,-0.2 0.520 89.1 93.3 -81.5 -5.0 -24.1 21.3 -7.4 30 1031 A H S << S- 0 0 21 -3,-0.7 2,-0.6 -4,-0.6 -1,-0.0 -0.809 70.0-148.9 -92.5 106.7 -21.6 18.7 -6.1 31 1032 A T - 0 0 121 -2,-0.8 2,-0.5 25,-0.0 -2,-0.1 -0.694 8.4-155.3 -80.7 124.4 -18.1 20.0 -6.9 32 1033 A I - 0 0 14 -2,-0.6 4,-0.1 1,-0.1 214,-0.0 -0.858 12.2-175.9-103.4 129.3 -15.7 17.1 -7.6 33 1034 A S + 0 0 104 -2,-0.5 2,-0.3 2,-0.1 -1,-0.1 0.058 56.6 65.5-119.4 21.7 -12.1 17.9 -6.9 34 1035 A H S S- 0 0 32 2,-0.1 2,-0.8 0, 0.0 215,-0.1 -0.924 93.0 -87.2-133.4 167.6 -10.3 14.7 -8.0 35 1036 A D + 0 0 101 -2,-0.3 2,-0.3 214,-0.1 -2,-0.1 -0.628 68.1 135.8 -77.4 107.9 -9.7 13.0 -11.3 36 1037 A V - 0 0 3 -2,-0.8 2,-0.8 -32,-0.1 -30,-0.2 -0.975 51.1-131.5-152.7 139.7 -12.7 10.7 -11.9 37 1038 A Q E -a 6 0A 39 -32,-2.7 -30,-2.0 -2,-0.3 2,-0.3 -0.870 25.9-163.0 -93.7 112.5 -15.0 9.9 -14.8 38 1039 A C E -ac 7 59A 0 20,-3.0 22,-1.8 -2,-0.8 2,-0.4 -0.717 6.2-166.5 -90.8 145.5 -18.6 10.1 -13.6 39 1040 A V E -ac 8 60A 1 -32,-2.2 -30,-3.1 -2,-0.3 2,-0.4 -0.999 11.1-164.8-135.1 134.9 -21.2 8.4 -15.9 40 1041 A V E -ac 9 61A 0 20,-2.1 22,-2.7 -2,-0.4 -30,-0.2 -0.995 2.8-169.0-119.8 127.4 -25.0 8.7 -15.9 41 1042 A A E +a 10 0A 0 -32,-2.8 -30,-1.7 -2,-0.4 -29,-0.4 -0.864 14.8 177.1-117.6 93.0 -27.0 6.1 -17.8 42 1043 A P - 0 0 1 0, 0.0 22,-0.4 0, 0.0 -30,-0.1 -0.371 42.8 -80.7 -80.4 169.1 -30.6 7.2 -18.0 43 1044 A T >> - 0 0 23 -29,-0.4 3,-1.4 -31,-0.1 4,-0.6 -0.325 50.3-104.1 -60.8 159.4 -33.4 5.4 -19.9 44 1045 A F G >4 S+ 0 0 71 1,-0.3 3,-1.2 2,-0.2 -1,-0.1 0.866 120.8 53.3 -55.7 -42.1 -33.3 6.1 -23.6 45 1046 A V G 34 S+ 0 0 119 1,-0.3 4,-0.3 2,-0.1 -1,-0.3 0.701 109.1 50.9 -71.0 -18.5 -36.3 8.5 -23.5 46 1047 A H G <> S+ 0 0 24 -3,-1.4 4,-2.3 1,-0.1 -1,-0.3 0.397 82.2 93.1 -93.3 -6.8 -34.6 10.5 -20.7 47 1048 A I H S+ 0 0 65 0, 0.0 4,-2.1 0, 0.0 -1,-0.2 0.907 110.8 50.0 -58.9 -41.1 -32.3 14.3 -24.1 49 1050 A L H > S+ 0 0 32 -4,-0.3 4,-1.8 2,-0.2 5,-0.2 0.930 113.0 45.7 -59.7 -48.5 -33.4 15.7 -20.8 50 1051 A V H X S+ 0 0 0 -4,-2.3 4,-3.0 1,-0.2 -1,-0.2 0.924 111.3 52.6 -63.7 -40.6 -30.2 14.7 -19.1 51 1052 A Q H < S+ 0 0 54 -4,-2.9 -1,-0.2 -5,-0.2 -2,-0.2 0.891 112.0 47.6 -60.1 -36.6 -28.2 16.1 -22.0 52 1053 A A H < S+ 0 0 54 -4,-2.1 -1,-0.2 -5,-0.2 -2,-0.2 0.810 124.0 28.8 -73.0 -32.1 -30.1 19.4 -21.5 53 1054 A K H < S+ 0 0 90 -4,-1.8 2,-0.4 -5,-0.1 -2,-0.2 0.739 92.8 92.7-106.0 -28.9 -29.7 19.6 -17.8 54 1055 A L < + 0 0 16 -4,-3.0 -29,-0.1 -5,-0.2 7,-0.1 -0.577 35.1 154.3 -77.4 127.9 -26.5 17.9 -16.7 55 1056 A R + 0 0 166 -2,-0.4 -1,-0.2 -31,-0.2 -30,-0.0 0.470 24.0 123.9-129.6 -7.7 -23.5 20.3 -16.6 56 1057 A N > - 0 0 14 1,-0.2 3,-2.0 -32,-0.2 -28,-0.1 -0.375 57.7-141.5 -62.5 122.9 -21.0 18.9 -14.1 57 1058 A P T 3 S+ 0 0 124 0, 0.0 -1,-0.2 0, 0.0 -29,-0.0 0.651 94.5 66.7 -68.2 -13.2 -17.8 18.6 -16.1 58 1059 A K T 3 S+ 0 0 61 -21,-0.1 -20,-3.0 2,-0.0 2,-0.3 0.516 91.7 87.9 -79.1 -5.0 -16.8 15.3 -14.5 59 1060 A Y E < +c 38 0A 20 -3,-2.0 2,-0.3 -22,-0.2 -20,-0.2 -0.747 47.0 179.8-104.1 150.0 -19.8 13.5 -16.2 60 1061 A V E -c 39 0A 30 -22,-1.8 -20,-2.1 -2,-0.3 2,-0.4 -0.899 29.7-118.9-127.0 161.9 -20.6 11.8 -19.4 61 1062 A I E -c 40 0A 28 -2,-0.3 28,-0.6 -22,-0.2 27,-0.5 -0.847 28.7-169.3-106.2 135.7 -23.9 10.3 -20.5 62 1063 A S E -d 89 0A 0 -22,-2.7 28,-0.2 -2,-0.4 2,-0.2 -0.906 20.4-126.0-120.6 149.8 -24.2 6.6 -21.3 63 1064 A A E -d 90 0A 0 26,-2.3 28,-2.1 -2,-0.3 -20,-0.1 -0.579 17.0-136.8 -81.3 157.6 -26.9 4.4 -22.8 64 1065 A Q S S- 0 0 42 -22,-0.4 2,-0.3 1,-0.2 30,-0.3 0.517 81.2 -14.6 -90.3 -10.0 -27.9 1.3 -20.8 65 1066 A N - 0 0 6 27,-0.1 2,-0.3 28,-0.1 -1,-0.2 -0.931 63.5-178.2-175.1 168.3 -27.9 -0.9 -23.9 66 1067 A A - 0 0 0 -2,-0.3 2,-0.3 -3,-0.1 12,-0.2 -0.951 23.9-122.9-167.0 166.1 -27.8 -0.8 -27.7 67 1068 A I B -i 78 0B 29 10,-2.0 12,-2.3 -2,-0.3 -2,-0.0 -0.804 30.3-119.9-109.7 159.9 -27.9 -2.8 -30.9 68 1069 A A S S+ 0 0 23 -2,-0.3 2,-0.4 10,-0.2 10,-0.1 0.822 84.1 31.6 -72.5 -36.5 -25.1 -2.6 -33.4 69 1070 A K S S- 0 0 115 10,-0.1 -1,-0.1 9,-0.1 2,-0.1 -0.956 72.5-118.1-132.1 145.8 -26.9 -1.5 -36.5 70 1071 A S + 0 0 65 -2,-0.4 2,-0.3 8,-0.1 7,-0.1 -0.341 63.2 84.2 -67.1 157.1 -29.8 0.6 -37.6 71 1072 A G S S- 0 0 62 2,-0.1 2,-2.1 -2,-0.1 7,-0.1 -0.990 85.0 -6.5 147.0-150.9 -32.7 -1.0 -39.5 72 1073 A A S S+ 0 0 97 -2,-0.3 2,-0.4 1,-0.1 -2,-0.1 -0.395 80.9 124.1 -83.9 65.7 -35.9 -3.0 -39.0 73 1074 A F > - 0 0 107 -2,-2.1 3,-2.3 3,-0.1 -1,-0.1 -0.682 51.2-151.2-130.6 72.9 -35.6 -3.5 -35.2 74 1075 A T T 3 S+ 0 0 147 -2,-0.4 3,-0.1 1,-0.3 -2,-0.1 -0.236 78.6 11.9 -56.0 128.6 -38.7 -2.2 -33.7 75 1076 A G T 3 S+ 0 0 73 1,-0.3 -1,-0.3 0, 0.0 2,-0.2 0.155 103.6 108.7 92.0 -15.0 -38.2 -0.9 -30.2 76 1077 A E < - 0 0 86 -3,-2.3 2,-0.4 -10,-0.0 -1,-0.3 -0.565 57.3-141.6 -97.6 160.0 -34.4 -1.0 -30.2 77 1078 A V - 0 0 32 -2,-0.2 -10,-2.0 -3,-0.1 2,-0.2 -0.978 21.4-143.6-120.6 128.0 -31.9 1.8 -30.3 78 1079 A S B > -i 67 0B 3 -2,-0.4 4,-2.3 -12,-0.2 -10,-0.2 -0.498 20.8-115.6 -94.6 162.6 -28.7 1.4 -32.4 79 1080 A M H > S+ 0 0 0 -12,-2.3 4,-2.7 1,-0.2 5,-0.2 0.901 114.9 52.5 -62.0 -42.6 -25.1 2.5 -31.9 80 1081 A P H > S+ 0 0 41 0, 0.0 4,-2.3 0, 0.0 -1,-0.2 0.896 108.6 51.6 -62.3 -36.4 -25.1 4.9 -34.9 81 1082 A I H > S+ 0 0 89 2,-0.2 4,-1.7 1,-0.2 -2,-0.2 0.923 111.1 47.5 -64.8 -43.9 -28.3 6.6 -33.6 82 1083 A L H X>S+ 0 0 4 -4,-2.3 5,-2.7 1,-0.2 4,-0.5 0.946 111.0 50.9 -60.4 -46.8 -26.6 7.1 -30.1 83 1084 A K H ><5S+ 0 0 84 -4,-2.7 3,-1.4 1,-0.2 -1,-0.2 0.922 108.7 52.3 -58.5 -45.2 -23.5 8.4 -31.7 84 1085 A D H 3<5S+ 0 0 141 -4,-2.3 -1,-0.2 1,-0.3 -2,-0.2 0.852 109.0 49.7 -60.8 -34.8 -25.5 10.9 -33.8 85 1086 A I H 3<5S- 0 0 79 -4,-1.7 -1,-0.3 -3,-0.2 -2,-0.2 0.460 126.2 -99.4 -86.6 3.3 -27.3 12.2 -30.7 86 1087 A G T <<5S+ 0 0 49 -3,-1.4 2,-0.6 -4,-0.5 -25,-0.2 0.610 80.6 130.0 96.7 11.7 -24.0 12.6 -28.8 87 1088 A V < + 0 0 0 -5,-2.7 -1,-0.3 -6,-0.2 -2,-0.2 -0.918 17.0 161.1-103.9 120.5 -23.9 9.5 -26.7 88 1089 A H + 0 0 82 -2,-0.6 33,-2.5 -27,-0.5 2,-0.3 0.090 52.4 78.5-130.6 23.6 -20.6 7.6 -26.9 89 1090 A W E +de 62 121A 10 -28,-0.6 -26,-2.3 31,-0.2 2,-0.3 -0.963 54.8 177.8-123.7 145.9 -20.8 5.5 -23.8 90 1091 A V E -de 63 122A 0 31,-1.9 33,-2.5 -2,-0.3 2,-0.4 -0.990 25.9-139.0-149.8 140.8 -22.8 2.3 -23.4 91 1092 A I E - e 0 123A 2 -28,-2.1 2,-0.4 -2,-0.3 33,-0.2 -0.847 31.2-174.8 -91.6 130.6 -23.4 -0.4 -20.8 92 1093 A L E + e 0 124A 1 31,-2.6 33,-2.6 -2,-0.4 -27,-0.1 -0.984 54.0 16.5-132.8 144.1 -23.4 -3.9 -22.4 93 1094 A G + 0 0 2 -2,-0.4 5,-0.1 31,-0.2 -1,-0.1 0.669 69.3 175.5 75.5 18.8 -24.2 -7.3 -21.0 94 1095 A H >> - 0 0 5 -30,-0.3 4,-1.8 1,-0.1 3,-0.8 -0.266 42.9-106.0 -58.8 145.6 -25.8 -6.2 -17.8 95 1096 A S H 3> S+ 0 0 14 1,-0.3 4,-2.8 2,-0.2 5,-0.3 0.798 114.1 48.1 -54.0 -45.9 -27.1 -9.3 -15.9 96 1097 A E H 3>>S+ 0 0 47 2,-0.2 4,-3.9 1,-0.2 5,-1.3 0.897 110.4 55.1 -71.2 -22.6 -30.9 -9.1 -16.5 97 1098 A R H <>5S+ 0 0 56 -3,-0.8 6,-2.1 3,-0.2 4,-0.6 0.934 112.1 44.3 -68.1 -38.9 -30.3 -8.6 -20.2 98 1099 A R H <5S+ 0 0 37 -4,-1.8 4,-0.3 4,-0.2 -2,-0.2 0.883 127.8 28.3 -61.6 -43.0 -28.2 -11.7 -20.1 99 1100 A T H <5S+ 0 0 91 -4,-2.8 -3,-0.2 -5,-0.2 -2,-0.2 0.887 133.5 28.6 -94.9 -33.6 -30.7 -13.7 -18.0 100 1101 A Y H <5S+ 0 0 171 -4,-3.9 -3,-0.2 -5,-0.3 -2,-0.1 0.817 126.5 38.9 -91.9 -42.3 -34.1 -12.0 -19.0 101 1102 A Y S < - 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0 0 10 -40,-2.9 45,-0.2 -2,-0.7 5,-0.1 -0.852 29.6-143.9-136.1 92.6 -21.1 -7.5 -10.7 167 1168 A P > - 0 0 0 0, 0.0 3,-1.9 0, 0.0 4,-0.4 -0.371 17.9-133.7 -57.6 134.5 -21.9 -10.8 -8.9 168 1169 A V G > S+ 0 0 44 -40,-2.4 3,-1.5 1,-0.3 -39,-0.2 0.877 103.8 60.1 -63.4 -33.7 -25.6 -11.5 -9.8 169 1170 A W G 3 S+ 0 0 39 -41,-0.6 -1,-0.3 1,-0.3 6,-0.2 0.576 103.0 52.8 -69.5 -11.3 -26.4 -12.2 -6.1 170 1171 A A G < S+ 0 0 0 -3,-1.9 2,-0.8 40,-0.1 4,-0.4 0.436 80.7 109.5 -99.4 -7.5 -25.3 -8.7 -5.1 171 1172 A I S < S- 0 0 33 -3,-1.5 -5,-0.0 -4,-0.4 5,-0.0 -0.660 104.3 -28.2 -80.3 109.0 -27.5 -6.9 -7.7 172 1173 A G S S+ 0 0 76 -2,-0.8 -1,-0.2 1,-0.1 -2,-0.1 0.502 113.5 104.7 72.8 5.5 -30.4 -5.1 -5.8 173 1174 A T S S- 0 0 63 -3,-0.2 -2,-0.1 2,-0.1 -1,-0.1 0.506 87.2-119.4 -99.5 -7.0 -30.4 -7.6 -3.0 174 1175 A G S S+ 0 0 68 -4,-0.4 2,-0.5 1,-0.1 -4,-0.1 0.670 82.0 114.4 71.3 19.4 -28.7 -5.7 -0.2 175 1176 A K - 0 0 136 -6,-0.2 -2,-0.1 -5,-0.1 -1,-0.1 -0.811 50.0-168.9-122.3 78.1 -25.9 -8.3 -0.1 176 1177 A V - 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0 0 11 -5,-2.3 4,-2.4 1,-0.1 5,-0.2 -0.747 25.1-115.1 165.2 148.2 -1.0 -7.2 -22.6 199 1200 A T H > S+ 0 0 106 -2,-0.2 4,-1.9 2,-0.2 5,-0.1 0.884 117.7 49.7 -68.5 -34.8 0.7 -5.9 -19.5 200 1201 A D H > S+ 0 0 79 2,-0.2 4,-1.6 1,-0.2 -1,-0.2 0.926 110.6 50.0 -64.5 -47.3 0.1 -2.3 -20.6 201 1202 A V H > S+ 0 0 13 1,-0.2 4,-1.4 2,-0.2 3,-0.4 0.944 110.2 51.0 -58.6 -46.3 -3.5 -3.0 -21.2 202 1203 A A H < S+ 0 0 4 -4,-2.4 3,-0.3 1,-0.2 -1,-0.2 0.889 107.5 52.1 -61.7 -40.2 -3.9 -4.6 -17.8 203 1204 A A H < S+ 0 0 63 -4,-1.9 -1,-0.2 1,-0.2 -2,-0.2 0.839 116.4 39.8 -66.4 -30.9 -2.3 -1.7 -16.0 204 1205 A K H < S+ 0 0 104 -4,-1.6 -1,-0.2 -3,-0.4 2,-0.2 0.560 89.6 111.3 -92.0 -15.8 -4.6 0.8 -17.6 205 1206 A L < - 0 0 5 -4,-1.4 2,-0.6 -3,-0.3 -43,-0.1 -0.431 60.9-139.7 -70.3 128.9 -7.8 -1.2 -17.5 206 1207 A R - 0 0 32 -45,-0.5 -43,-2.4 -2,-0.2 2,-0.5 -0.801 16.9-172.1 -85.5 126.1 -10.6 -0.0 -15.2 207 1208 A I E -g 163 0A 0 -2,-0.6 21,-2.8 -45,-0.2 22,-0.3 -0.980 11.9-165.1-117.6 110.8 -12.3 -2.9 -13.4 208 1209 A L E -g 164 0A 0 -45,-3.2 -43,-3.0 -2,-0.5 2,-0.4 -0.685 11.6-136.0 -95.1 151.0 -15.3 -1.6 -11.5 209 1210 A Y E +gh 165 230A 0 20,-2.5 22,-1.8 -2,-0.3 2,-0.3 -0.871 24.8 178.1-101.8 141.7 -17.3 -3.4 -8.8 210 1211 A G E + h 0 231A 0 -45,-2.2 22,-0.2 -2,-0.4 -40,-0.1 -0.995 31.0 89.9-140.5 153.2 -21.1 -3.4 -8.8 211 1212 A G S S- 0 0 3 20,-0.6 -34,-0.6 -2,-0.3 -40,-0.2 0.355 101.0 -10.5 126.8 96.9 -23.8 -4.9 -6.6 212 1213 A S S S+ 0 0 31 1,-0.2 -36,-0.2 -36,-0.1 2,-0.2 0.710 80.4 165.6 62.8 29.3 -25.3 -3.1 -3.6 213 1214 A V + 0 0 7 18,-0.3 22,-0.4 -43,-0.1 2,-0.3 -0.524 8.1 169.9 -65.1 136.4 -22.6 -0.4 -3.5 214 1215 A N > - 0 0 70 -2,-0.2 4,-1.5 20,-0.1 3,-0.4 -0.850 49.9 -93.5-140.2 177.6 -23.7 2.5 -1.3 215 1216 A A T 4 S+ 0 0 35 -2,-0.3 4,-0.4 1,-0.2 -2,-0.0 0.727 121.2 52.0 -65.3 -24.0 -22.1 5.6 0.2 216 1217 A A T 4 S+ 0 0 93 1,-0.1 -1,-0.2 2,-0.1 4,-0.2 0.755 116.9 34.4 -84.0 -29.3 -21.1 3.7 3.4 217 1218 A N T > S+ 0 0 28 -3,-0.4 4,-1.4 1,-0.1 -2,-0.2 0.529 96.9 84.6-100.0 -9.4 -19.4 0.7 1.9 218 1219 A A H X S+ 0 0 0 -4,-1.5 4,-2.7 1,-0.2 5,-0.2 0.890 83.6 53.5 -68.1 -43.2 -17.8 2.4 -1.2 219 1220 A A H > S+ 0 0 57 -4,-0.4 4,-1.6 1,-0.2 -1,-0.2 0.900 108.9 48.6 -64.2 -38.1 -14.5 3.8 0.3 220 1221 A T H 4 S+ 0 0 79 -4,-0.2 4,-0.3 2,-0.2 -1,-0.2 0.862 112.3 49.7 -75.3 -25.0 -13.4 0.5 1.8 221 1222 A L H >< S+ 0 0 2 -4,-1.4 3,-1.7 1,-0.2 -2,-0.2 0.931 110.2 51.2 -63.9 -49.1 -14.1 -1.3 -1.5 222 1223 A Y H 3< S+ 0 0 21 -4,-2.7 -2,-0.2 1,-0.3 5,-0.2 0.793 95.8 70.2 -64.6 -23.6 -12.1 1.4 -3.3 223 1224 A A T 3< S+ 0 0 80 -4,-1.6 -1,-0.3 -5,-0.2 -2,-0.2 0.708 77.1 98.4 -66.2 -19.4 -9.2 0.9 -0.9 224 1225 A K S X S- 0 0 52 -3,-1.7 3,-1.4 -4,-0.3 -44,-0.0 -0.469 82.8-124.8 -72.8 141.8 -8.5 -2.5 -2.5 225 1226 A P T 3 S+ 0 0 86 0, 0.0 -1,-0.1 0, 0.0 -3,-0.0 0.690 102.8 42.5 -68.9 -19.8 -5.7 -2.2 -5.1 226 1227 A D T 3 S+ 0 0 22 -224,-0.1 2,-0.5 -20,-0.0 -19,-0.2 0.278 88.7 99.3-111.4 14.2 -7.5 -3.7 -8.1 227 1228 A I < - 0 0 0 -3,-1.4 -19,-0.2 -6,-0.2 3,-0.1 -0.881 44.4-179.6-101.3 121.2 -10.9 -1.9 -7.7 228 1229 A N - 0 0 1 -21,-2.8 -222,-1.9 -2,-0.5 2,-0.3 0.152 55.2 -63.7-110.9 18.6 -11.2 1.1 -10.0 229 1230 A G E -b 6 0A 0 -22,-0.3 -20,-2.5 -224,-0.2 2,-0.3 -0.919 61.8 -67.3 128.4-161.5 -14.7 2.4 -9.1 230 1231 A F E -bh 7 209A 0 -224,-1.8 -222,-2.8 -2,-0.3 2,-0.5 -0.962 4.8-147.6-141.7 146.9 -18.2 1.4 -9.2 231 1232 A L E -bh 8 210A 2 -22,-1.8 -20,-0.6 -2,-0.3 2,-0.5 -0.984 37.9-165.5-111.1 116.5 -21.3 0.6 -11.3 232 1233 A V E +b 9 0A 3 -224,-3.1 -222,-3.0 -2,-0.5 -22,-0.1 -0.916 20.9 170.3-118.5 127.5 -24.2 1.7 -9.0 233 1234 A G S > S+ 0 0 16 -2,-0.5 3,-1.8 -224,-0.2 4,-0.4 0.733 75.1 15.7 -95.8 -96.1 -27.9 0.9 -9.4 234 1235 A G G > S+ 0 0 55 1,-0.3 3,-1.5 2,-0.2 -20,-0.1 0.821 124.6 53.2 -53.6 -43.0 -30.2 1.8 -6.6 235 1236 A A G > S+ 0 0 17 -22,-0.4 3,-1.3 1,-0.3 6,-0.4 0.701 97.2 68.9 -69.8 -16.2 -27.9 4.2 -4.7 236 1237 A S G < S+ 0 0 0 -3,-1.8 -1,-0.3 1,-0.3 -2,-0.2 0.591 90.1 62.0 -79.5 -6.1 -27.4 6.2 -8.0 237 1238 A L G < S+ 0 0 62 -3,-1.5 -1,-0.3 -4,-0.4 -2,-0.2 0.321 101.8 67.7 -88.7 0.5 -31.0 7.4 -7.9 238 1239 A K S X S- 0 0 117 -3,-1.3 3,-2.0 -4,-0.0 4,-0.2 -0.810 92.9-109.2-125.9 160.0 -30.3 9.1 -4.6 239 1240 A P T > S+ 0 0 46 0, 0.0 3,-2.0 0, 0.0 4,-0.3 0.734 107.6 78.3 -61.4 -21.2 -28.2 12.1 -3.4 240 1241 A E T >> + 0 0 86 1,-0.3 4,-1.5 2,-0.2 3,-0.6 0.622 69.3 84.5 -68.4 -9.1 -25.7 9.7 -1.7 241 1242 A F H <> S+ 0 0 0 -3,-2.0 4,-2.5 -6,-0.4 -1,-0.3 0.837 80.5 66.9 -56.6 -30.9 -24.2 9.0 -5.2 242 1243 A R H <> S+ 0 0 91 -3,-2.0 4,-2.1 1,-0.2 -1,-0.2 0.923 101.1 45.1 -54.0 -46.6 -22.2 12.1 -4.4 243 1244 A D H <> S+ 0 0 88 -3,-0.6 4,-1.3 -4,-0.3 -1,-0.2 0.819 107.9 57.5 -72.4 -25.3 -20.4 10.3 -1.6 244 1245 A I H < S+ 0 0 0 -4,-1.5 3,-0.4 2,-0.2 4,-0.2 0.940 108.0 48.2 -66.6 -43.8 -19.9 7.2 -3.8 245 1246 A I H >< S+ 0 0 0 -4,-2.5 3,-2.0 1,-0.2 -2,-0.2 0.934 111.4 49.3 -55.5 -50.6 -18.1 9.5 -6.3 246 1247 A D H >< S+ 0 0 21 -4,-2.1 3,-1.4 1,-0.3 -1,-0.2 0.722 96.4 72.0 -69.4 -16.9 -16.0 11.0 -3.4 247 1248 A A T 3< S+ 0 0 15 -4,-1.3 -1,-0.3 -3,-0.4 -2,-0.2 0.529 86.6 67.0 -70.6 -8.2 -15.2 7.4 -2.2 248 1249 A T T < 0 0 3 -3,-2.0 -1,-0.3 -4,-0.2 -2,-0.2 0.264 360.0 360.0 -93.4 9.7 -13.0 7.1 -5.3 249 1250 A R < 0 0 186 -3,-1.4 -1,-0.2 -215,-0.1 -2,-0.1 0.687 360.0 360.0 -69.8 360.0 -10.6 9.8 -3.9