==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=20-JUL-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE 02-AUG-06 2HWU . COMPND 2 MOLECULE: URIDINE PHOSPHORYLASE; . SOURCE 2 ORGANISM_SCIENTIFIC: SALMONELLA TYPHIMURIUM; . AUTHOR V.I.TIMOFEEV,A.G.GABDULKHAKOV,M.V.DONTSOVA,A.M.MIKHAILOV . 1466 11 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 45543.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 1080 73.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 212 14.5 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 155 10.6 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 6 0.4 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 . 12 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 0.1 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 . 104 7.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 163 11.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 343 23.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 35 2.4 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 5 2 1 5 4 6 0 2 0 3 10 2 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 4 10 2 2 0 0 1 5 6 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 PARALLEL BRIDGES PER LADDER . 1 11 4 2 2 10 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 0 0 6 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 1001 A M 0 0 171 0, 0.0 2,-0.1 0, 0.0 6,-0.1 0.000 360.0 360.0 360.0 25.2 -22.6 35.7 64.0 2 1002 A S - 0 0 107 0, 0.0 0, 0.0 0, 0.0 0, 0.0 -0.554 360.0 -46.6-111.5 62.9 -21.7 39.3 63.0 3 1003 A K S S+ 0 0 183 1,-0.2 2,-0.3 -2,-0.1 9,-0.1 0.983 109.9 133.3 60.2 73.3 -23.2 38.3 59.6 4 1004 A S - 0 0 21 1,-0.1 8,-0.3 8,-0.0 -1,-0.2 -0.947 50.1-161.6-152.2 129.1 -21.3 35.0 59.2 5 1005 A D S S+ 0 0 85 6,-2.7 2,-0.3 -2,-0.3 7,-0.2 0.523 85.2 53.0 -81.4 -8.0 -22.4 31.5 58.2 6 1006 A V S S- 0 0 8 5,-0.8 4,-0.3 1,-0.1 5,-0.0 -0.890 79.1-128.4-130.9 158.5 -19.3 30.1 59.8 7 1007 A F S S+ 0 0 78 -2,-0.3 -1,-0.1 2,-0.1 1452,-0.0 0.931 97.9 15.8 -73.8 -48.2 -17.6 30.4 63.2 8 1008 A H S S+ 0 0 20 68,-0.1 42,-0.1 1,-0.1 69,-0.1 0.931 117.6 55.2 -94.4 -55.3 -14.0 31.4 62.4 9 1009 A L S S- 0 0 0 67,-0.1 38,-0.2 1,-0.1 43,-0.1 0.678 88.6-138.0 -62.8 -22.0 -13.7 32.7 58.8 10 1010 A G + 0 0 15 -4,-0.3 2,-0.3 1,-0.2 -1,-0.1 0.871 55.4 131.7 67.6 40.6 -16.4 35.4 59.2 11 1011 A L - 0 0 0 34,-0.1 -6,-2.7 -5,-0.0 -5,-0.8 -0.849 44.6-148.9-126.6 158.2 -18.0 34.7 55.9 12 1012 A T > - 0 0 15 -2,-0.3 4,-0.8 -8,-0.3 3,-0.3 -0.824 33.8-110.9-118.8 160.3 -21.4 34.2 54.3 13 1013 A K H >>>S+ 0 0 121 -2,-0.3 5,-0.7 1,-0.2 4,-0.6 0.831 119.6 57.6 -57.0 -33.0 -22.6 32.1 51.3 14 1014 A N H >45S+ 0 0 117 1,-0.2 3,-1.3 2,-0.2 -1,-0.2 0.897 94.2 63.3 -64.8 -43.6 -23.3 35.5 49.6 15 1015 A D H 345S+ 0 0 42 -3,-0.3 -1,-0.2 1,-0.3 -2,-0.2 0.786 102.3 53.8 -48.8 -31.5 -19.8 36.8 50.0 16 1016 A L H X<5S- 0 0 3 -4,-0.8 3,-0.7 -3,-0.5 -1,-0.3 0.747 91.2-149.1 -79.3 -27.2 -18.7 33.9 47.7 17 1017 A Q T <<5S- 0 0 112 -3,-1.3 44,-0.3 -4,-0.6 -3,-0.1 0.881 75.8 -47.9 54.8 42.7 -21.1 34.7 44.9 18 1018 A G T 3 > - 0 0 19 1,-0.1 3,-1.2 40,-0.1 4,-0.6 -0.823 68.4-147.4-101.0 122.7 0.1 33.3 55.1 28 1028 A P T 34 S+ 0 0 17 0, 0.0 3,-0.4 0, 0.0 4,-0.4 0.763 101.7 55.5 -53.2 -30.4 -2.7 36.0 55.6 29 1029 A E T 3> S+ 0 0 100 1,-0.2 4,-0.6 2,-0.1 3,-0.3 0.743 99.6 59.3 -75.9 -25.9 -0.4 38.6 54.0 30 1030 A R H <> S+ 0 0 7 -3,-1.2 4,-1.8 1,-0.2 -1,-0.2 0.655 87.5 79.0 -76.3 -16.0 -0.0 36.5 50.8 31 1031 A V H X S+ 0 0 0 -4,-0.6 4,-2.2 -3,-0.4 -1,-0.2 0.887 92.5 46.1 -63.5 -45.8 -3.8 36.5 50.2 32 1032 A E H > S+ 0 0 109 -4,-0.4 4,-1.2 -3,-0.3 -1,-0.2 0.866 111.1 54.1 -63.6 -38.8 -4.0 40.0 48.7 33 1033 A K H < S+ 0 0 96 -4,-0.6 -2,-0.2 2,-0.2 -1,-0.2 0.863 110.8 45.6 -65.1 -38.6 -1.0 39.3 46.5 34 1034 A I H >< S+ 0 0 0 -4,-1.8 3,-1.6 1,-0.2 -2,-0.2 0.893 110.2 51.7 -73.1 -43.8 -2.6 36.2 45.0 35 1035 A A H >< S+ 0 0 0 -4,-2.2 3,-1.5 1,-0.3 -1,-0.2 0.747 97.7 71.0 -63.5 -23.1 -6.0 37.8 44.4 36 1036 A A T 3< S+ 0 0 71 -4,-1.2 -1,-0.3 1,-0.3 -2,-0.2 0.489 86.9 64.2 -73.2 -4.7 -4.1 40.6 42.6 37 1037 A L T < S+ 0 0 74 -3,-1.6 -1,-0.3 2,-0.1 2,-0.2 0.311 103.7 59.0 -95.2 5.8 -3.4 38.1 39.7 38 1038 A M S < S- 0 0 14 -3,-1.5 19,-0.2 19,-0.1 2,-0.1 -0.748 93.0 -82.2-130.7 173.0 -7.1 37.9 39.0 39 1039 A D E S-C 56 0A 96 17,-2.6 17,-3.1 -2,-0.2 -2,-0.1 -0.449 96.5 -4.8 -82.5 152.8 -10.0 40.2 38.1 40 1040 A K E S- 0 0 153 15,-0.2 2,-0.2 1,-0.1 -1,-0.2 0.772 77.7-171.6 33.0 55.5 -12.0 42.4 40.5 41 1041 A P E - 0 0 50 0, 0.0 2,-0.3 0, 0.0 14,-0.3 -0.539 5.3-179.5 -74.3 139.1 -10.4 41.2 43.8 42 1042 A V E -C 54 0A 62 12,-2.8 12,-2.7 -2,-0.2 2,-0.3 -1.000 30.8-115.5-141.6 136.6 -12.0 42.4 47.0 43 1043 A K E +C 53 0A 118 -2,-0.3 10,-0.2 10,-0.2 3,-0.1 -0.557 32.5 175.1 -68.2 127.6 -11.3 41.9 50.7 44 1044 A L E - 0 0 36 8,-2.5 2,-0.3 1,-0.4 9,-0.2 0.871 56.2 -21.7 -99.1 -59.6 -14.1 40.0 52.4 45 1045 A A E -C 52 0A 12 7,-1.2 7,-2.7 2,-0.0 -1,-0.4 -0.963 41.8-159.5-149.9 163.0 -13.0 39.3 55.9 46 1046 A S E +C 51 0A 44 -2,-0.3 2,-0.4 5,-0.2 5,-0.2 -0.763 26.3 152.7-149.9 100.3 -9.9 39.0 58.2 47 1047 A H E > -C 50 0A 74 3,-2.4 3,-2.3 -2,-0.2 -2,-0.0 -0.998 64.3 -36.3-131.2 136.9 -10.2 37.1 61.5 48 1048 A R T 3 S- 0 0 61 -2,-0.4 1210,-0.1 1,-0.3 20,-0.1 -0.283 124.7 -24.8 51.3-130.7 -7.4 35.3 63.3 49 1049 A E T 3 S+ 0 0 0 18,-0.1 2,-0.8 1,-0.1 -1,-0.3 0.392 119.5 98.1 -89.0 4.3 -5.0 33.7 60.7 50 1050 A F E < +C 47 0A 1 -3,-2.3 -3,-2.4 17,-0.1 2,-0.5 -0.817 44.3 169.9-101.8 102.0 -7.8 33.6 58.2 51 1051 A T E -C 46 0A 12 -2,-0.8 15,-2.3 -5,-0.2 2,-0.4 -0.950 15.3-166.3-106.4 127.8 -7.8 36.4 55.7 52 1052 A S E +CD 45 65A 0 -7,-2.7 -8,-2.5 -2,-0.5 -7,-1.2 -0.945 11.8 179.1-123.7 140.3 -10.2 36.0 52.7 53 1053 A W E -CD 43 64A 32 11,-3.1 11,-3.1 -2,-0.4 2,-0.4 -0.959 17.5-143.0-130.9 148.5 -10.5 37.7 49.4 54 1054 A R E +CD 42 63A 50 -12,-2.7 -12,-2.8 -2,-0.3 2,-0.3 -0.952 27.8 163.6-111.4 136.8 -12.9 37.2 46.5 55 1055 A A E - D 0 62A 0 7,-2.9 7,-3.1 -2,-0.4 2,-0.4 -0.830 32.7-113.0-137.3 176.9 -11.7 37.6 42.9 56 1056 A E E -CD 39 61A 65 -17,-3.1 -17,-2.6 -2,-0.3 2,-0.4 -0.957 20.5-170.7-118.9 137.0 -12.8 36.7 39.3 57 1057 A L E > S- D 0 60A 10 3,-3.1 3,-2.2 -2,-0.4 -19,-0.1 -0.989 78.6 -19.3-129.3 121.0 -11.1 34.2 37.0 58 1058 A D T 3 S- 0 0 89 -2,-0.4 -1,-0.1 1,-0.3 3,-0.1 0.871 131.1 -50.4 44.4 43.7 -12.2 34.0 33.4 59 1059 A G T 3 S+ 0 0 56 1,-0.2 2,-0.3 0, 0.0 -1,-0.3 0.162 118.3 107.0 90.1 -17.3 -15.5 35.7 34.5 60 1060 A K E < S- D 0 57A 129 -3,-2.2 -3,-3.1 1,-0.1 -1,-0.2 -0.760 73.4-104.8-106.5 144.4 -16.2 33.3 37.4 61 1061 A A E - D 0 56A 21 -44,-0.3 -41,-0.5 -2,-0.3 -40,-0.4 -0.341 38.1-178.2 -69.7 139.3 -15.9 34.0 41.2 62 1062 A V E - D 0 55A 0 -7,-3.1 -7,-2.9 -43,-0.2 2,-0.4 -0.990 17.7-135.7-140.8 141.9 -13.0 32.5 43.1 63 1063 A I E -bD 22 54A 0 -42,-2.2 -40,-3.2 -2,-0.3 2,-0.5 -0.814 8.8-167.3-101.0 137.2 -11.9 32.6 46.8 64 1064 A V E +bD 23 53A 0 -11,-3.1 -11,-3.1 -2,-0.4 2,-0.4 -0.987 22.8 165.9-116.8 117.4 -8.5 33.2 48.2 65 1065 A C E - D 0 52A 0 -42,-2.3 -13,-0.2 -2,-0.5 2,-0.1 -0.990 31.0-130.5-137.7 126.6 -8.3 32.3 51.9 66 1066 A S - 0 0 0 -15,-2.3 -40,-0.3 -2,-0.4 -39,-0.1 -0.384 10.9-165.8 -71.4 151.1 -5.3 31.8 54.2 67 1067 A T - 0 0 0 -42,-1.9 10,-0.2 1,-0.2 -41,-0.2 0.680 31.5-132.2-105.5 -27.3 -5.1 28.7 56.3 68 1068 A G - 0 0 0 -42,-1.0 2,-0.5 -43,-0.3 -1,-0.2 -0.296 47.7 -42.7 87.4 175.7 -2.4 29.6 58.8 69 1069 A I S S+ 0 0 6 -2,-0.1 1235,-0.7 4,-0.1 4,-0.3 -0.670 104.0 10.3 -83.3 123.9 0.5 27.4 59.6 70 1070 A G S > S- 0 0 0 -2,-0.5 4,-1.2 1233,-0.2 128,-0.2 -0.118 87.9 -73.1 104.2 166.1 -0.3 23.7 60.2 71 1071 A G H > S+ 0 0 0 126,-0.4 4,-3.2 2,-0.2 5,-0.2 0.869 116.6 60.9 -63.7 -44.7 -3.1 21.2 59.8 72 1072 A P H > S+ 0 0 0 0, 0.0 4,-1.3 0, 0.0 1321,-0.3 0.919 111.7 37.3 -53.1 -51.1 -5.3 22.3 62.7 73 1073 A S H > S+ 0 0 0 1227,-0.6 4,-2.0 -4,-0.3 -2,-0.2 0.777 116.3 55.0 -73.8 -27.4 -5.9 25.8 61.3 74 1074 A T H X S+ 0 0 1 -4,-1.2 4,-3.4 2,-0.2 5,-0.3 0.930 104.7 52.8 -66.7 -46.7 -6.1 24.4 57.8 75 1075 A S H X S+ 0 0 3 -4,-3.2 4,-2.2 1,-0.2 -2,-0.2 0.829 109.4 50.0 -59.8 -35.1 -8.8 22.0 58.8 76 1076 A I H X S+ 0 0 0 -4,-1.3 4,-2.6 -5,-0.2 5,-0.2 0.957 113.9 44.6 -65.1 -51.9 -10.9 24.8 60.2 77 1077 A A H X S+ 0 0 0 -4,-2.0 4,-2.4 -10,-0.2 -2,-0.2 0.920 116.6 45.2 -58.6 -49.4 -10.4 26.9 57.0 78 1078 A V H X S+ 0 0 0 -4,-3.4 4,-2.1 2,-0.2 -1,-0.2 0.931 114.9 47.8 -62.5 -48.4 -11.2 24.0 54.7 79 1079 A E H X S+ 0 0 6 -4,-2.2 4,-1.6 -5,-0.3 -2,-0.2 0.921 114.9 44.8 -57.7 -48.3 -14.2 22.8 56.7 80 1080 A E H X S+ 0 0 0 -4,-2.6 4,-1.6 1,-0.2 -1,-0.2 0.869 112.6 50.1 -71.0 -37.5 -15.7 26.3 57.0 81 1081 A L H X>S+ 0 0 0 -4,-2.4 5,-2.5 -5,-0.2 4,-1.2 0.871 108.7 54.7 -63.3 -38.1 -15.2 27.1 53.3 82 1082 A A H <5S+ 0 0 0 -4,-2.1 -2,-0.2 3,-0.2 -1,-0.2 0.849 105.8 51.5 -64.4 -36.8 -16.8 23.8 52.4 83 1083 A Q H <5S+ 0 0 45 -4,-1.6 -1,-0.2 1,-0.2 -2,-0.2 0.894 107.3 53.9 -62.8 -41.0 -19.9 24.8 54.4 84 1084 A L H <5S- 0 0 7 -4,-1.6 -2,-0.2 -5,-0.1 -1,-0.2 0.729 133.8 -88.2 -68.5 -25.1 -19.9 28.0 52.5 85 1085 A G T <5S+ 0 0 14 -4,-1.2 2,-0.3 1,-0.3 -3,-0.2 0.424 76.8 142.8 132.8 4.0 -20.0 26.1 49.2 86 1086 A I < + 0 0 0 -5,-2.5 -1,-0.3 1,-0.1 -65,-0.2 -0.568 12.7 166.6 -75.3 131.7 -16.3 25.5 48.2 87 1087 A R + 0 0 76 -67,-2.9 125,-2.5 -2,-0.3 2,-0.4 0.536 62.6 55.1-118.4 -18.3 -15.7 22.1 46.6 88 1088 A T E -ae 21 212A 7 -68,-2.1 -66,-3.0 123,-0.2 2,-0.5 -0.980 61.3-172.2-126.7 124.9 -12.2 22.6 45.1 89 1089 A F E -ae 22 213A 0 123,-2.7 125,-2.8 -2,-0.4 2,-0.6 -0.960 4.2-172.1-118.5 123.3 -9.2 23.6 47.1 90 1090 A L E -ae 23 214A 0 -68,-2.2 -66,-3.2 -2,-0.5 2,-0.4 -0.965 13.0-155.0-113.9 115.2 -5.8 24.5 45.6 91 1091 A R E - e 0 215A 6 123,-2.1 125,-2.8 -2,-0.6 2,-0.5 -0.763 8.7-171.1 -90.5 132.1 -3.1 25.1 48.1 92 1092 A I E + e 0 216A 2 -68,-0.5 -66,-0.5 -2,-0.4 125,-0.2 -0.982 25.2 148.8-120.1 116.9 -0.1 27.3 47.2 93 1093 A G E - e 0 217A 2 123,-2.1 125,-2.0 -2,-0.5 2,-0.3 -0.682 44.8-101.2-132.4-176.1 2.7 27.2 49.7 94 1094 A T E - e 0 218A 37 123,-0.2 2,-0.3 -2,-0.2 125,-0.2 -0.789 40.0-174.7-105.2 158.2 6.5 27.5 50.3 95 1095 A T E - e 0 219A 5 123,-2.0 125,-2.7 -2,-0.3 126,-0.8 -0.986 28.1-130.3-151.2 157.7 8.6 24.4 50.8 96 1096 A G E -Fe 195 221A 6 99,-1.8 99,-2.7 -2,-0.3 126,-0.2 -0.971 31.1-140.7-110.1 119.1 12.1 23.1 51.6 97 1097 A A E -Fe 194 222A 0 124,-2.1 126,-3.0 -2,-0.5 97,-0.3 -0.490 14.9-168.8 -79.7 148.3 13.3 20.5 49.1 98 1098 A I + 0 0 0 95,-2.4 96,-0.2 124,-0.2 -1,-0.1 0.435 59.8 90.7-115.9 -4.6 15.3 17.4 50.4 99 1099 A Q S > S- 0 0 27 94,-0.9 3,-1.1 1,-0.1 125,-0.2 -0.767 71.1-138.3 -93.5 139.5 16.5 16.0 47.0 100 1100 A P T 3 S+ 0 0 86 0, 0.0 -1,-0.1 0, 0.0 -3,-0.0 0.793 103.3 58.1 -63.2 -28.3 19.9 17.2 45.6 101 1101 A H T 3 S+ 0 0 116 2,-0.1 2,-0.7 1,-0.0 -3,-0.0 0.541 88.6 85.0 -82.1 -8.1 18.4 17.4 42.1 102 1102 A I < - 0 0 0 -3,-1.1 2,-0.1 91,-0.1 -5,-0.1 -0.863 67.8-160.0 -99.6 113.9 15.7 19.9 43.2 103 1103 A N > - 0 0 76 -2,-0.7 3,-1.7 1,-0.1 116,-0.2 -0.474 28.8 -88.0 -91.9 159.9 16.9 23.5 43.1 104 1104 A V T 3 S+ 0 0 41 1,-0.2 116,-0.2 -2,-0.1 -1,-0.1 -0.423 116.1 33.9 -62.6 137.6 15.6 26.6 44.8 105 1105 A G T 3 S+ 0 0 24 114,-2.6 45,-0.3 1,-0.4 -1,-0.2 0.222 89.1 129.9 94.8 -13.5 13.0 28.3 42.6 106 1106 A D < - 0 0 11 -3,-1.7 113,-2.7 113,-0.1 2,-0.5 -0.350 57.0-127.2 -66.0 153.7 11.7 24.9 41.3 107 1107 A V E -gH 151 218A 0 43,-2.9 45,-2.2 111,-0.2 2,-0.5 -0.919 21.2-159.6-110.1 129.3 8.0 24.3 41.5 108 1108 A L E -gH 152 217A 0 109,-3.2 109,-2.4 -2,-0.5 2,-0.5 -0.928 6.0-163.3-115.5 131.0 6.7 21.1 43.2 109 1109 A V E -gH 153 216A 0 43,-2.8 45,-2.1 -2,-0.5 2,-0.5 -0.943 18.6-137.5-109.6 130.4 3.3 19.5 42.7 110 1110 A T E +g 154 0A 1 105,-2.3 105,-0.4 -2,-0.5 45,-0.2 -0.765 23.3 178.6 -93.8 125.9 2.2 16.9 45.3 111 1111 A T E S- 0 0 12 43,-2.1 21,-3.0 -2,-0.5 2,-0.3 0.860 77.5 -18.5 -82.5 -45.1 0.5 13.6 44.3 112 1112 A A E -gI 155 131A 0 42,-0.5 44,-1.9 19,-0.3 -1,-0.4 -0.976 68.3-123.2-158.9 162.1 0.3 12.5 48.0 113 1113 A S E -gI 156 130A 0 17,-1.7 2,-0.6 -2,-0.3 17,-0.5 -0.819 17.6-119.9-118.4 149.4 1.8 13.3 51.4 114 1114 A V E -g 157 0A 0 42,-2.7 44,-2.0 -2,-0.3 2,-1.7 -0.785 38.8-128.3 -80.7 119.1 3.6 11.4 54.1 115 1115 A R E +g 158 0A 2 999,-2.2 44,-0.1 -2,-0.6 1000,-0.1 -0.508 54.1 145.6 -80.2 82.7 1.3 11.9 57.1 116 1116 A L E +g 159 0A 0 42,-2.0 44,-1.5 -2,-1.7 2,-0.2 0.031 54.8 90.6-100.3 22.8 3.6 13.3 59.8 117 1117 A D - 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0 0 39 8,-2.4 2,-0.3 1,-0.5 9,-0.2 0.837 53.6 -30.2-104.8 -63.4 15.4 -20.3 101.6 785 3045 D A E -G 792 0D 14 7,-1.2 7,-1.6 2,-0.0 -1,-0.5 -0.887 42.2-152.1-147.5 174.8 14.3 -16.6 101.8 786 3046 D S E +G 791 0D 48 -2,-0.3 2,-0.4 5,-0.2 5,-0.2 -0.748 24.9 157.4-158.5 110.0 11.2 -14.4 101.8 787 3047 D H E > -G 790 0D 82 3,-2.3 3,-2.4 -2,-0.2 -2,-0.0 -0.998 60.8 -36.9-136.9 140.7 11.2 -10.8 100.6 788 3048 D R T 3 S- 0 0 55 -2,-0.4 -510,-0.0 1,-0.3 -39,-0.0 -0.206 123.9 -25.8 46.9-126.7 8.4 -8.6 99.4 789 3049 D E T 3 S+ 0 0 1 18,-0.1 2,-0.8 1,-0.1 -1,-0.3 0.392 119.2 98.1 -93.7 5.1 6.0 -10.8 97.4 790 3050 D F E < +G 787 0D 0 -3,-2.4 -3,-2.3 -42,-0.1 2,-0.5 -0.816 47.0 175.0-100.1 103.0 8.7 -13.3 96.5 791 3051 D T E -G 786 0D 15 -2,-0.8 15,-2.0 -5,-0.2 2,-0.4 -0.939 11.8-167.1-107.8 122.2 8.7 -16.3 98.8 792 3052 D S E +GH 785 805D 0 -7,-1.6 -8,-2.4 -2,-0.5 -7,-1.2 -0.938 11.4 175.9-123.0 130.7 11.2 -19.1 97.8 793 3053 D W E -GH 783 804D 40 11,-2.9 11,-2.3 -2,-0.4 2,-0.5 -0.875 21.0-138.1-122.1 155.9 11.6 -22.7 98.9 794 3054 D R E +GH 782 803D 35 -12,-3.6 -12,-3.6 -2,-0.3 2,-0.2 -0.979 27.9 166.6-116.1 124.8 13.9 -25.5 97.9 795 3055 D A E - H 0 802D 0 7,-2.7 7,-3.3 -2,-0.5 2,-0.4 -0.750 28.0-125.0-121.9 173.1 12.6 -29.0 97.5 796 3056 D E E -GH 779 801D 30 -17,-2.7 -17,-2.5 5,-0.2 2,-0.4 -0.979 16.3-169.5-124.6 140.6 14.0 -32.2 95.8 797 3057 D L E > S- H 0 800D 7 3,-2.3 3,-1.0 -2,-0.4 -19,-0.1 -0.952 77.3 -18.9-135.0 111.3 12.4 -34.3 93.1 798 3058 D D T 3 S- 0 0 83 -2,-0.4 -1,-0.1 1,-0.2 3,-0.1 0.886 128.2 -53.4 53.9 43.5 13.9 -37.7 92.3 799 3059 D G T 3 S+ 0 0 58 1,-0.2 2,-0.4 0, 0.0 -1,-0.2 0.536 117.8 110.1 74.7 8.8 17.1 -36.6 93.9 800 3060 D K E < S- H 0 797D 94 -3,-1.0 -3,-2.3 -41,-0.0 -1,-0.2 -0.974 72.7-110.6-121.8 127.9 17.4 -33.4 91.9 801 3061 D A E - H 0 796D 15 -2,-0.4 -41,-0.6 -44,-0.3 -40,-0.5 -0.176 35.3-175.0 -61.7 140.8 17.0 -30.0 93.4 802 3062 D V E - H 0 795D 0 -7,-3.3 -7,-2.7 -43,-0.2 2,-0.4 -0.975 15.0-139.1-137.4 147.1 13.9 -27.9 92.6 803 3063 D I E -fH 762 794D 0 -42,-2.0 -40,-2.9 -2,-0.3 2,-0.5 -0.903 6.3-165.4-110.0 133.1 12.8 -24.3 93.4 804 3064 D V E +fH 763 793D 0 -11,-2.3 -11,-2.9 -2,-0.4 2,-0.4 -0.980 24.2 167.0-111.3 117.7 9.3 -23.2 94.3 805 3065 D C E - H 0 792D 0 -42,-2.3 -13,-0.2 -2,-0.5 2,-0.1 -0.986 30.9-129.2-138.6 125.4 9.1 -19.4 94.1 806 3066 D S - 0 0 0 -15,-2.0 -40,-0.2 -2,-0.4 -39,-0.1 -0.400 11.0-166.5 -71.3 145.8 6.1 -17.0 94.1 807 3067 D T - 0 0 1 -42,-2.6 10,-0.2 1,-0.2 -41,-0.2 0.702 31.3-139.0 -98.8 -28.2 5.8 -14.4 91.4 808 3068 D G - 0 0 0 -42,-1.0 2,-0.4 -43,-0.4 -1,-0.2 -0.351 45.4 -38.1 86.1-177.9 3.1 -12.3 92.9 809 3069 D I S S+ 0 0 7 -2,-0.1 -485,-0.6 4,-0.1 4,-0.4 -0.686 105.1 13.0 -84.8 129.1 0.2 -10.8 91.0 810 3070 D G S > S- 0 0 0 -2,-0.4 4,-1.2 -487,-0.2 128,-0.2 0.006 86.7 -78.9 99.7 161.4 0.9 -9.4 87.5 811 3071 D G H > S+ 0 0 0 126,-0.4 4,-2.9 1,-0.2 5,-0.2 0.886 116.5 63.4 -61.8 -46.3 3.6 -9.5 84.8 812 3072 D P H > S+ 0 0 0 0, 0.0 4,-0.7 0, 0.0 -399,-0.3 0.878 108.6 39.3 -48.6 -49.7 5.9 -6.9 86.4 813 3073 D S H > S+ 0 0 0 -493,-0.5 4,-2.1 -4,-0.4 3,-0.3 0.809 114.5 55.1 -74.7 -29.9 6.6 -8.9 89.6 814 3074 D T H X S+ 0 0 1 -4,-1.2 4,-2.8 1,-0.2 5,-0.3 0.907 102.9 56.9 -62.8 -42.4 6.8 -12.1 87.5 815 3075 D S H X S+ 0 0 2 -4,-2.9 4,-1.0 -404,-0.2 -1,-0.2 0.719 109.4 46.3 -64.2 -23.0 9.5 -10.4 85.4 816 3076 D I H X S+ 0 0 0 -4,-0.7 4,-2.4 -3,-0.3 5,-0.2 0.930 113.8 44.6 -81.6 -53.6 11.6 -9.8 88.5 817 3077 D A H X S+ 0 0 0 -4,-2.1 4,-2.0 -10,-0.2 5,-0.2 0.907 117.8 45.5 -57.4 -46.2 11.3 -13.3 90.0 818 3078 D V H X S+ 0 0 0 -4,-2.8 4,-2.5 2,-0.2 -1,-0.2 0.952 112.8 49.3 -63.4 -51.9 11.9 -15.0 86.6 819 3079 D E H X S+ 0 0 5 -4,-1.0 4,-1.7 -5,-0.3 -2,-0.2 0.878 115.1 44.1 -55.0 -43.6 14.9 -12.8 85.6 820 3080 D E H X S+ 0 0 0 -4,-2.4 4,-1.2 2,-0.2 -1,-0.2 0.826 112.5 50.3 -77.8 -33.1 16.6 -13.3 89.0 821 3081 D L H X>S+ 0 0 0 -4,-2.0 5,-2.6 -5,-0.2 4,-0.6 0.853 110.6 52.2 -66.5 -36.9 16.0 -17.0 89.1 822 3082 D A H ><5S+ 0 0 0 -4,-2.5 3,-0.7 3,-0.2 -2,-0.2 0.882 106.1 53.1 -64.6 -41.0 17.4 -17.2 85.6 823 3083 D Q H 3<5S+ 0 0 58 -4,-1.7 -1,-0.2 1,-0.2 -2,-0.2 0.829 108.0 52.1 -59.8 -34.6 20.5 -15.2 86.8 824 3084 D L H 3<5S- 0 0 9 -4,-1.2 -1,-0.2 -5,-0.1 -2,-0.2 0.587 132.9 -89.3 -82.4 -12.8 20.9 -17.9 89.5 825 3085 D G T <<5S+ 0 0 13 -3,-0.7 2,-0.3 -4,-0.6 -3,-0.2 0.347 75.8 142.8 124.9 -5.6 20.7 -20.7 87.0 826 3086 D I < + 0 0 0 -5,-2.6 -1,-0.3 1,-0.2 -65,-0.2 -0.505 15.0 170.7 -65.4 126.5 17.1 -21.7 86.5 827 3087 D R + 0 0 83 -67,-2.8 125,-2.4 -2,-0.3 2,-0.4 0.494 60.8 55.2-112.8 -12.1 16.4 -22.5 82.9 828 3088 D T E -ei 761 952D 6 -68,-2.0 -66,-2.8 123,-0.2 2,-0.4 -0.987 60.6-170.4-134.5 127.6 12.9 -24.0 83.2 829 3089 D F E -ei 762 953D 0 123,-3.1 125,-2.1 -2,-0.4 2,-0.5 -0.943 5.9-171.7-119.9 132.9 9.8 -22.4 84.7 830 3090 D L E -ei 763 954D 0 -68,-2.3 -66,-2.6 -2,-0.4 2,-0.5 -0.931 13.8-156.4-124.3 107.1 6.4 -24.0 85.5 831 3091 D R E - 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0 0 1 -3,-1.3 2,-0.2 91,-0.1 -5,-0.1 -0.819 67.1-158.0 -95.2 113.4 -15.3 -25.3 81.1 843 3103 D N > - 0 0 92 -2,-0.7 3,-2.0 1,-0.1 116,-0.2 -0.516 29.0 -89.1 -91.7 154.7 -16.4 -25.8 84.7 844 3104 D V T 3 S+ 0 0 69 1,-0.2 116,-0.2 -2,-0.2 -1,-0.1 -0.421 115.9 39.1 -56.3 127.0 -15.0 -24.6 88.0 845 3105 D G T 3 S+ 0 0 23 114,-2.0 -1,-0.2 1,-0.4 45,-0.1 0.076 88.6 122.3 114.9 -21.7 -12.5 -27.2 89.1 846 3106 D D < - 0 0 14 -3,-2.0 113,-2.2 112,-0.1 2,-0.4 -0.066 58.2-123.1 -68.6 170.2 -11.0 -27.9 85.7 847 3107 D V E -kL 891 958D 1 43,-2.6 45,-1.9 111,-0.2 2,-0.5 -0.962 18.9-160.1-119.2 134.3 -7.3 -27.6 84.6 848 3108 D L E -kL 892 957D 0 109,-2.5 109,-1.4 -2,-0.4 2,-0.6 -0.968 3.7-159.9-120.0 123.2 -6.2 -25.4 81.7 849 3109 D V E -kL 893 956D 0 43,-2.6 45,-1.7 -2,-0.5 2,-0.5 -0.902 19.1-140.4-100.7 117.8 -2.9 -25.9 80.0 850 3110 D T E +kL 894 955D 0 105,-1.6 105,-0.5 -2,-0.6 45,-0.2 -0.680 23.2 179.1 -85.2 119.9 -1.9 -22.7 78.1 851 3111 D T E S- 0 0 14 43,-2.4 21,-3.1 -2,-0.5 2,-0.3 0.877 76.1 -13.2 -77.8 -45.4 -0.3 -23.2 74.7 852 3112 D A E -kM 895 871D 0 42,-0.7 44,-2.1 19,-0.3 2,-0.4 -0.981 69.5-123.5-156.7 159.6 0.1 -19.5 74.1 853 3113 D S E -k 896 0D 0 17,-2.4 2,-0.6 -2,-0.3 17,-0.5 -0.891 16.1-124.8-119.6 136.7 -1.2 -16.2 75.6 854 3114 D V E -k 897 0D 0 42,-3.3 44,-2.4 -2,-0.4 2,-1.9 -0.673 36.9-130.3 -69.6 117.1 -3.1 -13.2 74.3 855 3115 D R E +k 898 0D 2 -232,-2.4 44,-0.1 -2,-0.6 -1,-0.1 -0.496 48.8 152.4 -81.2 77.0 -0.8 -10.4 75.3 856 3116 D L E +k 899 0D 1 -2,-1.9 44,-1.5 42,-1.5 45,-0.2 -0.200 54.8 86.2 -93.4 41.9 -3.1 -7.9 77.1 857 3117 D D S S- 0 0 7 42,-0.2 42,-0.1 43,-0.1 81,-0.0 -0.642 70.0-139.5-129.3-177.4 -0.1 -6.8 79.1 858 3118 D G S > S+ 0 0 2 -2,-0.2 3,-1.0 -447,-0.1 4,-0.3 0.679 90.2 68.2-114.4 -35.6 2.8 -4.3 79.0 859 3119 D A G > S+ 0 0 0 1,-0.3 3,-1.6 2,-0.2 4,-0.2 0.815 92.1 61.1 -60.4 -36.5 5.7 -6.3 80.5 860 3120 D S G >> S+ 0 0 0 1,-0.3 4,-2.0 2,-0.2 3,-1.7 0.825 95.5 63.2 -59.5 -33.7 6.0 -8.7 77.6 861 3121 D L G <4 S+ 0 0 39 -3,-1.0 -1,-0.3 1,-0.3 -431,-0.2 0.628 90.8 66.6 -66.6 -15.7 6.7 -5.7 75.3 862 3122 D H G <4 S+ 0 0 1 -3,-1.6 -434,-0.7 -4,-0.3 -1,-0.3 0.479 111.9 33.1 -84.1 -4.0 9.9 -5.1 77.3 863 3123 D F T <4 S+ 0 0 6 -3,-1.7 -2,-0.2 1,-0.4 -1,-0.1 0.654 133.9 0.9-118.3 -35.7 11.3 -8.4 76.0 864 3124 D A S < S- 0 0 0 -4,-2.0 -1,-0.4 -436,-0.1 81,-0.0 -0.986 76.6-101.9-154.9 146.7 9.7 -8.7 72.5 865 3125 D P > - 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