==== 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 PHOSPHOTRANSFERASE 27-APR-94 1NDC . COMPND 2 MOLECULE: NUCLEOSIDE DIPHOSPHATE KINASE; . SOURCE 2 ORGANISM_SCIENTIFIC: DICTYOSTELIUM DISCOIDEUM; . AUTHOR J.CHERFILS,S.MORERA,J.JANIN . 150 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 8155.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 94 62.7 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 . 22 14.7 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 . 1 0.7 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 0.7 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 . 5 3.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 18 12.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 43 28.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 2 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 0 2 0 1 1 1 0 2 0 0 0 0 0 0 0 0 0 0 0 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 . 1 0 1 0 0 1 1 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 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 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 V > 0 0 144 0, 0.0 3,-0.9 0, 0.0 80,-0.5 0.000 360.0 360.0 360.0 145.1 -5.0 -25.9 -18.4 2 7 A N T 3 + 0 0 64 1,-0.2 78,-0.2 78,-0.2 147,-0.0 0.311 360.0 74.0 -79.1 8.9 -4.9 -24.2 -15.0 3 8 A K T 3 + 0 0 123 75,-0.1 -1,-0.2 76,-0.1 77,-0.1 0.188 60.9 128.9-109.7 16.5 -1.8 -26.2 -14.1 4 9 A E < - 0 0 51 -3,-0.9 75,-2.4 75,-0.3 2,-0.3 -0.403 43.0-155.9 -67.2 150.3 0.8 -24.4 -16.3 5 10 A R E -A 78 0A 53 73,-0.2 2,-0.3 117,-0.1 73,-0.2 -0.943 12.2-165.2-132.7 151.9 3.9 -23.4 -14.3 6 11 A T E -A 77 0A 0 71,-2.2 71,-1.7 -2,-0.3 2,-0.5 -0.936 19.0-127.8-133.1 156.1 6.6 -20.7 -14.6 7 12 A F E +A 76 0A 0 -2,-0.3 112,-1.7 69,-0.2 2,-0.4 -0.923 27.6 178.7-105.6 129.3 10.0 -20.2 -13.0 8 13 A L E -AB 75 118A 0 67,-2.8 67,-3.0 -2,-0.5 2,-0.4 -0.960 6.4-171.3-128.7 145.2 10.7 -16.9 -11.4 9 14 A A E -AB 74 117A 0 108,-2.2 108,-2.2 -2,-0.4 2,-0.7 -0.979 20.0-141.7-140.6 122.5 13.9 -15.8 -9.6 10 15 A V E -AB 73 116A 0 63,-2.8 63,-1.9 -2,-0.4 106,-0.2 -0.786 33.8-137.0 -82.8 116.9 14.4 -12.6 -7.7 11 16 A K >> - 0 0 11 104,-2.1 4,-2.3 -2,-0.7 3,-0.5 -0.190 26.3 -91.6 -70.0 168.9 18.0 -11.8 -8.6 12 17 A P H 3> S+ 0 0 11 0, 0.0 4,-2.8 0, 0.0 5,-0.2 0.796 126.7 53.2 -52.2 -36.1 20.6 -10.5 -6.0 13 18 A D H 3> S+ 0 0 13 2,-0.2 4,-1.6 1,-0.2 6,-0.1 0.915 110.1 48.2 -67.6 -38.9 19.8 -6.9 -6.7 14 19 A G H <4>S+ 0 0 0 -3,-0.5 5,-2.2 101,-0.4 6,-0.3 0.902 114.2 46.2 -66.9 -41.0 16.1 -7.6 -6.0 15 20 A V H ><5S+ 0 0 27 -4,-2.3 3,-1.9 56,-0.3 5,-0.2 0.961 112.6 49.4 -65.8 -48.7 17.0 -9.5 -2.8 16 21 A A H 3<5S+ 0 0 90 -4,-2.8 -1,-0.2 1,-0.3 -2,-0.2 0.776 108.5 54.2 -61.0 -29.4 19.5 -6.8 -1.6 17 22 A R T 3<5S- 0 0 133 -4,-1.6 -1,-0.3 -5,-0.2 -2,-0.2 0.408 115.2-115.3 -87.4 3.1 16.9 -4.1 -2.2 18 23 A G T < 5S+ 0 0 63 -3,-1.9 4,-0.2 -4,-0.1 -3,-0.2 0.889 75.0 129.4 66.0 45.3 14.3 -5.9 -0.0 19 24 A L >< + 0 0 16 -5,-2.2 4,-2.3 2,-0.1 5,-0.2 0.285 35.0 99.8-112.4 7.1 11.8 -6.6 -2.8 20 25 A V H > S+ 0 0 36 -6,-0.3 4,-2.6 -5,-0.2 5,-0.2 0.967 88.2 41.4 -57.7 -55.7 11.2 -10.3 -2.3 21 26 A G H > S+ 0 0 49 1,-0.2 4,-2.6 2,-0.2 -1,-0.2 0.884 112.5 54.7 -60.3 -44.0 7.9 -9.9 -0.4 22 27 A E H > S+ 0 0 81 -4,-0.2 4,-1.5 2,-0.2 -1,-0.2 0.931 112.6 44.4 -54.9 -45.9 6.7 -7.1 -2.7 23 28 A I H X S+ 0 0 0 -4,-2.3 4,-1.4 2,-0.2 3,-0.3 0.940 112.9 48.0 -67.1 -49.2 7.2 -9.5 -5.7 24 29 A I H X S+ 0 0 25 -4,-2.6 4,-2.2 1,-0.2 3,-0.2 0.920 109.4 56.3 -58.7 -41.4 5.7 -12.6 -4.2 25 30 A A H X S+ 0 0 34 -4,-2.6 4,-2.6 1,-0.2 -1,-0.2 0.849 100.9 56.1 -60.1 -39.4 2.7 -10.6 -3.1 26 31 A R H X S+ 0 0 48 -4,-1.5 4,-1.4 -3,-0.3 -1,-0.2 0.914 111.1 44.4 -60.7 -40.3 1.9 -9.4 -6.6 27 32 A Y H X>S+ 0 0 0 -4,-1.4 5,-1.8 -3,-0.2 4,-1.1 0.859 113.0 50.3 -73.7 -34.4 1.7 -13.0 -7.8 28 33 A E H <5S+ 0 0 116 -4,-2.2 3,-0.3 1,-0.2 -2,-0.2 0.896 110.0 50.4 -69.1 -41.1 -0.4 -14.1 -4.8 29 34 A K H <5S+ 0 0 186 -4,-2.6 -1,-0.2 1,-0.2 -2,-0.2 0.840 105.7 57.5 -63.9 -35.1 -2.8 -11.2 -5.3 30 35 A K H <5S- 0 0 116 -4,-1.4 -1,-0.2 -5,-0.2 -2,-0.2 0.792 120.4-110.5 -64.2 -32.7 -3.1 -12.2 -9.0 31 36 A G T <5 + 0 0 10 -4,-1.1 114,-0.2 1,-0.3 2,-0.2 0.480 68.8 139.8 114.3 3.6 -4.2 -15.7 -8.0 32 37 A F < - 0 0 16 -5,-1.8 2,-0.4 47,-0.1 -1,-0.3 -0.552 49.1-124.6 -79.5 149.0 -1.2 -17.8 -8.9 33 38 A V E -C 78 0A 28 45,-2.6 45,-2.2 -2,-0.2 2,-0.6 -0.817 12.0-127.7-101.7 133.0 -0.2 -20.6 -6.5 34 39 A L E +C 77 0A 51 -2,-0.4 43,-0.2 43,-0.2 3,-0.1 -0.640 35.2 165.2 -75.7 114.5 3.2 -20.9 -5.1 35 40 A V E + 0 0 3 41,-3.1 104,-2.2 -2,-0.6 2,-0.3 0.519 65.3 20.8-110.0 -4.5 4.4 -24.5 -5.7 36 41 A G E +C 76 0A 4 40,-1.1 40,-1.9 102,-0.2 -1,-0.3 -0.966 62.5 165.8-159.7 142.8 8.2 -24.1 -5.0 37 42 A L E +C 75 0A 84 100,-0.4 2,-0.3 -2,-0.3 38,-0.2 -0.892 8.7 142.0-164.9 130.4 10.2 -21.6 -3.1 38 43 A K E -C 74 0A 43 36,-2.0 36,-2.8 -2,-0.3 2,-0.4 -0.970 36.5-130.9-166.8 151.1 13.8 -21.4 -1.8 39 44 A Q E +C 73 0A 125 -2,-0.3 2,-0.3 34,-0.2 34,-0.2 -0.931 39.5 150.5-107.5 136.7 16.7 -19.0 -1.3 40 45 A L E -C 72 0A 45 32,-2.2 32,-2.8 -2,-0.4 30,-0.1 -0.960 48.0-117.1-155.8 161.5 20.1 -20.2 -2.4 41 46 A V - 0 0 88 -2,-0.3 27,-0.1 30,-0.2 26,-0.0 -0.966 43.8-125.6-105.4 113.0 23.4 -18.6 -3.8 42 47 A P - 0 0 5 0, 0.0 2,-0.1 0, 0.0 28,-0.1 -0.320 16.0-132.2 -61.3 140.2 23.7 -20.0 -7.3 43 48 A T > - 0 0 88 1,-0.1 4,-2.3 -2,-0.0 5,-0.2 -0.428 28.3-106.2 -83.0 168.0 26.9 -21.8 -8.3 44 49 A K H > S+ 0 0 131 1,-0.2 4,-2.8 2,-0.2 5,-0.2 0.884 121.0 55.9 -63.0 -36.0 28.7 -20.9 -11.6 45 50 A D H > S+ 0 0 116 2,-0.2 4,-1.5 1,-0.2 -1,-0.2 0.858 108.9 44.9 -63.6 -41.3 27.5 -24.2 -13.1 46 51 A L H > S+ 0 0 27 2,-0.2 4,-2.9 1,-0.2 5,-0.2 0.923 113.7 50.1 -69.0 -45.2 23.8 -23.4 -12.3 47 52 A A H X S+ 0 0 0 -4,-2.3 4,-2.2 1,-0.2 -2,-0.2 0.925 111.8 47.5 -58.8 -48.8 24.2 -19.9 -13.6 48 53 A E H < S+ 0 0 72 -4,-2.8 -1,-0.2 2,-0.2 -2,-0.2 0.825 114.6 46.1 -63.5 -34.2 25.8 -21.0 -16.9 49 54 A S H >< S+ 0 0 48 -4,-1.5 3,-1.1 -5,-0.2 4,-0.3 0.918 112.5 49.7 -73.7 -46.7 23.2 -23.7 -17.5 50 55 A H H 3< S+ 0 0 3 -4,-2.9 3,-0.3 1,-0.2 -2,-0.2 0.901 121.4 34.2 -56.3 -46.8 20.3 -21.4 -16.7 51 56 A Y T >< S+ 0 0 13 -4,-2.2 3,-2.5 -5,-0.2 -1,-0.2 0.165 80.8 123.5 -97.6 17.4 21.6 -18.7 -19.0 52 57 A A G X + 0 0 32 -3,-1.1 3,-2.4 1,-0.3 4,-0.2 0.828 63.7 66.1 -46.8 -45.4 23.1 -21.1 -21.6 53 58 A E G 3 S+ 0 0 106 -3,-0.3 3,-0.3 1,-0.3 -1,-0.3 0.728 101.7 50.8 -52.8 -23.7 21.0 -19.6 -24.5 54 59 A H G X S+ 0 0 35 -3,-2.5 3,-2.1 1,-0.2 6,-0.4 0.307 72.3 116.2 -98.0 7.7 23.0 -16.3 -24.0 55 60 A K T < S+ 0 0 140 -3,-2.4 -1,-0.2 1,-0.3 -2,-0.1 0.767 80.2 41.7 -51.0 -29.8 26.5 -17.8 -24.1 56 61 A E T 3 S+ 0 0 173 -3,-0.3 -1,-0.3 -4,-0.2 -2,-0.1 0.457 95.6 99.7 -98.7 2.5 27.6 -16.0 -27.3 57 62 A R S X S- 0 0 117 -3,-2.1 3,-1.5 1,-0.1 4,-0.3 -0.588 81.3-118.0 -89.4 148.1 26.0 -12.6 -26.4 58 63 A P T 3 S+ 0 0 130 0, 0.0 3,-0.3 0, 0.0 4,-0.3 0.730 109.2 52.1 -55.8 -27.4 28.0 -9.7 -25.0 59 64 A F T 3> S+ 0 0 102 1,-0.2 4,-2.2 2,-0.1 5,-0.2 0.526 81.9 93.1 -90.0 -6.6 26.2 -9.5 -21.6 60 65 A F H <> S+ 0 0 33 -3,-1.5 4,-2.7 -6,-0.4 5,-0.3 0.877 81.3 54.6 -54.3 -46.0 26.6 -13.2 -20.7 61 66 A G H > S+ 0 0 46 -4,-0.3 4,-2.3 -3,-0.3 -1,-0.2 0.943 114.1 38.5 -54.8 -53.7 29.8 -12.7 -18.7 62 67 A G H > S+ 0 0 51 -4,-0.3 4,-2.7 2,-0.2 -1,-0.2 0.812 113.2 58.2 -68.2 -31.3 28.4 -10.1 -16.4 63 68 A L H X S+ 0 0 33 -4,-2.2 4,-2.3 2,-0.2 -2,-0.2 0.958 110.5 41.2 -62.6 -52.5 25.1 -11.9 -16.2 64 69 A V H X S+ 0 0 8 -4,-2.7 4,-1.2 1,-0.2 -2,-0.2 0.919 115.6 50.9 -64.4 -42.2 26.6 -15.1 -14.9 65 70 A S H < S+ 0 0 84 -4,-2.3 4,-0.3 -5,-0.3 3,-0.2 0.914 112.4 46.9 -61.9 -43.6 29.0 -13.2 -12.6 66 71 A F H >< S+ 0 0 33 -4,-2.7 3,-1.4 1,-0.2 4,-0.3 0.916 107.8 52.8 -67.6 -43.4 26.1 -11.1 -11.1 67 72 A I H 3< S+ 0 0 1 -4,-2.3 3,-0.4 1,-0.3 -1,-0.2 0.759 111.3 47.9 -67.0 -22.0 23.7 -13.9 -10.4 68 73 A T T 3< S+ 0 0 42 -4,-1.2 -1,-0.3 -3,-0.2 -2,-0.2 0.442 92.7 83.3 -94.9 0.7 26.3 -15.9 -8.5 69 74 A S S < S- 0 0 80 -3,-1.4 -1,-0.2 -4,-0.3 -2,-0.1 0.582 102.7 -7.5 -80.0 -14.4 27.3 -12.8 -6.4 70 75 A G S S- 0 0 14 -3,-0.4 -57,-0.1 -4,-0.3 -30,-0.1 -0.962 94.7 -45.6-165.0-179.7 24.6 -13.1 -3.8 71 76 A P - 0 0 49 0, 0.0 2,-0.3 0, 0.0 -56,-0.3 -0.212 44.5-163.3 -61.9 150.6 21.4 -14.9 -2.7 72 77 A V E - C 0 40A 0 -32,-2.8 -32,-2.2 -57,-0.1 2,-0.7 -0.953 14.5-138.2-131.4 143.1 18.6 -15.5 -5.2 73 78 A V E -AC 10 39A 9 -63,-1.9 -63,-2.8 -2,-0.3 2,-0.4 -0.947 22.5-162.8-107.5 111.7 15.0 -16.4 -4.3 74 79 A A E +AC 9 38A 0 -36,-2.8 -36,-2.0 -2,-0.7 2,-0.3 -0.804 15.0 168.4 -95.7 136.9 13.8 -19.1 -6.7 75 80 A M E -AC 8 37A 0 -67,-3.0 -67,-2.8 -2,-0.4 2,-0.4 -0.978 26.6-148.6-148.0 157.2 10.1 -19.8 -7.0 76 81 A V E -AC 7 36A 0 -40,-1.9 -41,-3.1 -2,-0.3 -40,-1.1 -0.998 16.2-165.8-127.7 124.7 7.6 -21.7 -9.2 77 82 A F E -AC 6 34A 0 -71,-1.7 -71,-2.2 -2,-0.4 2,-0.4 -0.903 4.2-155.8-112.8 145.2 4.0 -20.3 -9.7 78 83 A E E +AC 5 33A 10 -45,-2.2 -45,-2.6 -2,-0.4 2,-0.3 -0.946 35.0 99.2-123.4 139.5 1.1 -22.3 -11.1 79 84 A G S > S- 0 0 1 -75,-2.4 3,-1.5 -2,-0.4 -75,-0.3 -0.902 72.3 -48.1 165.3 170.7 -2.0 -21.1 -12.8 80 85 A K T 3 S- 0 0 141 1,-0.3 -78,-0.2 -2,-0.3 5,-0.1 -0.434 122.1 -8.4 -64.1 127.2 -3.8 -20.6 -16.1 81 86 A G T 3> S+ 0 0 32 -80,-0.5 4,-2.6 -2,-0.2 -1,-0.3 0.719 86.4 151.9 55.3 29.6 -1.5 -18.7 -18.6 82 87 A V H <> + 0 0 0 -3,-1.5 4,-2.9 1,-0.2 5,-0.2 0.827 62.4 57.1 -61.2 -36.3 1.1 -18.1 -15.8 83 88 A V H > S+ 0 0 6 -4,-0.2 4,-1.5 2,-0.2 -1,-0.2 0.979 115.9 33.9 -61.2 -54.5 4.1 -18.0 -18.1 84 89 A A H > S+ 0 0 72 2,-0.2 4,-2.0 1,-0.2 -2,-0.2 0.898 120.2 50.8 -69.3 -37.9 2.8 -15.2 -20.3 85 90 A S H X S+ 0 0 21 -4,-2.6 4,-2.2 1,-0.2 5,-0.2 0.933 107.5 52.7 -65.5 -44.4 1.0 -13.4 -17.5 86 91 A A H X S+ 0 0 1 -4,-2.9 4,-1.3 -5,-0.2 -1,-0.2 0.865 108.6 51.8 -60.5 -35.0 4.1 -13.5 -15.2 87 92 A R H X S+ 0 0 62 -4,-1.5 4,-2.5 -5,-0.2 3,-0.3 0.932 107.7 50.9 -66.6 -43.8 6.0 -11.8 -18.1 88 93 A L H < S+ 0 0 143 -4,-2.0 -2,-0.2 1,-0.2 -1,-0.2 0.878 110.4 50.7 -60.0 -36.7 3.4 -9.0 -18.4 89 94 A M H < S+ 0 0 36 -4,-2.2 14,-2.9 1,-0.2 -1,-0.2 0.801 110.4 49.6 -72.6 -27.4 3.7 -8.5 -14.7 90 95 A I H < S- 0 0 0 -4,-1.3 14,-2.8 -3,-0.3 15,-0.5 0.908 101.7-142.2 -77.1 -42.4 7.5 -8.3 -14.9 91 96 A G < - 0 0 16 -4,-2.5 -1,-0.3 12,-0.2 2,-0.3 -0.965 37.9 -46.0 116.3-136.7 7.5 -5.8 -17.8 92 97 A V - 0 0 73 -2,-0.4 6,-0.1 2,-0.3 5,-0.1 -0.811 60.9 -87.7-128.1 172.5 10.1 -6.0 -20.6 93 98 A T S S+ 0 0 86 -2,-0.3 3,-0.1 1,-0.1 5,-0.1 0.858 115.1 61.1 -47.5 -46.7 13.9 -6.5 -20.7 94 99 A N S > S- 0 0 72 1,-0.2 3,-1.1 3,-0.0 4,-0.4 -0.797 72.6-157.4 -88.8 114.9 14.7 -2.8 -20.3 95 100 A P G > S+ 0 0 3 0, 0.0 3,-0.9 0, 0.0 13,-0.2 0.806 91.9 60.3 -59.8 -32.5 13.2 -1.5 -17.0 96 101 A L G 3 S+ 0 0 125 13,-0.3 -3,-0.0 1,-0.2 14,-0.0 0.786 108.2 44.4 -68.3 -25.0 13.1 2.1 -18.3 97 102 A A G < S+ 0 0 68 -3,-1.1 2,-0.3 -5,-0.1 -1,-0.2 0.402 91.1 106.9 -95.8 -2.1 10.8 0.9 -21.1 98 103 A S S < S- 0 0 10 -3,-0.9 3,-0.1 -4,-0.4 -7,-0.1 -0.607 76.9-109.7 -81.2 139.6 8.6 -1.1 -18.7 99 104 A A > - 0 0 63 -2,-0.3 3,-2.3 1,-0.1 6,-0.3 -0.357 33.2 -97.4 -71.3 145.0 5.2 0.3 -18.0 100 105 A P T 3 S+ 0 0 120 0, 0.0 -1,-0.1 0, 0.0 3,-0.1 -0.383 114.4 44.0 -58.9 131.8 4.3 1.7 -14.5 101 106 A G T 3 S+ 0 0 53 1,-0.6 2,-0.2 2,-0.1 -2,-0.1 -0.014 94.1 95.6 117.3 -28.7 2.5 -1.1 -12.7 102 107 A S S <> S- 0 0 11 -3,-2.3 4,-2.1 1,-0.1 -1,-0.6 -0.544 86.3-111.3 -88.5 163.8 4.9 -3.8 -13.8 103 108 A I H > S+ 0 0 0 -14,-2.9 4,-2.1 2,-0.2 5,-0.2 0.945 117.3 37.4 -61.7 -52.8 7.8 -4.9 -11.5 104 109 A R H > S+ 0 0 10 -14,-2.8 4,-2.2 1,-0.2 -1,-0.2 0.862 115.0 57.5 -69.4 -30.8 10.6 -3.5 -13.6 105 110 A G H 4 S+ 0 0 23 -15,-0.5 -1,-0.2 -6,-0.3 -2,-0.2 0.858 114.4 36.7 -65.8 -36.4 8.5 -0.5 -14.5 106 111 A D H < S+ 0 0 71 -4,-2.1 -2,-0.2 -7,-0.2 -1,-0.2 0.789 132.8 20.9 -86.0 -28.8 8.1 0.4 -10.9 107 112 A F H < S+ 0 0 49 -4,-2.1 2,-0.3 -5,-0.2 -3,-0.2 0.505 102.9 77.8-121.7 -7.9 11.5 -0.6 -9.4 108 113 A G < + 0 0 8 -4,-2.2 -10,-0.1 -5,-0.2 6,-0.1 -0.830 25.6 162.4-118.9 154.5 14.2 -0.7 -12.1 109 114 A V + 0 0 106 4,-0.4 2,-0.4 -2,-0.3 -13,-0.3 0.596 66.6 58.1-129.5 -26.0 16.4 1.6 -14.1 110 115 A D B > -D 113 0B 90 3,-0.6 3,-1.5 1,-0.1 -1,-0.2 -0.914 66.3-140.3-117.3 136.3 19.3 -0.5 -15.5 111 116 A V T > S+ 0 0 75 -2,-0.4 3,-0.6 1,-0.3 -1,-0.1 0.830 105.8 54.6 -60.5 -31.4 19.0 -3.5 -17.7 112 117 A G T 3 S+ 0 0 37 1,-0.3 -1,-0.3 2,-0.1 2,-0.1 0.605 114.1 41.3 -77.7 -12.3 21.9 -5.2 -15.9 113 118 A R B < S+D 110 0B 119 -3,-1.5 -3,-0.6 1,-0.1 -4,-0.4 -0.563 72.4 143.7-130.3 63.9 20.1 -4.7 -12.6 114 119 A N < - 0 0 8 -3,-0.6 2,-2.8 -6,-0.1 -6,-0.1 -0.051 52.7-133.1-100.6 29.9 16.6 -5.6 -13.6 115 120 A I + 0 0 0 -8,-0.1 -104,-2.1 -105,-0.1 -101,-0.4 -0.112 68.2 38.4 64.2 -47.3 15.5 -7.3 -10.4 116 121 A I E -B 10 0A 0 -2,-2.8 2,-0.4 -106,-0.2 -106,-0.2 -0.933 56.8-143.1-143.1 157.4 13.8 -10.6 -11.5 117 122 A H E -B 9 0A 20 -108,-2.2 -108,-2.2 -2,-0.3 2,-0.4 -0.973 19.4-179.9-118.6 139.7 14.0 -13.4 -14.0 118 123 A G E -B 8 0A 1 -2,-0.4 -110,-0.2 -110,-0.2 -35,-0.0 -0.994 35.5-104.1-139.1 136.7 10.8 -15.0 -15.5 119 124 A S - 0 0 0 -112,-1.7 -32,-0.1 -2,-0.4 3,-0.1 -0.325 23.2-147.1 -55.6 146.3 10.7 -17.9 -18.0 120 125 A D S S+ 0 0 92 1,-0.1 2,-0.3 -33,-0.0 -1,-0.1 0.524 72.7 9.4 -97.8 -3.4 9.8 -16.7 -21.5 121 126 A S S > S- 0 0 35 1,-0.1 4,-2.3 -38,-0.0 5,-0.2 -0.969 78.4-101.3-163.3 165.9 7.8 -19.8 -22.7 122 127 A V H > S+ 0 0 49 -2,-0.3 4,-2.5 1,-0.2 5,-0.2 0.892 121.2 53.7 -63.1 -36.4 6.3 -23.0 -21.4 123 128 A E H > S+ 0 0 145 1,-0.2 4,-1.5 2,-0.2 -1,-0.2 0.904 112.1 41.4 -66.7 -43.9 9.3 -24.9 -22.8 124 129 A S H > S+ 0 0 19 2,-0.2 4,-2.8 1,-0.2 -1,-0.2 0.839 112.1 57.0 -74.3 -27.9 11.9 -22.8 -21.1 125 130 A A H X S+ 0 0 0 -4,-2.3 4,-2.9 2,-0.2 5,-0.2 0.953 107.5 47.5 -64.7 -48.0 9.8 -22.8 -17.9 126 131 A N H X S+ 0 0 95 -4,-2.5 4,-1.6 1,-0.2 -1,-0.2 0.866 114.4 47.5 -61.5 -35.6 9.8 -26.6 -17.8 127 132 A R H X S+ 0 0 110 -4,-1.5 4,-1.3 -5,-0.2 -1,-0.2 0.915 113.9 45.7 -70.9 -45.9 13.5 -26.6 -18.4 128 133 A E H X S+ 0 0 6 -4,-2.8 4,-2.4 2,-0.2 3,-0.3 0.924 109.3 54.9 -66.0 -42.8 14.3 -24.0 -15.7 129 134 A I H X S+ 0 0 12 -4,-2.9 4,-2.6 1,-0.2 -1,-0.2 0.936 109.6 47.3 -56.6 -46.6 12.0 -25.6 -13.1 130 135 A A H < S+ 0 0 76 -4,-1.6 -1,-0.2 -5,-0.2 -2,-0.2 0.771 111.8 52.0 -66.5 -26.8 13.9 -28.9 -13.5 131 136 A L H < S+ 0 0 61 -4,-1.3 -1,-0.2 -3,-0.3 -2,-0.2 0.887 120.3 30.4 -75.4 -43.6 17.3 -27.2 -13.3 132 137 A W H < S+ 0 0 7 -4,-2.4 2,-0.4 -5,-0.1 -2,-0.2 0.727 117.5 51.1 -90.0 -27.2 16.5 -25.3 -10.0 133 138 A F < - 0 0 9 -4,-2.6 -1,-0.1 -5,-0.3 5,-0.0 -0.909 65.9-139.6-121.2 145.9 14.2 -27.6 -8.2 134 139 A K > - 0 0 114 -2,-0.4 3,-1.7 1,-0.1 4,-0.2 -0.668 36.8-110.2 -90.9 153.0 14.2 -31.2 -7.3 135 140 A P G > S+ 0 0 101 0, 0.0 3,-1.5 0, 0.0 -1,-0.1 0.838 116.4 56.9 -53.0 -38.9 10.8 -33.0 -7.7 136 141 A E G 3 S+ 0 0 152 1,-0.3 4,-0.1 4,-0.0 -3,-0.0 0.621 97.6 63.7 -71.3 -11.4 10.2 -33.3 -3.9 137 142 A E G < S+ 0 0 74 -3,-1.7 2,-0.4 2,-0.1 -100,-0.4 0.456 92.7 79.7 -89.9 -1.2 10.6 -29.6 -3.5 138 143 A L S < S- 0 0 28 -3,-1.5 -102,-0.2 -4,-0.2 2,-0.1 -0.881 86.1-115.0-113.3 136.8 7.5 -29.0 -5.6 139 144 A L - 0 0 90 -104,-2.2 3,-0.1 -2,-0.4 -2,-0.1 -0.432 22.5-167.6 -64.8 139.5 3.9 -29.3 -4.4 140 145 A T S S+ 0 0 133 1,-0.2 2,-0.8 -2,-0.1 -1,-0.2 0.826 76.4 49.6 -96.1 -43.0 2.1 -32.1 -6.2 141 146 A E S S- 0 0 157 2,-0.0 2,-0.4 0, 0.0 -1,-0.2 -0.863 76.2-165.4-102.7 106.9 -1.5 -31.2 -5.2 142 147 A V - 0 0 8 -2,-0.8 -107,-0.1 -3,-0.1 -109,-0.0 -0.730 7.3-169.7 -93.4 141.1 -2.3 -27.6 -5.8 143 148 A K + 0 0 162 -2,-0.4 2,-0.1 3,-0.0 -2,-0.0 -0.863 12.1 171.1-135.3 93.2 -5.3 -25.9 -4.3 144 149 A P - 0 0 37 0, 0.0 -112,-0.1 0, 0.0 -65,-0.0 -0.266 47.5 -72.9 -86.0-173.1 -6.2 -22.4 -5.6 145 150 A N >> - 0 0 79 -114,-0.2 3,-2.0 1,-0.1 4,-0.9 -0.666 27.9-148.7 -84.3 127.8 -9.3 -20.4 -4.9 146 151 A P T 34 S+ 0 0 111 0, 0.0 -1,-0.1 0, 0.0 -3,-0.0 0.521 101.9 69.9 -73.2 -2.6 -12.4 -21.7 -6.7 147 152 A N T 34 S+ 0 0 149 1,-0.1 3,-0.1 3,-0.0 -2,-0.1 0.493 99.1 51.1 -83.4 -7.1 -13.3 -18.0 -6.6 148 153 A L T <4 S+ 0 0 78 -3,-2.0 2,-0.4 1,-0.2 -1,-0.1 0.773 110.3 45.3 -96.7 -36.2 -10.5 -17.8 -9.2 149 154 A Y < 0 0 56 -4,-0.9 -1,-0.2 1,-0.1 0, 0.0 -0.921 360.0 360.0-119.1 143.8 -11.5 -20.4 -11.6 150 155 A E 0 0 260 -2,-0.4 -1,-0.1 -3,-0.1 -2,-0.0 0.852 360.0 360.0 -79.6 360.0 -14.8 -21.3 -13.3