==== 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 22-MAR-96 1NCL . COMPND 2 MOLECULE: NUCLEOSIDE DIPHOSPHATE KINASE; . SOURCE 2 ORGANISM_SCIENTIFIC: DICTYOSTELIUM DISCOIDEUM; . AUTHOR J.JANIN,S.MORERA,I.LASCU . 150 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 7953.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 96 64.0 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 . 20 13.3 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 0 133 0, 0.0 3,-0.8 0, 0.0 80,-0.6 0.000 360.0 360.0 360.0 145.2 -25.3 48.0 7.9 2 7 A N T 3 + 0 0 61 1,-0.2 78,-0.2 78,-0.2 147,-0.0 0.318 360.0 72.3 -84.1 2.0 -24.1 47.7 11.5 3 8 A K T 3 + 0 0 142 75,-0.1 -1,-0.2 76,-0.1 77,-0.1 0.245 65.7 130.8-103.1 15.1 -26.3 44.8 12.4 4 9 A E < - 0 0 48 -3,-0.8 75,-2.9 75,-0.1 2,-0.3 -0.368 41.4-158.9 -65.5 143.8 -24.3 42.4 10.3 5 10 A R E -A 78 0A 56 73,-0.2 2,-0.3 117,-0.1 73,-0.2 -0.927 11.9-168.5-128.3 148.9 -23.4 39.2 12.2 6 11 A T E -A 77 0A 0 71,-2.3 71,-2.2 -2,-0.3 2,-0.5 -0.962 19.2-129.0-134.4 155.5 -20.8 36.5 11.9 7 12 A F E +A 76 0A 0 -2,-0.3 112,-1.8 69,-0.2 2,-0.4 -0.901 25.9 179.7-104.9 129.5 -20.3 33.1 13.4 8 13 A L E -AB 75 118A 0 67,-2.9 67,-3.5 -2,-0.5 2,-0.4 -0.971 6.6-171.9-127.2 143.2 -16.9 32.3 15.0 9 14 A A E -AB 74 117A 0 108,-2.2 108,-2.7 -2,-0.4 2,-0.9 -0.988 19.9-142.9-138.7 121.3 -15.9 29.0 16.7 10 15 A V E -AB 73 116A 0 63,-2.8 63,-1.8 -2,-0.4 106,-0.3 -0.834 35.2-136.0 -80.9 112.5 -12.6 28.6 18.6 11 16 A K >> - 0 0 19 104,-1.9 4,-2.2 -2,-0.9 3,-0.8 -0.102 26.4 -88.1 -67.9 171.3 -11.9 25.0 17.6 12 17 A P H 3> S+ 0 0 10 0, 0.0 4,-2.3 0, 0.0 5,-0.1 0.790 126.6 53.7 -51.9 -33.6 -10.7 22.3 20.0 13 18 A D H 3> S+ 0 0 14 2,-0.2 4,-1.7 1,-0.2 6,-0.1 0.880 109.4 48.5 -70.1 -35.4 -7.0 23.2 19.5 14 19 A G H <4>S+ 0 0 0 -3,-0.8 5,-2.5 101,-0.4 6,-0.4 0.878 113.7 46.3 -70.7 -40.8 -7.6 26.8 20.3 15 20 A V H ><5S+ 0 0 27 -4,-2.2 3,-1.6 56,-0.3 5,-0.2 0.947 113.1 49.4 -64.9 -47.8 -9.6 26.0 23.4 16 21 A A H 3<5S+ 0 0 87 -4,-2.3 -2,-0.2 1,-0.3 -1,-0.2 0.767 109.1 53.1 -62.6 -31.9 -7.0 23.5 24.5 17 22 A R T 3<5S- 0 0 126 -4,-1.7 -1,-0.3 -5,-0.1 -2,-0.2 0.316 115.8-113.7 -87.3 8.6 -4.1 26.0 24.0 18 23 A G T < 5S+ 0 0 62 -3,-1.6 4,-0.3 -4,-0.1 -3,-0.2 0.855 76.5 128.6 65.5 42.0 -5.9 28.6 26.2 19 24 A L >< + 0 0 17 -5,-2.5 4,-2.6 1,-0.1 5,-0.2 0.414 35.8 99.3-109.2 4.5 -6.6 31.1 23.4 20 25 A V H > S+ 0 0 31 -6,-0.4 4,-2.5 -5,-0.2 5,-0.2 0.914 87.6 40.4 -56.5 -51.1 -10.3 31.7 24.0 21 26 A G H > S+ 0 0 50 2,-0.2 4,-2.9 1,-0.2 -1,-0.2 0.867 113.8 54.1 -67.4 -40.5 -10.0 35.0 25.9 22 27 A E H > S+ 0 0 77 -4,-0.3 4,-1.5 2,-0.2 -1,-0.2 0.923 111.9 45.3 -60.7 -42.6 -7.2 36.3 23.7 23 28 A I H X S+ 0 0 0 -4,-2.6 4,-1.2 2,-0.2 3,-0.3 0.950 114.6 46.5 -68.0 -47.9 -9.4 35.7 20.6 24 29 A I H >X S+ 0 0 22 -4,-2.5 4,-2.4 1,-0.2 3,-0.6 0.928 109.4 55.4 -59.9 -45.0 -12.6 37.2 22.2 25 30 A A H 3X S+ 0 0 28 -4,-2.9 4,-2.0 1,-0.2 -1,-0.2 0.837 102.5 57.3 -56.7 -38.1 -10.6 40.2 23.4 26 31 A R H 3X S+ 0 0 41 -4,-1.5 4,-1.0 -3,-0.3 -1,-0.2 0.857 110.3 42.9 -61.7 -36.5 -9.4 41.0 19.9 27 32 A Y H S+ 0 0 0 -4,-1.2 5,-1.8 -3,-0.6 4,-1.1 0.863 112.3 52.5 -78.9 -34.6 -12.9 41.2 18.6 28 33 A E H <5S+ 0 0 114 -4,-2.4 -2,-0.2 1,-0.2 -1,-0.2 0.858 109.3 50.7 -67.1 -36.9 -14.1 43.3 21.5 29 34 A K H <5S+ 0 0 164 -4,-2.0 -1,-0.2 1,-0.2 -2,-0.2 0.807 103.9 57.7 -67.3 -36.3 -11.2 45.7 21.0 30 35 A K H <5S- 0 0 116 -4,-1.0 -1,-0.2 -5,-0.2 -2,-0.2 0.803 121.2-109.4 -62.7 -30.6 -12.1 46.1 17.4 31 36 A G T <5 + 0 0 11 -4,-1.1 114,-0.2 1,-0.3 -3,-0.2 0.472 69.6 141.6 112.3 3.7 -15.6 47.2 18.5 32 37 A F < - 0 0 16 -5,-1.8 2,-0.5 47,-0.1 -1,-0.3 -0.517 49.0-124.6 -76.2 148.2 -17.7 44.2 17.4 33 38 A V E -C 78 0A 28 45,-2.8 45,-2.0 -2,-0.2 2,-0.5 -0.859 12.9-124.8-101.9 127.0 -20.5 43.3 19.9 34 39 A L E +C 77 0A 52 -2,-0.5 43,-0.2 43,-0.2 3,-0.1 -0.549 37.0 166.0 -70.8 117.4 -20.8 39.8 21.4 35 40 A V E + 0 0 4 41,-2.8 104,-2.2 -2,-0.5 2,-0.3 0.607 64.7 14.1-109.9 -20.0 -24.3 38.6 20.6 36 41 A G E +C 76 0A 4 40,-1.4 40,-1.9 102,-0.2 -1,-0.4 -0.983 64.3 167.0-155.7 146.4 -24.0 34.9 21.3 37 42 A L E +C 75 0A 78 100,-0.4 2,-0.3 -2,-0.3 38,-0.2 -0.835 8.2 140.4-167.2 132.0 -21.5 32.8 23.2 38 43 A K E -C 74 0A 54 36,-2.0 36,-2.6 -2,-0.3 2,-0.4 -0.959 38.1-126.1-169.6 147.2 -21.2 29.3 24.7 39 44 A Q E +C 73 0A 123 -2,-0.3 2,-0.3 34,-0.2 34,-0.2 -0.836 40.7 154.3 -95.3 141.6 -18.9 26.4 25.1 40 45 A L E -C 72 0A 42 32,-2.8 32,-3.0 -2,-0.4 30,-0.1 -0.984 47.1-121.2-159.6 160.4 -19.9 23.0 23.8 41 46 A V - 0 0 91 -2,-0.3 27,-0.1 30,-0.3 2,-0.1 -0.980 44.9-128.7-105.9 109.8 -18.6 19.7 22.6 42 47 A P - 0 0 4 0, 0.0 2,-0.2 0, 0.0 28,-0.1 -0.401 14.5-131.5 -61.4 139.1 -20.2 19.4 19.1 43 48 A T > - 0 0 84 -2,-0.1 4,-2.4 1,-0.1 3,-0.3 -0.496 28.1-105.3 -85.3 164.7 -22.1 16.2 18.2 44 49 A K H > S+ 0 0 122 1,-0.2 4,-3.0 2,-0.2 5,-0.3 0.863 119.1 55.1 -58.6 -39.9 -21.4 14.5 14.9 45 50 A D H > S+ 0 0 117 2,-0.2 4,-1.6 1,-0.2 -1,-0.2 0.886 108.8 45.5 -62.6 -43.5 -24.6 15.7 13.4 46 51 A L H > S+ 0 0 27 -3,-0.3 4,-3.0 2,-0.2 -2,-0.2 0.941 114.7 50.4 -65.9 -43.8 -23.9 19.4 14.1 47 52 A A H X S+ 0 0 0 -4,-2.4 4,-2.5 1,-0.2 -2,-0.2 0.932 110.2 47.4 -58.3 -51.9 -20.3 18.9 12.8 48 53 A E H < S+ 0 0 62 -4,-3.0 -1,-0.2 1,-0.2 -2,-0.2 0.855 114.6 48.2 -61.3 -33.1 -21.4 17.3 9.5 49 54 A S H >< S+ 0 0 44 -4,-1.6 3,-1.3 -5,-0.3 4,-0.3 0.929 109.1 52.9 -72.8 -41.3 -24.0 20.0 9.0 50 55 A H H 3< S+ 0 0 1 -4,-3.0 3,-0.3 1,-0.3 -2,-0.2 0.920 120.1 33.7 -58.6 -45.9 -21.4 22.7 9.8 51 56 A Y T >< S+ 0 0 21 -4,-2.5 3,-3.3 1,-0.2 4,-0.3 0.160 79.3 126.1 -97.6 16.9 -19.0 21.3 7.1 52 57 A A G X + 0 0 27 -3,-1.3 3,-3.0 1,-0.3 4,-0.3 0.852 63.5 69.5 -44.6 -41.0 -21.8 20.1 4.7 53 58 A E G 3 S+ 0 0 110 -3,-0.3 -1,-0.3 1,-0.3 3,-0.3 0.756 105.2 40.8 -53.4 -22.0 -20.1 22.0 1.9 54 59 A H G X S+ 0 0 44 -3,-3.3 3,-2.8 1,-0.2 6,-0.4 0.329 77.4 115.5-107.6 7.3 -17.2 19.5 2.0 55 60 A K T < S+ 0 0 121 -3,-3.0 -1,-0.2 1,-0.3 -2,-0.1 0.709 77.6 50.4 -52.9 -19.5 -19.3 16.5 2.5 56 61 A E T 3 S+ 0 0 140 -3,-0.3 -1,-0.3 -4,-0.3 -2,-0.1 0.554 96.1 87.4 -95.7 -6.5 -18.2 15.2 -0.9 57 62 A R S X S- 0 0 160 -3,-2.8 3,-0.8 1,-0.1 4,-0.3 -0.572 80.4-126.9 -90.7 157.3 -14.5 15.7 -0.2 58 63 A P T > S+ 0 0 128 0, 0.0 3,-0.9 0, 0.0 4,-0.5 0.825 107.2 59.1 -70.4 -33.7 -12.2 13.1 1.6 59 64 A F T 3> S+ 0 0 104 1,-0.2 4,-1.8 2,-0.2 5,-0.1 0.542 81.4 89.6 -74.9 -4.9 -11.0 15.5 4.2 60 65 A F H <> S+ 0 0 27 -3,-0.8 4,-2.4 -6,-0.4 -1,-0.2 0.920 84.1 53.8 -56.4 -44.2 -14.6 16.0 5.3 61 66 A G H <> S+ 0 0 36 -3,-0.9 4,-2.5 -4,-0.3 -1,-0.2 0.916 107.6 48.9 -58.3 -44.5 -14.2 13.1 7.7 62 67 A G H > S+ 0 0 48 -4,-0.5 4,-1.8 2,-0.2 -1,-0.2 0.813 109.6 52.8 -65.5 -32.0 -11.1 14.6 9.3 63 68 A L H X S+ 0 0 41 -4,-1.8 4,-2.1 -3,-0.2 5,-0.2 0.966 110.9 46.2 -67.0 -49.8 -12.9 17.9 9.8 64 69 A V H X S+ 0 0 8 -4,-2.4 4,-1.3 1,-0.2 -2,-0.2 0.928 112.7 50.0 -59.0 -48.4 -15.9 16.3 11.5 65 70 A S H < S+ 0 0 74 -4,-2.5 4,-0.4 -5,-0.2 -1,-0.2 0.897 111.1 48.3 -60.0 -42.3 -13.7 14.2 13.8 66 71 A F H >< S+ 0 0 34 -4,-1.8 3,-1.9 1,-0.2 4,-0.3 0.970 109.7 49.2 -66.4 -47.2 -11.5 17.0 15.0 67 72 A I H 3< S+ 0 0 0 -4,-2.1 3,-0.4 1,-0.3 -1,-0.2 0.742 114.3 46.4 -67.5 -21.1 -14.3 19.5 15.8 68 73 A T T 3< S+ 0 0 39 -4,-1.3 -1,-0.3 -5,-0.2 -2,-0.2 0.457 91.2 88.3 -97.9 2.2 -16.1 16.9 17.8 69 74 A S S < S- 0 0 73 -3,-1.9 -1,-0.2 -4,-0.4 -2,-0.2 0.620 102.0 -15.4 -77.4 -10.2 -12.9 15.9 19.5 70 75 A G S S- 0 0 15 -3,-0.4 -57,-0.1 -4,-0.3 -30,-0.1 -0.942 94.8 -40.5-171.2-176.7 -13.2 18.4 22.4 71 76 A P - 0 0 52 0, 0.0 2,-0.3 0, 0.0 -56,-0.3 -0.284 47.8-163.1 -63.8 153.2 -14.9 21.6 23.6 72 77 A V E - C 0 40A 0 -32,-3.0 -32,-2.8 -57,-0.1 2,-0.7 -0.966 15.2-140.3-134.1 142.0 -15.5 24.4 21.2 73 78 A V E -AC 10 39A 9 -63,-1.8 -63,-2.8 -2,-0.3 2,-0.4 -0.944 24.0-166.9-108.4 109.2 -16.3 28.0 22.0 74 79 A A E +AC 9 38A 0 -36,-2.6 -36,-2.0 -2,-0.7 2,-0.3 -0.788 12.6 170.6 -94.5 138.4 -19.0 29.2 19.6 75 80 A M E -AC 8 37A 0 -67,-3.5 -67,-2.9 -2,-0.4 2,-0.4 -0.971 26.8-147.2-148.3 158.1 -19.7 32.8 19.3 76 81 A V E -AC 7 36A 0 -40,-1.9 -41,-2.8 -2,-0.3 -40,-1.4 -0.999 17.5-165.7-126.3 127.0 -21.6 35.3 17.2 77 82 A F E -AC 6 34A 0 -71,-2.2 -71,-2.3 -2,-0.4 2,-0.4 -0.908 3.9-154.0-113.4 147.5 -20.3 38.9 16.7 78 83 A E E +AC 5 33A 13 -45,-2.0 -45,-2.8 -2,-0.4 2,-0.3 -0.955 36.0 99.9-122.8 144.3 -22.3 41.8 15.3 79 84 A G S > S- 0 0 2 -75,-2.9 3,-1.4 -2,-0.4 4,-0.2 -0.879 72.3 -52.8 161.7 166.9 -21.0 44.9 13.6 80 85 A K T 3 S- 0 0 123 -2,-0.3 -78,-0.2 1,-0.3 5,-0.1 -0.454 120.7 -7.6 -63.2 129.1 -20.5 46.6 10.3 81 86 A G T 3> S+ 0 0 30 -80,-0.6 4,-2.7 -2,-0.2 3,-0.3 0.685 86.9 148.3 54.1 27.5 -18.6 44.4 7.8 82 87 A V H <> + 0 0 0 -3,-1.4 4,-3.0 1,-0.2 5,-0.2 0.824 61.4 59.6 -62.1 -33.4 -18.0 41.9 10.6 83 88 A V H > S+ 0 0 7 -4,-0.2 4,-1.2 2,-0.2 -1,-0.2 0.928 115.8 30.8 -64.0 -47.7 -18.0 38.9 8.3 84 89 A A H > S+ 0 0 67 -3,-0.3 4,-2.0 2,-0.2 -2,-0.2 0.884 120.5 54.2 -76.0 -40.4 -15.1 40.1 6.1 85 90 A S H X S+ 0 0 25 -4,-2.7 4,-2.1 1,-0.2 -2,-0.2 0.930 107.8 49.3 -58.6 -47.3 -13.4 41.9 8.9 86 91 A A H X S+ 0 0 1 -4,-3.0 4,-1.6 -5,-0.2 -1,-0.2 0.869 109.6 52.3 -64.2 -36.0 -13.4 38.8 11.1 87 92 A R H X S+ 0 0 87 -4,-1.2 4,-2.1 -5,-0.2 -1,-0.2 0.871 109.5 50.0 -63.6 -41.2 -11.9 36.8 8.3 88 93 A L H < S+ 0 0 141 -4,-2.0 -2,-0.2 1,-0.2 -1,-0.2 0.873 109.8 49.7 -65.2 -39.0 -9.2 39.3 7.9 89 94 A M H < S+ 0 0 33 -4,-2.1 14,-2.8 1,-0.2 -2,-0.2 0.775 110.2 53.5 -70.4 -26.8 -8.4 39.3 11.7 90 95 A I H < S- 0 0 2 -4,-1.6 14,-3.0 12,-0.2 15,-0.4 0.920 102.4-138.5 -74.2 -46.1 -8.3 35.5 11.5 91 96 A G < - 0 0 15 -4,-2.1 -1,-0.2 12,-0.2 2,-0.1 -0.726 33.5 -45.9 113.0-172.9 -5.7 35.2 8.7 92 97 A V - 0 0 80 2,-0.3 6,-0.2 -2,-0.3 5,-0.1 -0.431 62.8 -92.2 -92.6 171.6 -5.6 32.8 5.7 93 98 A T S S+ 0 0 87 -2,-0.1 3,-0.1 1,-0.1 -1,-0.1 0.853 114.9 61.7 -50.6 -45.4 -6.1 29.1 5.7 94 99 A N S >> S- 0 0 60 1,-0.2 3,-1.8 18,-0.0 4,-0.6 -0.811 73.8-155.4 -90.4 112.3 -2.5 28.3 6.2 95 100 A P G >4 S+ 0 0 2 0, 0.0 3,-0.9 0, 0.0 13,-0.2 0.835 93.5 61.9 -54.1 -32.3 -1.3 29.8 9.6 96 101 A L G 34 S+ 0 0 119 13,-0.3 13,-0.1 1,-0.3 14,-0.1 0.748 106.5 44.5 -66.7 -23.5 2.2 29.9 8.2 97 102 A A G <4 S+ 0 0 67 -3,-1.8 2,-0.3 -5,-0.1 -1,-0.3 0.480 92.2 104.1 -97.6 -8.3 1.2 32.2 5.5 98 103 A S S << S- 0 0 12 -3,-0.9 3,-0.1 -4,-0.6 2,-0.1 -0.616 75.3-116.5 -78.5 137.9 -0.9 34.4 7.8 99 104 A A > - 0 0 71 -2,-0.3 3,-1.8 1,-0.1 6,-0.4 -0.347 30.5 -97.0 -74.6 146.0 0.7 37.7 8.8 100 105 A G T 3 S+ 0 0 65 1,-0.3 -1,-0.1 5,-0.2 3,-0.1 -0.315 113.4 52.1 -53.1 144.0 1.6 38.6 12.3 101 106 A G T 3 S+ 0 0 62 1,-0.5 2,-0.3 2,-0.1 -1,-0.3 0.189 94.6 90.1 107.9 -19.9 -1.2 40.7 13.7 102 107 A S S <> S- 0 0 9 -3,-1.8 4,-2.4 1,-0.1 -1,-0.5 -0.749 86.5-114.5-108.6 161.0 -3.8 38.0 12.7 103 108 A I H > S+ 0 0 0 -14,-2.8 4,-2.0 -2,-0.3 5,-0.3 0.949 116.5 37.9 -59.4 -52.0 -4.9 35.1 14.9 104 109 A R H > S+ 0 0 16 -14,-3.0 4,-2.0 1,-0.2 -1,-0.2 0.874 115.2 55.2 -71.0 -29.5 -3.5 32.4 12.7 105 110 A G H 4 S+ 0 0 23 -15,-0.4 -5,-0.2 -6,-0.4 -1,-0.2 0.904 115.3 38.7 -68.5 -37.7 -0.4 34.4 11.9 106 111 A D H < S+ 0 0 66 -4,-2.4 -2,-0.2 -7,-0.3 -1,-0.2 0.770 132.1 18.4 -81.1 -31.8 0.4 34.9 15.6 107 112 A F H < S+ 0 0 51 -4,-2.0 2,-0.3 -5,-0.2 -3,-0.2 0.519 103.3 77.7-124.8 -5.8 -0.5 31.5 17.0 108 113 A G < + 0 0 8 -4,-2.0 -10,-0.1 -5,-0.3 6,-0.1 -0.817 27.2 167.1-118.4 161.3 -0.7 28.8 14.4 109 114 A V + 0 0 103 4,-0.4 2,-0.4 -2,-0.3 -13,-0.3 0.578 66.3 58.6-133.0 -24.5 1.6 26.6 12.4 110 115 A D B > -D 113 0B 98 3,-0.6 3,-1.7 1,-0.1 -1,-0.2 -0.934 63.7-141.0-124.3 134.7 -0.6 23.9 10.8 111 116 A V T > S+ 0 0 68 -2,-0.4 3,-0.7 1,-0.3 -1,-0.1 0.868 107.3 53.0 -52.0 -43.7 -3.6 24.0 8.5 112 117 A G T 3 S+ 0 0 36 1,-0.3 -1,-0.3 2,-0.1 2,-0.1 0.579 115.4 40.0 -69.9 -15.8 -5.2 21.2 10.4 113 118 A R B < S+D 110 0B 116 -3,-1.7 -3,-0.6 1,-0.1 -4,-0.4 -0.587 72.1 144.5-130.5 64.0 -4.9 23.0 13.7 114 119 A N < - 0 0 12 -3,-0.7 2,-2.5 -6,-0.1 -6,-0.1 0.057 51.1-135.1 -97.6 26.1 -5.7 26.4 12.6 115 120 A I + 0 0 0 -8,-0.1 -104,-1.9 -105,-0.1 -101,-0.4 -0.171 67.3 39.4 68.8 -50.2 -7.5 27.4 15.8 116 121 A I E -B 10 0A 0 -2,-2.5 2,-0.4 -106,-0.3 -106,-0.2 -0.954 56.4-146.0-141.1 155.8 -10.6 29.2 14.8 117 122 A H E -B 9 0A 31 -108,-2.7 -108,-2.2 -2,-0.3 2,-0.3 -0.966 17.0-178.1-118.7 139.9 -13.5 29.1 12.3 118 123 A G E -B 8 0A 6 -2,-0.4 -110,-0.2 -110,-0.2 -35,-0.0 -0.989 37.6-100.0-136.6 136.1 -15.1 32.3 10.9 119 124 A S - 0 0 0 -112,-1.8 -32,-0.1 -2,-0.3 3,-0.1 -0.316 25.6-146.6 -54.0 144.4 -18.1 32.4 8.4 120 125 A D S S+ 0 0 85 1,-0.1 2,-0.3 -33,-0.0 -1,-0.1 0.616 74.4 10.6 -92.9 -8.4 -16.8 33.0 4.9 121 126 A S S > S- 0 0 43 1,-0.1 4,-2.5 -37,-0.0 5,-0.2 -0.966 80.2-101.3-158.7 165.6 -19.9 35.0 3.8 122 127 A V H > S+ 0 0 48 -2,-0.3 4,-2.4 1,-0.2 5,-0.1 0.893 121.5 49.6 -61.2 -36.0 -23.0 36.6 5.1 123 128 A E H > S+ 0 0 141 2,-0.2 4,-1.8 1,-0.2 -1,-0.2 0.879 112.0 45.0 -74.8 -37.6 -25.1 33.7 3.9 124 129 A S H > S+ 0 0 13 2,-0.2 4,-2.8 1,-0.2 -1,-0.2 0.857 111.8 55.6 -71.9 -31.2 -22.9 31.1 5.4 125 130 A A H X S+ 0 0 0 -4,-2.5 4,-2.8 1,-0.2 -2,-0.2 0.916 108.6 47.3 -62.7 -44.5 -22.8 33.3 8.6 126 131 A N H X S+ 0 0 92 -4,-2.4 4,-1.7 2,-0.2 -1,-0.2 0.848 113.9 47.0 -65.4 -38.0 -26.6 33.2 8.7 127 132 A R H X S+ 0 0 98 -4,-1.8 4,-1.2 2,-0.2 -2,-0.2 0.919 115.0 45.6 -69.3 -45.5 -26.7 29.4 8.1 128 133 A E H X S+ 0 0 2 -4,-2.8 4,-3.3 2,-0.2 5,-0.3 0.934 111.4 51.5 -65.9 -42.8 -24.0 28.7 10.8 129 134 A I H X S+ 0 0 14 -4,-2.8 4,-2.6 1,-0.3 -1,-0.2 0.947 112.7 45.2 -59.4 -47.8 -25.6 31.0 13.3 130 135 A A H < S+ 0 0 76 -4,-1.7 -1,-0.3 -5,-0.2 -2,-0.2 0.737 115.3 51.0 -67.6 -22.3 -28.9 29.4 12.9 131 136 A L H < S+ 0 0 48 -4,-1.2 -2,-0.2 -3,-0.3 -1,-0.2 0.927 119.2 31.7 -79.2 -49.0 -27.2 26.0 13.1 132 137 A W H < S+ 0 0 6 -4,-3.3 2,-0.4 -5,-0.1 -2,-0.2 0.696 117.5 52.2 -86.2 -20.4 -25.2 26.6 16.2 133 138 A F < - 0 0 8 -4,-2.6 -1,-0.1 -5,-0.3 5,-0.1 -0.954 66.8-136.7-127.5 138.7 -27.5 28.8 18.2 134 139 A K > - 0 0 129 -2,-0.4 3,-2.0 1,-0.1 4,-0.2 -0.578 36.1-116.5 -77.3 149.9 -31.1 28.9 19.3 135 140 A P G > S+ 0 0 99 0, 0.0 3,-1.3 0, 0.0 -1,-0.1 0.770 115.6 63.7 -57.6 -29.4 -32.7 32.3 18.8 136 141 A E G 3 S+ 0 0 143 1,-0.3 4,-0.1 4,-0.0 -3,-0.0 0.716 96.2 60.1 -68.4 -19.7 -33.1 32.6 22.5 137 142 A E G < S+ 0 0 79 -3,-2.0 -100,-0.4 2,-0.1 2,-0.4 0.412 92.3 80.8 -88.9 1.2 -29.4 32.5 22.8 138 143 A L S < S- 0 0 24 -3,-1.3 -102,-0.2 -4,-0.2 2,-0.1 -0.876 84.6-113.1-114.0 138.1 -28.8 35.6 20.8 139 144 A L - 0 0 76 -104,-2.2 3,-0.1 -2,-0.4 -2,-0.1 -0.468 22.8-168.1 -66.4 142.3 -29.0 39.2 21.9 140 145 A T S S+ 0 0 131 1,-0.2 2,-0.7 -2,-0.1 -1,-0.2 0.834 76.2 51.0 -98.2 -46.7 -31.9 41.0 20.3 141 146 A E S S- 0 0 142 -106,-0.0 2,-0.5 2,-0.0 -1,-0.2 -0.822 72.4-173.3 -96.5 108.8 -31.0 44.5 21.3 142 147 A V - 0 0 8 -2,-0.7 -107,-0.1 -3,-0.1 -109,-0.0 -0.937 6.5-176.4-108.7 130.3 -27.4 45.3 20.6 143 148 A K - 0 0 154 -2,-0.5 2,-0.2 0, 0.0 -2,-0.0 -0.989 9.0-164.2-123.2 112.9 -25.9 48.5 21.7 144 149 A P - 0 0 40 0, 0.0 -112,-0.1 0, 0.0 5,-0.1 -0.541 42.8 -75.0 -92.1 167.1 -22.3 49.3 20.7 145 150 A N > - 0 0 88 -114,-0.2 3,-1.5 -2,-0.2 4,-0.4 -0.471 45.3-133.7 -57.9 129.0 -19.9 51.9 22.1 146 151 A P T 3 S+ 0 0 109 0, 0.0 -1,-0.2 0, 0.0 3,-0.1 0.558 102.0 67.4 -64.3 -12.7 -21.3 55.1 20.7 147 152 A N T 3 S+ 0 0 139 1,-0.2 -2,-0.1 3,-0.0 3,-0.1 0.382 91.0 65.5 -90.9 4.0 -17.8 56.2 19.8 148 153 A L S < S+ 0 0 71 -3,-1.5 2,-0.4 1,-0.2 -1,-0.2 0.768 96.9 48.0 -93.0 -37.9 -17.7 53.4 17.2 149 154 A Y 0 0 56 -4,-0.4 -1,-0.2 1,-0.2 -147,-0.0 -0.934 360.0 360.0-118.9 137.4 -20.3 54.4 14.7 150 155 A E 0 0 257 -2,-0.4 -1,-0.2 -3,-0.1 -2,-0.0 0.910 360.0 360.0 -81.4 360.0 -21.0 57.7 12.9