==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=9-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE 01-APR-03 1OX7 . COMPND 2 MOLECULE: CYTOSINE DEAMINASE; . SOURCE 2 ORGANISM_SCIENTIFIC: SACCHAROMYCES CEREVISIAE; . AUTHOR G.C.IRETON,M.E.BLACK,B.L.STODDARD . 319 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 12723.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 231 72.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 22 6.9 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 26 8.2 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 2 0.6 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 . 16 5.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 30 9.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 111 34.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 10 3.1 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 3 0 0 4 0 2 2 0 0 2 0 0 0 2 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 0 0 3 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 PARALLEL BRIDGES PER LADDER . 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 0 ANTIPARALLEL BRIDGES PER LADDER . 0 0 0 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 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 X 0 0 92 0, 0.0 2,-0.4 0, 0.0 81,-0.1 0.000 360.0 360.0 360.0 127.2 -3.7 18.5 52.4 2 2 A V + 0 0 141 1,-0.1 4,-0.0 2,-0.0 0, 0.0 -0.922 360.0 178.3-133.1 103.1 -2.3 15.3 51.0 3 3 A T > - 0 0 13 -2,-0.4 3,-1.6 3,-0.1 -1,-0.1 0.785 25.0-146.7 -79.7 -31.0 -4.8 13.6 48.6 4 4 A G T 3 S- 0 0 80 1,-0.3 3,-0.1 2,-0.0 -1,-0.1 0.719 81.6 -48.3 68.5 17.1 -2.8 10.6 47.4 5 5 A G T 3 S+ 0 0 61 1,-0.4 -1,-0.3 125,-0.0 2,-0.1 0.241 110.0 128.4 105.6 -14.1 -4.7 11.1 44.2 6 6 A X < - 0 0 141 -3,-1.6 -1,-0.4 1,-0.1 2,-0.1 -0.473 66.6-106.8 -73.5 146.6 -8.1 11.4 45.7 7 7 A A - 0 0 83 -2,-0.1 2,-0.2 -3,-0.1 -1,-0.1 -0.426 36.0-113.0 -69.9 149.5 -10.2 14.4 44.7 8 8 A S > - 0 0 10 1,-0.1 3,-1.8 -2,-0.1 4,-0.4 -0.560 22.3-116.8 -79.6 150.7 -10.5 17.1 47.4 9 9 A K T 3 S+ 0 0 165 1,-0.3 4,-0.3 -2,-0.2 3,-0.2 0.717 116.8 49.9 -61.5 -18.8 -13.9 17.6 48.9 10 10 A W T 3> S+ 0 0 51 1,-0.2 4,-2.5 2,-0.1 -1,-0.3 0.448 82.1 96.0 -98.7 0.0 -13.8 21.2 47.4 11 11 A D H <> S+ 0 0 15 -3,-1.8 4,-2.5 1,-0.2 5,-0.2 0.862 83.3 47.8 -62.3 -37.8 -12.7 20.2 43.9 12 12 A Q H > S+ 0 0 114 -4,-0.4 4,-2.5 -3,-0.2 -1,-0.2 0.921 111.9 51.1 -69.1 -39.8 -16.2 20.2 42.3 13 13 A K H > S+ 0 0 88 -4,-0.3 4,-2.0 1,-0.2 -2,-0.2 0.932 112.4 47.5 -59.7 -44.8 -16.9 23.6 43.9 14 14 A G H X S+ 0 0 0 -4,-2.5 4,-2.4 1,-0.2 -2,-0.2 0.916 112.8 46.2 -65.5 -43.1 -13.7 25.0 42.5 15 15 A X H X S+ 0 0 2 -4,-2.5 4,-2.6 1,-0.2 -1,-0.2 0.885 110.7 53.5 -69.1 -34.7 -14.1 23.7 39.0 16 16 A D H X S+ 0 0 58 -4,-2.5 4,-2.3 -5,-0.2 -1,-0.2 0.904 111.1 46.3 -65.4 -39.2 -17.7 24.9 38.9 17 17 A I H X S+ 0 0 15 -4,-2.0 4,-2.5 2,-0.2 -2,-0.2 0.923 111.0 52.1 -67.7 -43.2 -16.6 28.4 39.9 18 18 A A H X S+ 0 0 0 -4,-2.4 4,-2.2 1,-0.2 -2,-0.2 0.933 111.4 47.6 -58.0 -45.1 -13.8 28.4 37.4 19 19 A Y H X S+ 0 0 64 -4,-2.6 4,-2.7 1,-0.2 -1,-0.2 0.921 108.9 53.6 -63.4 -42.2 -16.2 27.4 34.7 20 20 A E H X S+ 0 0 112 -4,-2.3 4,-2.4 1,-0.2 -1,-0.2 0.916 109.7 49.2 -57.5 -42.1 -18.7 30.1 35.7 21 21 A E H X S+ 0 0 17 -4,-2.5 4,-2.6 2,-0.2 -1,-0.2 0.897 110.1 50.3 -64.4 -39.7 -15.8 32.6 35.4 22 22 A A H X S+ 0 0 0 -4,-2.2 4,-2.2 2,-0.2 -2,-0.2 0.919 111.1 49.1 -64.1 -42.9 -14.9 31.3 31.9 23 23 A A H X S+ 0 0 24 -4,-2.7 4,-2.1 2,-0.2 -2,-0.2 0.895 111.3 49.7 -64.6 -40.2 -18.6 31.6 30.8 24 24 A L H X S+ 0 0 75 -4,-2.4 4,-1.7 -5,-0.2 -2,-0.2 0.933 110.1 50.4 -64.4 -44.4 -18.8 35.1 32.2 25 25 A G H <>S+ 0 0 0 -4,-2.6 5,-2.8 1,-0.2 4,-0.3 0.909 108.7 52.9 -60.0 -40.2 -15.6 36.1 30.4 26 26 A Y H ><5S+ 0 0 64 -4,-2.2 3,-1.6 1,-0.2 -1,-0.2 0.926 108.2 49.7 -60.7 -45.1 -17.0 34.7 27.2 27 27 A K H 3<5S+ 0 0 177 -4,-2.1 -1,-0.2 1,-0.3 -2,-0.2 0.801 105.5 57.9 -65.2 -27.3 -20.2 36.7 27.5 28 28 A E T 3<5S- 0 0 91 -4,-1.7 -1,-0.3 -5,-0.2 -2,-0.2 0.481 124.7-104.2 -80.1 -2.3 -18.1 39.8 28.1 29 29 A G T < 5S+ 0 0 32 -3,-1.6 -3,-0.2 -4,-0.3 -2,-0.1 0.619 83.1 117.4 89.3 14.3 -16.4 39.2 24.7 30 30 A G S > - B 0 82A 29 5,-2.8 4,-2.4 -2,-0.4 3,-0.6 -0.721 18.9-153.6 -78.3 116.1 -8.3 27.5 50.9 40 40 A N T 34 S+ 0 0 9 41,-2.5 -1,-0.2 -2,-0.6 42,-0.2 0.764 87.1 66.9 -64.6 -24.6 -8.0 23.7 51.4 41 41 A K T 34 S- 0 0 157 40,-0.7 -1,-0.2 1,-0.2 41,-0.1 0.877 125.9 -0.4 -65.5 -40.7 -8.3 24.1 55.2 42 42 A D T <4 S- 0 0 86 -3,-0.6 -2,-0.2 2,-0.1 -1,-0.2 0.388 94.2-110.1-132.9 1.6 -11.9 25.4 55.2 43 43 A G < + 0 0 2 -4,-2.4 -3,-0.1 1,-0.2 2,-0.1 0.524 60.5 156.6 81.1 4.1 -13.1 25.5 51.6 44 44 A S - 0 0 55 -5,-0.3 -5,-2.8 1,-0.1 2,-0.8 -0.417 45.5-126.6 -67.2 136.7 -13.2 29.3 51.5 45 45 A V E -A 38 0A 52 -7,-0.2 -7,-0.2 1,-0.2 3,-0.1 -0.766 22.9-171.8 -84.6 110.1 -13.0 30.9 48.0 46 46 A L E - 0 0 48 -9,-2.4 2,-0.3 -2,-0.8 -1,-0.2 0.761 64.5 -33.2 -73.7 -26.8 -10.1 33.3 48.3 47 47 A G E -A 37 0A 10 -10,-1.1 -10,-2.4 -3,-0.1 2,-0.3 -0.942 51.8-152.2 177.2 163.5 -10.8 34.7 44.9 48 48 A R E +A 36 0A 86 -2,-0.3 2,-0.3 -12,-0.2 -12,-0.2 -0.981 22.6 151.4-147.9 153.8 -12.0 34.0 41.4 49 49 A G E -A 35 0A 0 -14,-2.1 -14,-2.6 -2,-0.3 2,-0.3 -0.989 24.6-138.8-170.0 175.8 -11.3 35.5 38.0 50 50 A H E -A 34 0A 12 -2,-0.3 -16,-0.2 -16,-0.2 -28,-0.1 -0.923 47.6 -64.2-143.1 168.4 -11.1 35.2 34.3 51 51 A N - 0 0 0 -18,-2.2 11,-0.2 -20,-0.4 4,-0.2 -0.266 40.1-172.9 -55.2 133.2 -8.9 36.3 31.4 52 52 A X > + 0 0 31 9,-2.6 4,-2.7 1,-0.1 6,-1.0 0.141 46.1 117.2-117.4 20.9 -9.0 40.1 31.0 53 53 A R H >>S+ 0 0 1 8,-0.4 4,-1.2 4,-0.2 5,-0.6 0.942 90.4 26.6 -51.8 -53.0 -7.0 40.6 27.8 54 54 A F H 45S+ 0 0 47 2,-0.2 -1,-0.2 3,-0.2 -2,-0.1 0.861 120.5 54.7 -82.6 -34.5 -9.9 42.1 25.9 55 55 A Q H 45S+ 0 0 55 -4,-0.2 -2,-0.2 1,-0.2 -1,-0.2 0.890 130.6 13.5 -65.1 -39.3 -11.8 43.6 28.8 56 56 A K H <5S- 0 0 136 -4,-2.7 -2,-0.2 2,-0.1 -1,-0.2 0.331 99.9-112.3-120.6 5.8 -8.8 45.5 30.0 57 57 A G T <5 + 0 0 36 -4,-1.2 2,-0.5 -5,-0.3 178,-0.3 0.892 62.4 166.5 62.0 39.6 -6.3 45.4 27.1 58 58 A S < - 0 0 0 -6,-1.0 -1,-0.2 -5,-0.6 -2,-0.1 -0.782 37.2-173.2 -99.7 126.9 -4.1 43.3 29.4 59 59 A A S S+ 0 0 0 -2,-0.5 -1,-0.1 172,-0.2 172,-0.1 0.545 90.9 36.8 -88.5 -10.0 -1.1 41.3 28.3 60 60 A T S S+ 0 0 2 1,-0.1 2,-2.4 -8,-0.1 5,-0.2 0.654 84.9 95.8-117.4 -15.8 -0.7 39.6 31.7 61 61 A L + 0 0 23 4,-0.1 -9,-2.6 -9,-0.1 -8,-0.4 -0.370 47.4 162.3 -79.8 66.3 -4.1 38.9 33.1 62 62 A H > - 0 0 7 -2,-2.4 4,-3.1 -11,-0.2 5,-0.3 -0.320 60.0 -92.6 -67.8 169.4 -4.6 35.3 32.0 63 63 A G H > S+ 0 0 0 1,-0.2 4,-2.0 2,-0.2 -28,-0.2 0.890 127.7 45.8 -54.2 -43.0 -7.4 33.6 33.9 64 64 A E H > S+ 0 0 9 2,-0.2 4,-2.2 1,-0.2 -1,-0.2 0.901 114.5 46.6 -68.6 -42.6 -5.0 32.3 36.5 65 65 A I H > S+ 0 0 2 2,-0.2 4,-2.6 1,-0.2 -2,-0.2 0.916 112.5 50.3 -66.9 -41.6 -3.1 35.6 37.0 66 66 A S H X S+ 0 0 4 -4,-3.1 4,-2.5 1,-0.2 -2,-0.2 0.900 108.5 53.9 -62.6 -38.9 -6.5 37.4 37.2 67 67 A T H X S+ 0 0 0 -4,-2.0 4,-0.9 -5,-0.3 -2,-0.2 0.946 110.8 45.1 -59.8 -48.5 -7.6 34.9 39.8 68 68 A L H >X S+ 0 0 0 -4,-2.2 3,-0.6 1,-0.2 4,-0.6 0.899 111.8 52.2 -63.9 -38.5 -4.5 35.6 41.9 69 69 A E H >< S+ 0 0 39 -4,-2.6 3,-1.2 1,-0.2 -1,-0.2 0.907 106.6 54.4 -63.2 -39.6 -4.8 39.3 41.5 70 70 A N H 3< S+ 0 0 91 -4,-2.5 -1,-0.2 1,-0.3 -2,-0.2 0.684 98.5 62.5 -70.2 -18.0 -8.5 39.1 42.6 71 71 A C H << S- 0 0 17 -4,-0.9 -1,-0.3 -3,-0.6 -2,-0.2 0.693 101.5-146.5 -76.4 -20.5 -7.4 37.4 45.8 72 72 A G << - 0 0 21 -3,-1.2 2,-0.2 -4,-0.6 -1,-0.2 -0.143 42.0 -26.1 80.3 179.7 -5.5 40.5 46.8 73 73 A R S S- 0 0 95 146,-0.3 2,-0.3 142,-0.1 148,-0.1 -0.489 72.6-174.6 -66.6 134.4 -2.2 40.6 48.8 74 74 A L - 0 0 34 -2,-0.2 2,-0.1 242,-0.2 245,-0.1 -0.957 33.5-100.1-135.0 151.9 -1.9 37.6 51.0 75 75 A E >> - 0 0 91 -2,-0.3 3,-1.7 1,-0.1 4,-0.7 -0.469 42.6-119.8 -64.0 135.5 0.5 36.3 53.7 76 76 A G H >> S+ 0 0 0 244,-0.6 3,-0.7 1,-0.3 4,-0.7 0.844 108.8 61.1 -49.1 -41.9 2.8 33.7 51.9 77 77 A K H >4 S+ 0 0 142 1,-0.2 3,-0.6 2,-0.2 4,-0.3 0.776 90.7 69.8 -60.1 -26.8 1.7 30.9 54.1 78 78 A V H X4 S+ 0 0 47 -3,-1.7 3,-1.5 1,-0.2 -1,-0.2 0.944 96.4 51.8 -57.3 -46.3 -1.9 31.2 53.0 79 79 A Y H X< S+ 0 0 0 -4,-0.7 3,-1.3 -3,-0.7 -1,-0.2 0.760 91.4 77.3 -62.0 -26.1 -1.0 29.9 49.5 80 80 A K T << S+ 0 0 87 -4,-0.7 -1,-0.3 -3,-0.6 -2,-0.2 0.598 102.0 37.4 -66.0 -11.2 0.8 26.8 50.8 81 81 A D T < S+ 0 0 24 -3,-1.5 -41,-2.5 -4,-0.3 -40,-0.7 -0.326 99.0 100.2-133.9 52.8 -2.5 25.1 51.5 82 82 A T E < -B 39 0A 0 -3,-1.3 23,-1.1 -43,-0.3 2,-0.4 -0.805 58.3-137.9-126.2 169.2 -4.7 26.2 48.6 83 83 A T E -Bc 38 105A 0 -45,-2.0 -45,-2.4 -2,-0.3 2,-0.6 -1.000 12.2-148.8-128.7 129.6 -5.8 24.8 45.3 84 84 A L E -Bc 37 106A 0 21,-2.4 23,-2.3 -2,-0.4 2,-0.4 -0.908 13.1-158.5 -99.7 125.0 -5.8 26.8 42.1 85 85 A Y E +Bc 36 107A 0 -49,-3.2 -49,-1.7 -2,-0.6 2,-0.4 -0.876 14.1 175.9-103.2 132.2 -8.6 25.8 39.7 86 86 A T E -Bc 35 108A 0 21,-2.5 23,-2.9 -2,-0.4 -51,-0.2 -0.999 33.0-140.7-136.8 139.7 -8.2 26.7 36.1 87 87 A T E S+ 0 0 4 -53,-2.3 23,-0.6 -2,-0.4 2,-0.3 0.706 91.3 38.1 -70.9 -17.2 -10.5 25.8 33.2 88 88 A L E S- c 0 110A 5 -54,-0.3 23,-0.2 21,-0.2 3,-0.1 -0.990 99.0 -91.8-138.0 143.2 -7.5 25.2 30.9 89 89 A S - 0 0 2 21,-2.1 29,-0.1 25,-0.5 6,-0.1 -0.246 59.1-101.3 -53.6 129.9 -4.0 23.7 31.4 90 90 A P - 0 0 0 0, 0.0 26,-0.5 0, 0.0 29,-0.3 -0.180 24.0-130.9 -63.8 142.1 -1.6 26.6 32.4 91 91 A C > - 0 0 5 27,-0.1 4,-2.5 -3,-0.1 5,-0.2 -0.133 44.2 -88.1 -72.5 179.1 0.9 28.3 30.2 92 92 A D H > S+ 0 0 18 1,-0.2 4,-1.8 2,-0.2 167,-0.2 0.827 127.6 51.1 -64.7 -29.6 4.5 28.7 31.4 93 93 A X H > S+ 0 0 0 165,-0.4 4,-1.9 2,-0.2 166,-0.2 0.946 112.5 42.9 -71.8 -48.8 3.6 32.0 33.1 94 94 A C H > S+ 0 0 0 2,-0.2 4,-2.1 1,-0.2 -2,-0.2 0.878 113.6 53.6 -65.8 -36.9 0.6 30.8 35.0 95 95 A T H X S+ 0 0 2 -4,-2.5 4,-2.4 1,-0.2 -1,-0.2 0.934 107.9 51.5 -58.4 -45.9 2.6 27.6 35.9 96 96 A G H X S+ 0 0 2 -4,-1.8 4,-3.0 -5,-0.2 159,-0.4 0.849 106.2 53.5 -61.5 -36.5 5.3 29.9 37.2 97 97 A A H X S+ 0 0 0 -4,-1.9 4,-2.3 158,-0.3 6,-0.2 0.923 109.3 48.5 -64.3 -43.8 2.9 31.8 39.4 98 98 A I H X>S+ 0 0 0 -4,-2.1 5,-1.9 1,-0.2 4,-0.7 0.925 115.4 45.4 -61.2 -43.3 1.7 28.6 41.0 99 99 A I H ><5S+ 0 0 11 -4,-2.4 3,-0.6 3,-0.2 -2,-0.2 0.927 110.9 51.5 -66.6 -45.4 5.3 27.5 41.6 100 100 A X H 3<5S+ 0 0 21 -4,-3.0 -2,-0.2 1,-0.3 -1,-0.2 0.928 115.3 41.3 -60.0 -45.4 6.4 30.9 42.9 101 101 A Y H 3<5S- 0 0 1 -4,-2.3 -1,-0.3 -5,-0.2 -2,-0.2 0.563 107.7-125.5 -80.0 -7.5 3.6 31.1 45.5 102 102 A G T <<5 + 0 0 22 -4,-0.7 -3,-0.2 -3,-0.6 -20,-0.2 0.837 40.7 174.5 68.7 31.3 3.9 27.4 46.4 103 103 A I < - 0 0 0 -5,-1.9 -1,-0.2 -6,-0.2 -23,-0.2 -0.624 21.4-151.6 -71.1 114.2 0.2 26.6 45.7 104 104 A P + 0 0 37 0, 0.0 24,-2.7 0, 0.0 2,-0.4 0.756 67.8 40.7 -63.1 -29.5 0.4 22.8 46.1 105 105 A R E -cd 83 128A 4 -23,-1.1 -21,-2.4 22,-0.2 2,-0.5 -0.971 54.2-171.5-129.0 138.4 -2.4 21.7 43.8 106 106 A C E -cd 84 129A 0 22,-2.4 24,-2.4 -2,-0.4 2,-0.6 -0.989 10.2-162.8-126.3 117.6 -3.6 22.8 40.4 107 107 A V E -cd 85 130A 1 -23,-2.3 -21,-2.5 -2,-0.5 2,-0.4 -0.922 12.6-158.9-106.1 121.7 -6.9 21.3 39.2 108 108 A V E -cd 86 131A 0 22,-3.7 24,-2.9 -2,-0.6 25,-0.6 -0.879 19.6-151.7-109.4 127.8 -7.3 21.7 35.4 109 109 A G E S- 0 0 0 -23,-2.9 25,-2.6 -2,-0.4 24,-1.2 0.960 76.9 -25.9 -59.8 -53.1 -10.5 21.6 33.4 110 110 A E E -c 88 0A 1 -23,-0.6 -21,-2.1 23,-0.2 -1,-0.2 -0.992 35.7-161.6-159.3 160.2 -8.9 20.3 30.3 111 111 A N S S+ 0 0 45 -2,-0.3 -23,-0.1 -23,-0.2 -1,-0.0 -0.036 72.4 93.2-133.7 28.0 -5.6 20.1 28.3 112 112 A V S S+ 0 0 91 1,-0.1 3,-0.1 3,-0.0 -24,-0.0 0.865 89.4 41.0 -88.8 -42.4 -7.0 19.2 24.9 113 113 A N S S+ 0 0 31 1,-0.3 2,-0.3 0, 0.0 -1,-0.1 0.704 134.1 1.7 -78.7 -18.0 -7.4 22.7 23.5 114 114 A F + 0 0 36 2,-0.0 -25,-0.5 -23,-0.0 2,-0.3 -0.939 58.5 166.9-168.1 143.2 -4.0 23.8 25.0 115 115 A K - 0 0 129 -2,-0.3 2,-0.2 -3,-0.1 -24,-0.1 -0.920 11.7-168.0-159.3 134.0 -1.2 22.4 27.0 116 116 A S > - 0 0 19 -26,-0.5 3,-0.9 -2,-0.3 4,-0.4 -0.561 45.5 -95.2-112.3-178.6 2.3 23.9 27.7 117 117 A K T 3> S+ 0 0 137 1,-0.2 4,-2.2 -2,-0.2 3,-0.3 0.626 113.6 82.1 -72.2 -9.8 5.4 22.3 29.2 118 118 A G H 3> S+ 0 0 0 -28,-0.3 4,-2.7 1,-0.2 -1,-0.2 0.852 76.8 64.8 -63.1 -35.8 4.2 23.9 32.4 119 119 A E H <> S+ 0 0 22 -3,-0.9 4,-0.8 -29,-0.3 -1,-0.2 0.927 112.9 33.9 -54.8 -46.2 1.7 21.0 33.1 120 120 A K H > S+ 0 0 129 -4,-0.4 4,-2.4 -3,-0.3 3,-0.4 0.852 112.4 61.2 -77.8 -34.0 4.6 18.6 33.5 121 121 A Y H X S+ 0 0 30 -4,-2.2 4,-2.4 1,-0.2 -2,-0.2 0.892 98.8 58.3 -60.3 -36.8 7.0 21.2 35.0 122 122 A L H <>S+ 0 0 0 -4,-2.7 5,-2.8 1,-0.2 -1,-0.2 0.903 107.9 46.7 -56.8 -41.1 4.5 21.6 37.9 123 123 A Q H ><5S+ 0 0 85 -4,-0.8 3,-1.8 -3,-0.4 -2,-0.2 0.917 109.2 53.0 -68.2 -42.5 5.0 17.9 38.6 124 124 A T H 3<5S+ 0 0 103 -4,-2.4 -2,-0.2 1,-0.3 -1,-0.2 0.881 108.8 52.1 -57.6 -38.1 8.8 18.2 38.3 125 125 A R T 3<5S- 0 0 59 -4,-2.4 -1,-0.3 -5,-0.2 -2,-0.2 0.362 126.4 -99.6 -83.6 5.6 8.6 21.0 40.9 126 126 A G T < 5S+ 0 0 70 -3,-1.8 -3,-0.2 1,-0.3 2,-0.1 0.531 76.7 132.6 94.8 7.0 6.5 18.9 43.4 127 127 A H < - 0 0 26 -5,-2.8 2,-0.5 -6,-0.2 -1,-0.3 -0.478 56.3-119.3 -89.1 160.4 3.0 20.0 42.8 128 128 A E E -d 105 0A 47 -24,-2.7 -22,-2.4 -2,-0.1 2,-0.5 -0.876 27.4-164.6 -98.2 130.9 -0.0 17.9 42.3 129 129 A V E -d 106 0A 27 -2,-0.5 2,-0.5 -24,-0.2 -22,-0.2 -0.975 4.2-170.7-118.2 128.6 -1.8 18.3 38.9 130 130 A V E -d 107 0A 38 -24,-2.4 -22,-3.7 -2,-0.5 2,-0.6 -0.980 6.1-162.9-119.3 125.8 -5.3 17.0 38.3 131 131 A V E -d 108 0A 56 -2,-0.5 -22,-0.2 -24,-0.2 -21,-0.1 -0.949 7.6-178.9-111.5 115.6 -6.8 17.0 34.8 132 132 A V - 0 0 68 -24,-2.9 -23,-0.2 -2,-0.6 -22,-0.2 0.771 28.1-139.6 -81.9 -29.6 -10.6 16.6 35.0 133 133 A D - 0 0 75 -24,-1.2 2,-0.6 -25,-0.6 -23,-0.2 0.956 27.3-169.1 59.5 56.1 -11.3 16.7 31.3 134 134 A D > - 0 0 15 -25,-2.6 4,-2.2 1,-0.2 3,-0.3 -0.658 15.3-155.7 -79.2 114.5 -14.5 18.8 31.9 135 135 A E H > S+ 0 0 87 -2,-0.6 4,-2.4 1,-0.2 5,-0.2 0.752 90.2 61.1 -66.1 -25.0 -16.5 18.9 28.6 136 136 A R H > S+ 0 0 94 2,-0.2 4,-1.9 1,-0.2 -1,-0.2 0.934 109.2 42.6 -66.7 -45.1 -18.2 22.2 29.5 137 137 A C H > S+ 0 0 2 -3,-0.3 4,-2.4 1,-0.2 5,-0.3 0.944 114.0 51.7 -63.3 -48.4 -14.8 23.9 29.6 138 138 A K H X S+ 0 0 35 -4,-2.2 4,-2.4 1,-0.2 -2,-0.2 0.895 109.4 50.4 -57.2 -43.0 -13.6 22.1 26.5 139 139 A K H X S+ 0 0 131 -4,-2.4 4,-2.0 2,-0.2 -1,-0.2 0.931 112.3 43.6 -64.7 -47.5 -16.7 23.2 24.5 140 140 A I H X S+ 0 0 13 -4,-1.9 4,-1.8 1,-0.2 -1,-0.2 0.892 115.4 49.3 -68.7 -35.8 -16.6 26.9 25.4 141 141 A X H X S+ 0 0 4 -4,-2.4 4,-2.3 -5,-0.2 -1,-0.2 0.927 110.5 50.0 -67.4 -43.4 -12.9 27.1 24.8 142 142 A K H X S+ 0 0 96 -4,-2.4 4,-2.5 -5,-0.3 -1,-0.2 0.878 107.1 56.1 -62.1 -38.0 -13.1 25.3 21.4 143 143 A Q H X S+ 0 0 92 -4,-2.0 4,-2.3 1,-0.2 -1,-0.2 0.939 109.0 46.2 -60.4 -45.3 -15.9 27.7 20.4 144 144 A F H X S+ 0 0 1 -4,-1.8 4,-3.1 1,-0.2 -2,-0.2 0.917 112.0 49.8 -64.3 -43.3 -13.7 30.7 21.0 145 145 A I H < S+ 0 0 27 -4,-2.3 -1,-0.2 1,-0.2 -2,-0.2 0.887 112.3 49.5 -62.6 -37.3 -10.7 29.1 19.2 146 146 A D H < S+ 0 0 104 -4,-2.5 -2,-0.2 -5,-0.2 -1,-0.2 0.898 119.0 37.1 -66.5 -42.8 -13.0 28.3 16.2 147 147 A E H < S+ 0 0 110 -4,-2.3 -2,-0.2 1,-0.2 -3,-0.2 0.840 131.9 21.6 -80.5 -37.3 -14.4 31.9 16.1 148 148 A R X + 0 0 71 -4,-3.1 4,-2.0 -5,-0.2 3,-0.4 -0.446 64.9 159.4-134.4 64.3 -11.4 34.0 16.9 149 149 A P H > S+ 0 0 54 0, 0.0 4,-2.8 0, 0.0 5,-0.2 0.872 76.9 51.1 -54.1 -44.2 -8.2 32.0 16.2 150 150 A Q H > S+ 0 0 122 1,-0.2 4,-1.8 2,-0.2 8,-0.1 0.871 109.8 49.8 -65.8 -34.9 -5.9 35.1 16.0 151 151 A D H > S+ 0 0 40 -3,-0.4 4,-1.5 2,-0.2 -1,-0.2 0.875 111.1 50.9 -68.4 -37.3 -7.1 36.4 19.3 152 152 A W H X S+ 0 0 10 -4,-2.0 4,-1.2 1,-0.2 3,-0.4 0.956 108.9 50.3 -63.5 -49.7 -6.5 33.0 20.8 153 153 A F H <>S+ 0 0 65 -4,-2.8 5,-3.1 1,-0.2 3,-0.4 0.867 106.1 56.6 -57.7 -36.2 -3.0 32.9 19.4 154 154 A E H ><5S+ 0 0 20 -4,-1.8 3,-1.5 1,-0.2 -1,-0.2 0.901 101.4 56.9 -63.0 -38.2 -2.3 36.3 20.9 155 155 A D H 3<5S+ 0 0 1 -4,-1.5 -1,-0.2 -3,-0.4 -2,-0.2 0.804 113.1 39.9 -64.5 -28.2 -3.2 35.1 24.4 156 156 A I T 3<5S- 0 0 23 -4,-1.2 -1,-0.3 -3,-0.4 -2,-0.2 0.150 118.1-108.0-107.6 20.5 -0.6 32.4 24.2 157 157 A G T < 5 0 0 8 -3,-1.5 -3,-0.2 -5,-0.1 -2,-0.1 0.751 360.0 360.0 64.1 28.7 2.1 34.5 22.5 158 158 A E < 0 0 155 -5,-3.1 -4,-0.2 -6,-0.2 -5,-0.1 0.904 360.0 360.0 -97.5 360.0 1.9 32.9 19.1 159 !* 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 0.0 160 198 B G 0 0 98 0, 0.0 2,-0.3 0, 0.0 123,-0.1 0.000 360.0 360.0 360.0-171.0 20.1 23.0 34.7 161 199 B S > - 0 0 61 121,-0.2 3,-1.2 1,-0.1 124,-0.0 -0.606 360.0-137.3 -91.1 146.6 23.0 22.1 32.4 162 200 B S T 3 S+ 0 0 119 -2,-0.3 -1,-0.1 1,-0.2 0, 0.0 0.646 102.9 63.3 -70.3 -14.9 26.7 22.1 33.1 163 201 B X T 3 S+ 0 0 170 2,-0.0 -1,-0.2 0, 0.0 2,-0.1 0.294 72.6 116.8 -96.9 9.9 27.1 23.6 29.6 164 202 B V < - 0 0 58 -3,-1.2 2,-0.3 0, 0.0 118,-0.0 -0.432 41.0-174.0 -75.2 154.2 25.3 26.9 30.0 165 203 B T - 0 0 119 -2,-0.1 126,-0.3 126,-0.0 -2,-0.0 -0.987 31.5 -94.0-146.8 149.2 27.2 30.1 29.6 166 204 B G - 0 0 51 -2,-0.3 126,-0.2 1,-0.1 124,-0.0 -0.306 48.3-107.3 -63.2 147.3 26.3 33.7 30.1 167 205 B G - 0 0 20 124,-2.3 126,-0.1 1,-0.1 -1,-0.1 -0.199 34.7 -98.3 -71.9 167.2 25.1 35.6 27.0 168 206 B X - 0 0 162 1,-0.1 -1,-0.1 124,-0.1 2,-0.1 -0.414 45.3 -93.1 -79.7 162.3 27.1 38.2 25.2 169 207 B A - 0 0 83 -2,-0.1 2,-0.3 2,-0.0 -1,-0.1 -0.407 34.6-144.9 -75.3 152.7 26.6 41.9 25.7 170 208 B S > - 0 0 31 -2,-0.1 3,-1.9 1,-0.1 4,-0.3 -0.871 22.8-118.1-115.4 149.9 24.2 43.8 23.5 171 209 B K T 3 S+ 0 0 171 -2,-0.3 3,-0.3 1,-0.3 4,-0.3 0.731 114.5 53.6 -61.1 -19.7 24.8 47.4 22.4 172 210 B W T 3> S+ 0 0 52 1,-0.2 4,-2.8 2,-0.1 -1,-0.3 0.419 78.4 98.2 -96.1 3.1 21.5 48.4 24.1 173 211 B D H <> S+ 0 0 15 -3,-1.9 4,-2.5 1,-0.2 5,-0.3 0.855 81.5 49.7 -63.0 -36.8 22.4 46.9 27.5 174 212 B Q H > S+ 0 0 131 -4,-0.3 4,-2.3 -3,-0.3 -1,-0.2 0.951 114.2 47.3 -65.8 -44.4 23.5 50.1 29.2 175 213 B K H > S+ 0 0 86 -4,-0.3 4,-2.0 1,-0.2 -2,-0.2 0.936 114.3 46.2 -58.9 -49.5 20.3 51.8 28.0 176 214 B G H X S+ 0 0 0 -4,-2.8 4,-2.5 1,-0.2 -1,-0.2 0.899 113.7 46.8 -63.3 -43.7 18.1 48.9 29.2 177 215 B X H X S+ 0 0 6 -4,-2.5 4,-2.8 1,-0.2 5,-0.2 0.873 110.5 53.3 -67.9 -36.5 19.7 48.6 32.6 178 216 B D H X S+ 0 0 58 -4,-2.3 4,-2.2 -5,-0.3 -1,-0.2 0.901 111.9 45.0 -65.6 -39.0 19.6 52.3 33.2 179 217 B I H X S+ 0 0 19 -4,-2.0 4,-2.2 2,-0.2 -2,-0.2 0.935 113.2 50.6 -68.3 -44.0 15.9 52.4 32.4 180 218 B A H X S+ 0 0 0 -4,-2.5 4,-2.0 1,-0.2 -2,-0.2 0.929 112.7 46.4 -59.4 -45.7 15.2 49.3 34.6 181 219 B Y H X S+ 0 0 59 -4,-2.8 4,-2.7 1,-0.2 5,-0.2 0.909 109.0 54.3 -64.0 -42.4 17.1 50.9 37.5 182 220 B E H X S+ 0 0 117 -4,-2.2 4,-2.0 1,-0.2 -1,-0.2 0.886 109.1 49.6 -58.0 -38.4 15.3 54.2 37.1 183 221 B E H X S+ 0 0 20 -4,-2.2 4,-2.4 2,-0.2 -1,-0.2 0.893 109.7 50.8 -67.7 -39.5 12.0 52.3 37.3 184 222 B A H X S+ 0 0 0 -4,-2.0 4,-2.4 1,-0.2 -2,-0.2 0.918 111.1 48.3 -64.3 -41.3 13.2 50.5 40.5 185 223 B A H X S+ 0 0 31 -4,-2.7 4,-2.5 2,-0.2 -1,-0.2 0.862 110.0 51.9 -67.6 -35.3 14.2 53.8 42.1 186 224 B L H X S+ 0 0 66 -4,-2.0 4,-1.8 -5,-0.2 -1,-0.2 0.939 110.5 48.3 -65.4 -45.3 10.9 55.4 41.1 187 225 B G H <>S+ 0 0 0 -4,-2.4 5,-2.8 1,-0.2 4,-0.3 0.912 110.2 52.7 -60.8 -41.4 9.1 52.5 42.8 188 226 B Y H ><5S+ 0 0 60 -4,-2.4 3,-1.8 1,-0.2 -1,-0.2 0.941 108.8 48.2 -59.9 -47.3 11.3 52.8 45.8 189 227 B K H 3<5S+ 0 0 174 -4,-2.5 -1,-0.2 1,-0.3 -2,-0.2 0.826 106.7 58.4 -64.9 -27.7 10.4 56.5 46.2 190 228 B E T 3<5S- 0 0 90 -4,-1.8 -1,-0.3 -5,-0.2 -2,-0.2 0.478 125.1-103.7 -77.8 -3.0 6.7 55.6 45.8 191 229 B G T < 5S+ 0 0 31 -3,-1.8 -3,-0.2 -4,-0.3 -2,-0.1 0.579 83.4 115.3 92.2 11.3 7.0 53.4 48.8 192 230 B G S > - F 0 244B 45 5,-2.6 4,-2.4 -2,-0.4 3,-0.7 -0.698 20.7-150.8 -77.4 116.6 13.8 45.6 20.6 202 240 B N T 34 S+ 0 0 29 41,-2.1 -1,-0.2 -2,-0.6 42,-0.1 0.734 89.9 61.2 -61.8 -23.8 17.3 44.2 20.0 203 241 B K T 34 S+ 0 0 151 40,-0.5 -1,-0.2 1,-0.1 41,-0.1 0.824 127.0 2.9 -75.6 -33.0 17.2 45.4 16.4 204 242 B D T <4 S- 0 0 82 -3,-0.7 -2,-0.2 2,-0.1 -1,-0.1 0.358 92.7-112.9-137.2 5.3 16.8 49.1 17.0 205 243 B G < + 0 0 1 -4,-2.4 -3,-0.1 1,-0.2 2,-0.0 0.524 58.7 158.0 74.5 5.7 16.9 49.8 20.7 206 244 B S - 0 0 55 -5,-0.3 -5,-2.6 1,-0.1 2,-0.7 -0.359 41.9-126.6 -65.1 141.4 13.3 50.9 20.8 207 245 B V E -E 200 0B 44 -7,-0.2 -7,-0.2 1,-0.2 3,-0.1 -0.819 21.8-174.1 -93.4 114.0 11.6 50.6 24.2 208 246 B L E - 0 0 54 -9,-2.7 2,-0.3 -2,-0.7 -1,-0.2 0.781 67.9 -38.1 -76.4 -27.8 8.3 48.6 24.0 209 247 B G E -E 199 0B 11 -10,-1.0 -10,-2.4 2,-0.0 -1,-0.3 -0.946 51.6-151.2 176.3 166.2 7.5 49.4 27.6 210 248 B R E +E 198 0B 89 -2,-0.3 2,-0.3 -12,-0.3 -12,-0.3 -0.974 22.6 149.3-149.6 158.2 8.9 49.9 31.1 211 249 B G E -E 197 0B 0 -14,-2.1 -14,-2.6 -2,-0.3 2,-0.3 -0.990 25.8-134.2-174.8 177.5 7.6 49.4 34.6 212 250 B H E -E 196 0B 12 -2,-0.3 -16,-0.2 -16,-0.2 -28,-0.1 -0.921 47.0 -65.5-144.4 167.9 8.2 48.6 38.3 213 251 B N - 0 0 0 -18,-2.2 11,-0.2 -20,-0.4 4,-0.2 -0.280 39.5-174.1 -56.4 134.6 6.6 46.4 41.0 214 252 B X > + 0 0 42 9,-2.4 4,-2.6 1,-0.1 6,-0.8 0.087 44.9 118.2-120.5 23.6 3.1 47.7 42.0 215 253 B R H >>S+ 0 0 1 8,-0.4 4,-1.1 4,-0.2 5,-0.9 0.953 89.1 28.6 -54.4 -53.1 2.4 45.4 44.9 216 254 B F H 45S+ 0 0 48 3,-0.2 -1,-0.2 2,-0.2 -2,-0.1 0.888 120.0 54.2 -79.6 -35.5 2.1 48.3 47.4 217 255 B Q H 45S+ 0 0 55 1,-0.2 -2,-0.2 -4,-0.2 -1,-0.2 0.876 129.1 16.0 -64.1 -39.1 0.9 51.0 45.0 218 256 B K H <5S- 0 0 136 -4,-2.6 -1,-0.2 2,-0.1 -2,-0.2 0.309 101.5-111.8-120.1 7.3 -2.0 48.9 43.7 219 257 B G T <5 + 0 0 34 -4,-1.1 2,-0.5 -5,-0.3 -146,-0.3 0.907 62.9 167.7 60.3 42.0 -2.4 46.2 46.3 220 258 B S < - 0 0 0 -5,-0.9 -1,-0.2 -6,-0.8 -151,-0.1 -0.787 38.9-174.2-102.4 127.8 -1.3 43.7 43.6 221 259 B A S S+ 0 0 0 -2,-0.5 -1,-0.1 -152,-0.2 -152,-0.1 0.476 91.3 37.8 -90.1 -5.9 -0.3 40.1 44.1 222 260 B T S S+ 0 0 2 1,-0.1 2,-2.3 -8,-0.1 5,-0.2 0.640 84.0 96.8-120.0 -15.4 0.8 39.7 40.4 223 261 B L + 0 0 18 4,-0.1 -9,-2.4 -9,-0.1 -8,-0.4 -0.349 46.2 162.4 -80.3 64.0 2.5 43.0 39.4 224 262 B H > - 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