==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=22-JAN-2012 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE 04-AUG-11 3ZX0 . COMPND 2 MOLECULE: ECTONUCLEOSIDE TRIPHOSPHATE DIPHOSPHOHYDROLASE 1; . SOURCE 2 ORGANISM_SCIENTIFIC: RATTUS NORVEGICUS; . AUTHOR M.ZEBISCH,P.SCHAEFER,N.STRAETER . 1561 18 20 20 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 63356.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 1127 72.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 111 7.1 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 189 12.1 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 1 0.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 4 0.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 16 1.0 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 . 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 . 98 6.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 209 13.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 446 28.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 20 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 9 0 0 4 3 9 5 1 5 5 0 6 4 0 0 2 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 0 5 4 10 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 PARALLEL BRIDGES PER LADDER . 5 4 0 4 5 10 2 3 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 . 4 4 0 4 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 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 48 A K 0 0 164 0, 0.0 19,-1.8 0, 0.0 2,-0.3 0.000 360.0 360.0 360.0 155.3 18.4 -22.4 96.1 2 49 A Y E -A 19 0A 43 17,-0.2 2,-0.3 63,-0.2 17,-0.2 -0.957 360.0-177.8-136.1 152.2 21.1 -19.9 97.2 3 50 A G E -A 18 0A 0 15,-2.0 15,-2.8 -2,-0.3 2,-0.4 -0.970 13.1-147.4-145.5 158.2 22.8 -16.9 95.8 4 51 A I E -Ab 17 71A 0 66,-2.2 68,-2.0 -2,-0.3 2,-0.4 -0.998 11.9-177.1-129.6 130.6 25.5 -14.6 97.1 5 52 A V E -Ab 16 72A 0 11,-2.1 11,-2.7 -2,-0.4 2,-0.5 -0.994 13.5-152.0-125.2 126.3 25.9 -10.9 96.4 6 53 A L E -Ab 15 73A 1 66,-3.4 68,-3.0 -2,-0.4 2,-0.9 -0.862 5.4-155.2 -93.1 124.3 28.9 -8.7 97.6 7 54 A D E -Ab 14 74A 26 7,-3.6 7,-3.1 -2,-0.5 2,-1.2 -0.894 9.8-165.9 -96.7 102.6 28.0 -5.0 98.1 8 55 A A E +Ab 13 75A 1 66,-2.8 68,-1.8 -2,-0.9 71,-0.3 -0.729 20.3 168.4 -92.6 84.9 31.4 -3.4 97.7 9 56 A G - 0 0 13 3,-2.1 27,-0.3 -2,-1.2 28,-0.2 -0.413 49.1 -98.2 -95.3 177.5 30.6 0.1 99.0 10 57 A S S S+ 0 0 17 1,-0.2 25,-1.2 25,-0.1 28,-0.1 0.723 119.1 30.3 -74.7 -22.3 33.1 2.8 99.9 11 58 A S S S+ 0 0 51 1,-0.3 2,-0.3 23,-0.2 -1,-0.2 0.768 130.1 7.3 -98.2 -39.2 33.3 2.1 103.7 12 59 A H - 0 0 26 22,-0.1 -3,-2.1 2,-0.0 2,-0.5 -0.982 57.0-132.9-146.3 153.1 32.6 -1.6 103.7 13 60 A T E -A 8 0A 0 18,-0.5 18,-2.6 -2,-0.3 2,-0.5 -0.950 30.5-166.0-101.7 125.4 32.2 -4.6 101.6 14 61 A N E -AC 7 30A 25 -7,-3.1 -7,-3.6 -2,-0.5 2,-0.5 -0.969 6.5-153.7-117.7 128.8 29.0 -6.5 102.7 15 62 A L E -AC 6 29A 0 14,-2.8 14,-2.2 -2,-0.5 2,-0.4 -0.899 10.8-166.1-104.2 131.1 28.3 -10.1 101.6 16 63 A Y E -AC 5 28A 8 -11,-2.7 -11,-2.1 -2,-0.5 2,-0.5 -0.948 9.2-156.9-115.7 136.6 24.7 -11.3 101.5 17 64 A I E -AC 4 27A 0 10,-2.8 9,-3.9 -2,-0.4 10,-1.3 -0.965 15.8-170.0-108.4 120.2 23.5 -14.8 101.2 18 65 A Y E -AC 3 25A 0 -15,-2.8 -15,-2.0 -2,-0.5 2,-0.3 -0.730 4.2-176.1-102.5 154.7 20.0 -15.2 99.8 19 66 A K E AC 2 24A 83 5,-2.1 5,-2.5 -2,-0.3 -17,-0.2 -0.988 360.0 360.0-146.8 155.6 17.9 -18.3 99.7 20 67 A W 0 0 88 -19,-1.8 3,-0.2 -2,-0.3 -2,-0.0 -0.997 360.0 360.0-155.0 360.0 14.5 -19.3 98.3 21 ! 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 22 77 A V 0 0 137 0, 0.0 2,-0.3 0, 0.0 108,-0.0 0.000 360.0 360.0 360.0 138.6 9.7 -15.5 98.2 23 78 A V - 0 0 9 -3,-0.2 2,-0.3 -5,-0.0 -3,-0.2 -0.716 360.0-169.9 -92.3 142.0 13.5 -14.8 98.6 24 79 A Q E -C 19 0A 98 -5,-2.5 -5,-2.1 -2,-0.3 2,-0.5 -0.934 30.2-108.7-131.6 152.0 15.0 -14.2 102.0 25 80 A Q E -C 18 0A 25 347,-0.3 -7,-0.3 -2,-0.3 3,-0.1 -0.702 29.7-174.0 -76.6 122.6 18.3 -13.0 103.4 26 81 A L E - 0 0 52 -9,-3.9 2,-0.3 -2,-0.5 -1,-0.2 0.914 63.6 -25.4 -81.4 -48.6 19.9 -16.1 105.0 27 82 A E E -C 17 0A 59 -10,-1.3 -10,-2.8 2,-0.0 -1,-0.4 -0.971 53.5-146.1-159.4 164.1 22.9 -14.3 106.5 28 83 A E E -C 16 0A 58 -2,-0.3 2,-0.4 -12,-0.2 -12,-0.2 -0.962 8.6-165.0-136.6 152.4 25.1 -11.2 106.0 29 84 A a E -C 15 0A 16 -14,-2.2 -14,-2.8 -2,-0.3 2,-0.7 -0.995 12.1-145.6-141.0 131.2 28.8 -10.7 106.7 30 85 A Q E -C 14 0A 89 -2,-0.4 -16,-0.2 -16,-0.2 2,-0.2 -0.873 21.4-133.0-101.8 116.7 30.7 -7.4 106.9 31 86 A V - 0 0 3 -18,-2.6 -18,-0.5 -2,-0.7 19,-0.1 -0.465 27.9-115.0 -66.1 129.5 34.2 -7.7 105.6 32 87 A K S S+ 0 0 151 17,-0.2 -1,-0.1 -2,-0.2 21,-0.1 -0.361 78.5 29.3 -64.8 144.3 36.6 -6.1 108.1 33 88 A G S S- 0 0 30 -3,-0.1 -20,-0.2 -2,-0.0 3,-0.1 -0.571 97.0 -50.0 105.0-168.3 38.4 -3.0 106.8 34 89 A P S S- 0 0 53 0, 0.0 -21,-0.3 0, 0.0 -23,-0.2 -0.122 74.4 -60.7 -91.9-165.3 37.5 -0.3 104.3 35 90 A G > - 0 0 0 -25,-1.2 3,-1.7 -23,-0.2 -25,-0.1 -0.328 51.9-103.3 -79.0 165.5 36.2 -0.6 100.8 36 91 A I G > S+ 0 0 2 -27,-0.3 3,-2.6 1,-0.3 4,-0.2 0.760 112.3 73.0 -65.8 -26.7 38.1 -2.3 98.0 37 92 A S G > S+ 0 0 17 1,-0.3 3,-1.8 2,-0.2 -1,-0.3 0.822 85.3 68.4 -57.4 -27.5 39.2 0.9 96.3 38 93 A K G < S+ 0 0 112 -3,-1.7 3,-0.3 1,-0.3 -1,-0.3 0.543 89.8 66.5 -68.0 -2.0 41.6 1.3 99.2 39 94 A Y G < + 0 0 22 -3,-2.6 -1,-0.3 1,-0.2 -2,-0.2 0.466 60.5 119.5 -98.1 -0.4 43.4 -1.7 97.8 40 95 A A S < S+ 0 0 15 -3,-1.8 3,-0.3 1,-0.2 -1,-0.2 0.719 86.4 30.3 -34.0 -42.0 44.5 0.1 94.6 41 96 A Q S S+ 0 0 170 -3,-0.3 2,-0.8 1,-0.2 3,-0.2 0.939 124.6 43.7 -82.1 -49.6 48.2 -0.5 95.5 42 97 A K > + 0 0 78 -4,-0.3 3,-1.9 1,-0.2 4,-0.4 -0.377 62.0 147.6-106.3 51.0 48.1 -3.6 97.4 43 98 A T G > + 0 0 30 -2,-0.8 3,-1.2 -3,-0.3 4,-0.4 0.732 66.7 68.9 -59.6 -27.3 45.7 -5.8 95.4 44 99 A D G 3 S+ 0 0 134 1,-0.2 3,-0.5 -3,-0.2 4,-0.3 0.771 93.9 60.0 -64.3 -21.5 47.5 -9.0 96.3 45 100 A E G <> S+ 0 0 104 -3,-1.9 4,-2.0 1,-0.2 3,-0.4 0.657 82.2 84.9 -76.3 -18.3 46.1 -8.4 99.9 46 101 A I H <> S+ 0 0 0 -3,-1.2 4,-2.2 -4,-0.4 5,-0.2 0.875 79.5 62.3 -50.5 -45.8 42.5 -8.5 98.6 47 102 A A H 4 S+ 0 0 49 -3,-0.5 4,-0.5 -4,-0.4 -1,-0.2 0.890 109.7 38.6 -49.5 -51.2 42.3 -12.4 98.8 48 103 A A H >> S+ 0 0 75 -3,-0.4 3,-1.1 -4,-0.3 4,-0.7 0.895 110.5 60.9 -68.5 -42.1 42.9 -12.5 102.6 49 104 A Y H 3< S+ 0 0 24 -4,-2.0 4,-0.3 1,-0.3 -17,-0.2 0.869 113.3 37.2 -50.6 -40.8 40.7 -9.4 103.1 50 105 A L T 3X S+ 0 0 2 -4,-2.2 4,-1.8 -5,-0.2 -1,-0.3 0.549 95.6 92.3 -87.5 -10.1 37.8 -11.3 101.6 51 106 A A H <> S+ 0 0 35 -3,-1.1 4,-3.0 -4,-0.5 5,-0.3 0.897 79.4 51.2 -59.8 -49.7 38.7 -14.6 103.2 52 107 A E H X S+ 0 0 120 -4,-0.7 4,-2.3 1,-0.2 -1,-0.2 0.940 114.1 41.8 -54.7 -54.7 36.7 -14.5 106.5 53 108 A a H > S+ 0 0 2 -4,-0.3 4,-1.1 1,-0.2 -1,-0.2 0.822 116.0 51.0 -66.0 -31.1 33.3 -13.6 104.9 54 109 A M H X S+ 0 0 1 -4,-1.8 4,-1.6 2,-0.2 -1,-0.2 0.892 109.2 49.0 -70.9 -43.8 33.9 -16.1 102.0 55 110 A K H X S+ 0 0 124 -4,-3.0 4,-2.0 1,-0.2 5,-0.2 0.888 105.9 59.1 -61.3 -40.5 34.8 -19.0 104.4 56 111 A M H X S+ 0 0 37 -4,-2.3 4,-0.8 -5,-0.3 -1,-0.2 0.900 106.6 48.2 -53.1 -40.9 31.7 -18.2 106.4 57 112 A S H X S+ 0 0 0 -4,-1.1 4,-2.3 1,-0.2 -1,-0.2 0.832 109.5 49.7 -72.1 -36.6 29.7 -18.8 103.2 58 113 A T H < S+ 0 0 36 -4,-1.6 -1,-0.2 1,-0.2 -2,-0.2 0.769 114.0 47.7 -71.5 -26.0 31.4 -22.1 102.4 59 114 A E H < S+ 0 0 133 -4,-2.0 -2,-0.2 -5,-0.1 -1,-0.2 0.648 116.9 45.3 -81.4 -19.4 30.7 -23.2 106.0 60 115 A R H < S+ 0 0 125 -4,-0.8 -2,-0.2 -5,-0.2 -3,-0.2 0.838 99.4 64.2-100.0 -39.5 27.1 -22.0 105.7 61 116 A I S < S- 0 0 4 -4,-2.3 5,-0.1 -5,-0.1 2,-0.0 -0.726 95.2-102.5 -88.0 135.4 25.8 -23.3 102.4 62 117 A P >> - 0 0 61 0, 0.0 3,-1.5 0, 0.0 4,-0.6 -0.365 29.4-121.6 -59.3 137.2 25.6 -27.1 102.1 63 118 A A G >4 S+ 0 0 76 1,-0.3 3,-1.1 2,-0.2 4,-0.5 0.789 110.2 56.9 -49.3 -38.4 28.4 -28.5 100.0 64 119 A S G 34 S+ 0 0 95 1,-0.3 4,-0.3 2,-0.1 3,-0.3 0.838 107.4 48.7 -64.9 -33.6 26.1 -30.1 97.4 65 120 A K G <4 S+ 0 0 96 -3,-1.5 4,-0.3 1,-0.2 -1,-0.3 0.554 92.6 86.4 -80.7 -6.2 24.4 -26.8 96.8 66 121 A Q S X< S+ 0 0 18 -3,-1.1 3,-0.9 -4,-0.6 41,-0.5 0.841 82.5 48.0 -73.4 -40.5 27.7 -24.9 96.3 67 122 A H T 3 S+ 0 0 133 -4,-0.5 -1,-0.2 -3,-0.3 -2,-0.1 0.829 112.6 51.9 -71.5 -28.7 28.7 -25.3 92.6 68 123 A Q T 3 S+ 0 0 155 -4,-0.3 -1,-0.2 -3,-0.1 -2,-0.2 0.529 89.5 102.6 -79.2 -7.5 25.2 -24.3 91.6 69 124 A T < - 0 0 2 -3,-0.9 38,-2.7 -4,-0.3 -66,-0.2 -0.667 66.9-136.9 -89.8 119.1 25.3 -21.1 93.7 70 125 A P E - d 0 107A 22 0, 0.0 -66,-2.2 0, 0.0 2,-0.4 -0.425 14.7-162.5 -76.3 150.0 25.9 -17.8 91.9 71 126 A V E +bd 4 108A 3 36,-1.7 38,-2.8 -68,-0.2 39,-0.4 -0.998 12.1 173.5-134.0 125.6 28.3 -15.2 93.3 72 127 A Y E -b 5 0A 33 -68,-2.0 -66,-3.4 -2,-0.4 2,-0.5 -0.960 18.3-156.4-129.0 144.9 28.3 -11.5 92.2 73 128 A L E -bd 6 111A 3 37,-2.3 39,-2.6 -2,-0.3 2,-0.5 -0.992 10.4-173.3-121.0 127.3 30.1 -8.5 93.4 74 129 A G E -bd 7 112A 3 -68,-3.0 -66,-2.8 -2,-0.5 2,-0.4 -0.982 8.3-160.4-117.7 127.3 28.6 -5.1 92.6 75 130 A A E -bd 8 113A 0 37,-2.6 39,-2.5 -2,-0.5 -66,-0.2 -0.854 8.7-168.9-111.9 147.2 30.7 -2.1 93.5 76 131 A T >> - 0 0 13 -68,-1.8 4,-1.6 -2,-0.4 3,-1.0 0.092 50.3 -30.8-117.7-141.5 29.3 1.4 94.0 77 132 A A H 3> S+ 0 0 1 1,-0.3 4,-2.6 2,-0.2 5,-0.2 0.757 123.1 62.4 -63.7 -29.8 30.4 5.0 94.3 78 133 A G H 3> S+ 0 0 7 1,-0.2 4,-1.7 2,-0.2 -1,-0.3 0.941 111.3 40.9 -57.1 -45.2 33.8 4.2 96.0 79 134 A M H <> S+ 0 0 2 -3,-1.0 4,-2.6 -71,-0.3 -1,-0.2 0.811 107.4 60.6 -76.4 -30.0 34.8 2.4 92.9 80 135 A R H X S+ 0 0 12 -4,-1.6 4,-2.2 2,-0.2 -2,-0.2 0.953 108.3 47.0 -57.1 -47.2 33.3 4.9 90.6 81 136 A L H X S+ 0 0 10 -4,-2.6 4,-1.6 2,-0.2 -2,-0.2 0.882 110.5 51.0 -61.9 -39.7 35.7 7.5 92.1 82 137 A L H X S+ 0 0 15 -4,-1.7 4,-3.4 2,-0.2 8,-0.2 0.935 110.2 49.6 -64.5 -44.5 38.6 5.1 91.8 83 138 A R H < S+ 0 0 20 -4,-2.6 4,-0.2 1,-0.2 -2,-0.2 0.879 107.7 55.3 -56.3 -43.6 37.8 4.5 88.1 84 139 A M H < S+ 0 0 39 -4,-2.2 -1,-0.2 -5,-0.2 -2,-0.2 0.858 114.2 39.9 -59.4 -37.8 37.6 8.3 87.6 85 140 A E H < S+ 0 0 100 -4,-1.6 2,-0.3 1,-0.2 -2,-0.2 0.922 138.2 2.2 -78.5 -47.0 41.2 8.6 89.1 86 141 A S X - 0 0 39 -4,-3.4 4,-2.2 -5,-0.1 -1,-0.2 -0.756 49.7-168.7-147.5 105.0 42.6 5.5 87.4 87 142 A K H > S+ 0 0 100 -2,-0.3 4,-2.5 1,-0.2 5,-0.1 0.871 97.7 53.8 -40.3 -44.6 40.8 3.2 85.0 88 143 A Q H > S+ 0 0 139 1,-0.2 4,-2.3 2,-0.2 -1,-0.2 0.931 106.4 48.7 -68.1 -49.8 43.8 0.9 85.4 89 144 A S H > S+ 0 0 22 2,-0.2 4,-2.7 1,-0.2 -1,-0.2 0.876 111.3 49.9 -54.2 -46.9 43.7 0.8 89.2 90 145 A A H X S+ 0 0 1 -4,-2.2 4,-3.1 -8,-0.2 -2,-0.2 0.947 111.1 49.5 -61.5 -47.3 40.0 0.0 89.2 91 146 A D H X S+ 0 0 83 -4,-2.5 4,-2.3 -5,-0.2 -2,-0.2 0.860 111.2 49.4 -58.0 -41.5 40.5 -2.7 86.6 92 147 A E H X S+ 0 0 84 -4,-2.3 4,-2.6 2,-0.2 -1,-0.2 0.900 111.8 48.8 -65.5 -43.9 43.4 -4.2 88.7 93 148 A V H X S+ 0 0 0 -4,-2.7 4,-2.6 2,-0.2 -2,-0.2 0.971 112.9 47.4 -58.4 -53.0 41.2 -4.1 91.8 94 149 A L H X S+ 0 0 23 -4,-3.1 4,-2.2 1,-0.2 -2,-0.2 0.864 113.2 48.7 -58.1 -40.2 38.3 -5.8 90.0 95 150 A A H X S+ 0 0 47 -4,-2.3 4,-2.9 2,-0.2 5,-0.2 0.922 109.8 50.6 -64.9 -45.3 40.5 -8.4 88.6 96 151 A A H X S+ 0 0 2 -4,-2.6 4,-2.1 1,-0.2 -2,-0.2 0.922 111.6 49.2 -60.9 -42.8 42.1 -9.2 92.0 97 152 A V H X S+ 0 0 0 -4,-2.6 4,-2.8 1,-0.2 -1,-0.2 0.910 111.5 50.9 -57.3 -46.3 38.6 -9.5 93.4 98 153 A S H X S+ 0 0 30 -4,-2.2 4,-3.4 2,-0.2 -2,-0.2 0.920 108.3 48.4 -60.9 -49.3 37.7 -11.8 90.6 99 154 A R H X S+ 0 0 158 -4,-2.9 4,-1.1 1,-0.2 -1,-0.2 0.915 114.2 49.1 -57.8 -42.5 40.7 -14.2 91.0 100 155 A S H < S+ 0 0 11 -4,-2.1 3,-0.4 -5,-0.2 4,-0.4 0.943 116.5 39.8 -61.9 -49.8 40.0 -14.4 94.7 101 156 A L H >< S+ 0 0 5 -4,-2.8 3,-1.8 1,-0.2 5,-0.4 0.910 108.7 61.6 -68.4 -42.3 36.2 -15.1 94.2 102 157 A K H 3< S+ 0 0 58 -4,-3.4 -1,-0.2 1,-0.3 -2,-0.2 0.818 96.4 63.0 -51.8 -32.6 36.8 -17.4 91.2 103 158 A S T 3< S+ 0 0 95 -4,-1.1 -1,-0.3 -3,-0.4 -2,-0.2 0.655 85.7 85.9 -74.2 -18.0 38.9 -19.7 93.5 104 159 A Y S < S- 0 0 51 -3,-1.8 2,-0.4 -4,-0.4 4,-0.2 -0.359 96.5-103.8 -77.4 162.5 36.0 -20.6 95.9 105 160 A P S S+ 0 0 46 0, 0.0 -36,-0.2 0, 0.0 2,-0.2 0.043 85.6 106.3 -81.8 37.6 33.7 -23.5 94.9 106 161 A F S S- 0 0 19 -2,-0.4 2,-1.4 -5,-0.4 -39,-0.2 -0.579 84.0 -94.6-106.9 174.1 30.9 -21.2 93.7 107 162 A D E -d 70 0A 65 -38,-2.7 -36,-1.7 -41,-0.5 2,-0.1 -0.675 44.9-144.6 -87.5 88.4 29.5 -20.2 90.4 108 163 A F E +d 71 0A 62 -2,-1.4 -36,-0.2 -38,-0.2 3,-0.1 -0.304 24.7 175.4 -61.5 126.9 31.4 -17.0 89.8 109 164 A Q E - 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0 0 53 8,-0.2 8,-1.6 5,-0.0 2,-0.2 -0.987 67.0-164.8-148.3 158.8 12.2 22.0 89.5 272 342 A d B -L 278 0D 15 -2,-0.3 6,-0.3 6,-0.3 3,-0.1 -0.770 26.9-128.8-129.1 178.5 15.5 20.4 90.3 273 343 A A S S- 0 0 11 4,-2.8 -1,-0.3 1,-0.4 2,-0.3 0.796 76.2 -60.3 -83.3 -91.4 17.2 18.4 93.1 274 344 A F S > S+ 0 0 10 4,-0.1 3,-1.6 1,-0.1 -1,-0.4 -0.857 114.8 38.7-144.8 171.5 20.4 20.5 93.4 275 345 A N T 3 S- 0 0 58 -10,-1.6 3,-0.1 -2,-0.3 -1,-0.1 0.837 127.7 -61.0 49.6 44.9 23.2 21.3 90.9 276 346 A G T 3 S+ 0 0 34 -11,-0.4 2,-0.4 1,-0.2 -1,-0.3 0.532 98.2 139.7 66.2 4.3 21.0 21.8 87.8 277 347 A V < - 0 0 38 -3,-1.6 -4,-2.8 -10,-0.1 -1,-0.2 -0.703 54.2-115.6 -85.2 129.4 19.7 18.2 88.0 278 348 A F B -L 272 0D 16 -2,-0.4 -6,-0.3 -6,-0.3 -4,-0.1 -0.251 31.4-179.4 -56.0 141.1 16.0 17.6 87.2 279 349 A L - 0 0 0 -8,-1.6 -8,-0.2 -6,-0.1 3,-0.1 -0.950 19.6-137.6-139.2 126.3 13.6 16.3 89.9 280 350 A P - 0 0 6 0, 0.0 3,-0.1 0, 0.0 2,-0.1 -0.154 46.5 -69.7 -65.6 173.2 10.0 15.7 89.3 281 351 A P - 0 0 77 0, 0.0 -124,-0.1 0, 0.0 -123,-0.1 -0.391 61.1-100.7 -53.7 138.7 7.3 16.7 91.9 282 352 A L - 0 0 41 74,-0.1 2,-0.4 -3,-0.1 3,-0.1 -0.433 48.4-171.4 -61.1 144.9 7.5 14.5 95.0 283 353 A Q - 0 0 88 -2,-0.1 -128,-0.1 -3,-0.1 -142,-0.1 -0.972 34.5 -31.8-149.8 125.7 4.8 11.9 94.9 284 354 A G S S- 0 0 30 -2,-0.4 2,-0.2 -144,-0.1 80,-0.1 -0.158 91.9 -26.8 70.6-159.3 3.5 9.4 97.4 285 355 A S - 0 0 36 -146,-0.3 -144,-3.1 -3,-0.1 2,-0.3 -0.574 51.9-156.3-102.6 160.6 5.5 7.7 100.1 286 356 A F E -ei 141 365B 0 78,-3.0 80,-2.8 -146,-0.3 2,-0.6 -0.937 15.4-146.3-137.3 144.1 9.2 6.8 100.6 287 357 A G E -ei 142 366B 0 -146,-2.9 -144,-1.8 -2,-0.3 2,-0.5 -0.950 20.0-161.3-111.2 112.0 11.5 4.4 102.4 288 358 A A E +ei 143 367B 0 78,-1.0 80,-2.0 -2,-0.6 -144,-0.2 -0.786 23.9 165.7 -90.0 130.3 14.8 6.0 103.3 289 359 A F E > +e 144 0B 2 -146,-3.1 3,-2.6 -2,-0.5 -144,-0.7 -0.549 31.0 32.1-135.5-161.0 17.6 3.5 104.1 290 360 A S E >> S+e 145 0B 42 78,-0.4 4,-2.5 86,-0.3 3,-1.3 -0.300 131.6 2.5 43.2-124.1 21.3 2.7 104.7 291 361 A A H 3> S+ 0 0 2 -146,-2.2 4,-1.9 1,-0.3 5,-0.4 0.760 131.8 62.5 -63.0 -21.2 22.8 5.8 106.2 292 362 A F H <> S+ 0 0 0 -3,-2.6 4,-1.5 -147,-0.3 -1,-0.3 0.910 112.7 37.9 -63.8 -36.2 19.4 7.5 106.2 293 363 A Y H <> S+ 0 0 71 -3,-1.3 4,-2.5 75,-0.2 5,-0.3 0.956 115.3 48.9 -84.2 -51.2 18.3 4.8 108.5 294 364 A F H X S+ 0 0 102 -4,-2.5 4,-1.0 1,-0.2 -3,-0.2 0.878 119.5 39.2 -61.8 -29.0 21.4 4.4 110.7 295 365 A V H X S+ 0 0 1 -4,-1.9 4,-1.7 -5,-0.2 -1,-0.2 0.919 118.2 44.6 -82.6 -45.7 21.7 8.1 111.3 296 366 A M H X S+ 0 0 11 -4,-1.5 4,-3.0 -5,-0.4 -2,-0.2 0.847 110.2 56.6 -68.6 -30.9 18.0 9.1 111.7 297 367 A D H X S+ 0 0 43 -4,-2.5 4,-1.9 2,-0.2 -1,-0.2 0.931 102.4 55.7 -67.8 -44.4 17.4 6.1 113.9 298 368 A F H < S+ 0 0 28 -4,-1.0 3,-0.3 -5,-0.3 4,-0.3 0.951 113.2 41.0 -48.1 -52.5 20.1 7.3 116.3 299 369 A F H >< S+ 0 0 5 -4,-1.7 3,-2.6 1,-0.2 -2,-0.2 0.925 107.6 60.7 -66.8 -41.1 18.3 10.6 116.6 300 370 A K H >< S+ 0 0 70 -4,-3.0 3,-2.3 1,-0.3 -1,-0.2 0.866 96.9 63.1 -50.5 -36.0 14.8 9.1 116.8 301 371 A K T 3< S+ 0 0 145 -4,-1.9 -1,-0.3 1,-0.3 -2,-0.2 0.550 88.6 68.1 -76.1 -5.3 16.0 7.2 119.9 302 372 A M T < 0 0 57 -3,-2.6 -1,-0.3 -4,-0.3 -2,-0.2 0.323 360.0 360.0 -88.8 8.9 16.5 10.5 121.7 303 373 A A < 0 0 95 -3,-2.3 -1,-0.2 -4,-0.1 -2,-0.2 0.136 360.0 360.0 -99.5 360.0 12.7 11.0 121.6 304 ! 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 0.0 305 378 A S 0 0 96 0, 0.0 5,-0.1 0, 0.0 -5,-0.0 0.000 360.0 360.0 360.0-113.9 8.2 12.0 114.5 306 379 A S > - 0 0 36 1,-0.1 4,-2.5 3,-0.1 5,-0.2 0.068 360.0-117.6 -67.0 165.3 8.0 15.5 112.9 307 380 A Q H > S+ 0 0 37 2,-0.2 4,-1.7 1,-0.2 5,-0.1 0.837 112.0 53.2 -74.8 -37.8 10.6 17.6 111.2 308 381 A E H > S+ 0 0 115 2,-0.2 4,-2.6 1,-0.2 -1,-0.2 0.877 112.1 51.8 -64.7 -31.2 10.6 20.6 113.5 309 382 A K H > S+ 0 0 96 2,-0.2 4,-2.5 1,-0.2 5,-0.2 0.973 107.8 47.8 -66.8 -56.2 11.1 18.0 116.3 310 383 A M H X S+ 0 0 3 -4,-2.5 4,-1.3 1,-0.2 -1,-0.2 0.773 112.6 52.2 -61.4 -22.7 14.1 16.3 114.6 311 384 A T H X S+ 0 0 37 -4,-1.7 4,-2.9 2,-0.2 3,-0.4 0.965 107.4 48.6 -72.2 -56.3 15.6 19.8 114.0 312 385 A E H X S+ 0 0 154 -4,-2.6 4,-2.3 1,-0.2 -2,-0.2 0.913 112.6 51.6 -48.7 -43.2 15.2 20.8 117.7 313 386 A I H X S+ 0 0 29 -4,-2.5 4,-2.4 1,-0.2 -1,-0.2 0.875 111.8 45.8 -63.5 -39.7 16.9 17.4 118.6 314 387 A T H X S+ 0 0 3 -4,-1.3 4,-2.4 -3,-0.4 -1,-0.2 0.893 109.4 53.0 -75.5 -37.5 19.8 18.0 116.3 315 388 A K H X S+ 0 0 79 -4,-2.9 4,-0.7 2,-0.2 -62,-0.3 0.959 114.5 44.7 -57.2 -43.8 20.4 21.6 117.3 316 389 A N H >X S+ 0 0 100 -4,-2.3 3,-1.5 -5,-0.3 4,-0.7 0.957 111.2 50.0 -70.7 -46.0 20.6 20.3 120.9 317 390 A F H >< S+ 0 0 2 -4,-2.4 3,-1.2 1,-0.3 -1,-0.2 0.885 103.8 60.9 -59.7 -39.8 22.8 17.3 120.2 318 391 A e H 3< S+ 0 0 0 -4,-2.4 -1,-0.3 1,-0.2 -2,-0.2 0.694 103.0 52.9 -59.8 -20.6 25.3 19.5 118.2 319 392 A S H << S+ 0 0 55 -3,-1.5 -1,-0.2 -4,-0.7 -2,-0.2 0.604 78.6 107.3 -88.5 -13.2 25.9 21.6 121.4 320 393 A K S << S- 0 0 64 -3,-1.2 5,-0.1 -4,-0.7 -69,-0.0 -0.494 81.7-111.8 -67.5 127.0 26.7 18.8 123.7 321 394 A P > - 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0 0 8 -69,-2.1 4,-1.9 -2,-0.4 3,-0.6 0.194 50.2 -27.9-115.2-136.1 15.5 35.2 26.1 861 132 C A H 3> S+ 0 0 2 1,-0.3 4,-3.1 2,-0.2 5,-0.2 0.773 123.2 61.2 -63.2 -33.8 14.0 32.2 24.3 862 133 C G H 3> S+ 0 0 7 1,-0.2 4,-1.9 2,-0.2 -1,-0.3 0.951 111.9 40.0 -56.1 -49.6 10.8 31.8 26.2 863 134 C M H <> S+ 0 0 1 -3,-0.6 4,-3.0 -72,-0.4 5,-0.3 0.847 108.4 60.9 -72.6 -33.3 9.7 35.2 25.2 864 135 C R H X S+ 0 0 9 -4,-1.9 4,-2.2 1,-0.2 -2,-0.2 0.975 108.2 46.0 -53.2 -52.7 11.0 34.7 21.7 865 136 C L H X S+ 0 0 9 -4,-3.1 4,-1.6 2,-0.2 -2,-0.2 0.889 111.9 50.2 -54.8 -41.3 8.6 31.8 21.4 866 137 C L H X S+ 0 0 14 -4,-1.9 4,-3.0 2,-0.2 8,-0.2 0.921 109.8 50.7 -66.2 -41.6 5.7 33.9 22.9 867 138 C R H < S+ 0 0 57 -4,-3.0 4,-0.2 1,-0.2 -1,-0.2 0.879 106.6 55.3 -58.4 -43.0 6.4 36.7 20.4 868 139 C M H < S+ 0 0 14 -4,-2.2 -1,-0.2 -5,-0.3 3,-0.2 0.876 113.7 40.9 -55.8 -41.8 6.3 34.2 17.7 869 140 C E H < S- 0 0 91 -4,-1.6 2,-0.2 1,-0.2 -2,-0.2 0.898 138.3 -0.2 -73.6 -46.1 2.8 33.1 18.8 870 141 C S X - 0 0 37 -4,-3.0 4,-2.2 -5,-0.1 -1,-0.2 -0.734 49.2-167.4-154.7 100.7 1.5 36.6 19.5 871 142 C K H > S+ 0 0 81 -3,-0.2 4,-2.3 -4,-0.2 5,-0.2 0.862 98.0 55.8 -35.5 -47.7 3.4 39.8 19.1 872 143 C Q H > S+ 0 0 136 1,-0.2 4,-2.4 2,-0.2 -1,-0.2 0.945 105.8 48.4 -62.8 -51.1 0.6 41.4 21.1 873 144 C S H > S+ 0 0 22 2,-0.2 4,-2.9 1,-0.2 -1,-0.2 0.889 110.9 49.9 -54.7 -46.3 0.9 39.1 24.1 874 145 C A H X S+ 0 0 0 -4,-2.2 4,-3.3 -8,-0.2 5,-0.2 0.941 111.1 49.4 -64.8 -44.4 4.7 39.6 24.3 875 146 C D H X S+ 0 0 82 -4,-2.3 4,-2.6 2,-0.2 -1,-0.2 0.888 111.1 50.0 -57.6 -42.3 4.3 43.4 24.2 876 147 C E H X S+ 0 0 87 -4,-2.4 4,-2.8 2,-0.2 -2,-0.2 0.939 112.4 47.5 -63.7 -46.5 1.6 43.2 26.9 877 148 C V H X S+ 0 0 0 -4,-2.9 4,-2.7 1,-0.2 5,-0.2 0.966 113.2 47.1 -58.2 -54.7 3.9 41.0 29.1 878 149 C L H X S+ 0 0 23 -4,-3.3 4,-2.0 1,-0.2 -1,-0.2 0.859 113.3 50.1 -55.7 -37.9 6.9 43.4 28.5 879 150 C A H X S+ 0 0 42 -4,-2.6 4,-2.9 -5,-0.2 5,-0.2 0.919 110.2 48.7 -66.8 -44.1 4.6 46.4 29.3 880 151 C A H X S+ 0 0 9 -4,-2.8 4,-2.1 2,-0.2 -2,-0.2 0.932 112.4 48.7 -61.9 -46.0 3.3 44.8 32.5 881 152 C V H X S+ 0 0 0 -4,-2.7 4,-2.6 -5,-0.2 5,-0.2 0.918 112.2 51.4 -51.6 -47.0 6.9 44.0 33.6 882 153 C S H X S+ 0 0 17 -4,-2.0 4,-3.1 -5,-0.2 -2,-0.2 0.930 108.2 48.1 -60.8 -52.2 7.8 47.6 32.7 883 154 C R H X S+ 0 0 153 -4,-2.9 4,-1.0 1,-0.2 -1,-0.2 0.889 114.0 49.7 -55.4 -41.9 5.1 49.2 34.8 884 155 C S H < S+ 0 0 10 -4,-2.1 3,-0.5 -5,-0.2 4,-0.4 0.944 116.0 39.1 -66.7 -49.4 6.0 47.0 37.7 885 156 C L H >< S+ 0 0 6 -4,-2.6 3,-1.7 1,-0.2 5,-0.4 0.893 108.7 62.9 -68.5 -38.4 9.8 47.7 37.6 886 157 C K H 3< S+ 0 0 122 -4,-3.1 -1,-0.2 1,-0.3 -2,-0.2 0.819 96.1 62.2 -53.7 -32.0 9.2 51.4 36.8 887 158 C S T 3< S+ 0 0 90 -4,-1.0 -1,-0.3 -3,-0.5 -2,-0.2 0.652 86.4 85.4 -77.5 -16.3 7.5 51.7 40.2 888 159 C Y S < S- 0 0 49 -3,-1.7 2,-0.3 -4,-0.4 4,-0.2 -0.311 96.4-102.7 -76.5 165.6 10.6 50.8 42.3 889 160 C P S S+ 0 0 46 0, 0.0 -36,-0.2 0, 0.0 2,-0.2 0.051 85.4 105.9 -88.6 39.8 13.0 53.6 43.1 890 161 C F S S- 0 0 18 -5,-0.4 2,-1.4 -2,-0.3 -39,-0.2 -0.601 83.9 -94.0-105.7 170.9 15.6 52.6 40.5 891 162 C D E -e 854 0L 67 -38,-2.3 -36,-2.0 -41,-0.5 2,-0.2 -0.674 45.2-144.1 -83.6 90.4 16.7 54.0 37.2 892 163 C F E +e 855 0L 51 -2,-1.4 -36,-0.1 -38,-0.2 3,-0.1 -0.333 24.9 175.5 -61.4 124.6 14.5 52.0 34.9 893 164 C Q E - 0 0 82 -38,-3.0 -37,-0.2 1,-0.3 -1,-0.1 0.414 48.3 -75.4-118.9 6.3 16.5 51.2 31.7 894 165 C G E - 0 0 24 -39,-0.4 -37,-2.6 -12,-0.1 2,-0.4 -0.246 24.8-121.2 119.8 152.2 14.1 49.0 29.7 895 166 C A E +e 857 0L 19 -39,-0.2 2,-0.3 -2,-0.1 -37,-0.2 -0.995 45.5 150.4-125.8 122.5 12.7 45.5 29.3 896 167 C K E -e 858 0L 90 -39,-2.4 -37,-3.0 -2,-0.4 2,-0.6 -0.964 50.3-105.8-148.6 163.8 13.3 43.8 26.0 897 168 C I E -e 859 0L 27 -2,-0.3 2,-0.2 -39,-0.2 -37,-0.2 -0.851 40.4-145.3 -88.6 120.0 13.8 40.4 24.3 898 169 C I - 0 0 0 -39,-2.4 -34,-0.1 -2,-0.6 -40,-0.0 -0.635 19.5-108.4 -89.9 148.8 17.5 40.1 23.5 899 170 C T > - 0 0 72 -2,-0.2 4,-2.0 1,-0.1 5,-0.1 -0.212 25.2-112.5 -66.9 162.4 18.6 38.3 20.3 900 171 C G H > S+ 0 0 12 1,-0.2 4,-2.2 2,-0.2 5,-0.2 0.825 119.9 53.9 -65.1 -28.0 20.2 34.8 20.5 901 172 C Q H > S+ 0 0 67 2,-0.2 4,-2.8 1,-0.2 5,-0.3 0.934 106.6 48.6 -78.9 -39.3 23.3 36.4 19.2 902 173 C E H > S+ 0 0 47 1,-0.2 4,-2.2 2,-0.2 -1,-0.2 0.911 111.8 52.4 -55.8 -40.0 23.4 39.0 22.0 903 174 C E H X S+ 0 0 11 -4,-2.0 4,-1.2 2,-0.2 -2,-0.2 0.877 114.7 39.6 -72.5 -38.6 22.8 36.2 24.4 904 175 C G H X S+ 0 0 3 -4,-2.2 4,-2.3 2,-0.2 -1,-0.2 0.908 115.3 51.0 -74.6 -45.1 25.8 34.1 23.1 905 176 C A H X S+ 0 0 10 -4,-2.8 4,-3.4 1,-0.2 -2,-0.2 0.933 112.8 48.6 -50.7 -43.5 28.1 37.1 22.6 906 177 C Y H X S+ 0 0 21 -4,-2.2 4,-2.5 -5,-0.3 261,-0.5 0.756 108.5 49.0 -83.0 -31.9 27.4 38.2 26.2 907 178 C G H X S+ 0 0 1 -4,-1.2 4,-2.8 2,-0.2 5,-0.3 0.904 112.9 51.6 -65.0 -40.7 27.9 34.9 27.9 908 179 C W H X S+ 0 0 0 -4,-2.3 4,-1.8 1,-0.2 -2,-0.3 0.973 113.3 43.8 -63.7 -49.8 31.2 34.7 26.0 909 180 C I H X S+ 0 0 10 -4,-3.4 4,-2.7 2,-0.2 -1,-0.2 0.910 110.0 56.8 -53.0 -49.5 32.1 38.1 27.2 910 181 C T H X S+ 0 0 0 -4,-2.5 4,-2.6 1,-0.2 5,-0.2 0.963 111.5 39.9 -52.7 -56.2 31.0 37.4 30.8 911 182 C I H X S+ 0 0 0 -4,-2.8 4,-1.9 1,-0.2 6,-0.3 0.821 113.7 52.5 -70.7 -25.9 33.2 34.4 31.3 912 183 C N H <>S+ 0 0 0 -4,-1.8 5,-1.8 -5,-0.3 6,-0.4 0.902 111.6 49.1 -76.3 -32.1 36.2 35.9 29.5 913 184 C Y H ><5S+ 0 0 34 -4,-2.7 3,-2.3 -5,-0.2 -2,-0.2 0.978 111.6 47.0 -61.9 -61.6 35.9 38.9 31.7 914 185 C L H 3<5S+ 0 0 22 -4,-2.6 -1,-0.2 1,-0.3 -2,-0.2 0.724 110.1 54.2 -59.4 -27.0 35.6 36.9 34.9 915 186 C L T 3<5S- 0 0 52 -4,-1.9 -1,-0.3 -5,-0.2 -2,-0.2 0.179 111.6-118.3 -89.5 16.7 38.6 34.7 33.9 916 187 C G T X 5 + 0 0 53 -3,-2.3 3,-1.6 1,-0.1 -3,-0.2 0.538 68.2 144.1 67.8 7.3 40.9 37.8 33.3 917 188 C R T 3 < + 0 0 89 -5,-1.8 -4,-0.2 -6,-0.3 -1,-0.1 0.540 54.5 56.6 -67.2 -6.3 41.1 36.7 29.8 918 189 C F T 3 0 0 19 -6,-0.4 -1,-0.3 -5,-0.2 -5,-0.1 0.702 360.0 360.0 -95.8 -16.8 41.2 40.0 28.1 919 190 C K < 0 0 137 -3,-1.6 0, 0.0 -6,-0.1 0, 0.0 0.014 360.0 360.0 -95.3 360.0 44.2 41.7 29.7 920 ! 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 0.0 921 205 C G 0 0 132 0, 0.0 2,-0.3 0, 0.0 -4,-0.0 0.000 360.0 360.0 360.0-158.2 46.6 35.3 25.0 922 206 C S - 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0 0 46 1,-0.1 4,-2.7 -2,-0.1 -1,-0.2 -0.275 48.2-116.0 -70.3 156.7 3.1 32.5 -16.4 1495 380 D Q H > S+ 0 0 65 2,-0.2 4,-2.6 1,-0.2 5,-0.2 0.843 114.9 57.0 -55.4 -42.4 5.6 29.9 -15.0 1496 381 D E H > S+ 0 0 77 2,-0.2 4,-2.5 1,-0.2 -1,-0.2 0.969 110.8 45.4 -57.5 -49.0 4.2 27.1 -17.3 1497 382 D K H > S+ 0 0 124 1,-0.2 4,-3.3 2,-0.2 5,-0.3 0.968 112.3 48.9 -57.9 -59.0 5.0 29.4 -20.3 1498 383 D M H X S+ 0 0 4 -4,-2.7 4,-2.2 1,-0.2 -1,-0.2 0.869 111.1 50.9 -53.7 -38.8 8.4 30.4 -19.2 1499 384 D T H X S+ 0 0 32 -4,-2.6 4,-2.6 2,-0.2 -1,-0.2 0.934 113.1 45.2 -63.9 -45.2 9.3 26.7 -18.5 1500 385 D E H X S+ 0 0 54 -4,-2.5 4,-2.9 -5,-0.2 -2,-0.2 0.958 112.5 51.5 -61.8 -49.0 8.1 25.8 -22.0 1501 386 D I H X S+ 0 0 31 -4,-3.3 4,-2.8 1,-0.2 -2,-0.2 0.899 114.5 44.1 -52.3 -41.7 9.9 28.8 -23.6 1502 387 D T H X S+ 0 0 3 -4,-2.2 4,-3.0 -5,-0.3 -1,-0.2 0.860 109.7 54.2 -74.0 -38.4 13.1 27.6 -21.7 1503 388 D K H X S+ 0 0 77 -4,-2.6 4,-1.2 2,-0.2 -67,-0.2 0.971 112.3 46.6 -58.0 -49.2 12.6 24.0 -22.6 1504 389 D N H >X S+ 0 0 113 -4,-2.9 3,-1.1 1,-0.2 4,-0.5 0.954 112.6 48.1 -55.8 -61.6 12.4 25.1 -26.3 1505 390 D F H >< S+ 0 0 3 -4,-2.8 3,-2.0 1,-0.2 -1,-0.2 0.900 104.6 59.7 -44.9 -52.2 15.5 27.4 -26.0 1506 391 D t H 3< S+ 0 0 0 -4,-3.0 -1,-0.2 1,-0.3 -2,-0.2 0.765 107.1 46.9 -55.7 -29.9 17.7 24.7 -24.3 1507 392 D S H << S+ 0 0 60 -4,-1.2 -1,-0.3 -3,-1.1 -2,-0.2 0.463 83.3 109.8 -89.3 -3.5 17.2 22.3 -27.3 1508 393 D K S << S- 0 0 69 -3,-2.0 5,-0.1 -4,-0.5 -74,-0.1 -0.598 81.5-108.2 -71.9 126.7 18.0 24.9 -30.0 1509 394 D P >> - 0 0 70 0, 0.0 4,-1.9 0, 0.0 3,-0.6 -0.209 26.0-114.6 -56.3 151.1 21.4 24.0 -31.5 1510 395 D W H 3> S+ 0 0 32 -111,-2.5 4,-2.6 1,-0.3 5,-0.3 0.880 116.5 52.7 -55.1 -44.5 24.2 26.4 -30.5 1511 396 D E H 3> S+ 0 0 134 1,-0.2 4,-1.6 2,-0.2 -1,-0.3 0.850 109.0 51.7 -58.8 -37.7 24.7 27.7 -34.1 1512 397 D E H <> S+ 0 0 92 -3,-0.6 4,-1.8 2,-0.2 -1,-0.2 0.886 110.3 49.0 -63.2 -41.7 20.9 28.4 -34.2 1513 398 D V H X S+ 0 0 0 -4,-1.9 4,-2.2 2,-0.2 3,-0.3 0.959 110.8 47.5 -69.7 -51.4 21.1 30.4 -31.0 1514 399 D K H < S+ 0 0 86 -4,-2.6 -1,-0.2 1,-0.2 -2,-0.2 0.867 115.8 47.6 -53.0 -40.3 24.1 32.5 -32.0 1515 400 D A H < S+ 0 0 73 -4,-1.6 -1,-0.2 -5,-0.3 -2,-0.2 0.792 111.2 49.4 -78.2 -24.6 22.4 33.2 -35.2 1516 401 D S H < S+ 0 0 47 -4,-1.8 -2,-0.2 -3,-0.3 -1,-0.2 0.799 120.9 33.5 -85.7 -27.1 19.0 34.1 -33.7 1517 402 D Y S >< S+ 0 0 52 -4,-2.2 3,-1.5 -5,-0.2 -1,-0.3 -0.608 70.8 160.9-122.6 67.7 20.4 36.5 -31.1 1518 403 D P T 3 + 0 0 101 0, 0.0 -1,-0.1 0, 0.0 4,-0.1 0.667 70.0 54.5 -71.0 -13.4 23.3 38.0 -33.0 1519 404 D T T 3 S+ 0 0 131 -3,-0.1 2,-0.4 2,-0.1 -5,-0.0 0.352 82.3 101.3-103.4 9.1 23.6 41.1 -30.8 1520 405 D V S < S- 0 0 36 -3,-1.5 -3,-0.1 -6,-0.2 0, 0.0 -0.783 86.3-106.5 -88.5 132.3 24.0 39.3 -27.5 1521 406 D K >> - 0 0 126 -2,-0.4 4,-2.0 1,-0.2 3,-1.3 -0.344 28.3-129.8 -53.2 132.0 27.5 39.0 -26.1 1522 407 D E H 3> S+ 0 0 62 1,-0.3 4,-2.1 2,-0.2 5,-0.2 0.834 106.4 64.7 -63.0 -23.2 28.5 35.3 -26.7 1523 408 D K H 34 S+ 0 0 133 2,-0.2 4,-0.3 1,-0.1 -1,-0.3 0.841 109.8 35.0 -65.8 -34.2 29.6 35.2 -23.0 1524 409 D Y H X4 S+ 0 0 80 -3,-1.3 3,-1.6 2,-0.1 4,-0.5 0.936 116.3 52.9 -80.8 -53.2 26.0 35.8 -21.8 1525 410 D L H >< S+ 0 0 3 -4,-2.0 3,-1.7 1,-0.3 4,-0.4 0.867 100.4 61.2 -52.9 -44.8 24.1 33.9 -24.4 1526 411 D S T 3< S+ 0 0 11 -4,-2.1 4,-0.3 1,-0.3 -1,-0.3 0.813 109.6 44.6 -50.0 -33.2 26.2 30.7 -23.9 1527 412 D E T <> S+ 0 0 35 -3,-1.6 4,-3.3 -4,-0.3 5,-0.3 0.461 85.1 95.9 -87.7 -8.1 24.8 30.7 -20.2 1528 413 D Y H <> S+ 0 0 25 -3,-1.7 4,-2.8 -4,-0.5 5,-0.3 0.837 81.5 49.5 -68.5 -33.4 21.1 31.4 -20.9 1529 414 D t H > S+ 0 0 0 -4,-0.4 4,-2.0 -3,-0.2 5,-0.3 0.975 118.9 41.9 -64.2 -50.9 19.7 27.9 -20.9 1530 415 D F H > S+ 0 0 2 -134,-0.6 4,-2.6 -4,-0.3 -2,-0.2 0.921 118.5 44.2 -57.2 -48.4 21.6 27.2 -17.7 1531 416 D S H X S+ 0 0 1 -4,-3.3 4,-2.7 2,-0.2 5,-0.2 0.880 112.7 51.2 -66.4 -42.7 20.7 30.7 -16.1 1532 417 D G H X S+ 0 0 4 -4,-2.8 4,-2.0 -5,-0.3 -1,-0.2 0.930 114.7 43.1 -60.2 -42.9 17.1 30.6 -17.1 1533 418 D T H X S+ 0 0 0 -4,-2.0 4,-2.5 -5,-0.3 -2,-0.2 0.918 112.6 53.9 -73.7 -39.4 16.7 27.2 -15.7 1534 419 D Y H X S+ 0 0 1 -4,-2.6 4,-3.3 -5,-0.3 -2,-0.2 0.939 108.2 48.2 -56.8 -51.6 18.6 28.1 -12.6 1535 420 D I H X S+ 0 0 3 -4,-2.7 4,-3.2 1,-0.2 5,-0.3 0.878 110.5 53.3 -56.8 -43.2 16.4 31.2 -11.9 1536 421 D L H X S+ 0 0 4 -4,-2.0 4,-3.2 -5,-0.2 5,-0.3 0.949 112.6 42.9 -60.1 -45.4 13.3 29.1 -12.3 1537 422 D S H X>S+ 0 0 2 -4,-2.5 4,-2.2 2,-0.2 5,-1.8 0.968 115.3 48.0 -70.1 -44.2 14.5 26.5 -9.8 1538 423 D L H <>S+ 0 0 0 -4,-3.3 5,-2.9 1,-0.2 6,-0.3 0.929 117.5 42.3 -60.7 -47.1 15.7 29.0 -7.4 1539 424 D L H <5S+ 0 0 0 -4,-3.2 6,-2.5 3,-0.2 -1,-0.2 0.899 123.8 36.9 -65.9 -39.7 12.5 31.0 -7.6 1540 425 D L H <5S+ 0 0 7 -4,-3.2 6,-0.6 -5,-0.3 4,-0.2 0.988 133.7 14.7 -80.6 -56.8 10.3 27.9 -7.6 1541 426 D Q T <5S+ 0 0 64 -4,-2.2 -3,-0.2 -5,-0.3 -2,-0.1 0.859 131.6 46.4 -88.4 -36.9 11.7 25.3 -5.3 1542 427 D G T + 0 0 1 -6,-2.5 5,-1.0 4,-0.1 -5,-0.2 0.236 33.7 148.4 -74.1 22.7 7.1 31.1 -5.5 1546 431 D T T > 5 - 0 0 73 -6,-0.6 3,-1.5 3,-0.2 4,-0.2 -0.030 55.6 -15.8 -63.1 161.7 5.4 28.0 -6.8 1547 432 D G G > 5S+ 0 0 51 1,-0.3 3,-1.2 2,-0.1 -52,-0.2 -0.224 137.4 4.0 41.9-121.2 1.9 27.9 -8.3 1548 433 D T G > 5S+ 0 0 124 1,-0.3 3,-1.5 2,-0.1 -1,-0.3 0.779 116.5 73.1 -61.4 -41.3 0.2 31.1 -7.4 1549 434 D S G X 5S+ 0 0 37 -3,-1.5 3,-2.3 1,-0.3 -1,-0.3 0.778 78.3 86.4 -50.4 -29.9 3.0 33.1 -5.7 1550 435 D W G X S-A 1562 0U 21 3,-2.6 3,-1.6 -2,-0.4 -245,-0.1 -0.989 81.7 -5.4-127.8 141.1 12.9 52.4 -11.0 1560 445 D K T 3 S- 0 0 146 -2,-0.4 -1,-0.2 1,-0.3 3,-0.1 0.923 133.6 -51.7 39.7 64.9 12.5 56.2 -11.5 1561 446 D D T 3 S+ 0 0 90 1,-0.1 2,-0.4 -3,-0.1 -1,-0.3 0.714 118.9 114.8 40.7 34.3 15.7 56.4 -13.7 1562 447 D S E < S-A 1559 0U 1 -3,-1.6 -3,-2.6 -355,-0.1 2,-0.2 -0.987 70.5-117.1-134.6 129.2 17.6 54.5 -10.8 1563 448 D N E -A 1558 0U 27 -2,-0.4 -5,-0.3 -5,-0.3 5,-0.3 -0.389 27.2-130.2 -59.3 119.6 19.2 51.1 -10.7 1564 449 D A + 0 0 2 -7,-3.2 -89,-0.4 -2,-0.2 2,-0.3 -0.572 64.1 104.9 -64.1 138.6 17.6 48.8 -8.2 1565 450 D G S S- 0 0 5 -259,-0.3 4,-0.3 -2,-0.2 -255,-0.2 -0.920 83.7 -84.5 167.2-179.6 20.4 47.3 -6.1 1566 451 D W S > S+ 0 0 3 -2,-0.3 4,-2.1 2,-0.1 5,-0.2 0.515 101.6 85.9 -91.6 -5.8 21.8 47.9 -2.6 1567 452 D T H > S+ 0 0 1 1,-0.2 4,-2.8 2,-0.2 5,-0.2 0.940 87.8 50.3 -66.1 -44.2 24.0 50.9 -3.3 1568 453 D L H > S+ 0 0 2 -5,-0.3 4,-3.3 2,-0.2 -1,-0.2 0.911 110.8 51.6 -51.4 -43.3 21.4 53.6 -2.9 1569 454 D G H > S+ 0 0 0 -4,-0.3 4,-2.4 -264,-0.3 -2,-0.2 0.980 111.5 46.0 -60.6 -58.1 20.3 52.1 0.4 1570 455 D Y H X S+ 0 0 6 -4,-2.1 4,-2.7 1,-0.2 5,-0.2 0.901 113.0 50.1 -48.7 -46.5 23.8 52.1 1.7 1571 456 D M H X S+ 0 0 1 -4,-2.8 4,-1.7 -5,-0.2 -1,-0.2 0.956 107.8 53.5 -66.0 -43.1 24.3 55.7 0.5 1572 457 D L H <>S+ 0 0 10 -4,-3.3 5,-1.7 -5,-0.2 -1,-0.2 0.925 114.8 42.7 -51.6 -47.8 21.1 56.9 2.2 1573 458 D N H ><5S+ 0 0 61 -4,-2.4 3,-3.6 3,-0.2 -2,-0.2 0.973 108.8 53.3 -63.0 -63.1 22.2 55.4 5.4 1574 459 D L H 3<5S+ 0 0 52 -4,-2.7 -1,-0.2 1,-0.3 -2,-0.2 0.714 113.1 47.2 -48.0 -27.1 25.9 56.5 5.4 1575 460 D T T 3<5S- 0 0 39 -4,-1.7 -1,-0.3 -5,-0.2 -2,-0.2 0.134 118.0-118.5-100.8 17.5 24.7 60.0 4.8 1576 461 D N T < 5 + 0 0 142 -3,-3.6 2,-0.3 1,-0.2 -3,-0.2 0.915 64.6 138.0 44.3 68.2 22.1 59.7 7.6 1577 462 D M < 0 0 79 -5,-1.7 -1,-0.2 0, 0.0 -2,-0.1 -0.947 360.0 360.0-124.8 123.7 18.8 60.1 6.0 1578 463 D I 0 0 86 -2,-0.3 -222,-0.4 -5,-0.0 -221,-0.1 -0.956 360.0 360.0 129.9 360.0 16.5 57.4 7.6