==== 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 OXIDOREDUCTASE 06-SEP-96 1OJT . COMPND 2 MOLECULE: SURFACE PROTEIN; . SOURCE 2 ORGANISM_SCIENTIFIC: NEISSERIA MENINGITIDIS; . AUTHOR I.LI DE LA SIERRA,T.PRANGE,L.PERNOT . 482 1 1 1 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 22306.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 351 72.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 42 8.7 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 67 13.9 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 2 0.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 4 0.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 3 0.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-3), SAME NUMBER PER 100 RESIDUES . 1 0.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-2), SAME NUMBER PER 100 RESIDUES . 2 0.4 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 . 43 8.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 50 10.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 120 24.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 11 2.3 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 1 2 1 1 0 0 1 1 1 2 0 1 0 0 0 1 0 0 0 0 0 1 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 1 2 2 3 0 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 PARALLEL BRIDGES PER LADDER . 2 0 3 0 1 2 2 0 1 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 . 1 1 0 1 1 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 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 1 117 A G 0 0 140 0, 0.0 2,-0.1 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 112.9 130.8 52.5 37.4 2 118 A S - 0 0 125 2,-0.1 2,-0.3 144,-0.1 143,-0.0 -0.570 360.0 -11.8 164.6 -87.7 131.8 56.1 36.2 3 119 A A S S+ 0 0 13 -2,-0.1 143,-2.6 2,-0.0 2,-0.3 -0.821 80.2 124.3-150.0 99.5 128.7 58.4 35.7 4 120 A D E -a 146 0A 106 -2,-0.3 2,-0.3 141,-0.2 143,-0.3 -0.956 26.8-179.6-148.1 145.4 125.2 57.0 35.8 5 121 A A E -a 147 0A 20 141,-1.5 143,-4.3 -2,-0.3 2,-0.4 -0.963 16.7-140.4-155.0 144.6 122.3 58.1 38.1 6 122 A E E +a 148 0A 109 -2,-0.3 2,-0.3 141,-0.2 143,-0.2 -0.933 24.4 170.7-111.9 130.6 118.7 56.9 38.4 7 123 A Y E -a 149 0A 13 141,-3.0 143,-2.4 -2,-0.4 3,-0.2 -0.986 40.6-138.4-144.2 154.4 115.6 59.1 38.9 8 124 A D E S+ 0 0 39 23,-1.7 143,-4.3 1,-0.3 2,-0.4 0.942 101.5 13.5 -60.9 -58.3 111.8 59.0 39.0 9 125 A V E -ab 151 32A 0 22,-1.9 24,-1.8 141,-0.2 2,-0.5 -0.985 63.0-172.3-133.1 136.7 111.7 62.3 37.2 10 126 A V E -ab 152 33A 0 141,-1.5 143,-2.3 -2,-0.4 2,-0.7 -0.992 13.7-156.0-125.9 115.5 114.5 64.1 35.3 11 127 A V E -ab 153 34A 0 22,-3.5 24,-3.0 -2,-0.5 2,-1.1 -0.882 7.4-148.6-103.6 121.0 113.5 67.7 34.1 12 128 A L E S+ab 154 35A 9 141,-1.8 143,-2.2 -2,-0.7 24,-0.2 -0.717 73.9 27.4 -85.0 94.4 115.6 68.8 31.2 13 129 A G - 0 0 10 22,-2.5 22,-0.2 -2,-1.1 23,-0.2 -0.184 65.5-139.5 125.4 136.9 115.8 72.6 31.6 14 130 A G + 0 0 0 26,-0.2 28,-3.4 4,-0.1 29,-0.2 0.038 61.5 124.2-117.6 23.7 115.6 74.7 34.9 15 131 A G S > S- 0 0 9 140,-0.4 4,-3.3 27,-0.2 5,-0.4 0.207 88.0 -75.0 -63.3-169.8 113.5 77.5 33.3 16 132 A P H > S+ 0 0 21 0, 0.0 4,-1.0 0, 0.0 5,-0.2 0.918 137.1 47.3 -58.7 -42.0 110.1 78.6 34.7 17 133 A G H >> S+ 0 0 5 1,-0.2 4,-2.8 138,-0.2 3,-0.9 0.996 117.6 39.8 -57.3 -75.8 108.6 75.4 33.2 18 134 A G H 3> S+ 0 0 0 137,-0.4 4,-3.9 1,-0.3 -1,-0.2 0.727 113.6 46.9 -42.1 -51.2 111.3 73.0 34.5 19 135 A Y H 3X S+ 0 0 54 -4,-3.3 4,-2.7 2,-0.2 -1,-0.3 0.810 115.9 49.0 -75.4 -19.4 112.0 74.2 38.0 20 136 A S H X S+ 0 0 0 -4,-2.8 4,-2.5 1,-0.2 3,-0.7 0.954 117.8 49.1 -52.1 -56.2 107.7 70.9 37.2 22 138 A A H 3X S+ 0 0 0 -4,-3.9 4,-2.1 1,-0.3 -1,-0.2 0.872 113.5 42.7 -51.1 -51.9 110.8 69.8 39.2 23 139 A F H 3X S+ 0 0 11 -4,-2.7 4,-1.6 1,-0.2 -1,-0.3 0.757 114.9 53.0 -68.8 -23.9 109.8 71.3 42.6 24 140 A A H S+ 0 0 0 -4,-2.5 5,-2.3 2,-0.3 -2,-0.2 0.922 115.6 52.2 -52.9 -47.7 107.2 66.4 41.4 26 142 A A H ><5S+ 0 0 16 -4,-2.1 3,-2.3 -5,-0.4 -1,-0.2 0.940 104.9 55.4 -54.9 -47.7 109.7 66.8 44.2 27 143 A D H 3<5S+ 0 0 98 -4,-1.6 -1,-0.3 1,-0.3 -2,-0.3 0.856 99.7 62.5 -58.5 -33.5 106.8 68.0 46.3 28 144 A E T 3<5S- 0 0 72 -4,-1.9 -1,-0.3 1,-0.1 -2,-0.2 0.370 125.4-100.0 -72.2 5.5 105.0 64.8 45.4 29 145 A G T < 5S+ 0 0 68 -3,-2.3 -3,-0.2 1,-0.3 2,-0.2 0.599 78.8 144.2 85.8 1.8 107.8 62.7 47.2 30 146 A L < - 0 0 37 -5,-2.3 2,-0.8 -6,-0.2 -1,-0.3 -0.517 56.9-122.7 -78.5 149.7 109.4 61.9 43.8 31 147 A K + 0 0 103 -2,-0.2 -22,-1.9 -3,-0.1 -23,-1.7 -0.849 47.9 175.5 -91.7 111.4 113.2 61.6 43.4 32 148 A V E -b 9 0A 3 -2,-0.8 79,-2.0 77,-0.3 2,-0.4 -0.816 24.2-161.8-120.2 157.7 113.8 64.3 40.7 33 149 A A E -bc 10 111A 0 -24,-1.8 -22,-3.5 -2,-0.3 2,-0.5 -0.999 11.3-146.0-139.8 142.6 116.8 65.9 38.9 34 150 A I E -bc 11 112A 0 77,-3.3 79,-3.8 -2,-0.4 2,-0.7 -0.935 9.0-159.2-107.7 126.3 117.1 69.2 36.9 35 151 A V E +bc 12 113A 2 -24,-3.0 -22,-2.5 -2,-0.5 2,-0.4 -0.949 23.5 165.9-106.1 110.6 119.5 69.1 34.0 36 152 A E E - c 0 114A 10 77,-1.9 79,-0.8 -2,-0.7 80,-0.1 -1.000 33.3-149.6-127.3 122.0 120.4 72.7 33.3 37 153 A R S S+ 0 0 96 -2,-0.4 2,-0.2 77,-0.3 79,-0.2 0.526 84.3 54.5 -72.0 -7.5 123.4 73.6 31.1 38 154 A Y S S- 0 0 29 2,-0.2 77,-0.2 77,-0.2 -2,-0.1 -0.683 90.5-118.0-116.3-179.4 124.1 76.9 33.0 39 155 A K S S+ 0 0 87 -2,-0.2 2,-0.4 75,-0.1 -1,-0.1 0.628 90.1 74.4 -96.9 -10.4 124.6 77.2 36.7 40 156 A T - 0 0 26 61,-0.0 3,-0.4 62,-0.0 -2,-0.2 -0.813 69.5-145.8-100.7 136.8 121.6 79.4 37.5 41 157 A L S S+ 0 0 5 -2,-0.4 -26,-0.2 57,-0.3 61,-0.1 -0.443 71.8 76.4 -84.7 170.6 118.0 78.1 37.5 42 158 A G S > S- 0 0 2 -28,-3.4 4,-2.0 -27,-0.2 -27,-0.2 0.118 82.9-142.4 112.9 -20.2 115.1 80.4 36.4 43 159 A G H > - 0 0 2 -3,-0.4 4,-1.9 -28,-0.3 5,-0.4 -0.097 54.4 -29.3 60.0-159.6 116.0 79.9 32.7 44 160 A V H > S+ 0 0 45 1,-0.2 4,-3.5 3,-0.2 5,-0.5 0.967 135.8 60.5 -55.8 -54.8 115.6 82.7 30.2 45 161 A a H > S+ 0 0 22 1,-0.2 6,-1.3 4,-0.2 4,-0.7 0.884 114.7 30.4 -44.2 -57.5 112.8 84.3 32.1 46 162 A L H < S+ 0 0 9 -4,-2.0 -1,-0.2 4,-0.2 -2,-0.2 0.941 131.2 34.2 -71.5 -41.8 114.7 85.0 35.4 47 163 A N H < S+ 0 0 20 -4,-1.9 -3,-0.2 1,-0.1 -2,-0.2 0.809 135.8 6.6 -85.8 -44.8 118.2 85.5 33.8 48 164 A V H < S+ 0 0 19 -4,-3.5 -3,-0.2 -5,-0.4 -2,-0.1 -0.031 127.6 23.1-139.0 39.4 117.9 87.2 30.4 49 165 A G S X S+ 0 0 14 -4,-0.7 4,-2.5 -5,-0.5 5,-0.4 -0.151 104.6 28.7-155.0-112.1 114.2 88.1 30.2 50 166 A a H > S+ 0 0 42 1,-0.2 4,-2.8 3,-0.2 5,-0.2 0.896 121.3 38.1 -36.9 -71.3 111.1 88.7 32.3 51 167 A I H > S+ 0 0 51 -6,-1.3 4,-2.0 2,-0.2 5,-0.3 0.876 118.8 40.1 -59.5 -49.0 112.9 90.0 35.4 52 168 A P H > S+ 0 0 1 0, 0.0 4,-2.1 0, 0.0 5,-0.3 0.971 117.1 52.7 -68.0 -42.0 115.9 92.2 34.2 53 169 A S H X S+ 0 0 9 -4,-2.5 4,-2.7 1,-0.2 -2,-0.2 0.934 113.7 42.1 -56.5 -46.0 113.7 93.6 31.4 54 170 A K H X S+ 0 0 57 -4,-2.8 4,-1.3 -5,-0.4 -1,-0.2 0.776 110.7 54.6 -70.1 -29.3 110.9 94.6 33.9 55 171 A A H X S+ 0 0 10 -4,-2.0 4,-1.2 -3,-0.2 -1,-0.2 0.867 114.2 44.0 -66.6 -38.1 113.4 96.0 36.6 56 172 A L H >X S+ 0 0 6 -4,-2.1 4,-2.6 -5,-0.3 3,-0.5 0.940 110.6 53.5 -70.1 -49.7 114.8 98.2 33.9 57 173 A L H 3X S+ 0 0 13 -4,-2.7 4,-2.2 -5,-0.3 -1,-0.2 0.811 106.4 54.4 -61.0 -28.1 111.3 99.1 32.5 58 174 A H H 3X S+ 0 0 117 -4,-1.3 4,-1.7 2,-0.2 -1,-0.2 0.856 108.8 46.5 -77.1 -30.1 110.3 100.2 36.1 59 175 A N H < S+ 0 0 108 -4,-1.1 3,-0.8 -5,-0.2 4,-0.4 0.957 110.0 44.4 -62.6 -45.4 109.2 114.6 33.3 68 184 A H H >< S+ 0 0 119 -4,-1.7 3,-1.7 1,-0.2 4,-0.3 0.968 99.1 66.9 -64.6 -54.0 105.4 114.9 33.8 69 185 A L G ><>S+ 0 0 43 -4,-2.4 5,-2.7 1,-0.3 3,-0.5 0.487 82.0 78.5 -46.8 -8.5 105.3 116.2 37.4 70 186 A A G X 5S+ 0 0 35 -3,-0.8 3,-3.5 -4,-0.4 -1,-0.3 0.958 87.9 57.7 -61.9 -51.7 106.9 119.5 36.5 71 187 A A G < 5S+ 0 0 89 -3,-1.7 -1,-0.3 -4,-0.4 -2,-0.2 0.678 100.8 56.7 -56.7 -19.9 103.6 120.7 35.2 72 188 A N G < 5S- 0 0 127 -3,-0.5 -1,-0.3 -4,-0.3 -2,-0.2 0.152 129.1-102.3 -96.2 20.7 102.2 120.0 38.7 73 189 A G T < 5S+ 0 0 46 -3,-3.5 2,-0.6 1,-0.3 -3,-0.2 0.860 86.9 129.5 70.8 27.0 104.9 122.4 39.9 74 190 A I < - 0 0 84 -5,-2.7 2,-0.6 -6,-0.1 -1,-0.3 -0.981 46.2-160.7-113.2 111.7 107.2 119.4 41.1 75 191 A K + 0 0 155 -2,-0.6 -8,-0.1 -3,-0.1 -5,-0.0 -0.864 24.0 156.4-115.1 125.5 110.5 120.3 39.5 76 192 A Y - 0 0 153 -2,-0.6 2,-0.1 -10,-0.3 -6,-0.1 -0.947 32.2-130.4-129.4 151.7 113.6 118.2 38.8 77 193 A P - 0 0 111 0, 0.0 3,-0.1 0, 0.0 0, 0.0 -0.352 57.0 -63.7 -86.6 176.9 116.4 118.6 36.3 78 194 A E - 0 0 140 1,-0.1 2,-0.2 -2,-0.1 -15,-0.0 -0.169 67.7-107.9 -57.1 157.5 117.4 115.6 34.0 79 195 A P - 0 0 63 0, 0.0 2,-0.6 0, 0.0 -1,-0.1 -0.580 23.4-111.1 -84.9 158.9 118.7 112.9 36.3 80 196 A E - 0 0 212 -2,-0.2 2,-0.6 -3,-0.1 0, 0.0 -0.808 37.4-146.6 -85.4 128.7 122.4 111.9 36.5 81 197 A L - 0 0 81 -2,-0.6 2,-0.8 126,-0.1 -3,-0.0 -0.894 18.6-174.9 -94.3 111.9 122.4 108.4 34.9 82 198 A D > - 0 0 79 -2,-0.6 4,-2.3 1,-0.2 3,-0.2 -0.874 2.5-179.8-101.6 98.3 125.0 105.9 36.3 83 199 A I H > S+ 0 0 38 -2,-0.8 4,-2.4 2,-0.2 5,-0.4 0.786 80.3 62.8 -70.4 -22.9 124.7 102.8 34.0 84 200 A D H > S+ 0 0 96 1,-0.2 4,-1.8 2,-0.2 -1,-0.2 0.947 114.3 35.2 -61.1 -40.5 127.4 100.9 35.9 85 201 A M H > S+ 0 0 128 -3,-0.2 4,-1.6 2,-0.2 -2,-0.2 0.772 116.5 52.9 -79.9 -29.6 125.0 101.1 38.9 86 202 A L H >X S+ 0 0 28 -4,-2.3 4,-2.2 2,-0.2 3,-1.5 0.991 112.5 46.9 -60.2 -60.7 121.9 100.8 36.8 87 203 A R H 3X S+ 0 0 57 -4,-2.4 4,-2.8 1,-0.3 5,-0.2 0.885 112.4 48.2 -40.3 -52.0 123.4 97.6 35.3 88 204 A A H 3X S+ 0 0 58 -4,-1.8 4,-1.5 -5,-0.4 -1,-0.3 0.795 105.4 59.8 -70.0 -25.4 124.4 96.3 38.6 89 205 A Y H X S+ 0 0 20 -4,-2.2 4,-2.3 1,-0.2 3,-0.8 0.965 111.8 51.9 -58.8 -55.4 119.3 94.7 37.5 91 207 A D H 3X S+ 0 0 75 -4,-2.8 4,-2.7 1,-0.3 5,-0.3 0.906 108.7 56.7 -50.4 -32.1 122.1 92.1 38.1 92 208 A G H 3X S+ 0 0 33 -4,-1.5 4,-1.6 -5,-0.2 -1,-0.3 0.884 105.0 45.1 -70.7 -36.8 121.1 92.4 41.7 93 209 A V H S+ 0 0 2 -4,-2.5 5,-2.9 2,-0.2 -1,-0.2 0.897 110.7 51.5 -62.9 -45.1 116.3 73.1 45.0 106 222 A K H ><5S+ 0 0 171 -4,-2.6 3,-3.2 -5,-0.3 -2,-0.2 0.995 112.4 45.2 -53.7 -60.7 118.8 72.2 47.9 107 223 A S H 3<5S+ 0 0 93 -4,-2.4 -1,-0.2 1,-0.3 -2,-0.2 0.861 113.0 50.4 -52.3 -39.2 115.9 72.3 50.4 108 224 A R T 3<5S- 0 0 81 -4,-2.0 -1,-0.3 -5,-0.2 -2,-0.2 0.404 109.6-125.9 -82.7 4.9 113.7 70.3 48.1 109 225 A K T < 5 + 0 0 162 -3,-3.2 2,-0.3 1,-0.2 -77,-0.3 0.857 58.3 151.5 55.4 33.9 116.5 67.7 47.7 110 226 A V < - 0 0 8 -5,-2.9 2,-0.7 -6,-0.1 -77,-0.2 -0.792 45.8-126.7 -89.6 145.3 116.2 68.2 43.9 111 227 A D E -c 33 0A 79 -79,-2.0 -77,-3.3 -2,-0.3 2,-0.6 -0.786 14.0-156.2 -95.9 124.1 119.6 67.5 42.1 112 228 A V E -c 34 0A 62 -2,-0.7 2,-0.6 -79,-0.2 -77,-0.2 -0.819 10.8-167.0 -86.5 129.0 120.7 70.3 39.8 113 229 A I E -c 35 0A 18 -79,-3.8 -77,-1.9 -2,-0.6 2,-0.9 -0.981 12.7-145.7-107.7 117.4 123.1 68.5 37.2 114 230 A Q E +c 36 0A 44 -2,-0.6 16,-1.6 -79,-0.2 -77,-0.3 -0.816 56.3 95.1 -84.0 111.1 124.9 71.3 35.3 115 231 A G E S-D 129 0A 0 -2,-0.9 2,-0.4 -79,-0.8 14,-0.3 -0.916 81.8 -90.6 177.4 155.4 125.4 69.9 31.8 116 232 A D E -D 128 0A 58 12,-2.2 12,-2.1 -2,-0.3 2,-0.4 -0.658 47.5-145.8 -77.6 132.9 123.8 69.9 28.3 117 233 A G E +D 127 0A 5 -2,-0.4 2,-0.3 10,-0.3 10,-0.2 -0.842 20.6 178.3-102.6 142.8 121.3 66.8 28.4 118 234 A Q E -D 126 0A 43 8,-1.7 8,-4.7 -2,-0.4 2,-0.2 -0.986 35.7-104.4-139.5 138.7 120.8 64.8 25.2 119 235 A F E +D 125 0A 3 172,-2.4 6,-0.3 -2,-0.3 176,-0.2 -0.537 31.4 179.6 -70.6 130.8 118.5 61.7 24.9 120 236 A L E S- 0 0 52 4,-5.2 5,-0.2 1,-0.6 -1,-0.2 0.784 71.6 -30.8 -87.3 -51.2 120.4 58.3 24.8 121 237 A D E > S-D 124 0A 59 3,-1.3 3,-4.0 175,-0.0 -1,-0.6 -0.946 87.6 -68.0-161.6 162.6 117.3 56.1 24.6 122 238 A P T 3 S+ 0 0 53 0, 0.0 174,-0.1 0, 0.0 196,-0.1 0.420 135.7 30.7 -40.2 -7.9 113.7 56.5 25.9 123 239 A H T 3 S+ 0 0 84 1,-0.1 26,-1.7 25,-0.0 2,-0.4 0.256 110.3 78.9-138.4 11.3 114.9 56.1 29.6 124 240 A H E < -DE 121 148A 50 -3,-4.0 -4,-5.2 24,-0.2 -3,-1.3 -0.964 49.9-167.2-135.1 131.6 118.4 57.6 29.3 125 241 A L E -DE 119 147A 0 22,-3.2 22,-2.8 -2,-0.4 2,-0.8 -0.862 15.4-148.9-103.8 129.3 119.8 61.1 29.2 126 242 A E E -DE 118 146A 62 -8,-4.7 -8,-1.7 -2,-0.5 2,-0.8 -0.918 17.3-159.1 -95.7 114.6 123.4 61.5 28.2 127 243 A V E -DE 117 145A 0 18,-4.1 18,-2.2 -2,-0.8 2,-1.4 -0.827 8.7-156.8 -96.5 106.2 124.6 64.6 30.2 128 244 A S E -DE 116 144A 26 -12,-2.1 -12,-2.2 -2,-0.8 16,-0.2 -0.633 33.0-126.2 -77.5 96.6 127.7 66.3 28.7 129 245 A L E -D 115 0A 35 -2,-1.4 12,-1.5 14,-0.7 13,-0.7 0.133 29.9-157.3 -42.5 148.1 128.8 68.1 31.9 130 246 A T E - E 0 140A 15 -16,-1.6 2,-0.4 10,-0.3 -16,-0.1 -0.944 9.8-152.7-133.7 151.3 129.4 71.8 31.6 131 247 A A E + E 0 139A 49 8,-6.7 8,-5.0 -2,-0.3 2,-0.2 -0.980 42.1 86.0-137.8 148.0 131.3 74.6 33.3 132 248 A G E - E 0 138A 23 -2,-0.4 6,-0.2 6,-0.3 3,-0.1 -0.837 50.9-135.0 152.5 176.8 130.8 78.3 33.7 133 249 A D E S+ 0 0 124 4,-0.5 2,-0.5 -2,-0.2 5,-0.1 0.445 75.1 86.7-137.4 -12.3 128.9 80.6 36.1 134 250 A A E > S- E 0 137A 58 3,-0.8 3,-3.5 -95,-0.1 -1,-0.1 -0.860 86.3-107.9-100.4 123.0 127.2 83.2 33.9 135 251 A Y T 3 S+ 0 0 40 -2,-0.5 -2,-0.1 1,-0.3 -97,-0.0 -0.211 107.6 14.6 -50.2 133.0 123.8 82.4 32.3 136 252 A E T 3 S+ 0 0 86 -4,-0.0 2,-0.4 1,-0.0 -1,-0.3 0.239 112.4 83.2 81.6 -9.1 124.4 81.7 28.6 137 253 A Q E < + E 0 134A 124 -3,-3.5 -3,-0.8 2,-0.0 -4,-0.5 -0.733 55.5 134.1-125.5 81.9 128.2 81.3 29.0 138 254 A A E - E 0 132A 25 -2,-0.4 -6,-0.3 -6,-0.2 -100,-0.1 -0.913 37.1-154.3-124.6 145.9 128.7 77.7 30.1 139 255 A A E - E 0 131A 39 -8,-5.0 -8,-6.7 -2,-0.3 2,-0.3 -0.975 23.3-105.2-130.3 142.0 131.3 75.4 28.5 140 256 A P E - 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0 0 6 -3,-1.6 4,-2.4 1,-0.2 5,-0.2 -0.732 61.1-154.8 -87.1 118.6 88.1 107.9 35.7 396 512 A G H > S+ 0 0 43 -2,-0.7 4,-3.8 1,-0.2 -1,-0.2 0.930 96.7 48.6 -50.9 -48.1 88.9 110.3 38.6 397 513 A R H > S+ 0 0 101 61,-0.3 4,-2.3 2,-0.2 -1,-0.2 0.891 110.4 47.7 -62.1 -42.1 92.1 108.3 39.4 398 514 A A H 4>S+ 0 0 0 60,-0.2 5,-3.4 2,-0.2 4,-0.4 0.904 113.5 49.5 -66.2 -36.9 93.5 108.2 35.9 399 515 A I H ><5S+ 0 0 93 -4,-2.4 3,-1.7 -7,-0.3 -2,-0.2 0.997 113.7 45.9 -64.1 -55.0 92.8 111.9 35.5 400 516 A A H 3<5S+ 0 0 83 -4,-3.8 -2,-0.2 1,-0.3 -1,-0.2 0.797 118.4 42.5 -53.4 -32.9 94.6 112.4 38.9 401 517 A N T 3<5S- 0 0 73 -4,-2.3 -1,-0.3 -5,-0.2 -2,-0.2 0.349 114.1-118.9 -96.2 0.3 97.5 110.1 37.8 402 518 A G T < 5S+ 0 0 57 -3,-1.7 -3,-0.2 -4,-0.4 -4,-0.1 0.892 84.8 110.6 62.3 44.4 97.5 111.6 34.4 403 519 A C < + 0 0 4 -5,-3.4 -4,-0.2 -6,-0.1 -1,-0.1 -0.393 25.2 131.0-137.2 54.9 96.7 108.5 32.5 404 520 A D + 0 0 73 -6,-0.2 -11,-0.4 1,-0.2 -12,-0.1 0.271 59.7 78.1 -91.0 7.4 93.1 109.3 31.3 405 521 A K S S+ 0 0 70 -13,-0.2 -1,-0.2 -7,-0.1 2,-0.1 0.565 84.4 73.8 -85.6 -14.9 94.1 108.3 27.7 406 522 A P - 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0 0 27 -3,-1.8 -3,-0.2 -4,-0.3 -2,-0.1 0.967 48.7-179.7 55.1 46.9 82.2 82.1 33.7 444 560 A C < - 0 0 27 -5,-2.0 -25,-2.2 -6,-0.1 2,-0.3 -0.286 17.8-142.2 -75.3 166.8 80.9 85.5 35.2 445 561 A D B >> -T 418 0F 65 -27,-0.2 4,-1.8 1,-0.1 3,-1.4 -0.815 32.9 -97.0-123.0 169.7 78.4 87.7 33.4 446 562 A A H 3> S+ 0 0 11 -29,-0.7 4,-2.7 1,-0.3 5,-0.3 0.832 128.2 54.3 -53.8 -37.7 78.3 91.6 33.2 447 563 A A H 3> S+ 0 0 36 1,-0.2 4,-1.7 3,-0.2 -1,-0.3 0.803 107.2 53.8 -67.7 -27.9 75.8 91.6 36.1 448 564 A D H <4 S+ 0 0 80 -3,-1.4 -2,-0.2 2,-0.2 -1,-0.2 0.870 117.1 32.6 -65.6 -49.4 78.4 89.5 38.0 449 565 A I H >< S+ 0 0 6 -4,-1.8 3,-1.6 2,-0.1 -2,-0.2 0.950 118.8 54.4 -72.5 -52.8 81.4 91.8 37.6 450 566 A G H 3< S+ 0 0 8 -4,-2.7 4,-0.2 1,-0.3 -2,-0.2 0.864 105.9 50.3 -53.0 -45.6 79.2 95.1 37.7 451 567 A K T 3< S+ 0 0 171 -4,-1.7 2,-0.6 -5,-0.3 -1,-0.3 0.496 87.7 105.7 -78.8 6.5 77.4 94.3 41.0 452 568 A T S < S- 0 0 72 -3,-1.6 2,-1.5 1,-0.1 -3,-0.0 -0.761 78.3-131.3 -84.0 125.2 80.9 93.7 42.4 453 569 A I - 0 0 166 -2,-0.6 -2,-0.1 11,-0.0 -1,-0.1 -0.587 29.0-171.5 -77.7 92.9 81.7 96.7 44.6 454 570 A H - 0 0 27 -2,-1.5 2,-0.1 -4,-0.2 4,-0.0 -0.558 30.0-102.8 -79.1 147.1 85.2 97.6 43.3 455 571 A P - 0 0 93 0, 0.0 6,-0.6 0, 0.0 3,-0.2 -0.380 43.9-104.8 -75.7 150.4 86.9 100.4 45.4 456 572 A H S S+ 0 0 135 1,-0.3 2,-0.1 -2,-0.1 3,-0.1 -0.927 88.3 28.5-121.2 153.7 87.2 104.1 44.3 457 573 A P S S+ 0 0 65 0, 0.0 2,-0.3 0, 0.0 -1,-0.3 0.550 95.7 112.4 -89.0 130.0 89.0 106.1 43.3 458 574 A T S S- 0 0 29 -3,-0.2 -61,-0.3 -2,-0.1 -60,-0.2 -0.927 70.5-125.5-150.8 173.4 91.1 103.4 41.5 459 575 A L S > S+ 0 0 17 -2,-0.3 3,-2.7 2,-0.1 4,-0.3 0.822 107.8 68.4 -85.3 -38.5 92.1 102.2 38.1 460 576 A G T > S+ 0 0 23 1,-0.3 3,-2.5 2,-0.2 4,-0.4 0.877 86.9 66.0 -45.4 -47.3 90.9 98.7 39.2 461 577 A E T 3> S+ 0 0 14 -6,-0.6 4,-3.1 1,-0.3 -1,-0.3 0.641 78.4 79.8 -61.0 -10.7 87.2 99.8 39.3 462 578 A S H <> S+ 0 0 2 -3,-2.7 4,-2.5 2,-0.2 -1,-0.3 0.814 85.4 63.1 -68.3 -15.0 87.0 100.4 35.5 463 579 A I H <> S+ 0 0 2 -3,-2.5 4,-1.9 -4,-0.3 -1,-0.2 0.995 109.7 39.5 -64.3 -51.7 86.6 96.5 35.3 464 580 A G H > S+ 0 0 3 -4,-0.4 4,-2.4 1,-0.2 3,-0.4 0.961 117.2 49.2 -53.5 -57.1 83.3 97.0 37.3 465 581 A M H X S+ 0 0 25 -4,-3.1 4,-2.0 1,-0.3 -1,-0.2 0.830 107.1 54.1 -58.6 -32.0 82.4 100.2 35.3 466 582 A A H X S+ 0 0 0 -4,-2.5 4,-2.1 -5,-0.3 -1,-0.3 0.892 108.5 52.1 -66.7 -34.2 83.1 98.5 32.0 467 583 A A H X S+ 0 0 0 -4,-1.9 4,-2.5 -3,-0.4 3,-0.3 0.976 109.0 47.2 -63.7 -56.1 80.6 95.8 33.3 468 584 A E H X>S+ 0 0 41 -4,-2.4 5,-2.6 1,-0.3 4,-0.6 0.881 108.3 54.9 -51.7 -41.5 77.8 98.5 34.2 469 585 A V H ><5S+ 0 0 30 -4,-2.0 3,-1.8 -5,-0.3 -1,-0.3 0.963 107.9 50.5 -58.0 -39.7 78.4 100.0 30.7 470 586 A A H 3<5S+ 0 0 38 -4,-2.1 -2,-0.2 -3,-0.3 -1,-0.2 0.987 113.1 45.2 -58.7 -50.2 77.7 96.4 29.5 471 587 A L H 3<5S- 0 0 70 -4,-2.5 -1,-0.3 -25,-0.1 -2,-0.2 0.479 115.0-122.3 -66.3 -5.4 74.6 96.5 31.7 472 588 A G T <<5S+ 0 0 37 -3,-1.8 8,-0.5 -4,-0.6 -3,-0.2 0.706 85.4 112.2 65.6 18.8 73.8 100.1 30.3 473 589 A T < + 0 0 79 -5,-2.6 2,-0.7 -6,-0.1 -4,-0.2 0.192 28.6 129.1-108.1 11.7 73.9 101.2 34.0 474 590 A C > - 0 0 4 -6,-0.5 3,-0.6 1,-0.1 6,-0.1 -0.665 29.6-178.4 -80.4 117.9 77.1 103.4 34.2 475 591 A T T 3 S+ 0 0 138 -2,-0.7 -1,-0.1 1,-0.2 -2,-0.0 0.106 76.9 68.7 -97.1 19.2 76.2 106.7 35.9 476 592 A D T 3 S+ 0 0 96 2,-0.1 -1,-0.2 -11,-0.1 -2,-0.1 0.273 103.2 47.5-114.1 -1.5 79.8 108.0 35.5 477 593 A L S < S- 0 0 34 -3,-0.6 3,-0.1 1,-0.1 -87,-0.0 -0.926 108.5 -73.7-136.5 160.0 79.3 108.2 31.9 478 594 A P S S- 0 0 105 0, 0.0 -2,-0.1 0, 0.0 -4,-0.1 -0.088 72.4 -77.5 -47.8 150.1 76.6 109.7 29.6 479 595 A P - 0 0 78 0, 0.0 2,-0.4 0, 0.0 3,-0.2 -0.161 46.9-127.0 -55.7 150.2 73.4 107.4 29.6 480 596 A Q S S- 0 0 42 -8,-0.5 -3,-0.0 1,-0.3 0, 0.0 -0.899 79.9 -10.1-105.5 132.1 73.6 104.3 27.5 481 597 A K 0 0 218 -2,-0.4 -1,-0.3 1,-0.2 0, 0.0 0.934 360.0 360.0 50.1 81.0 70.8 103.5 24.8 482 598 A K 0 0 203 -3,-0.2 -1,-0.2 0, 0.0 -2,-0.0 0.331 360.0 360.0 -49.0 360.0 68.6 106.4 26.1