==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=5-JAN-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE 05-NOV-07 2VFP . COMPND 2 MOLECULE: P22 TAILSPIKE PROTEIN; . SOURCE 2 ORGANISM_SCIENTIFIC: ENTEROBACTERIA PHAGE P22; . AUTHOR M.BECKER,J.J.MUELLER,U.HEINEMANN,R.SECKLER . 556 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 26479.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 382 68.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 167 30.0 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 52 9.4 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 1 0.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 2 0.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 2 0.4 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 0.2 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 . 53 9.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 36 6.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 24 4.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), 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 . 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 0 2 1 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 5 4 15 3 2 5 2 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 . 2 3 0 0 0 3 2 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 . 2 0 2 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 1 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 1 111 A D > 0 0 164 0, 0.0 4,-1.0 0, 0.0 5,-0.1 0.000 360.0 360.0 360.0 -30.2 10.2 42.3 -50.4 2 112 A Q H > + 0 0 137 2,-0.2 4,-1.7 1,-0.1 3,-0.3 0.931 360.0 46.4 -65.8 -48.5 13.1 41.0 -52.4 3 113 A Y H > S+ 0 0 128 1,-0.2 4,-3.4 2,-0.2 5,-0.2 0.903 106.4 58.3 -63.3 -42.5 15.7 41.9 -49.8 4 114 A S H > S+ 0 0 49 1,-0.2 4,-2.3 2,-0.2 -1,-0.2 0.829 105.1 51.0 -59.5 -35.0 13.6 40.4 -47.0 5 115 A I H X S+ 0 0 77 -4,-1.0 4,-0.8 -3,-0.3 -1,-0.2 0.934 115.1 42.5 -63.5 -48.0 13.7 37.0 -48.7 6 116 A E H X S+ 0 0 78 -4,-1.7 4,-1.7 2,-0.2 3,-0.4 0.890 114.3 51.1 -64.4 -42.5 17.5 37.3 -49.0 7 117 A A H X S+ 0 0 12 -4,-3.4 4,-1.6 1,-0.2 3,-0.2 0.911 105.1 55.3 -66.4 -43.1 17.9 38.6 -45.5 8 118 A D H < S+ 0 0 102 -4,-2.3 -1,-0.2 1,-0.2 -2,-0.2 0.763 113.7 43.7 -61.2 -25.7 15.9 35.8 -43.9 9 119 A K H < S+ 0 0 176 -4,-0.8 -1,-0.2 -3,-0.4 -2,-0.2 0.774 116.6 42.1 -87.6 -29.9 18.2 33.3 -45.6 10 120 A K H < S+ 0 0 106 -4,-1.7 2,-0.3 -3,-0.2 -2,-0.2 0.522 97.8 77.2-104.1 -9.4 21.6 34.9 -44.9 11 121 A F S < S- 0 0 112 -4,-1.6 2,-0.2 -5,-0.1 0, 0.0 -0.823 77.7-114.1-108.8 146.2 21.5 36.1 -41.3 12 122 A K - 0 0 164 -2,-0.3 2,-0.5 1,-0.1 -2,-0.1 -0.538 33.4-123.1 -72.2 134.3 21.8 34.2 -38.0 13 123 A Y + 0 0 106 -2,-0.2 20,-2.1 -5,-0.1 2,-0.3 -0.702 45.2 147.2 -84.7 124.6 18.6 34.2 -35.9 14 124 A S E -a 33 0A 70 -2,-0.5 2,-0.3 18,-0.2 20,-0.2 -0.934 28.0-157.2-153.5 136.3 18.9 35.5 -32.4 15 125 A V E -a 34 0A 22 18,-1.8 20,-2.9 -2,-0.3 2,-0.4 -0.755 15.3-146.8-104.2 158.4 16.4 37.4 -30.1 16 126 A K E > -a 35 0A 84 -2,-0.3 3,-2.1 18,-0.2 20,-0.2 -0.978 18.6-127.8-134.9 141.3 17.6 39.5 -27.2 17 127 A L G > S+ 0 0 0 18,-2.5 3,-2.0 -2,-0.4 19,-0.1 0.742 101.8 73.5 -62.4 -26.2 16.0 40.2 -23.8 18 128 A S G 3 S+ 0 0 58 1,-0.3 -1,-0.3 17,-0.2 18,-0.1 0.660 93.8 56.7 -61.0 -17.3 16.2 44.0 -24.2 19 129 A D G < S+ 0 0 92 -3,-2.1 -1,-0.3 2,-0.0 -2,-0.2 0.417 104.4 59.2 -93.3 0.7 13.3 43.7 -26.8 20 130 A Y < - 0 0 61 -3,-2.0 3,-0.0 -4,-0.1 4,-0.0 -0.944 67.7-140.2-134.5 149.3 10.9 42.0 -24.4 21 131 A P S S+ 0 0 101 0, 0.0 2,-0.3 0, 0.0 -1,-0.1 0.742 89.7 29.9 -79.1 -24.6 9.2 42.7 -21.1 22 132 A T S > S- 0 0 50 1,-0.1 4,-1.7 18,-0.0 5,-0.1 -0.949 75.6-121.9-133.1 158.1 9.5 39.1 -19.7 23 133 A L H > S+ 0 0 1 -2,-0.3 4,-2.8 1,-0.2 5,-0.2 0.898 113.6 56.3 -64.8 -37.7 11.9 36.2 -20.2 24 134 A Q H > S+ 0 0 53 2,-0.2 4,-2.9 1,-0.2 -1,-0.2 0.907 103.5 54.4 -59.5 -39.7 9.0 34.0 -21.4 25 135 A D H > S+ 0 0 70 1,-0.2 4,-1.7 2,-0.2 -1,-0.2 0.927 111.7 44.4 -60.8 -41.6 8.2 36.5 -24.1 26 136 A A H X S+ 0 0 0 -4,-1.7 4,-1.6 2,-0.2 -2,-0.2 0.928 113.0 50.7 -67.3 -43.9 11.8 36.3 -25.3 27 137 A A H < S+ 0 0 0 -4,-2.8 -2,-0.2 1,-0.2 -1,-0.2 0.918 109.4 51.8 -60.2 -42.7 11.9 32.5 -25.0 28 138 A S H < S+ 0 0 75 -4,-2.9 -1,-0.2 1,-0.2 -2,-0.2 0.884 111.9 45.9 -61.0 -39.8 8.7 32.3 -27.1 29 139 A A H < S+ 0 0 45 -4,-1.7 -1,-0.2 -5,-0.2 -2,-0.2 0.749 92.2 105.2 -74.8 -25.1 10.1 34.5 -29.9 30 140 A A < + 0 0 0 -4,-1.6 4,-0.1 -3,-0.2 23,-0.1 -0.226 32.3 163.9 -66.2 146.8 13.5 32.6 -30.0 31 141 A V S S- 0 0 98 2,-0.5 23,-0.2 22,-0.0 -1,-0.1 0.587 79.4 -13.7-125.9 -37.7 14.3 30.2 -32.8 32 142 A D S S+ 0 0 43 1,-0.5 24,-2.6 24,-0.1 2,-0.2 0.470 124.4 31.4-134.8 -72.0 18.1 29.6 -32.7 33 143 A G E -ab 14 56A 8 -20,-2.1 -18,-1.8 22,-0.2 -1,-0.5 -0.602 51.9-170.4 -98.2 152.9 19.9 32.2 -30.4 34 144 A L E -ab 15 57A 2 22,-2.2 24,-2.8 -20,-0.2 2,-0.5 -0.943 10.1-160.8-140.2 121.3 18.8 34.0 -27.3 35 145 A L E -ab 16 58A 37 -20,-2.9 -18,-2.5 -2,-0.3 2,-1.0 -0.891 11.6-151.5-106.8 124.6 21.0 36.8 -25.9 36 146 A I E + b 0 59A 1 22,-2.7 24,-2.5 -2,-0.5 -20,-0.1 -0.820 33.6 156.9 -91.6 95.7 20.6 38.0 -22.3 37 147 A D + 0 0 56 -2,-1.0 2,-0.3 22,-0.1 -1,-0.1 0.185 55.2 47.2-113.0 13.7 21.7 41.6 -22.8 38 148 A R S S- 0 0 78 24,-0.1 23,-0.2 -3,-0.0 22,-0.1 -0.980 92.9 -96.2-146.7 147.4 20.0 43.3 -19.8 39 149 A D - 0 0 80 -2,-0.3 2,-0.5 21,-0.1 24,-0.2 -0.357 41.2-153.1 -58.3 141.6 19.8 42.4 -16.2 40 150 A Y E -d 63 0B 14 22,-2.8 24,-2.8 -4,-0.1 2,-0.6 -0.968 8.3-151.0-128.7 116.9 16.6 40.5 -15.4 41 151 A N E -d 64 0B 110 -2,-0.5 2,-0.3 22,-0.2 24,-0.2 -0.786 23.3-171.9 -84.2 119.1 14.9 40.5 -12.1 42 152 A F - 0 0 13 22,-2.2 2,-0.3 -2,-0.6 24,-0.2 -0.818 19.9-126.1-108.7 154.9 13.0 37.2 -11.6 43 153 A Y > - 0 0 156 -2,-0.3 3,-2.7 22,-0.1 24,-0.1 -0.740 43.8 -87.7 -95.6 147.3 10.6 36.1 -9.0 44 154 A G T 3 S+ 0 0 46 -2,-0.3 25,-0.2 1,-0.3 23,-0.1 -0.280 117.3 18.5 -56.0 128.1 11.2 32.9 -7.1 45 155 A G T 3 S+ 0 0 34 23,-2.6 -1,-0.3 1,-0.3 24,-0.2 0.420 81.8 157.8 88.1 -3.3 9.6 30.0 -9.0 46 156 A E < - 0 0 14 -3,-2.7 24,-3.0 22,-0.5 2,-0.4 -0.403 28.0-155.0 -56.0 127.3 9.4 32.0 -12.3 47 157 A T E -c 70 0A 64 22,-0.2 2,-0.5 -2,-0.1 24,-0.2 -0.926 11.9-161.1-122.4 127.7 9.2 29.3 -15.0 48 158 A V E -c 71 0A 0 22,-3.0 24,-2.6 -2,-0.4 2,-0.6 -0.935 6.1-154.4-112.6 128.1 10.2 29.6 -18.6 49 159 A D E -c 72 0A 57 -2,-0.5 24,-0.2 22,-0.2 25,-0.1 -0.924 4.9-169.2-103.8 113.7 8.9 27.2 -21.3 50 160 A F > - 0 0 1 22,-2.4 3,-2.1 -2,-0.6 25,-0.2 0.252 35.9-123.6 -95.1 11.4 11.3 27.0 -24.2 51 161 A G T 3 - 0 0 54 1,-0.3 23,-0.1 21,-0.1 22,-0.1 0.661 58.9 -68.2 67.2 19.7 8.9 25.0 -26.5 52 162 A G T 3 S+ 0 0 47 21,-2.9 -1,-0.3 1,-0.2 22,-0.2 0.515 93.0 151.7 74.1 7.3 11.2 22.1 -27.1 53 163 A K < - 0 0 54 -3,-2.1 22,-2.8 20,-0.5 2,-1.1 -0.398 52.8-125.3 -75.7 145.0 13.5 24.4 -29.1 54 164 A V - 0 0 77 -23,-0.2 2,-0.3 20,-0.2 -1,-0.1 -0.778 45.4-177.1 -89.7 96.8 17.2 23.7 -29.4 55 165 A L - 0 0 0 -2,-1.1 24,-2.1 20,-0.2 2,-0.7 -0.762 33.0-148.7-109.1 144.7 18.5 27.1 -28.2 56 166 A T E -bd 33 79A 71 -24,-2.6 -22,-2.2 -2,-0.3 2,-0.6 -0.935 23.8-165.2-107.2 102.9 21.9 28.7 -27.8 57 167 A I E -bd 34 80A 2 22,-3.3 24,-3.1 -2,-0.7 2,-0.6 -0.845 4.5-169.8 -99.5 116.8 21.5 31.0 -24.9 58 168 A E E -bd 35 81A 100 -24,-2.8 -22,-2.7 -2,-0.6 2,-0.5 -0.935 8.5-154.8-112.7 116.4 24.3 33.5 -24.5 59 169 A C E +b 36 0A 12 22,-2.9 -22,-0.1 -2,-0.6 -24,-0.1 -0.832 30.0 156.8-103.1 127.9 24.4 35.5 -21.3 60 170 A K + 0 0 149 -24,-2.5 2,-0.3 -2,-0.5 -21,-0.1 -0.039 69.0 39.0-133.6 27.6 26.0 39.0 -21.0 61 171 A A S S- 0 0 18 -23,-0.2 23,-0.5 21,-0.1 2,-0.3 -0.916 88.1 -79.5-162.6-179.0 24.0 40.2 -18.0 62 172 A K - 0 0 69 -2,-0.3 -22,-2.8 21,-0.1 2,-0.6 -0.655 13.6-143.6-100.0 148.9 22.6 39.0 -14.6 63 173 A F E -de 40 85B 1 21,-2.8 23,-2.2 -2,-0.3 2,-0.5 -0.965 32.1-163.7 -99.0 118.8 19.6 37.0 -13.5 64 174 A I E +de 41 86B 29 -24,-2.8 -22,-2.2 -2,-0.6 2,-0.2 -0.904 31.8 95.5-117.1 124.0 18.7 38.7 -10.2 65 175 A G - 0 0 3 21,-2.7 2,-0.4 -2,-0.5 -22,-0.1 -0.793 63.5-108.6 168.1 144.3 16.5 37.2 -7.5 66 176 A D S S+ 0 0 46 -2,-0.2 84,-0.2 21,-0.2 -22,-0.2 -0.775 88.8 20.7 -80.5 145.5 16.2 35.1 -4.4 67 177 A G E S- e 0 150A 25 82,-3.0 84,-2.4 -2,-0.4 2,-0.4 -0.557 104.0 -28.0 91.9-163.1 14.9 31.6 -5.1 68 178 A N E - e 0 151A 36 -2,-0.2 -23,-2.6 82,-0.2 2,-0.6 -0.773 32.2-159.9-106.4 133.1 14.7 29.6 -8.3 69 179 A L E - e 0 152A 0 82,-2.8 84,-2.9 -2,-0.4 2,-0.6 -0.953 29.4-150.4-101.1 116.8 14.5 30.7 -12.0 70 180 A I E -ce 47 153A 11 -24,-3.0 -22,-3.0 -2,-0.6 2,-0.5 -0.828 13.5-165.6-108.4 117.9 13.2 27.5 -13.6 71 181 A F E +ce 48 154A 2 82,-3.2 84,-2.8 -2,-0.6 2,-0.3 -0.898 17.7 174.0-100.6 128.9 14.0 26.6 -17.2 72 182 A T E +ce 49 155A 17 -24,-2.6 -22,-2.4 -2,-0.5 -20,-0.2 -0.895 47.9 23.3-131.9 158.9 11.8 23.9 -18.8 73 183 A K + 0 0 125 82,-0.5 -21,-2.9 -2,-0.3 -20,-0.5 0.860 67.8 162.6 56.0 42.7 11.3 22.2 -22.2 74 184 A L - 0 0 10 -22,-0.2 84,-0.5 -23,-0.1 -1,-0.2 -0.771 39.4-114.7 -85.8 135.3 14.7 23.0 -23.7 75 185 A G > - 0 0 9 -22,-2.8 3,-1.9 -2,-0.4 -20,-0.2 -0.376 38.4 -86.4 -65.6 149.9 15.6 20.8 -26.7 76 186 A K T 3 S+ 0 0 146 1,-0.3 83,-0.2 -24,-0.1 84,-0.2 -0.358 118.0 33.5 -58.3 130.4 18.4 18.3 -26.6 77 187 A G T 3 S+ 0 0 55 82,-2.9 -1,-0.3 1,-0.3 83,-0.2 0.336 82.8 144.7 101.4 -4.5 21.6 20.1 -27.6 78 188 A S < - 0 0 1 -3,-1.9 83,-1.9 81,-0.3 2,-0.4 -0.339 30.6-161.8 -65.5 149.6 20.6 23.4 -26.0 79 189 A R E -df 56 161A 93 -24,-2.1 -22,-3.3 81,-0.2 2,-0.5 -0.993 13.2-163.3-139.0 138.2 23.5 25.4 -24.3 80 190 A I E -df 57 162A 0 81,-2.5 83,-2.9 -2,-0.4 2,-0.4 -0.985 19.0-172.9-124.8 114.7 23.4 28.2 -21.8 81 191 A A E +df 58 163A 12 -24,-3.1 -22,-2.9 -2,-0.5 83,-0.2 -0.912 56.7 5.3-117.7 137.9 26.7 30.2 -21.5 82 192 A G S S+ 0 0 29 81,-2.4 -1,-0.1 -2,-0.4 82,-0.1 0.518 73.9 172.2 79.9 11.2 27.9 32.9 -19.2 83 193 A V - 0 0 1 80,-0.4 83,-2.8 -26,-0.1 2,-0.4 -0.149 13.4-165.6 -57.0 140.3 24.9 32.8 -16.8 84 194 A F E - f 0 166B 52 -23,-0.5 -21,-2.8 81,-0.2 2,-0.4 -0.957 1.0-165.7-133.5 111.4 25.4 34.9 -13.7 85 195 A M E +ef 63 167B 0 81,-1.8 83,-2.4 -2,-0.4 2,-0.3 -0.822 9.6 177.6 -95.7 140.1 22.9 34.4 -10.8 86 196 A E E -ef 64 168B 27 -23,-2.2 -21,-2.7 -2,-0.4 83,-0.2 -0.988 23.0-129.5-144.8 133.5 22.7 37.0 -8.0 87 197 A S - 0 0 0 81,-1.1 -21,-0.2 -2,-0.3 63,-0.1 -0.263 8.7-141.4 -67.1 157.2 20.5 37.2 -4.9 88 198 A T S S+ 0 0 84 -24,-0.1 2,-0.3 2,-0.0 -1,-0.1 0.741 84.6 74.1 -83.4 -28.0 18.5 40.3 -4.0 89 199 A T - 0 0 55 29,-0.0 -2,-0.1 60,-0.0 -24,-0.1 -0.684 69.3-150.2 -91.6 138.5 19.3 39.8 -0.3 90 200 A T - 0 0 54 -2,-0.3 28,-0.2 26,-0.0 2,-0.0 -0.933 30.8-163.6-101.1 103.7 22.7 40.4 1.3 91 201 A P - 0 0 2 0, 0.0 26,-1.9 0, 0.0 2,-0.5 -0.260 25.0 -91.8 -85.6 174.9 22.7 37.9 4.2 92 202 A W E -G 116 0C 71 50,-0.3 2,-0.3 24,-0.2 24,-0.2 -0.758 48.3-171.5 -82.6 129.9 24.8 37.5 7.3 93 203 A V E -G 115 0C 0 22,-3.1 22,-1.7 -2,-0.5 2,-0.3 -0.920 16.7-141.0-125.4 148.2 27.9 35.3 6.7 94 204 A I B -H 122 0D 0 28,-3.0 28,-2.2 -2,-0.3 17,-0.1 -0.749 4.1-161.0-100.9 155.0 30.6 33.8 8.8 95 205 A K - 0 0 41 15,-0.4 2,-1.7 -2,-0.3 26,-0.1 -0.760 5.2-171.2-137.0 79.2 34.2 33.5 7.9 96 206 A P + 0 0 0 0, 0.0 8,-2.7 0, 0.0 2,-0.3 -0.137 58.2 78.3 -78.3 46.5 35.8 30.8 10.1 97 207 A W B S-I 103 0E 19 -2,-1.7 6,-0.2 6,-0.3 2,-0.1 -0.986 71.6-123.8-148.2 153.2 39.4 31.4 9.0 98 208 A T > - 0 0 48 4,-2.4 3,-2.0 -2,-0.3 6,-0.0 -0.271 35.7 -96.3 -90.3 176.6 42.1 34.1 9.8 99 209 A D T 3 S+ 0 0 167 1,-0.3 -1,-0.1 2,-0.1 0, 0.0 0.524 128.6 52.2 -74.3 -4.3 44.1 36.5 7.7 100 210 A D T 3 S- 0 0 124 2,-0.1 -1,-0.3 0, 0.0 -2,-0.0 0.103 122.5-109.3-106.3 14.4 46.9 33.9 7.8 101 211 A N < + 0 0 54 -3,-2.0 2,-0.4 1,-0.2 -2,-0.1 0.748 68.5 146.7 58.5 32.0 44.4 31.2 6.6 102 212 A Q - 0 0 111 1,-0.0 -4,-2.4 0, 0.0 -1,-0.2 -0.795 53.0-112.1 -88.5 136.5 44.3 29.3 9.9 103 213 A W B -I 97 0E 32 -2,-0.4 2,-0.5 -6,-0.2 -6,-0.3 -0.431 22.0-136.0 -63.4 138.0 41.0 27.7 10.6 104 214 A L + 0 0 37 -8,-2.7 -1,-0.0 1,-0.1 3,-0.0 -0.851 28.9 168.6 -89.6 131.2 39.0 29.1 13.5 105 215 A T + 0 0 62 -2,-0.5 2,-0.5 27,-0.0 -1,-0.1 0.566 46.9 96.9-113.6 -21.6 37.4 26.4 15.7 106 216 A D > - 0 0 100 1,-0.1 4,-2.2 26,-0.1 3,-0.4 -0.630 68.1-143.0 -75.8 123.0 36.3 28.5 18.7 107 217 A A H > S+ 0 0 6 26,-0.5 4,-2.6 -2,-0.5 5,-0.2 0.880 99.4 52.2 -53.4 -45.5 32.6 29.3 18.4 108 218 A A H > S+ 0 0 52 1,-0.2 4,-1.8 2,-0.2 -1,-0.2 0.889 109.3 50.0 -61.5 -38.5 33.0 32.8 19.9 109 219 A A H > S+ 0 0 31 -3,-0.4 4,-0.5 1,-0.2 -1,-0.2 0.900 110.7 50.3 -65.7 -41.0 35.8 33.7 17.4 110 220 A V H >< S+ 0 0 0 -4,-2.2 3,-1.4 1,-0.2 -15,-0.4 0.917 107.9 52.4 -62.5 -44.7 33.6 32.5 14.6 111 221 A V H >< S+ 0 0 28 -4,-2.6 3,-1.9 1,-0.3 -1,-0.2 0.903 101.2 62.0 -58.4 -37.3 30.7 34.6 15.7 112 222 A A H 3< S+ 0 0 85 -4,-1.8 -1,-0.3 1,-0.3 -2,-0.2 0.666 93.8 64.7 -64.0 -17.6 33.0 37.7 15.8 113 223 A T T << S+ 0 0 37 -3,-1.4 -1,-0.3 -4,-0.5 -2,-0.2 0.534 73.4 134.2 -82.0 -7.4 33.5 37.3 12.0 114 224 A L < + 0 0 36 -3,-1.9 2,-0.3 -4,-0.3 -20,-0.2 -0.143 22.6 152.1 -50.4 133.0 29.9 38.1 11.2 115 225 A K E -G 93 0C 58 -22,-1.7 -22,-3.1 2,-0.1 2,-0.7 -0.968 48.4-107.6-151.8 159.6 29.3 40.5 8.4 116 226 A Q E +G 92 0C 117 -2,-0.3 2,-0.3 -24,-0.2 -24,-0.2 -0.862 62.4 130.3 -90.6 114.2 26.6 41.2 5.8 117 227 A S - 0 0 28 -26,-1.9 -2,-0.1 -2,-0.7 3,-0.0 -0.983 61.3-133.0-158.4 154.6 28.0 40.1 2.4 118 228 A K S S+ 0 0 36 -2,-0.3 51,-0.7 -28,-0.2 2,-0.2 0.427 93.9 10.7 -84.7 -1.1 27.1 38.1 -0.6 119 229 A T S S+ 0 0 45 49,-0.1 -26,-0.1 1,-0.1 3,-0.1 -0.827 87.4 73.8-156.1-169.8 30.5 36.4 -0.6 120 230 A D S S+ 0 0 48 -2,-0.2 2,-0.3 1,-0.1 -1,-0.1 0.874 110.2 12.9 56.1 42.9 33.7 35.9 1.5 121 231 A G S S- 0 0 0 -3,-0.1 98,-0.5 125,-0.1 2,-0.3 -0.929 83.9-102.0 151.2-172.1 32.0 33.5 3.9 122 232 A Y B -H 94 0D 1 -28,-2.2 -28,-3.0 -2,-0.3 69,-0.1 -0.981 27.4 -98.3-146.3 158.5 28.8 31.6 4.2 123 233 A Q - 0 0 0 -2,-0.3 -30,-0.2 -30,-0.2 21,-0.1 -0.599 50.3-110.9 -72.3 127.1 25.4 31.6 5.9 124 234 A P - 0 0 1 0, 0.0 22,-0.3 0, 0.0 2,-0.3 -0.224 37.8-175.6 -56.0 146.2 25.3 29.4 9.0 125 235 A T >> - 0 0 13 95,-0.1 3,-1.5 123,-0.1 4,-0.6 -0.815 45.1 -86.9-129.9 178.8 23.3 26.2 8.9 126 236 A V H >> S+ 0 0 108 1,-0.3 3,-1.0 -2,-0.3 4,-0.6 0.779 122.0 65.3 -61.9 -26.6 22.5 23.6 11.5 127 237 A S H >> S+ 0 0 16 1,-0.2 4,-2.3 2,-0.2 3,-0.7 0.811 91.7 64.1 -67.3 -25.5 25.7 21.6 10.6 128 238 A D H <> S+ 0 0 0 -3,-1.5 4,-2.5 1,-0.2 -1,-0.2 0.811 91.0 65.1 -64.2 -26.4 27.7 24.6 11.9 129 239 A Y H << S+ 0 0 45 -3,-1.0 5,-0.5 -4,-0.6 6,-0.3 0.838 110.0 37.5 -64.2 -34.1 26.2 23.9 15.4 130 240 A V H << S+ 0 0 103 -3,-0.7 -2,-0.2 -4,-0.6 -1,-0.2 0.859 115.9 52.2 -78.9 -43.2 28.0 20.6 15.4 131 241 A K H < S+ 0 0 36 -4,-2.3 -2,-0.2 1,-0.3 -3,-0.2 0.875 120.5 32.4 -63.9 -37.3 31.2 21.9 13.6 132 242 A F S >< S- 0 0 0 -4,-2.5 3,-2.4 -5,-0.2 -1,-0.3 -0.781 92.9-141.1-122.6 81.9 31.6 24.8 16.1 133 243 A P T 3 S+ 0 0 101 0, 0.0 -26,-0.5 0, 0.0 -3,-0.1 -0.204 83.7 18.4 -54.3 129.2 30.3 23.5 19.4 134 244 A G T >> S+ 0 0 44 -5,-0.5 4,-1.2 -27,-0.1 3,-0.6 0.200 89.7 110.9 98.1 -12.7 28.4 26.2 21.4 135 245 A I H <> + 0 0 0 -3,-2.4 4,-2.4 -6,-0.3 -6,-0.1 0.792 65.4 67.7 -68.9 -27.6 27.8 28.4 18.3 136 246 A E H 34 S+ 0 0 101 -4,-0.3 -1,-0.2 -7,-0.3 -7,-0.1 0.913 106.2 41.9 -58.3 -42.0 24.1 27.8 18.3 137 247 A T H <4 S+ 0 0 125 -3,-0.6 -1,-0.2 1,-0.2 -2,-0.2 0.829 118.1 46.2 -71.3 -33.4 23.8 29.6 21.6 138 248 A L H < S+ 0 0 87 -4,-1.2 -2,-0.2 2,-0.1 -1,-0.2 0.712 87.4 96.0 -87.4 -24.3 26.1 32.4 20.6 139 249 A L S < S- 0 0 5 -4,-2.4 5,-0.1 -5,-0.1 -31,-0.0 -0.481 80.2-115.9 -66.5 136.4 24.9 33.3 17.1 140 250 A P > - 0 0 43 0, 0.0 3,-2.1 0, 0.0 4,-0.3 -0.369 26.6-112.8 -65.7 150.1 22.5 36.2 17.0 141 251 A P G > S+ 0 0 112 0, 0.0 3,-1.7 0, 0.0 -2,-0.1 0.850 114.9 62.4 -53.6 -34.3 19.0 35.2 15.8 142 252 A N G 3 S+ 0 0 93 1,-0.3 -50,-0.3 3,-0.0 -3,-0.0 0.629 103.0 51.1 -70.5 -9.4 19.4 37.2 12.6 143 253 A A G < S+ 0 0 0 -3,-2.1 2,-0.4 -52,-0.1 -1,-0.3 0.329 97.7 83.9-103.8 2.8 22.3 35.0 11.6 144 254 A K S < S+ 0 0 66 -3,-1.7 -19,-0.1 -4,-0.3 -52,-0.0 -0.865 92.9 9.1-108.8 142.5 20.4 31.7 12.1 145 255 A G S S+ 0 0 68 -2,-0.4 -1,-0.2 -21,-0.2 -20,-0.1 0.641 78.5 161.4 69.8 19.5 18.1 30.0 9.7 146 256 A Q - 0 0 28 -22,-0.3 -1,-0.2 -3,-0.2 -3,-0.0 -0.356 21.5-169.3 -69.5 155.8 18.9 32.1 6.7 147 257 A N + 0 0 105 -2,-0.1 2,-0.6 -22,-0.0 -1,-0.1 -0.271 22.6 151.4-146.3 49.3 17.9 30.7 3.3 148 258 A I + 0 0 22 -82,-0.1 44,-2.1 2,-0.0 2,-0.3 -0.779 10.0 136.0 -96.4 117.3 19.4 32.9 0.5 149 259 A T - 0 0 5 -2,-0.6 -82,-3.0 42,-0.3 2,-0.6 -0.962 40.4-148.3-150.9 142.3 20.3 31.4 -2.8 150 260 A S E -eg 67 170A 0 19,-2.8 21,-2.5 -2,-0.3 2,-0.5 -0.963 34.5-170.1-107.9 107.8 19.7 32.6 -6.4 151 261 A T E -eg 68 171A 6 -84,-2.4 -82,-2.8 -2,-0.6 2,-0.7 -0.881 27.3-151.2-115.4 127.6 19.3 29.3 -8.3 152 262 A L E -eg 69 172A 1 19,-2.5 21,-3.0 -2,-0.5 2,-0.6 -0.872 25.5-162.9 -86.0 115.8 19.2 28.4 -12.0 153 263 A E E -eg 70 173A 2 -84,-2.9 -82,-3.2 -2,-0.7 2,-0.6 -0.928 13.0-164.5-108.0 117.0 17.0 25.3 -12.1 154 264 A I E -eg 71 174A 2 19,-3.2 21,-2.5 -2,-0.6 2,-0.5 -0.902 22.0-159.7 -94.3 117.7 17.0 23.2 -15.2 155 265 A R E -eg 72 175A 72 -84,-2.8 -82,-0.5 -2,-0.6 21,-0.2 -0.897 54.3 -24.2-115.4 122.7 14.0 21.0 -14.8 156 266 A E S S+ 0 0 148 19,-3.1 2,-0.3 -2,-0.5 -1,-0.2 0.847 91.8 144.1 54.8 43.3 13.2 17.7 -16.6 157 267 A C - 0 0 3 18,-0.2 21,-1.8 -3,-0.2 2,-0.4 -0.783 39.0-149.2-109.7 153.9 15.5 18.4 -19.5 158 268 A I B S+j 178 0F 78 -84,-0.5 21,-0.2 -2,-0.3 -81,-0.2 -0.984 75.5 8.1-121.0 134.3 17.7 16.1 -21.6 159 269 A G S S+ 0 0 16 19,-2.0 -82,-2.9 -2,-0.4 2,-0.4 0.878 82.2 145.1 71.9 37.1 21.0 17.1 -23.2 160 270 A V - 0 0 0 18,-0.3 21,-1.7 -84,-0.2 2,-0.4 -0.933 29.1-162.9-110.0 134.0 21.4 20.6 -21.8 161 271 A E E -fh 79 181A 52 -83,-1.9 -81,-2.5 -2,-0.4 2,-0.5 -0.954 8.3-158.9-120.6 132.9 24.8 22.1 -21.0 162 272 A V E -fh 80 182A 1 19,-2.7 21,-3.0 -2,-0.4 2,-0.4 -0.960 21.1-168.7-108.3 120.1 25.5 25.1 -18.8 163 273 A H E -fh 81 183A 12 -83,-2.9 -81,-2.4 -2,-0.5 -80,-0.4 -0.906 56.6 -5.0-117.9 136.7 28.9 26.6 -19.6 164 274 A R S S+ 0 0 122 19,-2.2 21,-0.2 -2,-0.4 -1,-0.2 0.828 80.3 174.4 56.4 37.5 31.0 29.2 -17.7 165 275 A A + 0 0 0 18,-0.4 21,-2.5 -3,-0.2 2,-0.2 -0.419 3.0 162.0 -72.7 150.4 28.3 30.0 -15.1 166 276 A S E +f 84 0B 20 -83,-2.8 -81,-1.8 19,-0.2 2,-0.3 -0.817 1.0 136.7-150.2-172.2 29.1 32.3 -12.3 167 277 A G E -f 85 0B 3 -83,-0.3 22,-2.5 19,-0.3 2,-0.4 -0.916 46.6 -86.7 154.6-176.1 27.3 34.4 -9.6 168 278 A L E S-f 86 0B 45 -83,-2.4 -81,-1.1 -2,-0.3 22,-0.2 -0.999 109.6 -1.3-132.7 126.4 27.0 35.7 -6.1 169 279 A M S S+ 0 0 0 -51,-0.7 -19,-2.8 20,-0.5 22,-0.3 0.879 107.0 164.9 53.9 41.4 25.0 33.6 -3.6 170 280 A A E +gi 150 190A 0 19,-2.5 21,-0.6 -21,-0.2 2,-0.3 -0.606 27.3 178.7-103.2 144.2 24.5 31.4 -6.6 171 281 A G E -g 151 0A 0 -21,-2.5 -19,-2.5 -2,-0.3 2,-0.4 -0.960 14.9-153.6-138.7 161.1 23.3 27.8 -7.2 172 282 A F E -gj 152 196A 3 23,-1.9 25,-2.1 22,-0.4 2,-0.5 -0.993 15.7-174.1-137.5 120.1 22.7 25.5 -10.2 173 283 A L E -gj 153 197A 20 -21,-3.0 -19,-3.2 -2,-0.4 2,-0.6 -0.982 15.3-169.1-127.4 124.6 20.2 22.7 -10.0 174 284 A F E -gj 154 198A 1 23,-2.8 25,-2.6 -2,-0.5 2,-0.6 -0.965 19.3-171.3-107.7 107.4 19.5 20.0 -12.5 175 285 A R E -gj 155 199A 88 -21,-2.5 -19,-3.1 -2,-0.6 -18,-0.2 -0.914 67.3 -13.2-108.9 118.8 16.3 18.4 -11.3 176 286 A G S S+ 0 0 16 23,-2.8 2,-0.2 -2,-0.6 -1,-0.2 0.779 100.2 143.7 62.2 33.3 15.1 15.2 -13.0 177 287 A C - 0 0 0 22,-0.3 2,-0.3 -3,-0.2 30,-0.3 -0.592 33.8-162.1-101.5 160.9 17.5 15.8 -15.9 178 288 A H B +j 158 0F 32 -21,-1.8 -19,-2.0 -2,-0.2 -18,-0.3 -0.984 70.0 13.1-138.7 149.4 19.6 13.3 -18.0 179 289 A F S S+ 0 0 86 28,-2.9 2,-0.3 -2,-0.3 30,-0.2 0.827 90.2 140.0 55.3 36.8 22.6 13.8 -20.2 180 290 A C - 0 0 0 27,-0.2 30,-1.9 -21,-0.2 2,-0.4 -0.780 33.8-160.1-108.8 153.7 23.2 17.3 -18.8 181 291 A K E -hk 161 210A 59 -21,-1.7 -19,-2.7 -2,-0.3 2,-0.6 -0.990 21.9-151.3-138.4 144.8 26.5 18.9 -17.9 182 292 A M E -hk 162 211A 2 28,-2.5 30,-2.2 -2,-0.4 2,-0.4 -0.950 36.8-170.6-107.6 105.6 27.8 21.8 -15.8 183 293 A V E -hk 163 212A 14 -21,-3.0 -19,-2.2 -2,-0.6 -18,-0.4 -0.850 52.2 -14.1-113.7 132.5 31.0 22.7 -17.8 184 294 A D S S- 0 0 79 28,-2.9 30,-0.3 -2,-0.4 -1,-0.2 0.860 73.7-154.1 50.5 43.4 33.8 25.1 -16.9 185 295 A A - 0 0 3 28,-0.5 30,-2.0 27,-0.3 2,-1.2 -0.261 11.2-135.2 -47.2 127.7 32.0 26.7 -13.9 186 296 A N E - l 0 215A 104 -21,-2.5 -19,-0.3 28,-0.2 -1,-0.1 -0.438 53.3 -77.8 -94.0 59.2 33.5 30.2 -13.7 187 297 A N E - 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