==== 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 LATE PROTEIN 16-JUN-94 1TSP . COMPND 2 MOLECULE: TAILSPIKE-PROTEIN; . SOURCE 2 ORGANISM_SCIENTIFIC: ENTEROBACTERIA PHAGE P22; . AUTHOR S.STEINBACHER,R.SECKLER,S.MILLER,B.STEIPE,R.HUBER,P.REINEMER . 544 3 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 25898.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 395 72.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 171 31.4 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 52 9.6 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 . 61 11.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 39 7.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 21 3.9 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 1 0 1 1 1 2 0 0 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 . 3 6 14 4 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 1 1 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 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 1 113 A Y > 0 0 174 0, 0.0 4,-3.2 0, 0.0 5,-0.3 0.000 360.0 360.0 360.0 -45.0 48.5 45.9 41.0 2 114 A S H > + 0 0 82 1,-0.2 4,-2.7 2,-0.2 5,-0.2 0.859 360.0 46.1 -43.8 -45.3 50.1 43.8 43.7 3 115 A I H > S+ 0 0 127 2,-0.2 4,-1.0 1,-0.2 -1,-0.2 0.918 113.5 48.4 -67.0 -43.5 53.6 44.1 42.1 4 116 A E H >> S+ 0 0 100 1,-0.2 4,-1.0 2,-0.2 3,-0.7 0.945 114.4 46.5 -61.5 -48.4 53.2 47.9 41.6 5 117 A A H >X S+ 0 0 15 -4,-3.2 4,-1.4 1,-0.2 3,-0.9 0.912 106.6 56.3 -61.4 -47.9 52.0 48.3 45.2 6 118 A D H 3< S+ 0 0 90 -4,-2.7 -1,-0.2 -5,-0.3 -2,-0.2 0.722 113.8 43.9 -58.0 -21.6 54.8 46.1 46.7 7 119 A K H << S+ 0 0 180 -4,-1.0 -1,-0.2 -3,-0.7 -2,-0.2 0.618 116.4 41.5 -99.9 -14.7 57.3 48.4 45.0 8 120 A K H << S+ 0 0 107 -4,-1.0 2,-0.3 -3,-0.9 -2,-0.2 0.504 95.7 79.4-115.0 -0.1 55.8 51.9 45.8 9 121 A F S < S- 0 0 113 -4,-1.4 2,-0.3 -5,-0.1 0, 0.0 -0.845 76.3-111.6-115.9 150.0 54.6 51.9 49.4 10 122 A K - 0 0 157 -2,-0.3 2,-0.4 1,-0.1 -2,-0.1 -0.538 35.2-126.4 -73.8 129.7 56.4 52.2 52.7 11 123 A Y + 0 0 98 -2,-0.3 20,-2.1 -5,-0.1 2,-0.3 -0.669 43.2 149.4 -84.4 131.9 56.4 49.0 54.8 12 124 A S E -a 31 0A 70 -2,-0.4 2,-0.3 18,-0.2 20,-0.2 -0.917 28.5-155.9-163.0 133.0 55.0 49.3 58.3 13 125 A V E -a 32 0A 19 18,-1.5 20,-3.0 -2,-0.3 2,-0.4 -0.819 16.6-145.5-108.9 148.1 53.3 46.8 60.6 14 126 A K E > -a 33 0A 81 -2,-0.3 3,-2.4 18,-0.2 4,-0.2 -0.969 16.4-129.1-125.8 137.0 51.0 48.0 63.4 15 127 A L G > S+ 0 0 0 18,-2.6 3,-2.3 -2,-0.4 19,-0.1 0.781 101.7 71.0 -46.2 -39.3 50.4 46.5 66.9 16 128 A S G 3 S+ 0 0 56 1,-0.3 -1,-0.3 17,-0.3 18,-0.1 0.675 94.8 57.2 -58.4 -15.5 46.6 46.6 66.6 17 129 A D G < S+ 0 0 95 -3,-2.4 -1,-0.3 2,-0.0 -2,-0.2 0.525 103.9 58.7 -91.1 -10.8 46.9 43.8 64.0 18 130 A Y < - 0 0 61 -3,-2.3 3,-0.0 -4,-0.2 6,-0.0 -0.906 69.3-139.9-125.8 151.6 48.7 41.3 66.3 19 131 A P S S+ 0 0 98 0, 0.0 2,-0.3 0, 0.0 -1,-0.1 0.822 88.0 27.3 -75.5 -34.0 48.0 39.7 69.6 20 132 A T S > S- 0 0 51 1,-0.1 4,-1.5 18,-0.0 3,-0.4 -0.910 78.5-116.8-129.7 159.0 51.5 40.0 71.1 21 133 A L H > S+ 0 0 1 -2,-0.3 4,-2.4 1,-0.2 5,-0.1 0.839 114.0 56.9 -59.6 -37.2 54.5 42.3 70.6 22 134 A Q H > S+ 0 0 53 2,-0.2 4,-2.5 1,-0.2 -1,-0.2 0.833 102.4 53.8 -64.4 -36.8 56.6 39.4 69.2 23 135 A D H > S+ 0 0 74 -3,-0.4 4,-1.4 2,-0.2 -1,-0.2 0.891 111.5 45.9 -65.8 -39.3 54.1 38.6 66.5 24 136 A A H X S+ 0 0 0 -4,-1.5 4,-1.3 2,-0.2 -2,-0.2 0.913 112.7 51.0 -67.0 -44.3 54.3 42.3 65.4 25 137 A A H < S+ 0 0 0 -4,-2.4 -2,-0.2 1,-0.2 3,-0.2 0.890 108.7 50.1 -60.7 -44.0 58.2 42.2 65.6 26 138 A S H < S+ 0 0 77 -4,-2.5 -1,-0.2 1,-0.2 -2,-0.2 0.853 112.7 48.0 -64.9 -34.0 58.5 39.1 63.5 27 139 A A H < S+ 0 0 42 -4,-1.4 -1,-0.2 -5,-0.2 -2,-0.2 0.709 91.3 104.8 -77.8 -23.7 56.2 40.6 60.8 28 140 A A < + 0 0 4 -4,-1.3 4,-0.1 -3,-0.2 23,-0.1 -0.256 32.0 162.3 -63.0 145.6 58.1 43.9 60.8 29 141 A V S S- 0 0 83 2,-0.5 23,-0.2 22,-0.1 -1,-0.1 0.569 77.9 -12.6-130.7 -37.0 60.5 44.8 57.9 30 142 A D S S+ 0 0 47 1,-0.6 24,-2.0 24,-0.1 2,-0.2 0.402 124.3 26.1-132.5 -79.6 61.0 48.5 58.0 31 143 A G E -ab 12 54A 7 -20,-2.1 -18,-1.5 22,-0.2 -1,-0.6 -0.558 54.5-164.4 -95.6 160.2 58.6 50.4 60.3 32 144 A L E -ab 13 55A 2 22,-2.5 24,-2.6 -20,-0.2 2,-0.6 -0.941 8.7-158.3-143.4 115.3 56.7 49.3 63.4 33 145 A L E -ab 14 56A 38 -20,-3.0 -18,-2.6 -2,-0.3 2,-1.3 -0.860 8.8-155.2-102.6 121.6 53.8 51.4 64.7 34 146 A I E + b 0 57A 1 22,-3.0 24,-2.7 -2,-0.6 25,-0.2 -0.766 31.4 157.8 -93.1 92.3 52.7 51.0 68.3 35 147 A D + 0 0 55 -2,-1.3 2,-0.3 22,-0.1 -1,-0.2 0.337 54.1 44.3-103.0 4.5 49.1 52.1 67.9 36 148 A R S S- 0 0 79 -3,-0.1 23,-0.2 23,-0.1 -1,-0.1 -0.993 92.2 -92.4-148.1 146.5 47.4 50.6 70.9 37 149 A D - 0 0 80 -2,-0.3 2,-0.5 21,-0.1 24,-0.2 -0.293 40.2-156.3 -56.4 138.3 48.3 50.3 74.6 38 150 A Y E -c 61 0A 14 22,-2.7 24,-3.0 -4,-0.1 2,-0.6 -0.986 8.1-151.8-127.7 123.2 50.1 47.1 75.3 39 151 A N E -c 62 0A 118 -2,-0.5 2,-0.3 22,-0.2 24,-0.2 -0.832 22.5-171.5 -92.1 116.2 50.2 45.4 78.8 40 152 A F - 0 0 12 22,-2.5 2,-0.3 -2,-0.6 24,-0.2 -0.738 18.8-129.0-107.5 158.3 53.4 43.5 79.1 41 153 A Y > - 0 0 159 -2,-0.3 3,-2.2 22,-0.1 24,-0.1 -0.807 43.1 -87.6-101.6 147.7 54.4 41.1 81.9 42 154 A G T 3 S+ 0 0 44 -2,-0.3 25,-0.2 22,-0.3 23,-0.1 -0.303 115.7 21.7 -55.7 130.6 57.8 41.6 83.6 43 155 A G T 3 S+ 0 0 37 23,-2.5 -1,-0.3 1,-0.3 2,-0.2 0.367 81.0 153.0 93.1 -7.2 60.5 39.8 81.8 44 156 A E E < -d 67 0A 17 -3,-2.2 24,-2.5 22,-0.6 2,-0.4 -0.426 30.0-158.3 -58.4 121.7 58.6 39.7 78.5 45 157 A T E -d 68 0A 64 -2,-0.2 2,-0.5 22,-0.2 24,-0.2 -0.895 11.8-159.9-112.4 137.6 61.3 39.5 75.9 46 158 A V E -d 69 0A 1 22,-3.2 24,-2.6 -2,-0.4 2,-0.6 -0.944 5.6-154.1-117.2 130.1 61.1 40.5 72.2 47 159 A D E -d 70 0A 63 -2,-0.5 24,-0.2 22,-0.2 25,-0.1 -0.913 5.4-169.9-104.5 120.4 63.5 39.3 69.6 48 160 A F > - 0 0 1 22,-2.4 3,-1.9 -2,-0.6 25,-0.2 0.276 34.4-126.4 -93.5 8.3 63.8 41.6 66.6 49 161 A G T 3 - 0 0 55 1,-0.3 23,-0.2 21,-0.1 22,-0.1 0.610 59.9 -68.2 59.7 17.8 65.8 39.3 64.5 50 162 A G T 3 S+ 0 0 45 21,-3.0 -1,-0.3 1,-0.3 22,-0.2 0.513 90.8 153.0 80.2 6.8 68.6 41.7 63.8 51 163 A K < - 0 0 56 -3,-1.9 22,-3.2 20,-0.4 2,-1.0 -0.387 49.2-128.6 -72.0 144.6 66.3 43.9 61.7 52 164 A V + 0 0 85 -23,-0.2 2,-0.3 20,-0.2 22,-0.1 -0.842 46.5 171.8 -94.0 102.4 67.0 47.6 61.4 53 165 A L - 0 0 1 -2,-1.0 24,-1.7 20,-0.2 2,-0.6 -0.738 38.0-138.7-115.9 162.8 63.6 49.0 62.3 54 166 A T E -be 31 77A 58 -24,-2.0 -22,-2.5 -2,-0.3 2,-0.7 -0.954 22.5-162.7-119.9 105.8 61.9 52.3 63.0 55 167 A I E -be 32 78A 2 22,-2.7 24,-2.6 -2,-0.6 2,-0.6 -0.841 4.1-169.5 -95.9 118.0 59.6 52.0 66.0 56 168 A E E -be 33 79A 102 -24,-2.6 -22,-3.0 -2,-0.7 2,-0.5 -0.936 8.6-154.6-107.9 119.7 57.1 54.8 66.2 57 169 A C E +b 34 0A 14 22,-2.6 -22,-0.1 -2,-0.6 -24,-0.1 -0.859 31.2 155.3-101.5 123.9 55.1 54.8 69.5 58 170 A K S S+ 0 0 152 -24,-2.7 2,-0.3 -2,-0.5 -23,-0.1 0.090 71.7 39.1-127.5 17.4 51.7 56.4 69.6 59 171 A A S S- 0 0 18 -25,-0.2 23,-0.5 -23,-0.2 2,-0.3 -0.861 87.7 -93.6-150.2-179.2 50.4 54.4 72.5 60 172 A K - 0 0 61 -2,-0.3 -22,-2.7 21,-0.1 2,-0.6 -0.776 10.3-135.5-117.3 157.4 51.8 53.1 75.8 61 173 A F E -cf 38 83A 1 21,-2.4 23,-1.9 -2,-0.3 2,-0.4 -0.921 31.3-164.3-101.8 119.5 53.5 50.0 77.2 62 174 A I E +cf 39 84A 28 -24,-3.0 -22,-2.5 -2,-0.6 2,-0.2 -0.908 32.1 90.4-113.4 133.6 51.9 49.3 80.6 63 175 A G - 0 0 5 21,-2.5 2,-0.4 -2,-0.4 -22,-0.1 -0.770 64.5-102.2 158.8 156.7 53.3 47.0 83.3 64 176 A D S S+ 0 0 46 -24,-0.2 -22,-0.3 -2,-0.2 84,-0.2 -0.830 88.8 25.4 -96.4 141.6 55.5 46.7 86.4 65 177 A G E S- g 0 148A 24 82,-2.8 84,-2.5 -2,-0.4 2,-0.3 -0.565 101.9 -33.0 103.8-170.9 58.9 45.2 85.6 66 178 A N E - g 0 149A 41 -2,-0.2 -23,-2.5 82,-0.2 2,-0.6 -0.724 31.0-160.1-100.7 142.6 61.0 45.1 82.4 67 179 A L E -dg 44 150A 0 82,-2.5 84,-2.4 -2,-0.3 2,-0.6 -0.981 28.3-150.8-113.9 108.1 60.0 44.8 78.7 68 180 A I E -dg 45 151A 10 -24,-2.5 -22,-3.2 -2,-0.6 2,-0.5 -0.772 13.2-166.4 -96.3 121.9 63.2 43.5 77.1 69 181 A F E +dg 46 152A 2 82,-2.9 84,-2.4 -2,-0.6 2,-0.3 -0.916 18.5 176.2-102.4 127.9 64.0 44.4 73.5 70 182 A T E +dg 47 153A 24 -24,-2.6 -22,-2.4 -2,-0.5 -20,-0.2 -0.917 48.5 21.5-132.3 162.5 66.8 42.3 72.0 71 183 A K + 0 0 127 82,-0.6 -21,-3.0 -2,-0.3 -20,-0.4 0.881 68.1 165.9 51.7 48.1 68.5 41.8 68.7 72 184 A L - 0 0 10 81,-0.2 84,-0.5 -22,-0.2 -1,-0.2 -0.757 39.7-111.3 -90.7 136.7 67.6 45.2 67.2 73 185 A G > - 0 0 6 -22,-3.2 3,-2.1 -2,-0.4 -20,-0.2 -0.364 37.1 -88.6 -71.2 151.7 69.7 46.0 64.1 74 186 A K T 3 S+ 0 0 159 1,-0.3 83,-0.2 -24,-0.2 84,-0.2 -0.379 117.9 35.2 -59.0 127.9 72.4 48.7 64.1 75 187 A G T 3 S+ 0 0 48 82,-2.5 -1,-0.3 1,-0.3 83,-0.2 0.282 84.3 144.6 109.3 -9.5 70.6 51.9 63.1 76 188 A S < - 0 0 3 -3,-2.1 83,-2.3 80,-0.3 2,-0.4 -0.324 28.2-166.8 -65.0 142.0 67.4 51.1 64.8 77 189 A R E -eh 54 159A 79 -24,-1.7 -22,-2.7 81,-0.2 2,-0.5 -0.998 12.8-165.2-137.5 137.3 65.4 54.0 66.4 78 190 A I E -eh 55 160A 0 81,-2.3 83,-3.5 -2,-0.4 2,-0.4 -0.976 16.9-170.9-116.3 126.0 62.5 54.0 68.8 79 191 A A E +eh 56 161A 10 -24,-2.6 -22,-2.6 -2,-0.5 83,-0.2 -0.972 57.9 6.8-127.2 138.8 60.6 57.3 69.2 80 192 A G S S+ 0 0 25 81,-2.5 82,-0.1 -2,-0.4 83,-0.1 0.610 72.3 172.8 75.8 15.0 57.9 58.4 71.6 81 193 A V - 0 0 0 80,-0.5 83,-2.7 -26,-0.1 2,-0.5 -0.274 14.2-162.3 -56.2 138.0 57.9 55.4 73.9 82 194 A F E - i 0 164A 51 -23,-0.5 -21,-2.4 81,-0.2 2,-0.4 -0.968 3.0-166.0-128.2 113.1 55.7 55.9 77.0 83 195 A M E +fi 61 165A 0 81,-2.1 83,-2.2 -2,-0.5 2,-0.4 -0.837 10.6 174.9 -99.8 134.0 56.3 53.5 80.0 84 196 A E E -fi 62 166A 31 -23,-1.9 -21,-2.5 -2,-0.4 83,-0.2 -0.984 25.8-128.8-143.3 129.8 53.7 53.3 82.8 85 197 A S - 0 0 0 81,-1.3 -21,-0.2 -2,-0.4 63,-0.1 -0.238 9.7-140.9 -66.5 162.7 53.6 51.1 85.8 86 198 A T S S+ 0 0 91 -24,-0.1 2,-0.3 2,-0.0 -1,-0.1 0.706 85.3 75.6 -92.9 -27.1 50.4 49.2 86.5 87 199 A T - 0 0 54 80,-0.1 -2,-0.1 29,-0.0 -24,-0.1 -0.625 69.0-150.7 -90.3 140.9 50.9 49.9 90.2 88 200 A T - 0 0 62 -2,-0.3 28,-0.1 26,-0.0 -1,-0.0 -0.897 30.9-164.1-105.9 97.6 50.3 53.3 91.9 89 201 A P - 0 0 2 0, 0.0 26,-1.9 0, 0.0 2,-0.5 -0.123 25.8 -91.1 -77.8 177.3 52.8 53.2 94.8 90 202 A W E -G 114 0B 74 50,-0.3 2,-0.3 24,-0.2 24,-0.2 -0.811 48.4-170.9 -90.3 125.2 53.1 55.3 97.9 91 203 A V E -G 113 0B 0 22,-3.2 22,-1.4 -2,-0.5 2,-0.3 -0.913 16.1-144.7-123.3 146.8 55.3 58.4 97.4 92 204 A I B -H 120 0C 0 28,-2.3 28,-1.7 -2,-0.3 17,-0.1 -0.735 4.6-156.6-101.9 157.9 56.8 61.1 99.7 93 205 A K - 0 0 52 15,-0.4 2,-1.9 -2,-0.3 26,-0.1 -0.751 3.6-167.8-138.5 84.1 57.3 64.7 98.6 94 206 A P + 0 0 0 0, 0.0 8,-2.2 0, 0.0 2,-0.3 -0.092 61.6 76.4 -66.5 36.2 60.1 66.3 100.7 95 207 A W B S-I 101 0D 22 -2,-1.9 6,-0.2 6,-0.3 2,-0.1 -0.995 70.2-127.5-147.8 153.4 59.2 69.9 99.7 96 208 A T > - 0 0 44 4,-2.9 3,-2.5 -2,-0.3 6,-0.0 -0.344 36.3 -93.1 -96.6 176.6 56.6 72.5 100.5 97 209 A D T 3 S+ 0 0 161 1,-0.3 -1,-0.1 2,-0.1 -2,-0.0 0.610 128.5 51.4 -62.4 -14.6 54.1 74.7 98.6 98 210 A D T 3 S- 0 0 129 2,-0.1 -1,-0.3 3,-0.0 3,-0.1 0.196 122.6-108.8-102.8 9.0 56.8 77.4 98.6 99 211 A N S < S+ 0 0 65 -3,-2.5 2,-0.4 1,-0.3 -2,-0.1 0.778 70.0 148.0 67.0 27.7 59.4 75.0 97.2 100 212 A Q - 0 0 138 1,-0.0 -4,-2.9 0, 0.0 -1,-0.3 -0.770 51.6-113.2 -91.2 140.8 61.2 74.8 100.6 101 213 A W B -I 95 0D 31 -2,-0.4 2,-0.4 -6,-0.2 -6,-0.3 -0.489 20.9-142.1 -73.0 143.0 62.9 71.5 101.4 102 214 A L + 0 0 43 -8,-2.2 -1,-0.0 -2,-0.2 3,-0.0 -0.908 24.6 171.3-103.4 133.0 61.5 69.6 104.3 103 215 A T + 0 0 58 -2,-0.4 2,-0.6 27,-0.0 -1,-0.1 0.422 46.5 100.5-119.9 -8.3 64.3 67.8 106.3 104 216 A D > - 0 0 95 1,-0.1 4,-2.3 26,-0.1 5,-0.2 -0.729 67.8-141.8 -85.3 121.4 62.3 66.6 109.3 105 217 A A H > S+ 0 0 9 -2,-0.6 4,-2.4 26,-0.4 5,-0.2 0.835 100.9 49.4 -47.2 -45.5 61.3 62.9 109.1 106 218 A A H > S+ 0 0 52 2,-0.2 4,-2.1 1,-0.2 -1,-0.2 0.944 110.3 49.1 -63.5 -46.3 57.9 63.5 110.6 107 219 A A H 4 S+ 0 0 34 1,-0.2 4,-0.3 2,-0.2 -2,-0.2 0.887 113.4 48.5 -61.8 -35.1 57.1 66.3 108.3 108 220 A V H >< S+ 0 0 0 -4,-2.3 3,-1.6 1,-0.2 -15,-0.4 0.899 107.5 53.6 -71.8 -40.6 58.2 64.1 105.3 109 221 A V H >< S+ 0 0 28 -4,-2.4 3,-1.9 1,-0.3 -1,-0.2 0.906 100.5 63.1 -60.9 -38.7 56.1 61.1 106.4 110 222 A A T 3< S+ 0 0 86 -4,-2.1 -1,-0.3 1,-0.3 -2,-0.2 0.639 90.9 67.0 -62.2 -14.8 53.1 63.4 106.5 111 223 A T T < S+ 0 0 35 -3,-1.6 -1,-0.3 -4,-0.3 -2,-0.2 0.484 72.7 135.9 -85.9 -1.2 53.4 64.0 102.7 112 224 A L < + 0 0 38 -3,-1.9 2,-0.3 -4,-0.2 -20,-0.2 -0.161 20.5 146.3 -52.8 133.5 52.6 60.3 101.9 113 225 A K E -G 91 0B 60 -22,-1.4 -22,-3.2 2,-0.1 2,-0.7 -0.974 51.0-104.7-161.5 158.3 50.1 59.7 99.1 114 226 A Q E +G 90 0B 117 -2,-0.3 2,-0.3 -24,-0.2 -24,-0.2 -0.838 62.2 131.1 -93.2 116.3 49.5 57.1 96.4 115 227 A S - 0 0 30 -26,-1.9 -2,-0.1 -2,-0.7 3,-0.1 -0.980 59.4-133.6-160.8 160.4 50.6 58.6 93.1 116 228 A K S S+ 0 0 37 -2,-0.3 51,-0.6 -28,-0.1 2,-0.3 0.272 91.2 9.2-100.7 6.2 52.6 57.7 90.0 117 229 A T S S+ 0 0 47 49,-0.1 3,-0.1 1,-0.1 -26,-0.1 -0.941 91.3 68.3-165.5-175.8 54.4 61.1 90.0 118 230 A D S S+ 0 0 50 -2,-0.3 2,-0.3 1,-0.2 -1,-0.1 0.837 111.0 27.1 56.3 37.1 55.0 64.3 92.0 119 231 A G S S- 0 0 1 -3,-0.1 98,-0.5 -26,-0.1 2,-0.3 -0.950 79.8-116.7 167.1-174.9 57.0 62.3 94.5 120 232 A Y B -H 92 0C 3 -28,-1.7 -28,-2.3 -2,-0.3 69,-0.1 -0.997 27.5 -96.8-153.5 152.3 59.0 59.1 94.9 121 233 A Q - 0 0 0 -2,-0.3 -30,-0.2 -30,-0.2 21,-0.1 -0.490 50.1-107.7 -68.1 124.5 59.1 55.8 96.6 122 234 A P - 0 0 2 0, 0.0 22,-0.4 0, 0.0 2,-0.3 -0.279 40.0-169.4 -53.7 146.1 61.2 55.8 99.8 123 235 A T >> - 0 0 16 95,-0.1 3,-2.4 123,-0.1 4,-0.6 -0.858 41.1 -94.2-130.9 161.4 64.5 53.9 99.4 124 236 A V H >> S+ 0 0 107 -2,-0.3 3,-1.2 1,-0.3 4,-0.6 0.801 121.6 65.7 -51.9 -31.0 67.1 52.9 102.0 125 237 A S H >> S+ 0 0 29 1,-0.3 4,-2.1 2,-0.2 3,-0.6 0.799 91.8 64.4 -66.2 -21.8 69.1 56.1 101.3 126 238 A D H <> S+ 0 0 0 -3,-2.4 4,-2.8 1,-0.2 -1,-0.3 0.786 90.0 64.4 -69.4 -25.7 66.2 58.1 102.6 127 239 A Y H << S+ 0 0 39 -3,-1.2 5,-0.4 -4,-0.6 -1,-0.2 0.833 110.0 40.0 -65.4 -28.1 66.8 56.5 106.0 128 240 A V H << S+ 0 0 102 -4,-0.6 -2,-0.2 -3,-0.6 -1,-0.2 0.859 115.2 49.7 -85.8 -43.2 70.1 58.4 105.9 129 241 A K H < S+ 0 0 37 -4,-2.1 -2,-0.2 1,-0.3 -3,-0.2 0.894 123.3 29.7 -65.8 -42.7 68.8 61.6 104.4 130 242 A F S >< S- 0 0 0 -4,-2.8 3,-2.1 -5,-0.1 -1,-0.3 -0.762 91.7-145.7-120.5 84.5 65.9 62.0 106.8 131 243 A P T 3 S+ 0 0 99 0, 0.0 -26,-0.4 0, 0.0 -3,-0.1 -0.236 81.3 24.5 -55.9 126.2 67.1 60.4 110.1 132 244 A G T >> S+ 0 0 41 -5,-0.4 4,-1.3 -27,-0.1 3,-0.9 0.075 89.0 107.6 107.0 -18.7 64.3 58.7 112.0 133 245 A I H <> + 0 0 0 -3,-2.1 4,-2.6 1,-0.2 -6,-0.1 0.822 67.4 66.2 -62.4 -32.1 62.1 58.1 109.0 134 246 A E H 34 S+ 0 0 102 -4,-0.3 -1,-0.2 1,-0.2 -7,-0.1 0.901 107.1 42.6 -57.1 -36.9 62.8 54.4 108.9 135 247 A T H <4 S+ 0 0 121 -3,-0.9 -1,-0.2 1,-0.2 -2,-0.2 0.806 116.5 47.6 -77.9 -32.0 61.0 54.2 112.2 136 248 A L H < S+ 0 0 86 -4,-1.3 -2,-0.2 2,-0.1 -1,-0.2 0.767 87.2 96.4 -83.9 -27.8 58.1 56.5 111.2 137 249 A L S < S- 0 0 6 -4,-2.6 5,-0.1 -5,-0.1 -31,-0.0 -0.417 77.6-119.8 -66.0 136.0 57.2 55.1 107.8 138 250 A P > - 0 0 44 0, 0.0 3,-2.2 0, 0.0 4,-0.4 -0.426 28.6-109.6 -71.7 151.7 54.3 52.7 107.7 139 251 A P G > S+ 0 0 114 0, 0.0 3,-1.2 0, 0.0 -2,-0.1 0.806 115.4 60.7 -53.6 -33.1 55.2 49.2 106.4 140 252 A N G 3 S+ 0 0 94 1,-0.2 -50,-0.3 3,-0.0 -3,-0.0 0.548 103.9 51.0 -74.5 -3.8 53.2 49.6 103.1 141 253 A A G < S+ 0 0 0 -3,-2.2 3,-0.3 -52,-0.1 2,-0.3 0.412 97.5 85.9-108.0 -2.2 55.5 52.6 102.2 142 254 A K S < S+ 0 0 73 -3,-1.2 -19,-0.1 -4,-0.4 -52,-0.0 -0.762 91.7 8.9-102.2 148.1 58.7 50.7 102.8 143 255 A G S S+ 0 0 69 -2,-0.3 -1,-0.2 1,-0.2 -20,-0.1 0.672 79.5 162.9 61.8 21.3 60.6 48.5 100.4 144 256 A Q - 0 0 30 -22,-0.4 -1,-0.2 -3,-0.3 -3,-0.0 -0.378 19.8-172.2 -69.5 151.6 58.5 49.3 97.3 145 257 A N + 0 0 95 -2,-0.1 2,-0.5 -22,-0.0 -1,-0.1 -0.216 20.2 153.1-142.9 50.0 60.0 48.5 93.9 146 258 A I + 0 0 24 -82,-0.1 44,-2.6 2,-0.0 2,-0.3 -0.701 8.2 138.1 -92.3 126.4 57.8 49.9 91.2 147 259 A T - 0 0 5 -2,-0.5 -82,-2.8 42,-0.2 2,-0.8 -0.930 42.0-145.0-160.4 135.3 59.3 50.8 87.8 148 260 A S E -gj 65 168A 0 19,-2.7 21,-2.3 -2,-0.3 2,-0.4 -0.918 37.7-167.5-102.1 101.0 58.0 50.3 84.2 149 261 A T E -gj 66 169A 6 -84,-2.5 -82,-2.5 -2,-0.8 2,-0.7 -0.821 27.0-156.2-107.1 131.1 61.3 49.6 82.5 150 262 A L E -gj 67 170A 2 19,-2.5 21,-2.5 -2,-0.4 2,-0.6 -0.901 23.0-164.8 -95.3 112.7 62.2 49.5 78.8 151 263 A E E -gj 68 171A 3 -84,-2.4 -82,-2.9 -2,-0.7 2,-0.6 -0.920 10.7-163.7-107.3 119.7 65.4 47.4 78.7 152 264 A I E -gj 69 172A 2 19,-3.1 21,-2.7 -2,-0.6 2,-0.5 -0.920 21.3-154.6 -98.7 120.2 67.5 47.4 75.6 153 265 A R E -gj 70 173A 74 -84,-2.4 -82,-0.6 -2,-0.6 -81,-0.2 -0.888 53.0 -30.5-114.0 126.7 69.7 44.4 75.8 154 266 A E S S+ 0 0 147 19,-3.4 2,-0.2 -2,-0.5 -1,-0.2 0.848 92.1 142.1 42.8 48.4 73.1 43.8 74.2 155 267 A C - 0 0 4 18,-0.2 21,-1.5 -3,-0.2 2,-0.4 -0.701 38.6-146.7-110.2 167.5 72.3 46.0 71.2 156 268 A I B S+j 176 0E 82 -84,-0.5 -80,-0.3 -2,-0.2 -81,-0.3 -0.998 72.5 9.2-138.6 137.0 74.5 48.4 69.2 157 269 A G S S+ 0 0 13 19,-1.9 -82,-2.5 -2,-0.4 2,-0.5 0.869 83.7 144.1 65.1 37.5 73.7 51.6 67.5 158 270 A V - 0 0 0 18,-0.4 21,-1.4 -84,-0.2 2,-0.4 -0.935 30.9-162.8-110.9 128.8 70.2 51.8 68.8 159 271 A E E -hk 77 179A 53 -83,-2.3 -81,-2.3 -2,-0.5 2,-0.6 -0.922 8.9-155.7-115.5 140.1 68.7 55.3 69.7 160 272 A V E -hk 78 180A 0 19,-3.0 21,-2.9 -2,-0.4 2,-0.4 -0.960 19.3-165.2-114.0 116.9 65.7 56.0 71.9 161 273 A H E -hk 79 181A 24 -83,-3.5 -81,-2.5 -2,-0.6 -80,-0.5 -0.865 57.0 -9.6-110.7 141.3 64.1 59.4 71.1 162 274 A R S S+ 0 0 120 19,-2.0 21,-0.2 -2,-0.4 -1,-0.2 0.827 78.7 178.2 47.0 46.6 61.5 61.5 73.0 163 275 A A + 0 0 0 18,-0.4 21,-1.9 -3,-0.2 2,-0.3 -0.388 5.2 162.3 -74.8 156.2 60.8 58.8 75.6 164 276 A S E +i 82 0A 21 -83,-2.7 -81,-2.1 19,-0.1 2,-0.2 -0.866 2.5 136.7-156.8-174.9 58.3 59.5 78.4 165 277 A G E -i 83 0A 3 -83,-0.3 22,-2.7 19,-0.3 2,-0.5 -0.827 48.0 -89.0 148.6 174.1 56.2 57.7 81.0 166 278 A L E S-il 84 187A 44 -83,-2.2 -81,-1.3 -2,-0.2 22,-0.1 -0.985 110.8 -0.2-120.5 127.9 55.0 57.5 84.6 167 279 A M E S+ 0 0 1 20,-0.6 -19,-2.7 -51,-0.6 22,-0.3 0.866 105.4 168.0 58.8 37.8 57.2 55.5 87.1 168 280 A A E -jl 148 188A 0 19,-2.7 21,-0.8 -3,-0.2 2,-0.3 -0.551 24.2-178.0 -91.9 147.5 59.3 55.0 84.0 169 281 A G E -j 149 0A 0 -21,-2.3 -19,-2.5 -2,-0.2 2,-0.5 -0.994 12.1-157.1-141.9 147.7 62.8 53.6 83.6 170 282 A F E -jm 150 194A 3 23,-2.2 25,-2.6 22,-0.4 2,-0.5 -0.959 14.0-176.1-131.3 118.0 65.2 53.1 80.6 171 283 A L E -jm 151 195A 19 -21,-2.5 -19,-3.1 -2,-0.5 2,-0.7 -0.930 16.1-168.6-121.5 120.6 68.0 50.5 80.8 172 284 A F E -jm 152 196A 2 23,-3.1 25,-2.7 -2,-0.5 2,-0.6 -0.920 17.7-169.2-103.5 109.4 70.7 49.8 78.3 173 285 A R E S-jm 153 197A 78 -21,-2.7 -19,-3.4 -2,-0.7 25,-0.2 -0.921 70.3 -13.0-105.3 114.9 72.3 46.6 79.4 174 286 A G S S+ 0 0 19 23,-3.2 -1,-0.2 -2,-0.6 2,-0.2 0.745 99.7 148.5 70.4 25.7 75.5 45.6 77.6 175 287 A C - 0 0 0 22,-0.5 2,-0.3 -21,-0.2 30,-0.3 -0.502 30.1-165.4 -94.5 162.0 74.9 48.2 74.9 176 288 A H B +j 156 0E 25 -21,-1.5 -19,-1.9 -2,-0.2 -18,-0.4 -0.989 68.4 11.8-144.1 144.5 77.3 50.2 72.8 177 289 A F S S+ 0 0 88 28,-2.9 2,-0.3 -2,-0.3 30,-0.2 0.844 89.7 141.3 57.9 37.6 76.9 53.2 70.6 178 290 A C - 0 0 0 27,-0.2 30,-2.0 -21,-0.2 2,-0.4 -0.772 33.5-159.5-109.3 156.2 73.4 53.8 72.0 179 291 A K E -kn 159 208A 55 -21,-1.4 -19,-3.0 -2,-0.3 2,-0.7 -0.993 21.2-151.6-141.3 142.3 71.8 57.1 72.7 180 292 A M E -kn 160 209A 1 28,-2.3 30,-2.6 -2,-0.4 2,-0.4 -0.950 35.3-169.5-108.7 103.1 68.9 58.4 74.8 181 293 A V E -kn 161 210A 16 -21,-2.9 -19,-2.0 -2,-0.7 -18,-0.4 -0.858 52.9 -16.3-107.7 133.8 67.9 61.5 72.8 182 294 A D S S- 0 0 82 28,-2.7 -1,-0.2 -2,-0.4 30,-0.2 0.843 71.9-154.2 46.8 49.7 65.5 64.3 73.8 183 295 A A - 0 0 5 -3,-0.2 2,-1.7 27,-0.2 30,-0.4 -0.333 12.2-134.8 -54.0 122.1 63.9 62.5 76.7 184 296 A N - 0 0 104 -21,-1.9 -19,-0.3 -3,-0.2 -1,-0.1 -0.478 55.4 -75.4 -84.7 63.8 60.4 64.1 77.0 185 297 A N - 0 0 59 -2,-1.7 29,-0.3 28,-1.0 -20,-0.2 0.858 60.6-167.1 48.3 54.0 60.3 64.5 80.7 186 298 A P - 0 0 0 0, 0.0 29,-2.3 0, 0.0 2,-0.6 -0.445 19.7-128.6 -68.1 145.7 59.6 61.0 81.9 187 299 A S E -lo 166 215A 8 -22,-2.7 -19,-2.7 27,-0.2 -20,-0.6 -0.866 34.3-126.7 -94.7 120.1 58.7 60.7 85.6 188 300 A G E -lo 168 216A 3 27,-2.4 29,-0.6 -2,-0.6 -21,-0.4 -0.118 18.9-154.9 -74.1 165.3 60.9 58.1 87.2 189 301 A G - 0 0 1 -21,-0.8 29,-2.9 2,-0.4 30,-0.4 -0.120 53.0 -56.7-111.1-149.6 60.2 55.0 89.3 190 302 A K S S+ 0 0 56 -44,-2.6 -43,-0.1 27,-0.2 3,-0.1 0.894 116.0 56.1 -66.1 -42.1 62.2 53.1 91.8 191 303 A D S S- 0 0 69 1,-0.2 -2,-0.4 -45,-0.1 28,-0.4 -0.222 106.8 -65.5 -84.8 176.7 65.2 52.5 89.6 192 304 A G - 0 0 4 1,-0.1 -22,-0.4 26,-0.1 3,-0.2 -0.231 40.3-137.4 -59.1 149.9 67.5 54.9 87.7 193 305 A I S S+ 0 0 1 27,-1.3 -23,-2.2 1,-0.3 2,-0.5 0.910 92.3 18.3 -78.9 -43.0 65.6 56.8 84.9 194 306 A I E S+mp 170 222A 1 27,-2.1 29,-2.6 26,-0.3 2,-0.4 -0.975 79.8 175.8-131.4 114.4 68.4 56.4 82.3 195 307 A T E -mp 171 223A 10 -25,-2.6 -23,-3.1 -2,-0.5 2,-0.7 -0.983 21.8-168.1-127.7 128.6 71.0 53.7 83.0 196 308 A F E -mp 172 224A 0 27,-2.6 29,-2.6 -2,-0.4 2,-0.5 -0.923 21.8-179.5-113.3 100.7 73.9 52.5 80.8 197 309 A E E +mp 173 225A 36 -25,-2.7 -23,-3.2 -2,-0.7 -22,-0.5 -0.913 18.0 162.9-108.5 126.5 75.1 49.3 82.5 198 310 A N + 0 0 1 27,-1.4 6,-0.2 -2,-0.5 -25,-0.1 -0.374 23.0 136.8-137.9 54.8 78.0 47.4 81.1 199 311 A L S S+ 0 0 36 4,-0.1 2,-0.3 61,-0.0 -1,-0.1 0.702 70.9 48.2 -75.3 -20.1 79.1 45.1 83.9 200 312 A S S S+ 0 0 95 2,-0.1 2,-0.1 -3,-0.1 -26,-0.1 -0.825 107.6 5.8-119.1 160.3 79.5 42.2 81.5 201 313 A G S S- 0 0 62 -2,-0.3 3,-0.1 2,-0.0 2,-0.1 -0.392 112.9 -6.8 70.6-149.0 81.3 42.0 78.2 202 314 A D S S- 0 0 124 1,-0.1 2,-0.1 -28,-0.1 -2,-0.1 -0.314 85.7 -86.8 -77.2 161.9 83.3 45.0 77.0 203 315 A W - 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