Protein Data Bank File : 4aaha Title : OXIDOREDUCTASE (PQQ(A)-CHOH(D)) 10-MAR-96 4AAH Number of Amino Acid Residues : 571 Amino Acid Sequence : 1 2 3 4 5 6 7 8 9 10 0 ASP ALA ASP LEU ASP LYS GLN VAL ASN THR 10 ALA GLY ALA TRP PRO ILE ALA THR GLY GLY 20 TYR TYR SER GLN HIS ASN SER PRO LEU ALA 30 GLN ILE ASN LYS SER ASN VAL LYS ASN VAL 40 LYS ALA ALA TRP SER PHE SER THR GLY VAL 50 LEU ASN GLY HIS GLU GLY ALA PRO LEU VAL 60 ILE GLY ASP MET MET TYR VAL HIS SER ALA 70 PHE PRO ASN ASN THR TYR ALA LEU ASN LEU 80 ASN ASP PRO GLY LYS ILE VAL TRP GLN HIS 90 LYS PRO LYS GLN ASP ALA SER THR LYS ALA 100 VAL MET CYS CYS ASP VAL VAL ASP ARG GLY 110 LEU ALA TYR GLY ALA GLY GLN ILE VAL LYS 120 LYS GLN ALA ASN GLY HIS LEU LEU ALA LEU 130 ASP ALA LYS THR GLY LYS ILE ASN TRP GLU 140 VAL GLU VAL CYS ASP PRO LYS VAL GLY SER 150 THR LEU THR GLN ALA PRO PHE VAL ALA LYS 160 ASP THR VAL LEU MET GLY CYS SER GLY ALA 170 GLU LEU GLY VAL ARG GLY ALA VAL ASN ALA 180 PHE ASP LEU LYS THR GLY GLU LEU LYS TRP 190 ARG ALA PHE ALA THR GLY SER ASP ASP SER 200 VAL ARG LEU ALA LYS ASP PHE ASN SER ALA 210 ASN PRO HIS TYR GLY GLN PHE GLY LEU GLY 220 THR LYS THR TRP GLU GLY ASP ALA TRP LYS 230 ILE GLY GLY GLY THR ASN TRP GLY TRP TYR 240 ALA TYR ASP PRO LYS LEU ASN LEU PHE TYR 250 TYR GLY SER GLY ASN PRO ALA PRO TRP ASN 260 GLU THR MET ARG PRO GLY ASP ASN LYS TRP 270 THR MET THR ILE TRP GLY ARG ASP LEU ASP 280 THR GLY MET ALA LYS TRP GLY TYR GLN LYS 290 THR PRO HIS ASP GLU TRP ASP PHE ALA GLY 300 VAL ASN GLN MET VAL LEU THR ASP GLN PRO 310 VAL ASN GLY LYS MET THR PRO LEU LEU SER 320 HIS ILE ASP ARG ASN GLY ILE LEU TYR THR 330 LEU ASN ARG GLU ASN GLY ASN LEU ILE VAL 340 ALA GLU LYS VAL ASP PRO ALA VAL ASN VAL 350 PHE LYS LYS VAL ASP LEU LYS THR GLY THR 360 PRO VAL ARG ASP PRO GLU PHE ALA THR ARG 370 MET ASP HIS LYS GLY THR ASN ILE CYS PRO 380 SER ALA MET GLY PHE HIS ASN GLN GLY VAL 390 ASP SER TYR ASP PRO GLU SER ARG THR LEU 400 TYR ALA GLY LEU ASN HIS ILE CYS MET ASP 410 TRP GLU PRO PHE MET LEU PRO TYR ARG ALA 420 GLY GLN PHE PHE VAL GLY ALA THR LEU ALA 430 MET TYR PRO GLY PRO ASN GLY PRO THR LYS 440 LYS GLU MET GLY GLN ILE ARG ALA PHE ASP 450 LEU THR THR GLY LYS ALA LYS TRP THR LYS 460 TRP GLU LYS PHE ALA ALA TRP GLY GLY THR 470 LEU TYR THR LYS GLY GLY LEU VAL TRP TYR 480 ALA THR LEU ASP GLY TYR LEU LYS ALA LEU 490 ASP ASN LYS ASP GLY LYS GLU LEU TRP ASN 500 PHE LYS MET PRO SER GLY GLY ILE GLY SER 510 PRO MET THR TYR SER PHE LYS GLY LYS GLN 520 TYR ILE GLY SER MET TYR GLY VAL GLY GLY 530 TRP PRO GLY VAL GLY LEU VAL PHE ASP LEU 540 THR ASP PRO SER ALA GLY LEU GLY ALA VAL 550 GLY ALA PHE ARG GLU LEU GLN ASN HIS THR 560 GLN MET GLY GLY GLY LEU MET VAL PHE SER 570 LEU Main and Side Chain Dihedral Angles : Residue Type Phi Psi Omega Chi 1 Chi 2 Chi 3 Chi 4 1 ASP 0.0 -175.9 179.5 74.9 -60.9 2 ALA -63.4 -38.3 175.0 3 ASP -62.3 -48.6 -179.4 -168.7 50.5 4 LEU -66.2 -36.0 -179.2 168.2 70.4 5 ASP -60.1 -39.2 179.4 -76.2 -39.8 6 LYS -60.3 -53.3 -179.4 -168.7 174.8 157.8 -111.4 7 GLN -57.7 -44.6 -179.4 -59.9 -47.0 -39.4 8 VAL -62.2 -31.3 -179.3 161.6 9 ASN -87.2 -3.6 -178.0 -80.9 -47.7 10 THR -93.1 133.3 -179.4 -41.4 11 ALA -70.1 132.1 177.5 12 GLY 84.9 -5.5 175.2 13 ALA -83.8 167.8 -179.3 14 TRP -154.1 73.9 -177.2 -177.3 -80.4 15 PRO -88.9 -2.4 -177.9 33.9 -31.5 16 ILE -130.2 127.3 -178.7 -60.5 170.5 17 ALA -43.7 -52.0 -178.0 18 THR -83.4 2.7 175.2 47.9 19 GLY 104.9 -20.2 -176.9 20 GLY 159.8 174.7 -179.7 21 TYR -50.5 -41.9 -178.9 -76.2 -46.0 22 TYR -78.8 -16.0 178.0 -77.7 12.3 23 SER 59.0 46.7 175.2 -46.2 24 GLN -88.0 -10.7 177.7 -67.8 -178.4 -1.3 25 HIS 42.8 59.3 -179.3 -160.0 -100.7 26 ASN -137.8 175.6 179.9 60.2 -147.4 27 SER -149.6 137.8 178.0 -179.7 28 PRO -74.0 -6.5 -179.3 21.2 -20.7 29 LEU -66.0 122.6 -178.4 -53.1 179.2 30 ALA -122.1 13.1 178.5 31 GLN -61.7 -41.1 176.1 164.3 -168.8 102.4 32 ILE -90.6 131.1 -178.5 -54.2 171.6 33 ASN -145.3 178.4 -178.0 54.4 52.8 34 LYS -55.3 -20.8 -174.1 -72.8 163.1 -171.0 -156.3 35 SER -96.2 -18.4 -178.5 63.9 36 ASN -93.4 -46.2 -171.5 -108.8 -7.4 37 VAL -35.8 -44.7 -179.2 81.5 38 LYS -54.1 -22.3 -178.7 -95.2 -175.9 -151.6 160.5 39 ASN -97.4 4.0 -179.9 -53.2 -45.6 40 VAL -63.1 143.7 178.6 171.8 41 LYS -144.1 159.6 177.8 77.4 -148.8 167.2 66.5 42 ALA -58.1 139.2 -179.0 43 ALA -108.2 -34.9 -177.7 44 TRP 179.2 164.5 -177.5 69.8 -102.8 45 SER -145.5 167.4 -177.7 45.3 46 PHE -150.3 129.8 177.0 179.2 87.5 47 SER -100.7 139.9 -179.0 165.1 48 THR -85.6 -19.7 -178.1 63.7 49 GLY 76.7 21.9 -178.8 50 VAL -130.6 147.6 178.6 171.3 51 LEU -99.6 -151.7 177.3 -78.9 -21.3 52 ASN 69.4 177.1 -174.8 -61.3 -90.4 53 GLY -60.8 125.5 179.3 54 HIS -110.4 93.4 178.9 -76.5 64.7 55 GLU -96.8 168.1 179.0 -86.8 171.4 7.2 56 GLY 82.7 -164.4 179.9 57 ALA -157.5 159.8 -177.4 58 PRO -75.5 165.7 177.9 27.6 -29.3 59 LEU -104.5 140.7 174.5 -75.3 -169.6 60 VAL -120.8 119.6 178.0 166.4 61 ILE -131.2 100.2 179.3 -53.8 111.4 62 GLY 78.3 -122.4 178.5 63 ASP -105.6 17.5 179.7 55.8 -2.6 64 MET -110.6 141.9 173.7 -58.4 -96.4 150.6 65 MET -116.6 136.3 179.9 -166.2 -171.3 -83.0 66 TYR -122.2 117.0 -177.8 -56.4 85.9 67 VAL -112.0 147.7 180.0 -169.3 68 HIS -135.2 155.1 -179.2 77.8 -68.6 69 SER -119.2 178.6 174.4 72.8 70 ALA -68.7 -176.0 175.9 71 PHE -50.8 140.6 2.7 179.2 87.9 72 PRO -80.3 23.4 173.1 34.1 -32.9 73 ASN 59.3 62.2 179.0 -48.8 108.2 74 ASN -85.8 156.0 178.2 -53.7 -29.5 75 THR -123.4 130.0 177.5 -55.3 76 TYR -120.3 124.3 177.5 -50.5 -74.8 77 ALA -102.9 124.5 179.8 78 LEU -120.2 139.4 173.5 -53.6 178.5 79 ASN -92.3 126.6 -178.6 -174.7 -71.8 80 LEU -58.8 -13.0 179.6 -105.3 20.9 81 ASN -76.1 -15.0 179.7 -89.5 -80.6 82 ASP -168.1 83.4 179.3 173.6 6.3 83 PRO -50.8 -19.2 -179.3 -23.9 27.6 84 GLY -71.2 -19.5 179.2 85 LYS -107.4 132.3 178.3 -25.3 -133.1 163.5 97.0 86 ILE -94.7 98.0 -178.0 -63.0 -178.9 87 VAL -56.3 -44.9 178.4 179.4 88 TRP -157.6 152.3 178.2 62.8 -91.0 89 GLN -140.4 151.3 178.5 56.4 -161.5 -95.1 90 HIS -127.7 123.5 -177.4 172.4 82.7 91 LYS -131.1 97.5 -177.4 -69.1 -173.2 138.1 -175.1 92 PRO -66.4 155.1 175.1 -13.9 26.3 93 LYS -105.8 107.2 -180.0 -168.0 158.2 169.1 -22.3 94 GLN -128.1 142.8 176.0 -70.1 178.5 68.2 95 ASP -62.5 142.2 -178.5 -163.0 -52.6 96 ALA -77.0 -10.0 179.5 97 SER -72.5 -31.2 176.3 30.7 98 THR -44.1 -41.7 -177.7 -53.1 99 LYS -57.9 -35.9 -178.0 -73.4 156.4 61.0 165.9 100 ALA -73.3 -10.1 179.6 101 VAL -112.9 27.8 -179.0 -80.5 102 MET -118.3 119.6 -177.1 -73.9 177.0 112.0 103 CYS -72.1 -35.8 -169.9 73.3 104 CYS -131.7 52.0 -178.7 -44.6 105 ASP 87.6 154.8 -175.8 -163.7 19.6 106 VAL -90.3 52.6 -178.3 -54.5 107 VAL -76.4 167.7 -178.5 -74.6 108 ASP -153.6 117.8 -178.0 -178.6 -24.5 109 ARG -83.7 2.8 174.1 -49.3 -159.3 179.0 64.3 110 GLY 126.0 178.3 -179.4 111 LEU -97.3 163.1 175.5 -53.2 -177.2 112 ALA -132.7 159.4 -178.8 113 TYR -131.9 136.3 177.0 170.6 84.5 114 GLY -161.8 144.5 176.4 115 ALA 43.9 46.5 177.9 116 GLY 59.1 33.2 179.5 117 GLN -133.1 154.0 177.6 -46.9 167.2 -61.1 118 ILE -100.7 122.7 -179.5 -67.1 -69.6 119 VAL -99.9 122.6 -176.5 -178.1 120 LYS -139.2 150.7 177.3 137.4 -151.7 -160.8 100.7 121 LYS -116.0 176.3 178.8 43.4 109.1 -167.4 -16.3 122 GLN -134.4 141.6 179.8 -71.8 172.6 22.6 123 ALA -51.5 -32.1 -175.7 124 ASN -78.5 12.1 177.6 76.2 -22.9 125 GLY 94.9 3.2 179.9 126 HIS -88.9 152.8 -179.5 -65.0 -147.3 127 LEU -132.4 132.8 -178.0 165.3 63.0 128 LEU -145.8 160.9 179.6 40.1 163.4 129 ALA -120.7 125.7 -176.7 130 LEU -127.0 142.5 177.9 -39.6 153.6 131 ASP -59.1 142.4 -179.2 170.8 53.6 132 ALA -79.5 -14.4 -178.3 133 LYS -101.8 -29.8 -179.7 -25.5 -142.8 85.2 -83.6 134 THR -118.0 -24.0 179.6 72.2 135 GLY 83.4 8.1 178.2 136 LYS -67.1 137.9 179.4 178.6 -122.9 -58.9 165.5 137 ILE -75.3 111.9 178.6 -62.4 -175.7 138 ASN -78.2 -48.7 -179.0 -73.3 -22.4 139 TRP -154.1 149.9 178.2 45.6 -92.5 140 GLU -139.8 115.3 -179.8 -171.8 167.8 3.0 141 VAL -123.9 164.9 177.3 -52.2 142 GLU -98.3 127.5 178.9 -53.7 169.1 69.6 143 VAL -107.1 -37.9 -178.0 -171.0 144 CYS -130.3 165.5 179.6 -38.5 145 ASP -131.2 107.9 179.7 -174.6 -5.5 146 PRO -59.4 -20.4 -178.3 -27.1 42.0 147 LYS -71.8 -10.6 176.9 -50.8 175.5 -154.3 91.0 148 VAL -120.6 25.1 -178.9 -64.7 149 GLY 61.3 30.5 -178.1 150 SER -105.5 121.2 -178.0 -175.8 151 THR -136.7 167.9 179.2 60.3 152 LEU -107.5 140.9 178.9 -68.7 170.8 153 THR -147.7 -29.7 -177.0 77.3 154 GLN -77.3 166.7 177.4 75.0 164.0 -179.9 155 ALA -80.2 147.9 177.7 156 PRO -69.4 165.3 179.1 -23.1 42.9 157 PHE -129.6 139.8 178.3 -172.1 81.6 158 VAL -126.9 135.2 178.3 170.1 159 ALA -151.0 126.2 -176.9 160 LYS 55.9 -133.5 -178.8 -73.6 159.8 93.8 -156.7 161 ASP -100.9 31.3 -179.0 -58.1 5.8 162 THR -125.6 139.6 175.7 -68.3 163 VAL -119.0 127.9 179.4 12.1 164 LEU -103.5 133.0 178.6 -57.2 178.5 165 MET -142.9 137.4 177.9 -83.6 -107.8 95.1 166 GLY -134.0 138.0 179.9 167 CYS -78.4 158.7 178.8 -57.9 168 SER -109.7 159.8 177.9 -65.2 169 GLY 141.7 12.3 -178.9 170 ALA -57.8 -29.2 178.0 171 GLU -71.7 -9.0 177.8 -72.5 36.7 -79.9 172 LEU -112.8 11.7 -179.4 -56.1 -61.5 173 GLY 69.2 38.0 -179.8 174 VAL -86.9 137.4 -178.5 168.5 175 ARG -89.7 109.5 -179.0 175.0 165.7 164.4 -108.4 176 GLY -59.2 144.1 177.0 177 ALA -158.7 149.0 174.3 178 VAL -100.4 122.0 -179.0 37.9 179 ASN -100.5 136.2 179.3 -51.3 101.4 180 ALA -116.5 124.1 180.0 181 PHE -122.4 158.9 176.5 -53.8 80.1 182 ASP -77.3 122.1 -179.6 -167.9 -51.3 183 LEU -51.6 -47.8 -177.8 -141.3 -155.5 184 LYS -69.0 -34.8 -177.8 -96.9 117.8 -89.0 -167.2 185 THR -130.5 -8.8 -180.0 81.2 186 GLY 73.3 15.7 176.7 187 GLU -83.1 140.7 -178.1 142.0 -177.1 45.5 188 LEU -66.3 135.2 -178.4 178.8 83.6 189 LYS -97.0 -50.8 -179.6 -80.2 162.8 111.8 -99.1 190 TRP -168.6 164.9 -178.4 47.6 -101.8 191 ARG -137.4 132.2 -178.7 -174.0 167.0 -72.4 148.6 192 ALA -123.8 105.5 -178.3 193 PHE -75.4 163.0 179.9 -57.5 80.2 194 ALA -93.7 -17.6 179.7 195 THR -135.7 170.5 180.0 80.9 196 GLY 102.8 -164.2 -179.2 197 SER -69.7 157.5 179.8 65.5 198 ASP -55.1 -33.6 -179.4 -72.2 1.1 199 ASP -69.7 -44.0 -178.7 -58.8 53.8 200 SER -71.0 -37.1 -179.6 49.4 201 VAL -76.9 -25.4 179.4 170.4 202 ARG 63.6 67.8 177.7 -78.2 -141.6 166.6 -144.2 203 LEU -99.6 137.0 176.2 -53.2 -169.1 204 ALA -77.0 163.4 -178.8 205 LYS -66.0 -18.8 179.7 -59.3 -150.3 -168.1 63.2 206 ASP -98.4 13.1 178.7 52.3 -90.0 207 PHE -45.6 117.6 176.6 -176.4 57.7 208 ASN 57.8 17.0 -179.1 -91.1 -25.5 209 SER -49.3 -30.7 -178.8 75.1 210 ALA -84.2 -14.6 -178.5 211 ASN -141.5 61.1 -177.5 -78.1 -69.4 212 PRO -53.4 -24.5 -178.2 17.7 -30.2 213 HIS -73.5 -9.7 -179.9 55.8 -56.9 214 TYR -74.8 -29.3 -178.0 -78.0 -7.4 215 GLY 117.6 160.9 -179.4 216 GLN -136.4 -108.2 -174.7 -66.1 -169.8 114.1 217 PHE -88.3 139.5 -179.2 -44.9 -86.0 218 GLY 77.3 1.0 -179.4 219 LEU -67.1 -22.8 -179.2 -58.4 169.7 220 GLY -54.0 -31.1 -179.6 221 THR -118.5 -38.8 -179.0 62.4 222 LYS -65.9 -27.0 -179.5 -40.2 -149.7 -174.1 -144.8 223 THR -83.6 13.7 177.7 63.3 224 TRP -138.7 144.1 178.3 -53.8 85.2 225 GLU -92.6 113.3 179.8 179.5 172.6 -30.2 226 GLY 73.2 -147.8 179.9 227 ASP -89.8 21.1 -175.8 -66.9 -19.2 228 ALA -61.7 -26.3 -179.6 229 TRP -69.9 -14.2 -175.7 54.6 -86.9 230 LYS -65.2 -23.0 -179.7 -83.7 174.6 170.7 -159.0 231 ILE -133.6 40.3 -177.6 51.3 156.3 232 GLY -79.6 -5.6 178.7 233 GLY 78.7 -146.4 -178.8 234 GLY 80.9 22.5 -178.9 235 THR -69.8 146.6 179.1 55.2 236 ASN -107.6 101.7 -178.5 60.1 -65.7 237 TRP -116.8 13.9 179.5 51.7 -84.3 238 GLY -95.6 -134.4 -178.6 239 TRP -119.5 159.2 176.7 -43.6 90.4 240 TYR -111.3 169.7 175.6 -51.8 87.8 241 ALA -148.8 157.6 -178.5 242 TYR -147.9 143.8 178.1 173.1 67.0 243 ASP -118.3 100.2 -179.4 -169.7 -35.8 244 PRO -59.6 -38.2 177.3 -23.3 40.2 245 LYS -58.0 -66.8 179.2 -136.3 -154.9 -176.2 -158.4 246 LEU -64.9 -24.1 -178.3 -88.1 14.7 247 ASN 65.5 28.0 178.5 -171.0 -129.6 248 LEU -108.5 144.5 177.7 -64.7 179.4 249 PHE -122.2 146.0 -178.4 71.6 86.4 250 TYR -122.3 151.8 179.3 -44.3 82.4 251 TYR -172.4 161.2 178.2 70.8 -83.3 252 GLY -103.0 147.7 178.4 253 SER -102.8 152.7 -174.2 69.3 254 GLY -79.4 -158.2 -177.7 255 ASN -82.4 149.5 177.6 62.3 -76.9 256 PRO -75.8 158.7 178.7 35.0 -39.9 257 ALA -114.7 147.5 -1.5 258 PRO -80.4 -175.2 178.1 31.7 -35.6 259 TRP -69.1 -24.9 -179.3 -76.7 16.4 260 ASN -68.9 94.5 -178.6 -180.0 -28.0 261 GLU -51.6 -38.7 -179.7 82.3 85.0 43.3 262 THR -67.3 -11.7 179.6 -48.4 263 MET -91.4 -5.0 -178.2 -58.4 -167.6 43.4 264 ARG -146.6 67.7 177.9 53.4 172.0 169.0 76.9 265 PRO -50.7 156.1 179.3 13.5 -33.9 266 GLY 114.1 173.0 -179.9 267 ASP -79.8 -15.0 178.7 -100.0 13.0 268 ASN 57.4 43.0 -179.1 -59.5 -44.1 269 LYS -74.6 149.3 1.6 -79.9 -177.7 155.0 67.3 270 TRP -106.8 44.9 177.6 -77.3 101.0 271 THR -76.4 167.7 179.6 68.2 272 MET 49.2 40.3 -179.2 -53.9 -64.3 -128.1 273 THR -130.4 147.2 177.3 105.8 274 ILE -89.2 127.8 -179.3 -50.8 171.8 275 TRP -109.3 153.6 176.9 -62.2 99.1 276 GLY -132.7 92.5 -176.8 277 ARG -116.9 141.1 178.0 -49.8 -163.6 -178.0 -100.8 278 ASP -64.7 125.6 179.9 171.2 83.3 279 LEU -57.4 -42.3 -178.1 178.8 59.7 280 ASP -70.3 -44.1 -178.2 -63.9 -29.7 281 THR -104.6 -18.9 -176.5 63.0 282 GLY 73.1 8.0 -178.6 283 MET -72.7 131.3 -179.0 -52.3 -67.4 -78.2 284 ALA -69.5 129.3 179.0 285 LYS -92.9 -39.4 177.3 153.1 70.3 62.9 -175.3 286 TRP -154.1 160.0 179.6 57.6 -93.0 287 GLY -162.5 127.1 177.8 288 TYR -124.3 119.6 178.1 165.9 79.7 289 GLN -80.8 115.0 -176.3 -166.0 -174.2 41.6 290 LYS -78.3 -34.8 -177.3 -59.2 152.2 -65.0 176.4 291 THR -134.6 90.1 179.5 -52.2 292 PRO -69.9 141.2 -179.8 -13.5 28.3 293 HIS 47.3 66.9 -179.6 -166.7 67.2 294 ASP -57.2 143.1 180.0 169.3 56.7 295 GLU -132.5 1.7 -177.7 -68.5 172.3 26.1 296 TRP -132.6 4.6 -176.5 -45.8 -81.9 297 ASP 66.4 51.2 177.2 176.9 57.7 298 PHE -94.0 51.2 -177.7 -61.8 -33.1 299 ALA -36.5 116.5 -176.3 300 GLY -82.9 51.6 -178.1 301 VAL -96.1 -11.7 179.9 -64.8 302 ASN -41.5 156.5 -179.5 -60.7 -1.5 303 GLN -50.0 144.9 176.5 -173.5 -163.2 -175.9 304 MET -109.4 125.1 179.3 -49.6 -79.2 162.8 305 VAL -116.2 119.2 -179.3 177.7 306 LEU -97.9 124.9 177.9 -47.4 -167.5 307 THR -133.2 163.7 176.2 89.4 308 ASP -119.5 103.7 -177.0 -61.7 -20.5 309 GLN -140.3 153.2 176.6 -61.3 -169.6 64.7 310 PRO -69.9 126.0 179.0 26.9 -31.5 311 VAL -127.3 110.1 -178.0 175.6 312 ASN 68.1 35.3 179.5 -76.1 -37.4 313 GLY 70.3 12.1 175.4 314 LYS -115.5 147.3 -178.5 19.6 -156.1 -150.9 169.1 315 MET -77.2 118.7 179.1 -171.8 70.4 42.1 316 THR -129.5 144.1 178.3 146.3 317 PRO -78.6 100.6 178.6 24.8 -18.3 318 LEU -97.3 158.7 174.1 -40.9 171.3 319 LEU -129.4 132.7 179.4 172.2 160.3 320 SER -129.3 154.0 -175.8 -74.8 321 HIS -174.3 135.6 178.1 161.6 87.1 322 ILE -105.9 114.9 -176.9 -59.2 146.8 323 ASP -85.4 162.9 176.7 -172.2 81.4 324 ARG -59.8 -29.6 -179.5 -109.3 162.0 86.9 -176.3 325 ASN -65.3 -20.7 176.3 73.4 13.7 326 GLY 102.2 13.0 178.0 327 ILE -110.5 133.8 173.9 -49.7 -65.2 328 LEU -87.9 124.1 179.5 161.1 40.4 329 TYR -112.0 133.8 173.5 -63.4 -88.0 330 THR -127.3 122.9 -179.8 -60.7 331 LEU -124.8 168.5 176.6 -44.3 -138.3 332 ASN -91.9 128.1 -176.7 165.3 -48.5 333 ARG -74.8 -9.0 -178.9 67.5 -177.2 -172.3 -102.3 334 GLU -78.4 -60.1 -179.1 -142.3 151.6 0.1 335 ASN -113.8 -4.2 178.8 55.1 -137.4 336 GLY 87.7 23.2 -179.5 337 ASN -72.4 138.6 178.3 -64.8 -12.7 338 LEU -74.4 116.1 177.9 -143.9 -16.2 339 ILE -110.4 -44.0 -177.2 -56.0 -171.5 340 VAL -136.2 144.0 -179.9 173.6 341 ALA -155.8 76.0 -178.2 342 GLU -114.5 152.1 177.8 -72.1 -64.2 -44.0 343 LYS -67.8 132.0 179.3 -67.0 177.8 161.8 -164.5 344 VAL -74.9 -22.8 178.5 -74.4 345 ASP -151.1 138.3 -177.4 -168.5 -80.5 346 PRO -59.0 -15.3 -179.8 1.6 -1.7 347 ALA -67.1 -21.4 -179.3 348 VAL -59.5 124.0 -179.2 -179.2 349 ASN -133.0 6.7 178.9 65.9 23.7 350 VAL -68.0 -33.1 -179.6 -88.2 351 PHE -119.5 142.1 175.3 -46.4 -37.8 352 LYS -68.9 -39.5 178.4 -87.7 140.0 -160.3 -75.6 353 LYS 177.6 179.6 178.3 49.0 101.0 176.3 -143.0 354 VAL -115.3 119.7 -178.1 3.8 355 ASP -76.4 115.1 -179.2 -164.3 -63.7 356 LEU -66.2 -23.4 179.0 -60.8 169.0 357 LYS -77.3 -54.0 -178.1 -54.7 -178.9 -166.7 143.2 358 THR -78.3 -18.0 179.5 94.7 359 GLY 67.5 27.0 -175.1 360 THR -123.8 141.6 177.2 -113.3 361 PRO -67.9 130.6 179.0 4.5 -0.9 362 VAL -89.6 92.2 -179.4 -175.9 363 ARG -58.0 145.3 179.3 -36.7 175.4 83.8 94.2 364 ASP -117.2 113.6 -175.1 -179.6 -23.4 365 PRO -59.9 -29.7 -176.7 -33.1 50.9 366 GLU -65.2 -25.9 -179.1 156.4 170.6 39.4 367 PHE -112.3 28.5 178.2 -52.9 -74.2 368 ALA -98.8 175.6 177.6 369 THR -127.3 141.7 179.9 72.0 370 ARG -158.7 161.6 178.0 36.5 -148.6 -160.9 65.5 371 MET -58.2 161.2 -179.7 -83.4 -66.4 -85.0 372 ASP 48.6 21.5 -179.8 -48.8 -64.2 373 HIS -145.1 130.1 177.6 166.1 74.4 374 LYS -98.2 113.5 177.1 172.1 -174.3 -175.0 -151.7 375 GLY -77.1 142.3 -179.3 376 THR -134.6 148.4 -179.5 63.6 377 ASN 58.7 37.0 178.4 -52.2 -88.1 378 ILE -83.4 127.8 179.7 -53.1 177.1 379 CYS -127.7 129.9 1.2 -56.3 380 PRO -77.6 167.5 175.8 -12.3 31.5 381 SER -75.6 176.6 178.0 86.0 382 ALA -62.6 -22.6 179.0 383 MET -73.0 -18.0 178.8 -75.3 -172.2 76.5 384 GLY 71.3 177.0 179.8 385 PHE -91.4 0.4 177.8 -88.5 13.0 386 HIS -164.2 136.4 -179.6 -165.2 -72.2 387 ASN -123.3 -141.0 -176.6 -159.7 -83.0 388 GLN -61.6 -10.8 -178.4 152.3 -67.0 -17.8 389 GLY -67.6 152.6 177.3 390 VAL -105.1 115.4 -179.6 -9.4 391 ASP -84.5 164.0 179.5 -62.4 -28.1 392 SER -116.3 169.8 179.9 46.7 393 TYR -133.8 125.5 176.6 178.1 74.9 394 ASP -94.6 110.4 -176.4 167.1 21.1 395 PRO -71.3 -18.1 -179.4 28.3 -33.5 396 GLU -81.1 -53.3 -178.0 -83.7 176.5 40.9 397 SER -90.8 -2.3 -178.8 71.0 398 ARG 57.4 57.7 -179.3 -102.1 128.4 50.8 40.7 399 THR -125.4 142.0 178.1 -40.4 400 LEU -111.1 129.4 -178.5 178.4 103.9 401 TYR -105.6 109.0 -174.1 -47.4 -84.2 402 ALA -103.4 141.7 175.5 403 GLY -101.0 109.0 -175.8 404 LEU -118.5 155.1 176.5 -61.0 177.8 405 ASN -105.5 148.1 177.4 -35.1 144.7 406 HIS -125.3 78.1 -175.9 -159.4 55.9 407 ILE -138.0 134.5 179.2 -64.6 158.2 408 CYS -119.6 171.3 -178.4 -58.2 409 MET -144.9 176.3 176.7 74.9 -177.6 161.8 410 ASP -123.3 134.6 -175.2 -64.1 -22.3 411 TRP -147.6 131.1 177.9 179.7 -51.7 412 GLU -143.8 122.5 -178.1 178.5 159.7 -2.4 413 PRO -87.5 171.1 179.4 27.9 -21.8 414 PHE -155.7 153.9 -177.5 66.6 84.7 415 MET -82.5 150.2 -179.3 -55.3 -90.1 -41.1 416 LEU -170.4 153.4 179.4 53.6 39.5 417 PRO -79.3 178.8 177.4 23.2 -24.8 418 TYR -122.1 121.6 176.5 170.9 79.1 419 ARG -128.1 112.6 -179.7 -47.8 -138.6 171.1 -63.1 420 ALA -46.6 102.8 178.7 421 GLY 117.6 3.9 -179.8 422 GLN -121.4 163.9 179.3 -47.9 -83.5 -50.3 423 PHE -70.7 145.2 -179.3 -82.5 -82.5 424 PHE -132.1 56.2 -177.7 -165.7 40.4 425 VAL -86.4 -69.5 178.1 -178.6 426 GLY 77.0 41.0 177.3 427 ALA -153.7 152.8 178.8 428 THR -124.9 121.7 -178.1 -57.0 429 LEU -126.7 165.2 175.1 -57.1 55.0 430 ALA -136.7 130.2 179.7 431 MET -117.8 153.3 -176.5 -60.3 -174.2 -154.8 432 TYR -164.6 165.6 -177.5 42.0 87.8 433 PRO -66.7 147.8 178.6 1.8 6.3 434 GLY -68.4 179.2 -176.9 435 PRO -88.3 -14.5 -175.0 34.8 -36.0 436 ASN -89.7 -1.8 -179.8 -53.6 139.0 437 GLY -59.5 147.6 -179.9 438 PRO -57.9 -17.0 177.8 -22.5 36.5 439 THR -132.1 16.5 179.1 69.1 440 LYS 63.3 8.7 -179.8 -90.6 59.3 93.9 177.7 441 LYS -106.9 -33.9 -176.2 -100.0 90.2 171.9 -83.3 442 GLU -58.3 142.0 178.7 -48.0 48.6 37.3 443 MET -119.5 9.4 -179.9 -58.6 -169.1 -87.8 444 GLY -146.4 156.7 178.9 445 GLN -152.2 149.6 172.9 -31.8 142.0 -89.8 446 ILE -111.3 112.8 -178.6 -52.8 -69.0 447 ARG -120.6 135.9 178.2 -170.5 167.6 -100.3 161.1 448 ALA -96.4 132.1 179.0 449 PHE -121.9 153.9 172.7 -67.4 -79.0 450 ASP -96.3 118.4 -174.5 -174.1 -56.5 451 LEU -74.8 -21.3 -177.5 -59.6 175.0 452 THR -88.5 -22.0 176.5 69.6 453 THR -109.7 -18.3 -178.4 82.0 454 GLY 68.2 17.8 -179.0 455 LYS -98.7 146.6 -175.9 -53.0 -128.7 93.7 101.2 456 ALA -90.0 130.3 179.1 457 LYS -86.0 -38.5 -178.3 -45.0 -172.5 -165.0 -175.3 458 TRP -159.6 161.0 179.3 55.1 -102.2 459 THR -136.2 135.9 176.1 -64.5 460 LYS -119.8 120.9 -179.7 -155.9 -65.2 -156.7 -86.1 461 TRP -87.0 149.4 178.4 -78.7 90.2 462 GLU -131.8 148.6 -178.2 -83.2 -69.9 -24.5 463 LYS -60.4 -43.9 -180.0 -178.5 -178.7 -148.5 163.3 464 PHE -115.3 166.5 -179.7 -70.4 -86.0 465 ALA -50.6 143.8 176.7 466 ALA -92.3 74.3 -176.4 467 TRP -69.0 -39.6 -173.7 -147.6 -107.2 468 GLY -77.3 -38.6 179.2 469 GLY 124.4 -163.6 178.7 470 THR -143.5 156.9 176.7 74.0 471 LEU -126.4 146.9 179.9 161.2 87.7 472 TYR -125.0 125.2 178.1 -177.1 70.6 473 THR -120.5 140.6 -177.3 69.3 474 LYS -51.2 -13.2 178.3 -168.5 147.6 161.2 -97.6 475 GLY -72.8 -2.3 178.9 476 GLY 90.2 29.0 -176.9 477 LEU -122.3 148.3 174.4 -78.2 -27.8 478 VAL -116.5 108.8 -179.0 19.5 479 TRP -93.3 129.1 176.7 -60.2 93.0 480 TYR -152.9 156.0 177.6 69.0 -78.4 481 ALA -106.9 147.0 -179.1 482 THR -116.1 159.0 -177.6 80.8 483 LEU -63.5 -27.7 -178.2 -70.9 180.0 484 ASP -86.8 5.2 177.4 55.5 -50.2 485 GLY 97.4 19.0 -179.2 486 TYR -116.9 157.1 177.3 -68.2 88.1 487 LEU -113.4 129.3 -177.2 178.4 74.6 488 LYS -128.3 155.6 177.6 -44.8 -155.7 165.7 164.7 489 ALA -129.6 119.1 179.0 490 LEU -108.3 154.6 175.5 -51.2 172.5 491 ASP -76.0 118.2 -177.3 -179.2 -16.0 492 ASN -57.3 -34.7 177.8 75.8 -28.4 493 LYS -54.7 -50.5 -176.5 -100.1 47.4 -161.0 135.9 494 ASP -125.9 -4.2 -178.9 53.7 1.9 495 GLY 77.5 19.9 178.3 496 LYS -81.1 142.6 -178.3 48.7 167.7 -180.0 -55.7 497 GLU -75.0 119.5 -179.6 -112.3 -161.5 75.5 498 LEU -100.2 -22.0 -175.8 -93.4 27.5 499 TRP -172.1 159.5 176.8 177.5 93.1 500 ASN -163.1 165.9 -180.0 66.5 34.9 501 PHE -154.5 136.7 179.8 -177.5 90.1 502 LYS -87.2 108.3 179.1 177.5 61.6 -165.9 50.5 503 MET -85.2 164.6 -177.9 -63.7 -167.1 -65.7 504 PRO -57.1 -44.0 -178.6 -18.5 31.2 505 SER -137.0 163.0 178.2 -160.0 506 GLY -58.6 159.3 -177.5 507 GLY -112.7 137.9 178.5 508 ILE -119.7 9.6 178.0 56.3 162.0 509 GLY -114.0 -174.1 178.2 510 SER -114.4 146.5 -178.1 -162.3 511 PRO -66.7 161.2 177.9 -23.8 38.8 512 MET -135.9 167.0 -179.2 50.9 78.3 81.6 513 THR -143.9 152.3 -176.8 -166.6 514 TYR -157.9 170.0 -179.1 67.3 -83.2 515 SER -124.8 141.6 178.6 -137.0 516 PHE -147.4 124.1 -179.3 174.7 72.0 517 LYS 43.3 54.7 177.9 -53.7 -65.6 77.4 150.6 518 GLY 65.7 18.8 178.6 519 LYS -123.8 137.0 178.6 -135.7 -177.1 143.7 128.7 520 GLN -87.5 131.5 178.1 -177.8 -171.4 15.7 521 TYR -126.7 147.2 175.5 -63.4 83.4 522 ILE -109.2 123.8 180.0 -55.8 -70.4 523 GLY -108.7 137.4 176.4 524 SER -145.2 139.4 175.2 -172.7 525 MET -81.2 161.8 179.2 -62.7 -56.3 -68.0 526 TYR -146.8 150.0 -175.2 67.2 81.2 527 GLY 123.0 93.0 -178.4 528 VAL -70.1 149.2 -178.0 78.9 529 GLY 167.7 -146.6 -178.3 530 GLY 77.7 -169.0 180.0 531 TRP -56.6 -42.0 -179.0 -159.0 -4.5 532 PRO -57.4 -38.1 -178.3 -16.9 28.8 533 GLY -96.8 20.1 -178.9 534 VAL -68.2 -34.3 -179.0 -63.1 535 GLY -64.6 -52.6 178.8 536 LEU -62.1 -38.7 -177.6 161.6 59.1 537 VAL -78.3 -31.7 -178.0 160.4 538 PHE -110.7 -1.1 -178.8 -63.3 -81.6 539 ASP 71.3 62.7 178.4 -85.5 40.1 540 LEU -107.3 143.3 179.9 -80.2 -22.6 541 THR -121.7 -24.2 178.8 46.8 542 ASP -71.1 121.4 -179.6 -160.0 54.8 543 PRO -57.0 -36.5 -178.9 18.3 -29.8 544 SER -79.0 -23.4 -179.5 151.6 545 ALA -65.4 161.2 -179.7 546 GLY 62.3 40.8 178.0 547 LEU 56.7 25.0 177.5 -65.2 154.6 548 GLY 102.9 -13.8 -179.8 549 ALA -64.7 -35.3 -176.9 550 VAL -55.3 -49.2 179.4 165.9 551 GLY -57.1 -50.6 -178.5 552 ALA -52.2 -51.5 -177.8 553 PHE -95.1 29.6 -179.0 -67.4 88.1 554 ARG -54.1 -46.4 179.8 60.4 178.1 -157.7 -89.8 555 GLU -70.2 -11.2 -177.1 -74.1 -134.2 36.3 556 LEU -57.2 -37.7 177.6 -134.6 -139.7 557 GLN -48.6 -30.7 -177.8 -171.6 -124.5 43.5 558 ASN -98.8 10.6 -177.8 -45.6 121.0 559 HIS -125.9 -28.9 -175.9 -65.7 -104.2 560 THR -157.9 166.6 176.8 -170.9 561 GLN -132.5 174.2 178.7 -55.6 -69.4 -48.9 562 MET -57.7 167.7 -178.5 -74.6 -163.3 -73.3 563 GLY -176.2 -179.0 -178.4 564 GLY -174.7 99.1 178.3 565 GLY 173.6 -164.1 -178.6 566 LEU -127.4 141.0 172.1 176.6 83.6 567 MET -125.5 138.5 177.7 -59.5 -141.1 55.9 568 VAL -118.9 142.0 -178.5 175.8 569 PHE -128.1 163.3 180.0 -56.0 81.8 570 SER -178.1 178.8 -179.9 75.1 571 LEU -83.6 156.4 0.0 -111.9 25.5 Alpha Carbon Cartesian Coordinates : Residue Type X Y Z 1 ASP -30.225 4.382 34.754 2 ALA -31.970 1.138 35.722 3 ASP -33.988 1.515 32.548 4 LEU -30.765 1.886 30.486 5 ASP -29.212 -0.918 32.540 6 LYS -32.135 -3.049 31.454 7 GLN -31.626 -2.188 27.754 8 VAL -27.865 -2.710 28.026 9 ASN -28.580 -6.161 29.468 10 THR -30.998 -7.180 26.694 11 ALA -29.615 -9.173 23.758 12 GLY -29.900 -7.412 20.398 13 ALA -30.799 -3.961 21.781 14 TRP -28.460 -1.031 21.094 15 PRO -29.241 1.748 23.571 16 ILE -25.779 3.301 23.648 17 ALA -24.055 5.118 20.839 18 THR -20.728 3.552 21.671 19 GLY -21.951 0.019 22.273 20 GLY -21.942 0.207 26.057 21 TYR -20.626 1.968 29.103 22 TYR -17.065 0.956 28.195 23 SER -17.384 2.106 24.589 24 GLN -15.789 -0.968 23.028 25 HIS -18.367 -0.692 20.228 26 ASN -18.755 -4.439 19.660 27 SER -21.389 -7.173 19.702 28 PRO -21.772 -10.757 20.822 29 LEU -24.101 -11.373 17.835 30 ALA -22.644 -14.152 15.706 31 GLN -25.479 -15.196 13.406 32 ILE -23.580 -13.391 10.598 33 ASN -20.000 -14.762 10.394 34 LYS -17.023 -15.183 8.086 35 SER -18.700 -18.157 6.415 36 ASN -21.999 -16.390 5.922 37 VAL -21.043 -12.844 5.201 38 LYS -21.016 -13.215 1.442 39 ASN -24.801 -13.637 1.544 40 VAL -25.679 -10.512 3.589 41 LYS -28.068 -8.355 1.536 42 ALA -29.952 -5.055 1.943 43 ALA -33.124 -5.558 3.996 44 TRP -34.690 -2.081 3.903 45 SER -33.789 1.628 3.861 46 PHE -34.915 4.998 5.091 47 SER -34.240 8.569 3.895 48 THR -34.143 11.354 6.491 49 GLY -34.984 13.919 3.818 50 VAL -32.022 16.170 4.896 51 LEU -28.639 16.264 3.080 52 ASN -25.208 16.994 4.616 53 GLY -23.198 14.781 6.941 54 HIS -25.074 11.958 8.595 55 GLU -22.971 11.046 11.624 56 GLY -23.787 8.638 14.458 57 ALA -26.010 5.545 14.110 58 PRO -29.595 4.797 15.197 59 LEU -30.598 3.389 18.616 60 VAL -32.542 0.119 18.989 61 ILE -34.660 -0.245 22.112 62 GLY -37.102 -3.181 22.069 63 ASP -38.896 -3.244 18.701 64 MET -38.263 0.453 18.166 65 MET -35.598 2.112 16.062 66 TYR -34.642 5.797 16.512 67 VAL -32.997 7.601 13.584 68 HIS -31.450 11.078 13.576 69 SER -30.343 13.517 10.861 70 ALA -27.975 16.415 10.301 71 PHE -29.272 19.942 11.090 72 PRO -32.197 20.621 11.582 73 ASN -31.797 17.522 13.737 74 ASN -35.080 15.642 13.194 75 THR -35.969 12.467 15.027 76 TYR -37.809 9.456 13.567 77 ALA -39.224 6.570 15.621 78 LEU -39.947 3.338 13.644 79 ASN -41.436 0.031 14.908 80 LEU -39.246 -2.798 13.601 81 ASN -42.494 -4.659 12.914 82 ASP -43.053 -2.364 9.927 83 PRO -40.211 -0.082 8.960 84 GLY -42.612 1.591 6.516 85 LYS -44.420 3.439 9.274 86 ILE -43.031 6.394 11.158 87 VAL -44.586 6.161 14.637 88 TRP -43.548 9.638 15.774 89 GLN -41.087 12.184 14.518 90 HIS -39.569 15.290 16.138 91 LYS -38.721 18.132 13.788 92 PRO -37.325 21.269 15.375 93 LYS -37.857 24.834 14.314 94 GLN -34.320 26.236 14.390 95 ASP -32.893 29.486 13.118 96 ALA -30.725 29.015 10.004 97 SER -27.957 31.272 11.387 98 THR -26.954 28.430 13.669 99 LYS -25.374 26.940 10.572 100 ALA -22.953 29.807 10.148 101 VAL -21.300 29.266 13.584 102 MET -20.547 25.563 12.914 103 CYS -16.994 24.821 11.760 104 CYS -17.187 21.376 10.267 105 ASP -20.593 20.653 8.731 106 VAL -24.029 20.722 10.403 107 VAL -23.530 17.233 11.786 108 ASP -25.101 15.391 14.730 109 ARG -23.444 12.335 16.325 110 GLY -26.641 10.908 17.767 111 LEU -29.199 10.091 20.347 112 ALA -29.013 8.783 23.902 113 TYR -31.679 6.872 25.828 114 GLY -32.513 6.947 29.545 115 ALA -35.443 6.331 31.886 116 GLY -37.739 5.482 28.968 117 GLN -36.996 8.796 27.279 118 ILE -34.980 9.682 24.199 119 VAL -32.356 12.291 25.107 120 LYS -31.756 14.492 22.137 121 LYS -30.100 17.817 21.382 122 GLN -30.426 20.452 18.667 123 ALA -27.516 22.287 17.021 124 ASN -28.827 25.594 18.412 125 GLY -28.104 24.488 21.968 126 HIS -31.363 22.954 23.206 127 LEU -31.324 19.565 24.946 128 LEU -34.460 17.459 25.438 129 ALA -35.981 14.328 26.804 130 LEU -38.927 12.869 24.895 131 ASP -41.104 9.908 25.794 132 ALA -39.786 7.004 23.690 133 LYS -43.258 5.652 22.799 134 THR -45.101 8.890 21.968 135 GLY -42.327 11.423 21.492 136 LYS -43.974 13.882 23.851 137 ILE -41.487 16.441 25.149 138 ASN -40.823 15.875 28.840 139 TRP -38.370 18.830 29.282 140 GLU -36.428 21.313 27.177 141 VAL -33.408 23.350 28.314 142 GLU -30.732 25.557 26.821 143 VAL -27.144 24.274 27.075 144 CYS -25.254 26.487 24.606 145 ASP -25.607 29.838 22.901 146 PRO -24.836 30.228 19.193 147 LYS -24.508 34.025 19.532 148 VAL -21.133 33.415 21.178 149 GLY -20.370 30.693 18.574 150 SER -21.409 27.713 20.797 151 THR -23.373 24.758 19.337 152 LEU -24.310 21.080 19.948 153 THR -23.152 18.163 17.810 154 GLN -22.013 15.321 20.101 155 ALA -24.326 12.568 21.382 156 PRO -25.624 13.046 24.937 157 PHE -24.245 10.367 27.372 158 VAL -26.399 8.783 30.079 159 ALA -25.257 7.098 33.295 160 LYS -27.426 6.689 36.434 161 ASP -29.687 9.808 36.494 162 THR -27.226 12.008 34.653 163 VAL -26.889 13.259 31.114 164 LEU -23.571 14.762 30.113 165 MET -23.420 17.352 27.338 166 GLY -20.629 19.509 26.006 167 CYS -20.859 22.357 23.529 168 SER -18.764 22.772 20.389 169 GLY -17.036 25.965 19.286 170 ALA -13.280 26.154 20.033 171 GLU -12.732 27.506 16.512 172 LEU -14.973 30.398 17.640 173 GLY -12.998 30.618 20.898 174 VAL -15.623 28.939 23.164 175 ARG -14.506 27.789 26.592 176 GLY -15.242 24.130 26.982 177 ALA -17.156 22.539 29.833 178 VAL -18.901 19.226 30.419 179 ASN -22.491 19.999 31.572 180 ALA -24.427 17.534 33.779 181 PHE -28.211 17.421 33.863 182 ASP -30.824 15.435 35.747 183 LEU -32.258 12.769 33.380 184 LYS -35.663 13.209 34.975 185 THR -36.111 16.987 34.949 186 GLY -33.268 18.528 32.989 187 GLU -32.062 20.854 35.798 188 LEU -28.299 21.546 35.849 189 LYS -26.288 19.559 38.352 190 TRP -22.762 20.929 37.809 191 ARG -20.526 22.237 34.992 192 ALA -16.814 21.426 34.669 193 PHE -14.724 23.809 32.582 194 ALA -11.481 22.916 30.800 195 THR -9.742 26.204 31.700 196 GLY -9.950 28.662 34.585 197 SER -9.640 28.273 38.335 198 ASP -9.556 24.934 40.168 199 ASP -13.117 25.638 41.262 200 SER -14.411 26.104 37.665 201 VAL -12.388 23.136 36.443 202 ARG -13.438 20.999 39.430 203 LEU -10.320 19.194 40.609 204 ALA -10.766 17.013 43.697 205 LYS -8.200 17.472 46.497 206 ASP -6.609 14.209 45.411 207 PHE -6.331 15.397 41.814 208 ASN -3.430 13.574 40.108 209 SER -2.061 12.599 43.494 210 ALA -0.649 9.431 41.873 211 ASN 1.048 11.386 39.107 212 PRO 1.954 14.774 40.550 213 HIS 4.274 15.504 37.597 214 TYR 1.266 15.705 35.280 215 GLY 0.372 18.867 37.181 216 GLN -2.163 19.804 39.794 217 PHE -3.624 22.992 41.194 218 GLY -3.679 26.380 39.514 219 LEU -2.424 25.337 36.053 220 GLY -5.803 26.424 34.669 221 THR -4.599 30.039 34.746 222 LYS -0.816 29.939 35.272 223 THR -0.449 27.952 32.039 224 TRP -2.067 30.989 30.419 225 GLU -1.043 34.654 30.198 226 GLY -3.793 36.936 31.479 227 ASP -7.424 36.119 30.724 228 ALA -6.521 34.314 27.508 229 TRP -8.075 31.190 29.010 230 LYS -11.430 32.963 29.010 231 ILE -11.680 32.139 25.285 232 GLY -9.321 29.253 25.641 233 GLY -11.117 26.412 23.877 234 GLY -11.046 22.904 25.319 235 THR -14.608 21.973 24.267 236 ASN -15.543 18.289 24.462 237 TRP -17.451 17.302 21.314 238 GLY -16.220 13.674 21.178 239 TRP -17.163 10.493 23.071 240 TYR -17.418 9.324 26.685 241 ALA -16.864 6.061 28.577 242 TYR -17.969 4.979 32.039 243 ASP -16.883 2.615 34.771 244 PRO -19.843 1.754 37.011 245 LYS -17.522 0.088 39.540 246 LEU -15.278 3.181 39.930 247 ASN -18.186 5.507 39.183 248 LEU -15.801 7.488 36.977 249 PHE -16.562 8.720 33.448 250 TYR -13.752 9.607 31.021 251 TYR -13.429 11.996 28.085 252 GLY -10.978 14.253 26.210 253 SER -11.125 18.069 26.176 254 GLY -10.403 19.798 22.841 255 ASN -7.990 22.313 21.374 256 PRO -6.987 25.676 22.858 257 ALA -8.020 28.826 20.856 258 PRO -7.037 30.461 18.540 259 TRP -5.279 27.990 16.189 260 ASN -2.522 30.681 16.164 261 GLU -0.097 29.348 18.820 262 THR 1.899 32.592 19.201 263 MET -1.229 34.327 20.559 264 ARG -1.451 32.070 23.656 265 PRO 1.857 31.272 25.370 266 GLY 1.609 28.662 28.102 267 ASP 0.764 24.991 28.450 268 ASN -2.852 26.047 27.848 269 LYS -4.145 23.671 30.546 270 TRP -6.486 21.866 30.885 271 THR -7.222 21.583 27.160 272 MET -6.055 18.477 25.277 273 THR -6.400 16.258 28.348 274 ILE -7.841 12.920 29.239 275 TRP -10.021 13.058 32.353 276 GLY -11.170 10.675 35.128 277 ARG -14.147 12.367 36.850 278 ASP -16.610 11.273 39.514 279 LEU -19.994 10.983 37.817 280 ASP -21.942 12.392 40.796 281 THR -19.858 15.516 41.559 282 GLY -17.906 15.912 38.318 283 MET -14.723 16.428 40.422 284 ALA -11.562 15.334 38.564 285 LYS -9.759 12.279 40.023 286 TRP -6.953 12.335 37.461 287 GLY -6.316 14.334 34.296 288 TYR -3.393 13.919 31.861 289 GLN -2.700 16.623 29.197 290 LYS -1.571 14.900 25.947 291 THR -0.535 17.968 23.961 292 PRO 0.635 20.854 26.159 293 HIS 0.590 24.111 24.114 294 ASP -1.143 22.746 20.966 295 GLU 0.236 24.098 17.700 296 TRP -1.678 21.910 15.247 297 ASP -5.378 21.722 16.172 298 PHE -5.176 18.132 17.513 299 ALA -8.446 18.578 19.515 300 GLY -8.158 15.774 22.061 301 VAL -11.730 14.510 21.942 302 ASN -11.386 11.021 20.449 303 GLN -13.172 7.947 21.883 304 MET -12.100 6.450 25.217 305 VAL -12.073 2.603 25.192 306 LEU -12.073 0.798 28.526 307 THR -10.699 -2.760 28.696 308 ASP -9.594 -5.294 31.326 309 GLN -6.314 -6.765 30.147 310 PRO -3.126 -8.368 31.386 311 VAL -0.166 -6.010 31.700 312 ASN 3.110 -7.702 32.557 313 GLY 0.910 -10.744 33.032 314 LYS -1.240 -9.009 35.671 315 MET -4.883 -7.947 35.102 316 THR -5.265 -4.187 34.839 317 PRO -8.124 -1.754 34.296 318 LEU -7.076 0.176 31.148 319 LEU -8.317 3.200 29.273 320 SER -7.185 3.445 25.591 321 HIS -7.455 6.186 22.969 322 ILE -5.984 7.180 19.634 323 ASP -5.484 10.933 19.617 324 ARG -5.536 13.284 16.690 325 ASN -1.806 13.787 17.454 326 GLY -1.128 10.254 16.206 327 ILE -0.315 8.607 19.507 328 LEU -2.145 5.551 20.839 329 TYR -2.424 5.985 24.649 330 THR -2.942 3.307 27.313 331 LEU -3.408 4.445 30.919 332 ASN -4.695 2.735 34.101 333 ARG -8.277 3.999 34.356 334 GLU -8.006 3.967 38.140 335 ASN -5.271 6.507 38.861 336 GLY -4.214 7.689 35.365 337 ASN -0.852 5.922 35.051 338 LEU 0.809 6.061 31.674 339 ILE 1.307 2.578 30.300 340 VAL 1.536 3.011 26.498 341 ALA 2.176 5.979 24.275 342 GLU 3.023 4.923 20.746 343 LYS 2.843 6.444 17.292 344 VAL -0.059 5.011 15.281 345 ASP 2.026 5.495 12.100 346 PRO 5.737 6.061 11.590 347 ALA 4.755 9.135 9.571 348 VAL 4.112 11.090 12.821 349 ASN 6.744 13.794 13.203 350 VAL 5.474 16.560 15.536 351 PHE 7.073 14.686 18.438 352 LYS 10.197 12.543 18.531 353 LYS 8.235 10.361 20.949 354 VAL 6.393 10.587 24.241 355 ASP 8.594 10.122 27.288 356 LEU 6.771 7.790 29.680 357 LYS 8.858 9.129 32.557 358 THR 8.179 12.851 32.056 359 GLY 4.772 11.945 30.537 360 THR 5.449 14.510 27.915 361 PRO 5.724 14.636 24.165 362 VAL 9.320 15.284 23.113 363 ARG 8.592 18.063 20.644 364 ASP 10.472 18.446 17.343 365 PRO 11.018 22.099 16.401 366 GLU 11.238 21.420 12.736 367 PHE 7.566 20.433 12.821 368 ALA 6.187 23.124 15.112 369 THR 4.101 26.122 14.178 370 ARG 4.814 29.794 14.933 371 MET 4.204 33.277 13.542 372 ASP 6.191 34.497 10.521 373 HIS 6.994 30.888 9.656 374 LYS 5.318 28.411 7.373 375 GLY 5.630 24.890 8.748 376 THR 5.749 22.149 6.092 377 ASN 5.345 18.358 5.965 378 ILE 3.839 18.339 9.461 379 CYS 2.300 14.950 10.335 380 PRO -0.387 14.466 11.412 381 SER -2.409 17.145 9.664 382 ALA -5.040 19.081 11.633 383 MET -7.590 16.453 10.555 384 GLY -5.322 14.139 12.532 385 PHE -4.367 10.493 12.218 386 HIS -7.643 9.732 13.941 387 ASN -10.758 11.901 14.289 388 GLN -14.347 11.530 15.434 389 GLY -14.812 7.884 14.501 390 VAL -15.762 5.111 16.910 391 ASP -13.444 2.062 16.732 392 SER -14.221 -1.440 17.971 393 TYR -12.697 -3.980 20.279 394 ASP -12.485 -7.758 19.889 395 PRO -12.401 -9.022 23.478 396 GLU -11.227 -12.467 22.468 397 SER -8.048 -11.637 20.525 398 ARG -7.734 -8.368 22.443 399 THR -7.630 -6.281 19.235 400 LEU -8.794 -2.710 18.514 401 TYR -9.735 -2.037 14.874 402 ALA -8.988 1.597 14.110 403 GLY -10.136 3.923 11.370 404 LEU -7.213 6.199 10.691 405 ASN -6.502 9.060 8.332 406 HIS -3.075 9.305 6.610 407 ILE -2.937 13.052 6.007 408 CYS -0.301 15.717 6.516 409 MET -0.181 19.527 6.194 410 ASP 1.500 22.897 5.642 411 TRP 0.773 25.550 8.256 412 GLU 1.267 29.241 8.731 413 PRO -0.546 31.278 11.361 414 PHE -1.732 34.893 11.378 415 MET -2.976 37.433 13.890 416 LEU -6.599 38.363 14.382 417 PRO -8.957 39.728 16.961 418 TYR -11.637 38.024 18.904 419 ARG -15.317 38.910 18.540 420 ALA -17.765 36.823 20.567 421 GLY -19.636 34.987 17.818 422 GLN -17.064 35.050 15.018 423 PHE -14.450 32.535 13.915 424 PHE -11.112 32.630 15.740 425 VAL -8.782 30.253 13.813 426 GLY -5.850 32.334 12.609 427 ALA -4.041 29.807 10.428 428 THR -3.879 28.945 6.703 429 LEU -3.267 25.311 5.702 430 ALA -2.784 22.985 2.809 431 MET -3.472 19.238 3.419 432 TYR -2.358 16.214 1.392 433 PRO -1.873 12.473 1.816 434 GLY 0.872 11.247 4.141 435 PRO 3.875 9.418 2.800 436 ASN 3.360 5.765 3.649 437 GLY 0.440 4.898 1.324 438 PRO 1.313 2.188 -1.239 439 THR 0.991 4.747 -4.030 440 LYS 1.726 7.758 -1.850 441 LYS -1.962 8.613 -2.495 442 GLU -4.022 6.727 0.110 443 MET -5.487 8.789 2.953 444 GLY -7.044 6.004 5.091 445 GLN -6.249 2.804 6.907 446 ILE -8.019 0.295 9.053 447 ARG -5.177 -0.786 11.438 448 ALA -5.461 -3.452 14.136 449 PHE -3.716 -2.823 17.487 450 ASP -2.714 -4.546 20.763 451 LEU -3.579 -1.867 23.393 452 THR -0.970 -3.011 25.905 453 THR 1.930 -2.980 23.435 454 GLY 0.607 -0.302 21.102 455 LYS 1.787 -2.527 18.217 456 ALA -0.077 -3.156 14.976 457 LYS -1.138 -6.601 13.813 458 TRP -2.273 -5.690 10.275 459 THR -3.173 -2.835 7.950 460 LYS -5.819 -2.351 5.235 461 TRP -5.311 0.817 3.131 462 GLU -8.197 2.961 1.833 463 LYS -8.326 5.639 -0.848 464 PHE -9.922 8.223 1.510 465 ALA -9.863 8.764 5.295 466 ALA -11.532 6.073 7.433 467 TRP -13.665 8.682 9.206 468 GLY -16.621 6.859 10.784 469 GLY -15.086 3.999 12.727 470 THR -15.486 0.277 12.940 471 LEU -17.775 -2.188 14.628 472 TYR -16.822 -5.652 15.731 473 THR -19.260 -8.563 15.824 474 LYS -18.399 -11.908 17.386 475 GLY -18.857 -13.605 13.992 476 GLY -15.261 -12.499 13.330 477 LEU -15.964 -9.399 11.243 478 VAL -14.904 -5.740 11.234 479 TRP -17.621 -3.596 9.647 480 TYR -17.018 -0.025 8.392 481 ALA -18.427 2.603 6.033 482 THR -16.218 4.659 3.649 483 LEU -16.291 8.223 2.444 484 ASP -16.625 6.953 -1.137 485 GLY -19.821 5.048 -0.297 486 TYR -19.433 1.358 0.670 487 LEU -20.083 -0.648 3.827 488 LYS -17.391 -3.389 4.047 489 ALA -16.864 -6.488 6.160 490 LEU -13.298 -7.601 6.762 491 ASP -11.907 -10.807 8.222 492 ASN -10.656 -9.657 11.701 493 LYS -7.673 -12.021 11.463 494 ASP -5.949 -10.449 8.459 495 GLY -8.123 -7.544 7.356 496 LYS -9.073 -9.236 4.047 497 GLU -12.354 -8.022 2.495 498 LEU -15.246 -10.462 2.681 499 TRP -18.087 -8.255 1.468 500 ASN -19.176 -4.740 0.552 501 PHE -22.200 -2.892 -0.730 502 LYS -22.508 0.434 -2.554 503 MET -24.672 2.804 -0.492 504 PRO -26.212 5.954 -1.960 505 SER -23.559 8.129 -0.339 506 GLY -20.328 7.771 1.604 507 GLY -20.690 7.060 5.337 508 ILE -19.387 9.192 8.196 509 GLY -20.820 7.217 11.124 510 SER -19.998 3.772 12.515 511 PRO -22.180 0.710 11.930 512 MET -24.412 -0.679 14.679 513 THR -26.030 -4.131 15.018 514 TYR -29.221 -5.375 16.571 515 SER -31.527 -8.311 16.749 516 PHE -35.173 -8.450 15.850 517 LYS -37.243 -11.631 16.037 518 GLY -34.084 -13.743 16.172 519 LYS -32.422 -12.084 13.169 520 GLN -29.225 -10.040 13.287 521 TYR -29.123 -6.790 11.285 522 ILE -26.282 -4.395 10.547 523 GLY -27.297 -0.729 10.428 524 SER -25.458 2.150 8.756 525 MET -26.064 5.866 8.086 526 TYR -25.173 7.287 4.658 527 GLY -24.720 10.921 3.615 528 VAL -21.176 12.134 3.369 529 GLY -20.070 15.340 4.998 530 GLY -18.214 16.352 8.179 531 TRP -14.842 18.081 7.704 532 PRO -13.872 15.793 4.802 533 GLY -16.917 16.635 2.681 534 VAL -16.959 20.420 3.139 535 GLY -15.796 21.124 -0.450 536 LEU -18.439 18.786 -1.841 537 VAL -21.065 19.993 0.636 538 PHE -20.643 23.746 0.280 539 ASP -19.310 23.821 -3.233 540 LEU -15.763 24.909 -2.350 541 THR -13.133 24.903 -5.082 542 ASP -10.400 26.701 -3.148 543 PRO -7.786 24.255 -1.892 544 SER -7.141 26.475 1.112 545 ALA -10.878 26.783 1.841 546 GLY -12.562 24.563 4.395 547 LEU -9.539 24.985 6.669 548 GLY -7.320 23.281 4.132 549 ALA -9.614 20.288 3.725 550 VAL -10.914 21.250 0.238 551 GLY -7.621 20.596 -1.536 552 ALA -7.205 17.182 0.153 553 PHE -10.627 15.824 -0.747 554 ARG -10.874 17.220 -4.319 555 GLU -11.493 13.769 -5.770 556 LEU -14.374 12.744 -3.411 557 GLN -16.714 14.498 -5.838 558 ASN -16.132 11.813 -8.519 559 HIS -17.053 9.016 -6.194 560 THR -20.154 10.210 -4.285 561 GLN -22.643 13.090 -3.767 562 MET -24.645 14.196 -0.713 563 GLY -27.331 11.933 0.738 564 GLY -29.147 11.379 4.005 565 GLY -30.448 8.167 5.447 566 LEU -30.191 4.615 6.695 567 MET -29.597 1.188 5.193 568 VAL -30.130 -2.062 7.110 569 PHE -28.578 -5.394 6.041 570 SER -29.044 -9.022 7.093 571 LEU -28.982 -12.536 5.727 Richards-Kundrot Secondary Structure Assignment : 1 2 3 4 5 6 7 8 9 10 0 H H H H H H H H H H 10 C S S S S T T T T T 20 T T T C S S S S/S S S 30 S C T T T T/T T T T/S S 40 S S C S S S S S S/S S 50 S S S/S S S S/S S S S S 60 S/T T T T/S S S S S S T 70 T/P T T/S S S S S S S/T T 80 T T C S S S S S/S S S 90 S S S S S H H H H 3 100 3 3/T T T T S S S S S/S 110 S S S S/T T T T/S S S S 120 S S/T T T T/S S S S S S 130 S/T T T T C S S S S/S S 140 S S S S C T T T T/S S 150 S S S S S/S S S S S/T T 160 T T/S S S S S S S S/T T 170 T T/S S S S/S S S S S S 180 S S/T T T T S S S S S/S 190 S S S S/S S S S/H H H H 200 H H/S S S S C C T T T 210 T T T T T/S S S S/H H H 220 H H H H C C T T T T 230 S S S S/S S S S/S S S S 240 S S T T T T S S S S 250 S S S S S S S/P S C T 260 T T T/S S S S S C C/P C 270 C S S S S S S S/T T T 280 T S S S S/S S S S S S 290 S C C T T T T C C S 300 S S S/S S S S S S S S/T 310 T T T/S S S S S/S S S S 320 S S S/T T T T/S S S S S 330 S S/T T T T/S S S S S S 340 S S S C C C S S S S 350 C S S S S/T T T T S S 360 S S C T T T T/S S S S/T 370 T T T/S S S S S C C/P C 380 T T T T S S S S/S S S 390 S S S S/T T T T S S S 400 S S S S S/S S S S S/S S 410 S S S S S S S/S S S S 420 S S S S S S S S S S 430 S S S C C C T T T T 440 S S S S/S S S S S S S/T 450 T T T S S S S S/S S S 460 S S S/S S S S S S S S 470 S S S/T T T T/S S S S S 480 S S/T T T T/S S S S S S 490 S/T T T T S S S S S S 500 S S S S/S S S S S/S S S 510 S S S S S/T T T T/S S S 520 S S S S S S S S S/T T 530 T T H H H H H H H/S S 540 S S/T T T T/T T T T H H 550 H H H H H H H H H H/S 560 S S S S S S S S S S/S 570 S Kabsch-Sander Secondary Structure Assignment : 1 2 3 4 5 6 7 8 9 10 0 h H H H H H H H h t 10 T T t B t T T t t 20 T T t e E E 30 S S t T T g G G G g 40 E E E E E E E e S 50 S S E E 60 E T e E E E E E e t 70 T T T e E E E E E e 80 T t T T e E E E E E 90 t T g G G G 100 G g S S S 110 E E E T e E E E E 120 E e T T e E E E E E 130 E e T T t e E E E E 140 E E e g G G G g t 150 B S E E E T 160 e E E E E B g G 170 G G g t e E E E E 180 E E e T T t e E E E 190 E E E e S S h H H H 200 H h B t T T T T T T 210 g G G G g t T h H H 220 H H h t t T g G G G 230 G g S 240 E E E T T T e E E E 250 E E e S S S g 260 G G G g S t T T 270 T e E E E E E E e T 280 T t e E E E E E E e 290 t T T t S S 300 E E E E E E 310 E T T E E E E E E E 320 E E e T T e E E E E 330 E E e T T t e E E E 340 E E E e t T T t e 350 E E E E E T T T T E 360 E E E e G G G g B 370 T T B E E E E S S 380 t T T t S S S B 390 E E E T T T T E E 400 E E E E E e E E E E 410 E E E e t T 420 T t e E E E E 430 E E E e S t T T t 440 e E E E E E E e 450 T T T t e E E E E E 460 E E S S S B 470 E E E e T e E E E E 480 E e T T e E E E E E 490 E e T T t e E E E E 500 E E e S S S 510 E E E E E T T E E 520 E E E E E E t g 530 G G h H H H H H h t 540 t T T g G G h H H 550 H H h G G G G G g t 560 e E E E E E E 570 Buried Surface Area Percentages : Residue Type Buried Area % Buried % Polar Cover 1 ASP 99.5 90.0 58.5 2 ALA 0.0 0.0 82.1 3 ASP 73.5 66.5 66.4 4 LEU 146.4 99.0 47.2 5 ASP 52.8 47.8 68.7 6 LYS 36.9 21.3 88.6 7 GLN 133.0 89.5 51.1 8 VAL 85.2 71.7 53.1 9 ASN 24.9 20.6 78.3 10 THR 42.2 39.4 78.7 11 ALA 0.0 0.0 83.3 12 GLY 33.7 97.0 57.5 13 ALA 68.7 94.6 62.4 14 TRP 193.7 94.5 50.6 15 PRO 114.9 92.3 37.6 16 ILE 129.0 89.9 44.4 17 ALA 52.4 72.2 58.0 18 THR 103.2 96.6 41.0 19 GLY 33.9 97.5 59.6 20 GLY 21.5 61.9 59.6 21 TYR 158.2 87.4 45.3 22 TYR 120.3 66.5 66.5 23 SER 83.6 100.0 67.5 24 GLN 118.3 79.6 52.4 25 HIS 147.9 98.4 51.7 26 ASN 92.9 76.8 57.5 27 SER 79.0 94.5 39.2 28 PRO 33.0 26.5 75.0 29 LEU 116.3 78.7 62.6 30 ALA 40.7 56.1 76.4 31 GLN 76.9 51.8 69.2 32 ILE 143.4 99.9 38.4 33 ASN 76.7 63.4 70.5 34 LYS 109.5 63.1 61.1 35 SER 10.8 12.9 84.4 36 ASN 85.5 70.7 68.3 37 VAL 117.8 99.1 31.1 38 LYS 22.0 12.7 85.3 39 ASN 23.6 19.5 82.1 40 VAL 118.8 100.0 33.2 41 LYS 47.7 27.5 85.5 42 ALA 51.3 70.6 50.7 43 ALA 57.0 78.5 60.5 44 TRP 157.9 77.0 43.6 45 SER 44.1 52.8 60.2 46 PHE 141.3 84.7 40.1 47 SER 29.4 35.2 75.5 48 THR 106.8 99.9 43.4 49 GLY 0.0 0.0 85.9 50 VAL 99.7 83.9 70.7 51 LEU 54.5 36.9 68.4 52 ASN 91.9 76.0 49.9 53 GLY 34.8 100.0 54.0 54 HIS 149.1 99.3 54.5 55 GLU 136.2 98.3 51.1 56 GLY 27.9 80.3 56.6 57 ALA 64.6 89.0 57.4 58 PRO 124.1 99.7 32.6 59 LEU 146.5 99.2 46.6 60 VAL 118.5 99.7 40.3 61 ILE 130.6 91.0 43.7 62 GLY 0.0 0.0 83.5 63 ASP 61.7 55.9 67.3 64 MET 139.6 87.6 62.4 65 MET 159.4 100.0 26.4 66 TYR 177.7 98.2 35.1 67 VAL 118.8 100.0 29.2 68 HIS 147.1 98.0 55.7 69 SER 83.3 99.7 50.3 70 ALA 72.3 99.6 58.1 71 PHE 153.9 92.2 44.6 72 PRO 81.6 65.5 62.7 73 ASN 119.8 99.1 59.9 74 ASN 113.3 93.7 47.4 75 THR 106.7 99.8 39.6 76 TYR 173.6 95.9 42.7 77 ALA 72.6 100.0 46.3 78 LEU 147.8 100.0 37.0 79 ASN 91.3 75.5 56.4 80 LEU 144.5 97.8 39.1 81 ASN 52.6 43.5 70.5 82 ASP 57.4 52.0 65.1 83 PRO 90.7 72.8 58.6 84 GLY 0.0 0.0 80.6 85 LYS 32.8 18.9 84.8 86 ILE 96.3 67.1 59.7 87 VAL 69.4 58.4 61.8 88 TRP 183.3 89.4 48.4 89 GLN 87.0 58.6 53.6 90 HIS 122.6 81.6 47.9 91 LYS 74.6 43.0 75.7 92 PRO 119.3 95.8 66.1 93 LYS 0.0 0.0 91.6 94 GLN 147.2 99.1 53.2 95 ASP 20.3 18.3 85.8 96 ALA 13.5 18.6 78.6 97 SER 18.2 21.7 78.9 98 THR 103.7 97.0 39.0 99 LYS 91.6 52.8 56.2 100 ALA 8.2 11.3 81.6 101 VAL 99.0 83.4 54.1 102 MET 153.7 96.4 53.8 103 CYS 70.8 71.3 48.1 104 CYS 69.7 70.2 53.8 105 ASP 109.6 99.1 39.8 106 VAL 114.2 96.1 40.6 107 VAL 115.1 96.9 60.1 108 ASP 106.2 96.1 56.9 109 ARG 194.9 93.3 49.9 110 GLY 33.9 97.4 60.8 111 LEU 142.5 96.4 42.2 112 ALA 65.3 90.0 50.6 113 TYR 171.1 94.6 39.3 114 GLY 34.8 100.0 44.4 115 ALA 60.6 83.5 56.9 116 GLY 14.8 42.5 67.7 117 GLN 136.0 91.5 54.4 118 ILE 143.5 100.0 27.2 119 VAL 118.8 100.0 33.8 120 LYS 170.2 98.2 45.4 121 LYS 172.3 99.3 51.3 122 GLN 139.5 93.9 53.4 123 ALA 72.5 99.9 50.7 124 ASN 98.8 81.7 59.9 125 GLY 34.8 100.0 61.2 126 HIS 99.2 66.0 66.4 127 LEU 147.8 100.0 24.2 128 LEU 147.5 99.8 40.5 129 ALA 72.6 100.0 48.3 130 LEU 147.8 100.0 39.9 131 ASP 76.0 68.7 67.5 132 ALA 64.9 89.4 51.0 133 LYS 42.1 24.3 78.0 134 THR 34.1 31.9 71.3 135 GLY 34.0 97.6 56.0 136 LYS 39.9 23.0 86.8 137 ILE 86.8 60.5 63.3 138 ASN 91.2 75.4 61.9 139 TRP 183.4 89.5 50.6 140 GLU 86.7 62.6 57.1 141 VAL 80.8 68.0 57.1 142 GLU 23.5 16.9 79.0 143 VAL 116.8 98.3 41.0 144 CYS 93.3 94.1 48.9 145 ASP 59.3 53.7 58.2 146 PRO 97.9 78.6 62.1 147 LYS 12.8 7.4 87.2 148 VAL 52.6 44.2 67.1 149 GLY 34.8 100.0 47.1 150 SER 77.6 92.8 45.0 151 THR 103.9 97.2 44.1 152 LEU 147.8 100.0 43.1 153 THR 97.4 91.1 60.7 154 GLN 147.6 99.3 63.1 155 ALA 69.3 95.5 52.4 156 PRO 124.5 100.0 45.0 157 PHE 152.8 91.6 46.2 158 VAL 117.9 99.3 44.5 159 ALA 72.5 99.8 38.4 160 LYS 80.7 46.5 80.6 161 ASP 44.7 40.5 68.6 162 THR 103.6 96.9 54.4 163 VAL 118.8 100.0 31.2 164 LEU 147.7 99.9 28.9 165 MET 159.4 100.0 36.8 166 GLY 34.8 100.0 74.9 167 CYS 83.7 84.4 61.4 168 SER 68.2 81.6 64.5 169 GLY 29.4 84.6 56.8 170 ALA 71.3 98.2 73.9 171 GLU 119.8 86.4 47.0 172 LEU 146.2 98.9 46.5 173 GLY 34.8 100.0 49.4 174 VAL 100.6 84.7 64.5 175 ARG 165.9 79.4 58.8 176 GLY 33.1 95.1 61.5 177 ALA 64.8 89.3 61.1 178 VAL 118.8 100.0 46.7 179 ASN 114.4 94.6 47.5 180 ALA 72.6 100.0 40.5 181 PHE 159.6 95.7 39.5 182 ASP 73.1 66.1 61.6 183 LEU 147.8 100.0 46.8 184 LYS 87.5 50.5 70.2 185 THR 36.6 34.3 72.0 186 GLY 34.8 100.0 48.6 187 GLU 16.1 11.6 87.8 188 LEU 104.2 70.5 64.0 189 LYS 117.0 67.5 71.1 190 TRP 190.8 93.1 51.8 191 ARG 109.1 52.2 59.7 192 ALA 72.6 100.0 54.5 193 PHE 122.5 73.5 62.6 194 ALA 68.2 93.9 54.3 195 THR 106.9 100.0 49.7 196 GLY 34.8 99.9 51.6 197 SER 31.3 37.5 73.3 198 ASP 78.3 70.8 55.8 199 ASP 0.0 0.0 84.8 200 SER 57.2 68.4 70.7 201 VAL 118.0 99.3 48.5 202 ARG 140.9 67.5 58.7 203 LEU 147.3 99.6 42.4 204 ALA 54.6 75.2 62.5 205 LYS 0.0 0.0 87.1 206 ASP 48.9 44.2 70.3 207 PHE 166.8 100.0 43.2 208 ASN 119.9 99.2 50.0 209 SER 30.3 36.2 72.4 210 ALA 37.8 52.1 75.2 211 ASN 108.2 89.5 56.8 212 PRO 57.0 45.8 82.9 213 HIS 70.6 47.0 74.8 214 TYR 171.3 94.6 57.4 215 GLY 21.7 62.3 57.1 216 GLN 96.8 65.2 51.8 217 PHE 95.7 57.4 72.0 218 GLY 15.0 43.1 72.9 219 LEU 106.0 71.7 55.1 220 GLY 33.8 97.1 63.3 221 THR 60.4 56.5 62.6 222 LYS 23.4 13.5 83.9 223 THR 91.5 85.6 48.3 224 TRP 204.6 99.8 52.2 225 GLU 20.4 14.7 77.6 226 GLY 0.0 0.0 83.5 227 ASP 32.1 29.1 70.8 228 ALA 44.6 61.5 64.2 229 TRP 167.5 81.7 52.2 230 LYS 66.7 38.5 66.9 231 ILE 98.4 68.6 56.3 232 GLY 34.8 100.0 58.3 233 GLY 34.8 100.0 57.7 234 GLY 34.8 100.0 51.4 235 THR 106.1 99.2 54.4 236 ASN 117.0 96.8 51.4 237 TRP 167.2 81.6 66.0 238 GLY 32.0 91.9 57.3 239 TRP 192.2 93.7 43.4 240 TYR 177.8 98.2 48.6 241 ALA 72.6 100.0 47.4 242 TYR 174.1 96.2 32.4 243 ASP 108.6 98.3 44.5 244 PRO 74.2 59.6 59.9 245 LYS 5.0 2.9 88.0 246 LEU 108.9 73.7 59.5 247 ASN 95.0 78.6 70.9 248 LEU 136.6 92.4 52.1 249 PHE 166.7 100.0 25.8 250 TYR 181.0 100.0 33.4 251 TYR 173.9 96.1 42.9 252 GLY 34.8 100.0 55.2 253 SER 82.1 98.2 57.3 254 GLY 34.7 99.8 58.1 255 ASN 119.2 98.6 51.8 256 PRO 124.4 99.9 54.0 257 ALA 72.2 99.5 57.2 258 PRO 119.8 96.3 40.5 259 TRP 199.8 97.5 40.4 260 ASN 120.9 100.0 43.4 261 GLU 117.2 84.5 64.0 262 THR 54.6 51.1 68.0 263 MET 124.2 77.9 54.5 264 ARG 205.9 98.6 51.3 265 PRO 60.4 48.5 75.3 266 GLY 14.4 41.4 76.0 267 ASP 57.9 52.4 61.4 268 ASN 120.7 99.8 52.3 269 LYS 156.8 90.4 51.0 270 TRP 204.3 99.6 42.0 271 THR 106.4 99.5 50.8 272 MET 158.5 99.4 54.8 273 THR 106.9 100.0 46.7 274 ILE 143.5 100.0 29.5 275 TRP 204.6 99.8 44.8 276 GLY 34.8 100.0 46.1 277 ARG 208.7 99.9 41.9 278 ASP 72.3 65.4 66.5 279 LEU 146.5 99.1 42.5 280 ASP 50.5 45.7 82.2 281 THR 45.4 42.5 66.1 282 GLY 34.8 100.0 48.0 283 MET 96.5 60.5 64.8 284 ALA 72.6 100.0 47.2 285 LYS 93.4 53.9 67.4 286 TRP 204.4 99.7 41.4 287 GLY 34.8 100.0 46.7 288 TYR 177.9 98.3 33.4 289 GLN 146.6 98.7 51.3 290 LYS 172.8 99.6 48.6 291 THR 106.2 99.4 38.8 292 PRO 109.2 87.7 70.2 293 HIS 124.0 82.5 73.1 294 ASP 109.0 98.6 43.3 295 GLU 126.3 91.1 57.4 296 TRP 203.7 99.4 36.8 297 ASP 108.0 97.7 53.4 298 PHE 166.8 100.0 42.7 299 ALA 71.5 98.4 53.6 300 GLY 34.6 99.5 64.4 301 VAL 118.1 99.4 54.0 302 ASN 119.6 98.9 58.0 303 GLN 144.2 97.0 48.9 304 MET 159.4 100.0 45.3 305 VAL 115.2 96.9 45.3 306 LEU 147.8 100.0 38.1 307 THR 106.2 99.3 47.8 308 ASP 54.4 49.2 67.6 309 GLN 148.6 100.0 43.9 310 PRO 87.9 70.6 59.6 311 VAL 100.3 84.4 49.8 312 ASN 9.2 7.7 77.0 313 GLY 1.7 4.9 72.5 314 LYS 27.8 16.0 85.4 315 MET 57.7 36.2 68.9 316 THR 90.2 84.4 50.0 317 PRO 91.6 73.5 73.5 318 LEU 147.8 100.0 51.5 319 LEU 147.8 100.0 29.9 320 SER 82.8 99.0 43.4 321 HIS 147.4 98.1 44.8 322 ILE 141.1 98.3 35.0 323 ASP 109.8 99.3 54.3 324 ARG 201.8 96.6 59.4 325 ASN 120.9 100.0 41.8 326 GLY 34.8 100.0 44.3 327 ILE 143.1 99.8 40.4 328 LEU 147.4 99.7 37.8 329 TYR 180.7 99.8 38.9 330 THR 106.9 100.0 43.4 331 LEU 147.8 100.0 35.2 332 ASN 95.6 79.1 62.8 333 ARG 200.2 95.8 47.5 334 GLU 59.5 42.9 63.7 335 ASN 81.3 67.2 60.1 336 GLY 34.8 100.0 52.8 337 ASN 62.1 51.3 76.4 338 LEU 141.9 96.0 43.7 339 ILE 109.4 76.2 50.8 340 VAL 108.4 91.3 53.3 341 ALA 72.6 100.0 37.1 342 GLU 62.5 45.1 76.6 343 LYS 123.2 71.1 63.3 344 VAL 118.6 99.8 33.1 345 ASP 109.3 98.9 51.2 346 PRO 31.4 25.2 84.8 347 ALA 65.4 90.1 51.6 348 VAL 118.8 100.0 45.1 349 ASN 85.4 70.7 61.3 350 VAL 118.8 100.0 40.1 351 PHE 166.8 100.0 38.3 352 LYS 64.1 37.0 71.7 353 LYS 66.7 38.5 66.1 354 VAL 118.3 99.6 42.9 355 ASP 85.0 77.0 59.9 356 LEU 74.1 50.1 71.8 357 LYS 3.8 2.2 89.9 358 THR 39.7 37.2 67.2 359 GLY 34.3 98.5 57.0 360 THR 52.4 49.0 67.0 361 PRO 123.3 99.1 47.2 362 VAL 66.0 55.6 60.5 363 ARG 143.2 68.5 58.6 364 ASP 91.5 82.9 54.4 365 PRO 27.6 22.2 78.9 366 GLU 27.6 19.9 76.2 367 PHE 137.7 82.5 66.7 368 ALA 55.0 75.7 67.7 369 THR 106.8 99.9 40.5 370 ARG 89.6 42.9 74.8 371 MET 121.4 76.1 60.0 372 ASP 8.6 7.8 80.7 373 HIS 97.0 64.6 80.7 374 LYS 77.8 44.9 70.2 375 GLY 34.5 99.2 62.1 376 THR 54.9 51.3 75.4 377 ASN 31.0 25.7 75.3 378 ILE 143.5 100.0 47.8 379 CYS 93.1 93.9 44.9 380 PRO 124.5 100.0 40.4 381 SER 83.6 100.0 43.7 382 ALA 72.6 100.0 41.1 383 MET 159.4 100.0 30.1 384 GLY 34.8 100.0 63.8 385 PHE 165.9 99.4 44.7 386 HIS 147.4 98.1 62.8 387 ASN 115.5 95.5 50.8 388 GLN 141.5 95.3 58.5 389 GLY 32.2 92.5 67.1 390 VAL 111.4 93.8 48.4 391 ASP 108.6 98.2 52.9 392 SER 83.5 99.9 51.3 393 TYR 173.9 96.1 42.1 394 ASP 106.9 96.7 50.1 395 PRO 63.8 51.3 69.4 396 GLU 26.2 18.9 78.6 397 SER 53.7 64.3 80.2 398 ARG 124.8 59.7 74.2 399 THR 103.3 96.6 53.9 400 LEU 143.7 97.2 30.9 401 TYR 179.4 99.1 43.8 402 ALA 72.6 100.0 42.3 403 GLY 34.6 99.3 53.8 404 LEU 147.1 99.5 46.0 405 ASN 120.5 99.7 50.7 406 HIS 150.2 100.0 46.6 407 ILE 143.5 100.0 35.2 408 CYS 96.6 97.4 35.3 409 MET 159.4 100.0 35.5 410 ASP 88.3 79.9 52.6 411 TRP 204.6 99.8 34.9 412 GLU 73.0 52.7 63.5 413 PRO 124.4 99.9 56.8 414 PHE 77.9 46.7 72.5 415 MET 66.9 42.0 61.0 416 LEU 114.6 77.5 49.4 417 PRO 41.4 33.2 73.5 418 TYR 131.1 72.4 50.9 419 ARG 56.2 26.9 71.4 420 ALA 36.4 50.1 65.9 421 GLY 30.1 86.5 67.5 422 GLN 42.7 28.8 76.5 423 PHE 99.1 59.4 58.7 424 PHE 161.6 96.9 40.6 425 VAL 106.5 89.7 40.9 426 GLY 34.8 100.0 44.1 427 ALA 72.6 100.0 41.8 428 THR 37.8 35.4 70.4 429 LEU 146.0 98.8 38.3 430 ALA 28.0 38.5 68.1 431 MET 159.4 100.0 38.6 432 TYR 119.5 66.0 63.5 433 PRO 90.4 72.6 57.3 434 GLY 34.3 98.5 46.3 435 PRO 62.4 50.1 62.4 436 ASN 64.3 53.2 63.0 437 GLY 34.8 100.0 49.0 438 PRO 58.9 47.3 65.0 439 THR 33.8 31.6 73.7 440 LYS 37.7 21.8 87.9 441 LYS 32.8 18.9 82.9 442 GLU 114.7 82.7 52.3 443 MET 147.0 92.2 45.5 444 GLY 34.8 100.0 59.0 445 GLN 148.0 99.6 45.5 446 ILE 143.3 99.9 29.8 447 ARG 180.0 86.2 50.4 448 ALA 72.6 100.0 41.5 449 PHE 164.1 98.4 38.8 450 ASP 84.1 76.1 72.1 451 LEU 147.7 99.9 44.0 452 THR 93.7 87.6 54.3 453 THR 46.0 43.0 71.1 454 GLY 34.8 100.0 48.5 455 LYS 38.7 22.3 82.1 456 ALA 49.3 67.9 61.3 457 LYS 103.7 59.8 72.0 458 TRP 174.8 85.3 51.7 459 THR 89.5 83.7 59.1 460 LYS 128.6 74.2 65.7 461 TRP 167.3 81.6 52.3 462 GLU 126.2 91.0 58.6 463 LYS 78.8 45.4 68.9 464 PHE 164.4 98.6 35.7 465 ALA 72.6 100.0 37.1 466 ALA 67.5 92.9 57.8 467 TRP 199.6 97.4 49.5 468 GLY 34.8 99.9 68.8 469 GLY 34.4 98.9 64.2 470 THR 106.9 100.0 49.2 471 LEU 147.8 100.0 40.5 472 TYR 168.1 92.9 50.4 473 THR 106.8 99.9 53.0 474 LYS 73.7 42.5 74.0 475 GLY 31.3 89.9 59.5 476 GLY 28.1 80.8 60.7 477 LEU 147.8 100.0 41.9 478 VAL 118.8 100.0 32.4 479 TRP 204.9 99.9 26.9 480 TYR 179.6 99.2 33.5 481 ALA 72.1 99.4 56.8 482 THR 101.3 94.7 62.4 483 LEU 147.5 99.8 36.1 484 ASP 91.6 82.9 49.2 485 GLY 34.8 99.9 62.1 486 TYR 111.2 61.4 64.6 487 LEU 147.8 100.0 30.7 488 LYS 149.4 86.1 56.1 489 ALA 72.6 100.0 34.5 490 LEU 147.8 100.0 38.3 491 ASP 102.2 92.5 52.8 492 ASN 116.7 96.5 54.2 493 LYS 65.7 37.9 84.1 494 ASP 53.6 48.5 64.7 495 GLY 34.5 99.2 50.3 496 LYS 70.2 40.5 75.6 497 GLU 103.3 74.6 66.1 498 LEU 123.8 83.8 47.0 499 TRP 178.7 87.2 46.6 500 ASN 70.1 58.0 57.0 501 PHE 94.6 56.7 55.7 502 LYS 92.8 53.5 70.5 503 MET 159.4 100.0 43.8 504 PRO 63.0 50.6 57.8 505 SER 83.4 99.8 58.5 506 GLY 34.8 100.0 58.1 507 GLY 34.8 99.9 60.2 508 ILE 143.5 100.0 48.3 509 GLY 31.9 91.5 72.7 510 SER 79.8 95.4 59.6 511 PRO 124.5 100.0 48.6 512 MET 159.4 100.0 34.4 513 THR 106.2 99.3 35.2 514 TYR 179.4 99.1 29.4 515 SER 61.6 73.7 54.3 516 PHE 139.6 83.7 53.8 517 LYS 41.5 23.9 78.0 518 GLY 0.0 0.0 86.0 519 LYS 94.5 54.5 80.8 520 GLN 146.5 98.6 47.7 521 TYR 149.8 82.8 48.1 522 ILE 143.5 100.0 34.4 523 GLY 34.8 100.0 43.9 524 SER 82.1 98.3 42.5 525 MET 159.4 100.0 50.4 526 TYR 164.2 90.7 47.6 527 GLY 34.8 100.0 64.9 528 VAL 118.8 100.0 41.5 529 GLY 34.8 100.0 51.2 530 GLY 33.4 96.1 59.5 531 TRP 193.1 94.2 37.7 532 PRO 124.5 100.0 33.6 533 GLY 34.5 99.2 54.1 534 VAL 110.3 92.9 45.0 535 GLY 27.9 80.3 55.5 536 LEU 126.2 85.4 51.2 537 VAL 117.8 99.2 46.0 538 PHE 88.1 52.8 62.7 539 ASP 4.3 3.9 88.9 540 LEU 93.6 63.3 58.4 541 THR 0.0 0.0 85.0 542 ASP 37.5 33.9 65.5 543 PRO 45.6 36.6 73.8 544 SER 42.0 50.2 71.7 545 ALA 44.9 61.8 62.5 546 GLY 19.9 57.1 50.5 547 LEU 110.0 74.4 52.8 548 GLY 34.8 100.0 64.1 549 ALA 72.6 100.0 47.4 550 VAL 110.0 92.6 53.6 551 GLY 20.4 58.6 62.1 552 ALA 69.4 95.7 48.1 553 PHE 163.2 97.8 36.8 554 ARG 35.9 17.2 87.4 555 GLU 68.8 49.6 71.9 556 LEU 147.1 99.5 32.0 557 GLN 52.8 35.5 81.2 558 ASN 38.8 32.1 81.6 559 HIS 102.5 68.2 65.6 560 THR 99.1 92.7 56.9 561 GLN 41.5 27.9 76.7 562 MET 111.4 69.9 58.9 563 GLY 23.7 68.0 50.6 564 GLY 34.6 99.3 64.6 565 GLY 34.8 100.0 49.0 566 LEU 147.8 100.0 26.9 567 MET 141.5 88.8 35.3 568 VAL 118.8 100.0 38.4 569 PHE 166.8 100.0 30.1 570 SER 78.7 94.2 43.3 571 LEU 120.0 81.2 59.6