Protein Data Bank File : 1zncb Title : LYASE 17-SEP-96 1ZNC Number of Amino Acid Residues : 247 Amino Acid Sequence : 1 2 3 4 5 6 7 8 9 10 0 TRP CYS TYR GLU VAL GLN ALA GLU SER SER 10 ASN TYR PRO CYS LEU VAL PRO VAL LYS TRP 20 GLY GLY ASN CYS GLN LYS ASP ARG GLN SER 30 PRO ILE ASN ILE VAL THR THR LYS ALA LYS 40 VAL ASP LYS LYS LEU GLY ARG PHE PHE PHE 50 SER GLY TYR ASP LYS LYS GLN THR TRP THR 60 VAL GLN ASN ASN GLY HIS SER VAL MET MET 70 LEU LEU GLU ASN LYS ALA SER ILE SER GLY 80 GLY GLY LEU PRO ALA PRO TYR GLN ALA LYS 90 GLN LEU HIS LEU HIS TRP SER ASP LEU PRO 100 TYR LYS GLY SER GLU HIS SER LEU ASP GLY 110 GLU HIS PHE ALA MET GLU MET HIS ILE VAL 120 HIS GLU GLU ASP GLU ILE ALA VAL LEU ALA 130 PHE LEU VAL GLU ALA GLY THR GLN VAL ASN 140 GLU GLY PHE GLN PRO LEU VAL GLU ALA LEU 150 SER ASN ILE PRO LYS PRO GLU MET SER THR 160 THR MET ALA GLU SER SER LEU LEU ASP LEU 170 LEU PRO LYS GLU GLU LYS LEU ARG HIS TYR 180 PHE ARG TYR LEU GLY SER LEU THR THR PRO 190 THR CYS ASP GLU LYS VAL VAL TRP THR VAL 200 PHE ARG GLU PRO ILE GLN LEU HIS ARG GLU 210 GLN ILE LEU ALA PHE SER GLN LYS LEU TYR 220 TYR ASP LYS GLU GLN THR VAL SER MET LYS 230 ASP ASN VAL ARG PRO LEU GLN GLN LEU GLY 240 GLN ARG THR VAL ILE LYS SER Main and Side Chain Dihedral Angles : Residue Type Phi Psi Omega Chi 1 Chi 2 Chi 3 Chi 4 1 TRP 0.0 158.1 -177.1 52.9 -92.1 2 CYS -143.2 166.4 175.6 -67.8 3 TYR -97.1 149.5 -178.6 -73.6 -70.9 4 GLU -44.6 -55.3 -178.8 -67.7 160.2 63.4 5 VAL -47.2 -49.3 -178.6 65.7 6 GLN -75.3 -23.5 179.7 77.5 -178.6 136.5 7 ALA -67.4 -37.7 -179.8 8 GLU -64.1 -39.4 -178.5 -61.1 -179.6 86.6 9 SER -102.5 2.7 179.5 40.1 10 SER -72.8 158.5 179.0 170.1 11 ASN -102.4 10.1 178.9 -98.1 175.0 12 TYR -150.0 156.1 -179.5 43.6 85.9 13 PRO -56.1 153.5 179.2 31.6 -45.1 14 CYS -174.5 142.9 180.0 64.4 15 LEU -74.1 129.3 178.0 -61.3 168.3 16 VAL -88.3 164.9 -179.8 -67.4 17 PRO -41.2 -51.7 -179.0 -37.1 45.4 18 VAL -65.3 -18.8 -179.8 -57.8 19 LYS -110.0 19.5 179.2 -65.9 170.7 -179.6 63.4 20 TRP -70.1 153.5 179.7 -77.6 -2.6 21 GLY -91.0 -133.2 179.5 22 GLY 43.6 -147.1 -179.8 23 ASN -90.1 14.9 -179.0 -32.2 -60.7 24 CYS -63.3 -16.5 -179.5 -45.8 25 GLN -102.1 13.6 -178.8 -51.5 -60.0 -29.5 26 LYS -81.3 -161.0 -176.7 -72.1 -160.4 167.3 -178.4 27 ASP -105.4 -6.1 179.7 -46.6 -58.7 28 ARG -122.5 62.6 -177.4 -69.4 177.4 47.9 -129.9 29 GLN -98.8 166.0 178.5 -62.9 -68.0 -76.0 30 SER -134.7 156.2 0.3 -63.6 31 PRO -79.3 170.0 -179.6 39.3 -42.6 32 ILE -138.6 169.4 177.6 67.8 171.1 33 ASN -96.9 134.3 -179.8 165.8 67.5 34 ILE -103.7 115.9 177.0 -57.1 172.0 35 VAL -86.7 95.8 -178.0 -178.1 36 THR -44.7 -42.7 -178.7 55.6 37 THR -71.7 -19.1 179.9 52.6 38 LYS -92.1 -10.1 179.7 -76.7 -168.6 178.6 -175.5 39 ALA -75.6 124.4 -179.7 40 LYS -73.3 143.9 178.9 -59.7 -82.2 -168.1 172.1 41 VAL -82.3 139.9 -179.6 -179.1 42 ASP -137.4 121.3 -179.7 -169.0 -20.0 43 LYS -67.6 -28.7 179.8 -77.2 -173.2 177.4 177.5 44 LYS -61.9 -13.6 179.9 -64.0 -173.5 178.8 -176.0 45 LEU -84.7 77.0 179.6 -63.7 -179.4 46 GLY -77.1 -173.8 179.9 47 ARG -74.4 163.9 179.8 49.7 177.1 -68.5 -135.7 48 PHE -93.7 160.8 178.7 -78.3 90.3 49 PHE -127.5 125.1 -178.8 -66.6 -63.1 50 PHE -106.9 140.4 178.4 -53.4 -82.8 51 SER -129.7 125.7 179.9 57.1 52 GLY 86.0 -12.0 179.9 53 TYR -63.2 -18.0 -177.1 -86.7 66.1 54 ASP -100.5 -5.8 -179.1 43.2 22.5 55 LYS -88.9 120.6 178.5 57.0 -178.2 -74.0 71.0 56 LYS -52.1 148.6 -177.6 -56.1 -60.2 -175.2 178.2 57 GLN -176.5 154.7 178.2 -169.9 169.5 -160.8 58 THR -88.0 141.4 -179.5 54.4 59 TRP -122.9 151.8 176.3 -54.7 95.4 60 THR -93.6 123.3 178.4 -62.2 61 VAL -118.4 144.4 -179.6 49.3 62 GLN -145.0 160.1 179.7 66.8 -176.7 71.4 63 ASN -103.9 102.9 -179.2 171.8 -23.9 64 ASN -87.8 14.7 179.7 57.8 31.4 65 GLY 82.2 -6.3 179.7 66 HIS -123.9 -20.4 -178.0 -58.7 -73.9 67 SER -176.9 174.9 176.8 169.1 68 VAL -96.9 124.1 -178.5 53.0 69 MET -132.5 134.2 177.9 163.1 -167.8 50.5 70 MET -112.4 133.9 -178.6 61.3 173.5 100.9 71 LEU -79.9 131.6 -178.7 -54.0 -175.2 72 LEU -99.6 -14.4 177.0 -54.3 -176.7 73 GLU 42.8 42.8 179.0 -61.6 151.8 -22.8 74 ASN 60.1 14.8 -178.8 -51.2 -86.6 75 LYS -83.9 22.3 179.1 -61.6 178.6 -175.8 170.2 76 ALA -172.3 158.2 -179.5 77 SER -153.7 169.3 -179.1 46.8 78 ILE -135.3 162.7 178.1 55.7 172.1 79 SER -157.5 172.9 -179.4 67.0 80 GLY 80.4 -151.4 -179.6 81 GLY 50.0 32.7 179.5 82 GLY 77.3 -4.4 179.8 83 LEU -66.7 130.2 -179.8 -99.8 37.2 84 PRO -65.4 -12.5 -178.5 32.2 -45.2 85 ALA -169.5 167.8 179.8 86 PRO -67.1 151.1 178.5 -28.2 42.6 87 TYR -133.3 134.5 179.4 -73.9 69.9 88 GLN -100.2 136.6 -177.9 50.7 -168.9 -18.0 89 ALA -63.2 125.8 179.0 90 LYS -101.8 -56.8 -179.2 -67.7 -63.0 -170.0 172.5 91 GLN -151.9 172.5 -179.5 72.0 165.6 -123.3 92 LEU -143.9 147.8 179.2 172.3 163.5 93 HIS -164.9 170.4 -178.4 62.3 -101.1 94 LEU -129.9 166.6 178.2 -65.4 85.4 95 HIS -131.9 135.3 -177.9 -66.6 -78.4 96 TRP -155.4 -175.5 178.8 64.6 88.5 97 SER -163.0 171.4 179.1 173.2 98 ASP -89.9 -10.1 179.2 47.8 25.1 99 LEU -103.7 126.4 -179.3 -68.8 173.5 100 PRO -52.8 -22.5 -178.9 28.6 -43.8 101 TYR -103.8 12.1 -179.9 53.3 79.0 102 LYS -147.4 35.9 -178.9 61.0 -171.7 -58.6 175.7 103 GLY -103.9 -11.7 -179.1 104 SER -102.3 153.4 178.3 62.4 105 GLU -79.0 -50.9 179.0 -62.6 -161.7 -55.5 106 HIS -83.3 162.9 178.5 -72.3 91.6 107 SER -139.8 153.4 179.7 52.1 108 LEU -117.3 113.2 -178.1 -64.7 172.2 109 ASP 54.6 41.9 179.1 -56.3 -32.0 110 GLY 81.0 -9.0 179.3 111 GLU -87.2 136.9 178.0 -70.3 175.6 -58.3 112 HIS -111.9 153.8 -179.2 -73.6 -107.8 113 PHE -114.4 -178.7 -178.7 -59.6 67.4 114 ALA -59.9 -42.2 179.9 115 MET -153.1 171.2 176.1 -45.6 172.1 83.8 116 GLU -141.3 138.0 -178.6 -165.6 175.5 -40.3 117 MET -115.6 132.6 -179.3 -173.9 169.9 89.2 118 HIS -117.2 120.4 178.4 -62.4 150.0 119 ILE -109.2 103.3 -177.4 -55.8 -172.6 120 VAL -84.1 131.1 178.6 -179.6 121 HIS -131.9 163.0 178.4 -55.6 68.7 122 GLU -154.2 153.2 -64.4 67.5 159.8 -73.8 123 GLU 4.9 -63.6 178.5 33.7 -86.0 -86.7 124 ASP -108.5 33.7 -179.6 59.6 3.3 125 GLU -59.1 -50.0 -179.2 -138.9 -64.6 -44.3 126 ILE -108.5 141.9 179.3 -61.6 168.9 127 ALA -124.4 117.1 179.9 128 VAL -114.4 143.5 179.2 40.5 129 LEU -108.3 126.7 -178.8 -56.9 -160.8 130 ALA -113.7 135.4 178.9 131 PHE -125.2 137.8 -180.0 -65.8 86.0 132 LEU -95.1 144.9 -178.3 -59.0 170.7 133 VAL -121.3 141.0 179.3 -175.8 134 GLU -143.3 157.4 -178.5 59.4 176.2 31.5 135 ALA -70.4 145.1 179.6 136 GLY -138.2 177.7 -179.9 137 THR -83.4 -46.9 -179.5 55.9 138 GLN -69.8 147.5 177.5 -70.9 -68.1 69.1 139 VAL -82.5 126.9 -179.6 55.8 140 ASN -81.0 105.6 -179.9 -167.5 -54.3 141 GLU -64.0 -32.3 180.0 -65.2 -61.9 -37.0 142 GLY -63.8 -28.7 -179.6 143 PHE -90.1 -16.7 -179.4 -99.9 80.0 144 GLN -44.2 -51.3 -179.9 -75.0 -63.7 64.5 145 PRO -55.2 -42.8 179.9 -31.9 44.3 146 LEU -64.8 -46.1 -179.8 175.2 54.9 147 VAL -57.7 -41.7 179.6 175.9 148 GLU -61.3 -53.9 -179.1 -55.7 -83.0 57.7 149 ALA -47.7 -27.3 -178.8 150 LEU -56.2 -38.3 179.8 -53.5 -177.3 151 SER -52.8 -33.8 -177.7 -54.0 152 ASN -85.1 -0.5 -179.4 -52.4 -9.7 153 ILE -140.7 50.4 -179.4 52.9 158.5 154 PRO -57.9 -48.1 -178.1 -23.0 40.9 155 LYS -87.9 158.6 179.4 -50.7 166.4 -179.2 62.4 156 PRO -61.2 155.0 178.9 -35.2 44.8 157 GLU 74.1 -7.6 179.3 -58.7 -167.2 -69.3 158 MET -78.5 159.7 180.0 -69.2 -178.0 71.2 159 SER -146.4 168.9 178.7 -59.9 160 THR -169.3 -176.1 -180.0 -172.2 161 THR -125.1 117.9 -179.9 -62.1 162 MET -82.2 157.3 -179.9 56.5 176.2 -76.7 163 ALA -55.3 155.3 -179.9 164 GLU -57.0 129.0 -179.4 63.6 -177.9 -24.7 165 SER -157.2 163.4 178.5 -52.7 166 SER -114.9 148.9 -179.7 47.8 167 LEU -56.3 -30.6 -179.9 -68.3 169.7 168 LEU -63.2 -22.6 178.9 -138.6 55.3 169 ASP -66.6 -22.4 -178.6 -80.1 -32.6 170 LEU -86.4 -46.9 -177.9 -52.9 172.1 171 LEU -72.5 162.0 179.1 -32.3 -175.5 172 PRO -77.1 168.7 -179.4 28.3 -42.2 173 LYS -54.4 132.5 -178.1 -60.1 -59.6 -78.7 59.5 174 GLU -42.0 -28.7 179.6 -66.9 -172.0 67.0 175 GLU -69.4 -27.9 179.6 55.5 178.1 89.2 176 LYS -81.6 -15.7 -179.7 -70.1 -177.4 169.5 -63.7 177 LEU -84.7 20.7 -178.9 -56.5 173.2 178 ARG -80.4 -35.5 -179.6 -164.5 179.9 -179.2 -151.6 179 HIS -100.9 132.3 -179.9 -61.5 117.5 180 TYR -160.3 163.7 -179.7 57.7 80.2 181 PHE -107.1 150.9 -177.0 -54.2 -82.7 182 ARG -136.6 143.8 178.6 165.2 68.6 51.4 65.0 183 TYR -174.5 152.9 179.8 81.8 -86.4 184 LEU -88.8 142.3 -178.7 -63.4 178.6 185 GLY -162.9 -150.5 -178.6 186 SER -125.6 -175.4 178.1 67.9 187 LEU -83.1 156.5 -179.2 -54.0 160.0 188 THR -99.8 30.8 179.3 60.9 189 THR -154.4 158.8 179.6 49.7 190 PRO -60.2 148.4 0.3 -34.7 45.8 191 THR -86.6 20.9 177.6 47.5 192 CYS 52.8 42.9 -178.8 -49.9 193 ASP -60.7 132.0 -179.8 -65.2 17.0 194 GLU -87.7 71.2 -179.9 -54.7 -176.2 -21.1 195 LYS -143.7 39.9 -178.0 54.9 -175.9 -178.8 176.1 196 VAL -122.3 138.3 176.7 -176.7 197 VAL -107.8 108.5 -177.1 43.4 198 TRP -85.5 153.4 178.8 -74.7 88.4 199 THR -146.2 115.4 -179.6 -61.9 200 VAL -116.6 115.2 179.7 -174.8 201 PHE -76.8 146.0 -179.4 -63.2 84.3 202 ARG -79.0 -26.5 -179.6 -162.1 -169.7 64.6 -125.1 203 GLU -79.9 115.6 -180.0 -71.1 -52.3 -57.4 204 PRO -75.9 146.5 177.4 34.5 -43.8 205 ILE -82.4 146.4 179.4 -66.5 177.7 206 GLN -110.9 136.6 178.8 -64.0 -176.7 -105.5 207 LEU -136.6 154.4 178.8 -66.2 -174.0 208 HIS -71.6 147.3 -179.2 -165.9 -111.6 209 ARG -50.1 -47.9 180.0 -170.3 167.7 -173.7 73.4 210 GLU -56.3 -37.3 179.7 -61.4 171.5 2.9 211 GLN -64.0 -41.4 178.8 -63.0 -175.4 -80.7 212 ILE -64.1 -48.8 -179.6 -64.6 171.2 213 LEU -61.4 -25.3 179.6 -64.2 -179.5 214 ALA -52.0 -40.4 -178.6 215 PHE -63.2 -43.1 -179.8 -66.4 80.9 216 SER -74.7 -30.8 -178.6 -41.7 217 GLN -82.6 -23.7 -178.9 -73.0 166.5 6.2 218 LYS -110.7 -13.1 -179.1 -60.1 176.8 -177.8 165.7 219 LEU -105.2 146.9 -179.6 -57.0 -170.5 220 TYR -133.7 153.0 179.6 -59.2 78.2 221 TYR -83.5 -34.1 -177.3 -83.6 -69.4 222 ASP -105.4 159.6 178.9 67.8 -39.0 223 LYS -71.8 -31.5 179.8 -55.9 -156.9 179.1 -172.0 224 GLU -66.7 -5.5 -179.8 -59.4 76.0 30.5 225 GLN 56.3 45.8 179.9 -76.0 -153.4 -146.1 226 THR -112.4 -23.1 -179.0 57.9 227 VAL -116.1 113.6 179.8 -162.3 228 SER -63.8 147.7 -179.8 -64.9 229 MET -89.8 109.8 178.6 -179.0 176.8 -91.6 230 LYS -161.6 167.4 -179.3 56.8 -167.7 174.4 72.9 231 ASP 55.9 38.5 178.1 -65.3 -48.9 232 ASN -90.8 62.5 -179.5 51.4 -20.3 233 VAL -124.1 146.0 179.9 -39.8 234 ARG -90.7 132.2 179.7 -175.9 -168.5 -166.2 -163.3 235 PRO -59.7 145.0 -179.9 26.8 -42.5 236 LEU -47.1 154.7 179.3 -66.8 174.1 237 GLN -122.8 164.2 -179.4 -59.4 -59.8 -57.3 238 GLN -81.4 139.4 179.2 -113.0 51.1 54.4 239 LEU -64.7 -48.1 179.7 -176.0 70.9 240 GLY 75.2 -138.4 -179.6 241 GLN -70.1 -15.6 -178.2 -122.3 69.4 -76.0 242 ARG -68.8 155.9 177.3 -62.4 176.4 -67.8 175.7 243 THR -129.3 153.9 -179.0 60.8 244 VAL -112.8 143.8 178.8 178.4 245 ILE -124.4 163.6 -178.2 55.9 -176.0 246 LYS -143.1 175.9 178.8 62.3 -171.6 -178.0 -172.8 247 SER -112.2 -39.7 0.0 57.8 Alpha Carbon Cartesian Coordinates : Residue Type X Y Z 1 TRP 27.508 -16.779 25.084 2 CYS 24.938 -18.206 27.517 3 TYR 21.619 -17.803 29.252 4 GLU 21.896 -17.496 33.066 5 VAL 20.474 -20.957 33.793 6 GLN 23.073 -22.766 31.665 7 ALA 25.987 -20.613 32.815 8 GLU 25.478 -21.870 36.363 9 SER 25.626 -25.550 35.364 10 SER 28.052 -25.365 32.410 11 ASN 31.520 -26.913 32.649 12 TYR 33.215 -24.043 30.796 13 PRO 33.250 -20.196 30.729 14 CYS 30.578 -18.229 28.885 15 LEU 29.124 -14.708 28.801 16 VAL 25.799 -14.302 30.563 17 PRO 23.124 -11.859 29.267 18 VAL 24.356 -8.835 31.264 19 LYS 27.869 -9.458 29.982 20 TRP 27.010 -10.026 26.327 21 GLY 29.026 -8.115 23.762 22 GLY 27.903 -6.703 20.430 23 ASN 25.111 -4.141 20.361 24 CYS 23.476 -6.023 23.241 25 GLN 24.247 -3.055 25.489 26 LYS 22.552 -0.408 23.316 27 ASP 19.264 1.540 23.610 28 ARG 16.759 -0.167 21.274 29 GLN 16.753 -3.732 22.609 30 SER 14.219 -6.540 22.885 31 PRO 12.388 -8.166 24.616 32 ILE 10.329 -5.545 26.443 33 ASN 7.171 -5.542 28.572 34 ILE 4.129 -4.320 26.670 35 VAL 1.703 -2.169 28.611 36 THR -1.310 -2.934 26.446 37 THR -3.147 0.214 27.558 38 LYS -0.340 2.642 26.690 39 ALA 0.030 1.376 23.123 40 LYS -1.494 3.828 20.645 41 VAL -3.989 2.518 18.065 42 ASP -2.980 2.857 14.381 43 LYS -5.238 2.238 11.350 44 LYS -2.295 1.757 8.965 45 LEU -1.724 -1.592 10.680 46 GLY -3.804 -3.758 8.399 47 ARG -3.929 -7.539 8.294 48 PHE -1.070 -9.720 7.109 49 PHE -0.858 -11.779 3.967 50 PHE 0.805 -15.160 3.912 51 SER 2.241 -16.998 0.927 52 GLY 3.397 -20.595 1.168 53 TYR 2.296 -20.897 4.789 54 ASP -0.282 -23.510 3.788 55 LYS 1.628 -26.099 1.767 56 LYS 2.510 -29.345 3.567 57 GLN 6.226 -29.961 3.356 58 THR 9.147 -31.616 5.105 59 TRP 11.364 -29.266 7.087 60 THR 14.908 -29.565 8.389 61 VAL 14.832 -28.909 12.139 62 GLN 17.943 -28.694 14.300 63 ASN 19.250 -28.222 17.840 64 ASN 21.756 -25.361 17.642 65 GLY 22.580 -25.686 21.336 66 HIS 20.537 -22.579 22.167 67 SER 17.112 -23.623 20.898 68 VAL 15.179 -25.850 18.513 69 MET 15.158 -24.199 15.073 70 MET 13.630 -25.252 11.771 71 LEU 14.984 -23.784 8.526 72 LEU 12.404 -22.133 6.278 73 GLU 14.738 -21.504 3.290 74 ASN 12.817 -18.575 1.727 75 LYS 9.992 -21.030 0.968 76 ALA 7.262 -18.654 2.250 77 SER 6.642 -14.932 2.740 78 ILE 4.440 -12.228 4.257 79 SER 3.124 -8.760 3.442 80 GLY 0.656 -6.235 4.819 81 GLY 0.488 -5.709 8.555 82 GLY 1.920 -2.242 8.000 83 LEU 5.088 -3.719 6.522 84 PRO 6.669 -1.438 3.885 85 ALA 7.505 -4.448 1.680 86 PRO 7.405 -8.273 1.442 87 TYR 9.648 -10.317 3.721 88 GLN 10.698 -13.913 3.102 89 ALA 10.853 -16.552 5.860 90 LYS 14.353 -17.607 6.884 91 GLN 13.912 -19.609 10.108 92 LEU 11.747 -20.354 13.110 93 HIS 12.579 -21.311 16.702 94 LEU 11.245 -21.193 20.231 95 HIS 11.997 -20.070 23.756 96 TRP 10.484 -21.928 26.716 97 SER 10.694 -23.161 30.313 98 ASP 9.047 -25.819 32.490 99 LEU 7.146 -23.286 34.592 100 PRO 3.955 -21.809 32.993 101 TYR 4.722 -18.269 34.167 102 LYS 8.284 -17.828 32.887 103 GLY 8.764 -19.154 29.358 104 SER 8.299 -16.115 27.113 105 GLU 10.683 -13.266 26.391 106 HIS 8.090 -10.496 25.966 107 SER 5.352 -9.964 28.528 108 LEU 1.926 -8.314 28.385 109 ASP 1.130 -6.147 31.386 110 GLY 3.751 -8.064 33.309 111 GLU 2.413 -11.515 32.478 112 HIS 4.792 -14.053 30.920 113 PHE 3.585 -17.221 29.160 114 ALA 4.661 -20.873 28.704 115 MET 6.710 -20.372 25.498 116 GLU 7.344 -17.858 22.732 117 MET 7.782 -18.524 19.007 118 HIS 9.852 -16.434 16.627 119 ILE 9.435 -16.578 12.854 120 VAL 12.280 -14.601 11.284 121 HIS 11.908 -12.902 7.874 122 GLU 13.990 -10.347 5.987 123 GLU 16.200 -0.391 11.013 124 ASP 13.318 -2.590 9.771 125 GLU 15.711 -4.960 7.992 126 ILE 14.441 -8.143 9.706 127 ALA 10.787 -8.791 10.547 128 VAL 9.881 -11.327 13.203 129 LEU 6.477 -12.614 14.198 130 ALA 6.103 -13.582 17.843 131 PHE 3.476 -15.877 19.288 132 LEU 2.853 -16.512 22.953 133 VAL 2.122 -20.050 24.067 134 GLU 0.056 -21.296 26.964 135 ALA -1.250 -24.648 28.202 136 GLY -4.609 -25.969 27.071 137 THR -6.749 -29.075 27.449 138 GLN -6.753 -30.294 23.834 139 VAL -3.712 -31.919 22.251 140 ASN -2.546 -29.607 19.484 141 GLU -2.306 -31.771 16.351 142 GLY -0.548 -29.058 14.355 143 PHE 2.461 -29.164 16.670 144 GLN 2.654 -32.961 16.872 145 PRO 5.140 -33.386 13.985 146 LEU 7.565 -30.910 15.591 147 VAL 7.190 -32.510 19.023 148 GLU 7.988 -35.924 17.527 149 ALA 11.121 -34.654 15.768 150 LEU 12.619 -33.624 19.134 151 SER 13.446 -37.243 19.955 152 ASN 15.980 -37.248 17.100 153 ILE 18.005 -34.204 18.203 154 PRO 18.724 -34.248 21.997 155 LYS 22.328 -33.023 21.723 156 PRO 23.638 -29.788 20.107 157 GLU 24.559 -29.827 16.408 158 MET 22.114 -32.623 15.612 159 SER 19.516 -32.410 12.813 160 THR 16.613 -34.289 11.274 161 THR 13.598 -34.018 8.980 162 MET 10.204 -33.573 10.567 163 ALA 7.054 -35.046 9.015 164 GLU 5.341 -33.042 6.265 165 SER 3.484 -30.047 7.725 166 SER 2.620 -26.497 6.722 167 LEU 3.542 -23.385 8.727 168 LEU -0.185 -22.616 8.964 169 ASP -0.519 -25.751 11.116 170 LEU 1.367 -23.959 13.889 171 LEU -0.340 -20.555 14.048 172 PRO -3.898 -19.888 15.321 173 LYS -6.825 -19.331 12.903 174 GLU -6.299 -16.260 10.681 175 GLU -9.277 -14.473 12.249 176 LYS -7.542 -14.343 15.656 177 LEU -4.406 -12.828 14.083 178 ARG -6.124 -9.463 13.616 179 HIS -4.864 -7.728 16.777 180 TYR -1.167 -7.216 17.447 181 PHE 1.500 -4.890 18.853 182 ARG 4.303 -3.311 16.848 183 TYR 7.631 -1.669 17.732 184 LEU 11.220 -1.436 16.502 185 GLY 13.933 -3.339 18.347 186 SER 16.764 -5.858 18.197 187 LEU 17.428 -9.592 18.068 188 THR 17.278 -11.373 21.430 189 THR 20.697 -13.051 21.041 190 PRO 24.188 -11.761 20.145 191 THR 25.038 -9.711 18.418 192 CYS 21.603 -8.227 19.229 193 ASP 21.501 -6.136 16.063 194 GLU 18.923 -3.329 16.198 195 LYS 17.364 -3.838 12.785 196 VAL 14.166 -5.645 13.662 197 VAL 10.520 -4.666 13.308 198 TRP 8.681 -6.735 15.934 199 THR 5.119 -7.994 15.876 200 VAL 3.506 -9.644 18.849 201 PHE 0.023 -11.059 18.357 202 ARG -2.305 -10.844 21.334 203 GLU -3.900 -14.262 20.745 204 PRO -1.840 -16.993 22.412 205 ILE -1.300 -20.333 20.712 206 GLN -2.502 -23.258 22.827 207 LEU -0.622 -26.511 23.438 208 HIS -1.251 -29.388 25.792 209 ARG 0.910 -29.184 28.926 210 GLU 2.681 -32.401 27.972 211 GLN 3.548 -30.943 24.552 212 ILE 5.210 -27.977 26.250 213 LEU 7.128 -30.209 28.682 214 ALA 8.346 -32.295 25.731 215 PHE 10.842 -29.545 24.929 216 SER 12.366 -29.449 28.386 217 GLN 12.308 -33.253 28.603 218 LYS 13.945 -34.202 25.310 219 LEU 16.404 -31.366 24.660 220 TYR 19.754 -30.733 26.356 221 TYR 22.264 -27.864 26.312 222 ASP 25.304 -30.122 26.624 223 LYS 26.533 -33.141 24.671 224 GLU 26.872 -35.123 27.921 225 GLN 23.064 -34.931 28.164 226 THR 23.106 -33.658 31.741 227 VAL 21.513 -30.193 31.445 228 SER 17.958 -29.831 30.107 229 MET 17.273 -27.052 27.635 230 LYS 14.927 -24.575 29.243 231 ASP 14.755 -20.972 30.364 232 ASN 16.492 -19.948 27.169 233 VAL 15.015 -16.433 27.495 234 ARG 16.662 -12.982 27.508 235 PRO 15.838 -10.759 30.505 236 LEU 13.599 -7.802 29.687 237 GLN 15.078 -4.579 28.351 238 GLN 13.975 -0.970 28.826 239 LEU 11.565 0.642 26.345 240 GLY 13.263 4.033 26.590 241 GLN 12.317 6.747 24.125 242 ARG 10.309 4.232 22.071 243 THR 6.522 3.921 21.892 244 VAL 4.411 0.916 20.965 245 ILE 1.403 0.895 18.631 246 LYS -1.296 -1.705 17.971 247 SER -4.145 -2.759 15.640 Richards-Kundrot Secondary Structure Assignment : 1 2 3 4 5 6 7 8 9 10 0 C C H H H H H H H H 10 S S S S S T T T T C 20 T T T T S S S S/S S S/P 30 S/S S S S S/T T T T/S S S 40 S S S S S S S/S S S S 50 S S C S S S S S/S S S 60 S S S/T T T T S S S S 70 S S/T T T T C S S S S 80 S C C C S S S S S S 90 S/S S S S S S C C T T 100 T T S S S S T T T T/S 110 S S S S/S S S S S S S 120 S S/X X/C C S S S S S S 130 S S S S S S S/S S S S 140 S C H H H H H H H H/T 150 T T T S S S S/S S S S/S 160 S S S S C H H H H 3 170 3 C T T T T C S S S 180 S S S S S/S S S S C C/P 190 C C C S S S S/S S S S 200 S S/S S S S S S S/H H H 210 H H H H/H H H H H H C 220 C T T T T S S S S S 230 C S S S S S/S S S S/T T 240 T T/S S S S S/S 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 10 S S g G G G g 20 g G G G G g S S S 30 e E E g G G G g E 40 E e T T t e E E E 50 E t T T t E E E E 60 E E E e S S e E E E 70 E e T T t e E E E E 80 e T t S S E E E E 90 E E E E E E e S t T 100 T t S S E E e T 110 B e E E E E E E 120 E E S E E E E E 130 E E E E E E S S t 140 T T h H H H H H H h 150 G G g t T T e E E 160 E E E E E g G G G g 170 t t T g G G G e E 180 E E E E E S t T 190 T t S e E E E E E 200 E e S E E E E H H 210 H H H H H H H H h B 220 S t T T t S B 230 t T 240 T t e E E e Buried Surface Area Percentages : Residue Type Buried Area % Buried % Polar Cover 1 TRP 154.9 75.5 49.4 2 CYS 90.5 91.3 49.0 3 TYR 178.9 98.8 48.3 4 GLU 46.2 33.4 61.7 5 VAL 81.7 68.7 68.1 6 GLN 129.2 86.9 47.2 7 ALA 62.4 85.9 47.7 8 GLU 17.5 12.6 83.8 9 SER 39.0 46.7 68.0 10 SER 66.1 79.0 67.1 11 ASN 2.8 2.3 85.9 12 TYR 31.8 17.6 79.6 13 PRO 7.4 5.9 78.7 14 CYS 81.8 82.4 57.8 15 LEU 55.9 37.8 70.2 16 VAL 88.0 74.0 49.7 17 PRO 122.3 98.2 39.3 18 VAL 28.4 23.9 74.1 19 LYS 46.7 26.9 73.1 20 TRP 204.8 99.9 41.1 21 GLY 0.3 0.9 77.3 22 GLY 17.5 50.4 63.1 23 ASN 75.9 62.8 64.7 24 CYS 99.0 99.8 52.2 25 GLN 62.0 41.7 82.4 26 LYS 56.5 32.6 81.1 27 ASP 0.0 0.0 83.1 28 ARG 137.2 65.7 64.8 29 GLN 145.1 97.7 64.0 30 SER 83.6 100.0 46.6 31 PRO 124.5 100.0 44.1 32 ILE 142.8 99.5 41.0 33 ASN 79.4 65.7 59.4 34 ILE 142.8 99.5 31.1 35 VAL 63.0 53.0 74.4 36 THR 79.9 74.8 51.5 37 THR 11.6 10.9 82.5 38 LYS 21.5 12.4 83.5 39 ALA 71.8 98.9 53.2 40 LYS 22.0 12.7 83.5 41 VAL 40.2 33.9 75.4 42 ASP 70.3 63.6 55.2 43 LYS 0.0 0.0 91.3 44 LYS 3.8 2.2 88.8 45 LEU 140.9 95.4 53.5 46 GLY 0.4 1.1 86.7 47 ARG 69.9 33.5 73.6 48 PHE 163.6 98.1 38.7 49 PHE 70.6 42.4 77.9 50 PHE 156.1 93.6 37.1 51 SER 27.3 32.7 82.2 52 GLY 23.2 66.6 65.3 53 TYR 179.6 99.2 32.0 54 ASP 30.8 27.9 68.2 55 LYS 58.2 33.6 85.2 56 LYS 70.3 40.5 81.2 57 GLN 112.9 76.0 55.7 58 THR 40.9 38.2 64.7 59 TRP 197.8 96.5 48.8 60 THR 58.3 54.6 71.4 61 VAL 118.8 100.0 33.4 62 GLN 100.6 67.7 52.8 63 ASN 120.9 100.0 52.9 64 ASN 78.9 65.3 60.9 65 GLY 27.7 79.7 61.8 66 HIS 96.9 64.5 63.8 67 SER 77.9 93.2 55.9 68 VAL 117.5 98.9 28.8 69 MET 144.8 90.9 61.5 70 MET 157.4 98.7 25.4 71 LEU 92.0 62.2 63.4 72 LEU 147.6 99.8 37.1 73 GLU 65.6 47.3 72.6 74 ASN 71.5 59.1 75.7 75 LYS 84.4 48.7 80.1 76 ALA 67.1 92.4 52.1 77 SER 52.3 62.5 63.9 78 ILE 142.3 99.2 37.1 79 SER 47.4 56.8 57.3 80 GLY 15.2 43.7 70.2 81 GLY 34.8 100.0 56.2 82 GLY 21.8 62.7 73.1 83 LEU 145.7 98.6 45.8 84 PRO 53.8 43.2 78.0 85 ALA 22.6 31.1 65.0 86 PRO 38.6 31.0 65.3 87 TYR 168.1 92.9 49.2 88 GLN 65.6 44.2 70.0 89 ALA 72.6 100.0 43.8 90 LYS 106.3 61.3 69.7 91 GLN 98.4 66.2 49.9 92 LEU 146.9 99.4 27.9 93 HIS 121.9 81.2 56.8 94 LEU 147.1 99.6 25.6 95 HIS 147.5 98.2 61.7 96 TRP 205.0 100.0 43.0 97 SER 83.3 99.6 58.8 98 ASP 72.3 65.4 57.4 99 LEU 73.6 49.8 70.0 100 PRO 73.9 59.4 66.2 101 TYR 48.4 26.7 67.5 102 LYS 78.7 45.4 70.3 103 GLY 34.8 100.0 63.3 104 SER 83.6 100.0 56.9 105 GLU 138.1 99.6 47.9 106 HIS 150.1 99.9 39.7 107 SER 83.4 99.7 50.7 108 LEU 134.3 90.9 39.7 109 ASP 53.4 48.3 74.7 110 GLY 6.4 18.4 79.6 111 GLU 23.9 17.3 79.9 112 HIS 104.6 69.6 68.3 113 PHE 134.1 80.4 57.9 114 ALA 69.0 95.0 47.1 115 MET 159.4 100.0 27.7 116 GLU 138.6 100.0 46.5 117 MET 159.4 100.0 24.6 118 HIS 146.3 97.4 46.6 119 ILE 143.5 100.0 33.5 120 VAL 91.8 77.2 46.8 121 HIS 150.2 100.0 41.8 122 GLU 74.6 53.8 58.8 123 GLU 19.4 14.0 85.3 124 ASP 62.3 56.4 54.9 125 GLU 57.4 41.4 72.0 126 ILE 124.5 86.7 42.6 127 ALA 71.2 98.0 36.7 128 VAL 114.8 96.6 35.7 129 LEU 146.5 99.2 34.4 130 ALA 72.6 100.0 47.2 131 PHE 166.6 99.9 28.8 132 LEU 147.4 99.7 39.0 133 VAL 118.8 100.0 33.9 134 GLU 81.5 58.8 53.6 135 ALA 50.0 68.9 65.1 136 GLY 25.5 73.1 72.0 137 THR 0.0 0.0 82.4 138 GLN 2.6 1.7 91.7 139 VAL 58.3 49.1 74.8 140 ASN 83.6 69.2 67.9 141 GLU 29.9 21.6 76.2 142 GLY 24.1 69.3 70.7 143 PHE 166.8 100.0 31.0 144 GLN 89.2 60.0 61.8 145 PRO 98.0 78.7 62.0 146 LEU 147.0 99.5 22.4 147 VAL 105.9 89.2 50.6 148 GLU 30.9 22.3 81.4 149 ALA 67.2 92.5 51.4 150 LEU 147.8 100.0 32.3 151 SER 37.2 44.5 76.3 152 ASN 41.7 34.5 72.9 153 ILE 143.5 100.0 40.4 154 PRO 99.9 80.2 61.5 155 LYS 94.2 54.3 63.5 156 PRO 109.7 88.1 56.6 157 GLU 28.7 20.7 84.3 158 MET 88.5 55.5 69.6 159 SER 46.5 55.6 64.5 160 THR 81.4 76.2 62.7 161 THR 41.4 38.7 75.8 162 MET 154.2 96.7 40.7 163 ALA 15.6 21.5 72.5 164 GLU 35.3 25.5 71.3 165 SER 78.5 94.0 51.8 166 SER 80.2 96.0 63.5 167 LEU 146.6 99.2 26.4 168 LEU 99.0 67.0 56.4 169 ASP 73.0 66.1 71.7 170 LEU 142.8 96.6 35.5 171 LEU 147.4 99.7 26.6 172 PRO 104.6 84.0 45.5 173 LYS 27.7 16.0 83.0 174 GLU 66.4 47.9 64.9 175 GLU 11.8 8.5 81.7 176 LYS 67.1 38.7 71.4 177 LEU 141.2 95.6 38.7 178 ARG 37.8 18.1 84.7 179 HIS 83.6 55.7 77.4 180 TYR 180.8 99.9 48.0 181 PHE 160.0 95.9 30.1 182 ARG 190.4 91.1 40.7 183 TYR 174.1 96.2 39.9 184 LEU 77.6 52.5 66.1 185 GLY 34.8 100.0 67.3 186 SER 83.6 100.0 61.5 187 LEU 103.3 69.9 56.5 188 THR 103.1 96.4 49.9 189 THR 69.7 65.2 53.3 190 PRO 110.3 88.6 33.8 191 THR 38.1 35.7 71.7 192 CYS 99.2 100.0 53.0 193 ASP 74.8 67.6 64.6 194 GLU 117.6 84.9 60.3 195 LYS 100.8 58.1 64.5 196 VAL 118.7 100.0 47.8 197 VAL 111.5 93.8 41.9 198 TRP 199.7 97.4 46.8 199 THR 105.4 98.6 44.0 200 VAL 118.6 99.9 37.0 201 PHE 166.4 99.7 38.7 202 ARG 110.9 53.1 65.1 203 GLU 100.6 72.6 63.0 204 PRO 97.7 78.5 67.3 205 ILE 138.9 96.8 39.7 206 GLN 53.0 35.6 77.7 207 LEU 147.7 99.9 34.7 208 HIS 101.8 67.8 67.9 209 ARG 104.1 49.8 56.3 210 GLU 23.1 16.6 72.8 211 GLN 139.9 94.1 43.3 212 ILE 136.3 95.0 43.8 213 LEU 103.0 69.7 67.0 214 ALA 65.2 89.8 52.5 215 PHE 166.8 100.0 28.7 216 SER 77.6 92.8 55.7 217 GLN 46.8 31.5 70.7 218 LYS 104.5 60.3 66.5 219 LEU 147.8 100.0 40.7 220 TYR 135.0 74.6 71.4 221 TYR 175.7 97.1 48.8 222 ASP 88.4 80.0 61.9 223 LYS 58.9 34.0 75.4 224 GLU 25.8 18.6 75.3 225 GLN 98.2 66.1 62.6 226 THR 32.1 30.0 73.2 227 VAL 89.7 75.5 65.2 228 SER 51.5 61.6 62.2 229 MET 159.4 100.0 48.7 230 LYS 117.7 67.9 64.5 231 ASP 84.9 76.8 55.2 232 ASN 120.9 100.0 48.3 233 VAL 89.3 75.1 66.6 234 ARG 203.1 97.2 44.7 235 PRO 74.0 59.4 68.7 236 LEU 97.9 66.2 69.8 237 GLN 109.2 73.5 68.4 238 GLN 1.2 0.8 88.9 239 LEU 91.1 61.6 63.4 240 GLY 2.6 7.4 80.5 241 GLN 0.0 0.0 91.4 242 ARG 180.9 86.6 56.9 243 THR 18.3 17.1 75.8 244 VAL 110.0 92.6 36.9 245 ILE 92.8 64.7 57.0 246 LYS 121.5 70.1 57.2 247 SER 76.5 91.5 63.3