Protein Data Bank File : 1g0uk Title : HYDROLASE 09-OCT-00 1G0U Number of Amino Acid Residues : 211 Amino Acid Sequence : 1 2 3 4 5 6 7 8 9 10 0 THR THR THR LEU ALA PHE ARG PHE GLN GLY 10 GLY ILE ILE VAL ALA VAL ASP SER ARG ALA 20 THR ALA GLY ASN TRP VAL ALA SER GLN THR 30 VAL LYS LYS VAL ILE GLU ILE ASN PRO PHE 40 LEU LEU GLY THR MET ALA GLY GLY ALA ALA 50 ASP CYS GLN PHE TRP GLU THR TRP LEU GLY 60 SER GLN CYS ARG LEU HIS GLU LEU ARG GLU 70 LYS GLU ARG ILE SER VAL ALA ALA ALA SER 80 LYS ILE LEU SER ASN LEU VAL TYR GLN TYR 90 LYS GLY ALA GLY LEU SER MET GLY THR MET 100 ILE CYS GLY TYR THR ARG GLU GLY PRO THR 110 ILE TYR TYR VAL ASP SER ASP GLY THR ARG 120 LEU LYS GLY ASP ILE PHE CYS VAL GLY SER 130 GLY GLN THR PHE ALA TYR GLY VAL LEU ASP 140 SER ASN TYR LYS TRP ASP LEU SER VAL GLU 150 ASP ALA LEU TYR LEU GLY LYS ARG SER ILE 160 LEU ALA ALA ALA HIS ARG ASP ALA TYR SER 170 GLY GLY SER VAL ASN LEU TYR HIS VAL THR 180 GLU ASP GLY TRP ILE TYR HIS GLY ASN HIS 190 ASP VAL GLY GLU LEU PHE TRP LYS VAL LYS 200 GLU GLU GLU GLY SER PHE ASN ASN VAL ILE 210 GLY Main and Side Chain Dihedral Angles : Residue Type Phi Psi Omega Chi 1 Chi 2 Chi 3 Chi 4 1 THR 0.0 150.8 178.5 -59.4 2 THR -142.1 123.0 180.0 -53.6 3 THR -134.9 138.3 177.5 58.5 4 LEU -142.0 159.9 178.6 69.3 -64.1 5 ALA -155.1 129.3 176.3 6 PHE -137.5 149.5 -177.6 56.2 103.8 7 ARG -96.7 141.9 178.9 -150.0 169.3 72.1 97.9 8 PHE -164.4 -179.0 178.0 72.8 114.8 9 GLN -40.7 -69.2 -178.1 163.5 -90.9 136.9 10 GLY -66.2 2.0 -179.5 11 GLY 131.4 -125.8 179.7 12 ILE -135.4 140.7 177.7 -67.8 173.7 13 ILE -112.2 131.6 179.8 -63.2 -63.4 14 VAL -130.2 120.4 -178.8 173.8 15 ALA -133.5 136.4 -178.8 16 VAL -143.5 158.5 177.3 -51.4 17 ASP -87.2 -160.0 -179.8 78.1 103.4 18 SER -155.0 39.4 -178.3 60.0 19 ARG -111.1 138.7 177.9 173.7 174.6 -73.4 -178.3 20 ALA -127.3 124.8 -179.6 21 THR -119.3 160.5 178.0 48.9 22 ALA -135.0 73.3 -178.0 23 GLY 98.3 -114.6 179.2 24 ASN -106.0 -9.1 -179.6 -59.4 -26.3 25 TRP -79.8 131.8 179.2 156.7 -111.6 26 VAL -93.0 102.0 -177.8 162.7 27 ALA -66.7 -44.5 -179.3 28 SER -155.9 145.1 178.4 179.0 29 GLN -107.5 -7.5 -177.3 -65.6 -101.6 64.8 30 THR -113.6 48.0 -179.0 59.4 31 VAL -94.6 147.4 179.6 176.3 32 LYS -102.0 112.6 -178.7 -75.5 74.0 -175.4 173.7 33 LYS -97.5 5.7 176.6 -62.9 -179.5 -178.3 171.6 34 VAL -112.4 115.5 178.1 174.0 35 ILE -93.2 122.6 179.3 -67.7 87.4 36 GLU -83.2 89.7 -178.0 -63.7 156.9 -21.4 37 ILE -55.2 -48.3 176.8 -59.3 -176.5 38 ASN -169.2 163.8 -179.7 86.4 47.1 39 PRO -43.7 -13.2 179.5 -36.2 46.5 40 PHE -118.2 -13.1 -177.4 -62.3 -94.2 41 LEU -124.3 141.6 179.7 -62.8 -179.8 42 LEU -121.6 145.8 178.0 -72.7 177.6 43 GLY -132.1 143.1 179.9 44 THR -104.8 152.1 -178.6 45.4 45 MET -107.8 132.6 178.6 167.8 -172.6 -44.2 46 ALA -170.5 131.7 -179.6 47 GLY 111.7 -105.1 178.8 48 GLY -102.0 128.7 -178.8 49 ALA -69.6 -52.8 179.1 50 ALA -56.5 -53.8 -178.8 51 ASP -46.7 -43.7 179.7 -65.3 -172.1 52 CYS -75.6 -60.1 -179.0 -65.0 53 GLN -45.4 -40.5 -178.9 -155.2 178.6 70.4 54 PHE -77.6 -62.4 -177.7 -176.8 100.7 55 TRP -63.8 -20.6 179.2 -66.5 114.8 56 GLU -86.2 -36.3 177.3 -79.4 178.6 17.2 57 THR -58.6 -47.1 178.7 -75.4 58 TRP -58.8 -43.3 179.4 169.5 90.1 59 LEU -53.3 -42.1 -179.5 -177.5 57.4 60 GLY -51.0 -45.2 179.9 61 SER -67.8 -48.2 179.8 -73.1 62 GLN -56.1 -29.1 179.0 -70.8 -68.7 -57.8 63 CYS -70.8 -47.7 180.0 -81.2 64 ARG -57.8 -47.0 177.2 172.0 68.6 160.3 134.3 65 LEU -51.8 -45.4 179.9 -108.0 54.2 66 HIS -64.1 -36.1 -179.3 177.0 103.8 67 GLU -70.1 -31.9 177.9 -57.7 -163.2 157.4 68 LEU -72.1 -49.6 -179.5 -76.9 172.8 69 ARG -56.4 -41.2 -175.9 -119.0 112.9 69.3 170.8 70 GLU -112.6 1.1 180.0 -36.7 -62.4 -54.2 71 LYS 49.7 30.5 -179.8 -64.3 100.5 65.0 -178.8 72 GLU -141.3 145.3 178.6 -167.1 175.6 -118.4 73 ARG -63.8 131.0 -178.8 -91.8 -172.3 52.5 -160.8 74 ILE -67.3 140.3 -179.7 -173.2 165.5 75 SER -73.9 156.1 178.1 57.4 76 VAL -61.6 -45.9 -179.6 178.4 77 ALA -48.1 -51.5 -180.0 78 ALA -69.2 -41.8 -179.7 79 ALA -61.1 -33.7 179.8 80 SER -77.2 -38.7 -179.3 69.2 81 LYS -63.2 -21.3 177.9 -161.6 149.0 -167.3 178.1 82 ILE -72.5 -59.7 -179.6 -76.2 164.2 83 LEU -53.6 -43.3 179.6 -172.4 69.1 84 SER -60.6 -53.4 -179.3 165.1 85 ASN -62.8 -34.5 179.2 -83.0 153.6 86 LEU -65.9 -55.6 179.2 173.1 -70.6 87 VAL -48.5 -51.1 179.4 142.0 88 TYR -56.4 -29.4 179.8 -177.9 -102.8 89 GLN -63.1 -31.6 -178.9 -87.3 -66.4 114.5 90 TYR -92.5 5.3 -177.9 -76.9 -90.8 91 LYS -47.6 122.1 -179.5 -172.9 161.3 -175.9 161.7 92 GLY 102.7 -28.7 -179.5 93 ALA -61.5 -21.0 -179.9 94 GLY 105.7 28.2 178.0 95 LEU -75.2 145.3 -179.9 -78.1 -174.1 96 SER -130.0 108.5 177.7 -163.4 97 MET -166.3 141.2 178.8 53.3 -170.6 -86.2 98 GLY -138.7 117.4 -177.1 99 THR -143.6 160.9 176.5 -173.5 100 MET -114.1 125.0 177.3 -95.6 96.4 59.1 101 ILE -102.0 115.5 -175.8 -59.5 -53.1 102 CYS -116.2 133.8 -179.4 -48.0 103 GLY -163.7 152.5 -178.7 104 TYR -124.3 106.7 179.3 -165.9 -11.0 105 THR -120.2 157.4 -179.7 62.9 106 ARG -58.6 17.9 76.9 167.5 80.1 163.4 -128.8 107 GLU 0.8 -48.2 -176.9 -59.5 165.5 128.6 108 GLY 108.9 -159.2 179.5 109 PRO -79.3 138.2 -178.2 -7.5 28.9 110 THR -143.0 138.3 178.5 -48.0 111 ILE -129.3 128.2 178.1 -55.5 -179.5 112 TYR -121.9 136.7 177.9 -84.9 -80.9 113 TYR -98.5 127.1 179.8 164.4 69.3 114 VAL -131.8 136.1 176.4 178.0 115 ASP -136.4 167.7 179.9 67.6 16.2 116 SER -60.0 -9.9 178.7 30.8 117 ASP -84.8 -5.7 179.8 -81.4 -149.0 118 GLY 88.7 23.1 180.0 119 THR -90.7 137.0 179.2 -64.4 120 ARG -136.1 122.8 -178.3 -176.3 170.8 164.9 -91.3 121 LEU -136.8 137.4 178.3 -81.8 -178.1 122 LYS -99.4 129.5 179.9 -170.6 172.2 59.2 -174.1 123 GLY -157.0 -177.9 -177.8 124 ASP -103.4 -27.4 178.7 -38.4 97.7 125 ILE -145.6 135.1 178.9 -44.4 179.1 126 PHE -150.0 141.2 176.7 -76.8 132.7 127 CYS -128.7 143.6 180.0 -50.9 128 VAL -140.8 140.9 178.7 -176.8 129 GLY 127.2 168.0 179.4 130 SER -54.9 -26.6 -179.1 46.1 131 GLY -99.3 9.7 -178.6 132 GLN -48.4 -52.6 -177.2 69.8 -173.5 49.9 133 THR -52.7 -34.8 -179.9 59.1 134 PHE -69.0 -44.5 178.5 -60.6 -53.1 135 ALA -65.7 -42.2 179.2 136 TYR -59.0 -39.2 -179.3 -92.4 125.5 137 GLY -51.5 -57.3 178.5 138 VAL -59.0 -62.7 179.9 175.5 139 LEU -43.4 -56.8 -176.8 -102.7 26.4 140 ASP -49.9 -42.8 -178.6 -74.0 29.1 141 SER -83.5 -30.7 -179.8 56.7 142 ASN -102.9 15.6 -179.4 -76.6 92.6 143 TYR -97.4 132.2 178.3 169.9 -87.9 144 LYS -145.6 133.5 -179.6 -91.7 65.1 -157.5 172.6 145 TRP -57.4 -36.2 -178.4 173.1 -94.6 146 ASP -71.7 20.7 -178.0 -40.5 -93.1 147 LEU -74.3 164.2 178.0 -118.7 71.2 148 SER -99.1 164.0 178.8 60.5 149 VAL -61.1 -34.2 -179.9 166.4 150 GLU -74.5 -44.8 177.8 -167.6 -174.9 -123.7 151 ASP -64.9 -52.2 179.0 -72.1 176.3 152 ALA -51.4 -47.0 178.9 153 LEU -56.2 -46.8 179.6 -82.1 171.8 154 TYR -59.2 -57.3 -179.9 -176.6 -103.7 155 LEU -40.0 -57.0 -179.8 -179.1 46.0 156 GLY -59.2 -48.4 -179.9 157 LYS -53.7 -39.1 -179.3 -178.0 -177.6 -178.1 -170.7 158 ARG -72.5 -49.4 -179.6 -177.8 57.2 173.9 87.0 159 SER -51.9 -32.7 178.1 -55.7 160 ILE -72.0 -51.3 179.5 -69.7 -54.7 161 LEU -46.4 -48.4 178.7 -175.2 57.2 162 ALA -49.9 -57.6 -179.6 163 ALA -62.2 -37.8 -179.1 164 ALA -61.3 -31.6 -178.0 165 HIS -72.1 -55.9 -179.0 179.5 55.8 166 ARG -74.6 -47.9 -178.4 -69.3 -49.3 -156.1 138.7 167 ASP -76.5 128.8 -178.2 176.5 -162.9 168 ALA -74.9 -27.5 -178.5 169 TYR -86.8 7.9 178.8 -63.2 -46.6 170 SER -127.1 162.6 179.3 -50.2 171 GLY 140.7 -159.4 -179.2 172 GLY 92.0 -82.2 -179.8 173 SER -167.3 155.7 179.8 60.6 174 VAL -101.6 137.3 178.1 -171.9 175 ASN -113.8 128.3 -177.5 -79.8 134.7 176 LEU -113.4 146.6 179.1 -82.9 159.0 177 TYR -145.7 136.8 176.8 -77.8 87.3 178 HIS -113.7 123.2 179.9 179.2 -165.7 179 VAL -105.7 121.8 179.7 -177.4 180 THR -119.7 176.5 -179.6 80.4 181 GLU -68.3 -31.7 179.4 -165.9 -178.6 159.2 182 ASP -80.6 6.6 -179.0 -64.9 175.2 183 GLY 118.6 -167.3 -179.8 184 TRP -108.1 157.5 -179.9 50.4 -103.7 185 ILE -130.9 131.0 -179.8 -35.9 166.6 186 TYR -75.5 143.0 178.5 -173.5 41.0 187 HIS -127.7 41.1 176.4 -83.0 -71.6 188 GLY 83.6 165.6 178.4 189 ASN -112.4 119.4 -177.9 158.8 -92.6 190 HIS -116.1 106.7 -179.8 -51.8 -80.1 191 ASP -54.3 120.6 -179.1 -175.8 81.5 192 VAL -61.6 -34.9 178.6 177.8 193 GLY -51.6 -70.0 179.9 194 GLU -57.2 -30.3 -179.4 -56.6 164.4 -123.1 195 LEU -70.8 -43.2 -178.9 -176.8 70.0 196 PHE -56.4 -49.5 179.8 -179.7 -97.2 197 TRP -58.4 -49.5 179.9 -65.5 135.2 198 LYS -58.2 -54.6 -179.6 -167.2 -172.5 -175.4 78.7 199 VAL -59.3 -43.4 -179.5 -174.6 200 LYS -55.8 -55.9 -179.8 -173.9 -154.8 171.0 -171.1 201 GLU -53.1 -53.9 -179.0 -173.8 149.8 -101.4 202 GLU -69.8 -47.9 -178.0 -61.4 173.4 9.2 203 GLU -83.1 -26.3 179.7 -162.1 164.8 -138.4 204 GLY 86.7 -3.0 -179.2 205 SER -81.7 -179.6 -177.0 55.0 206 PHE 61.2 43.6 -177.9 -66.5 -53.9 207 ASN -62.7 -40.8 -178.4 -165.4 100.0 208 ASN -56.6 -19.1 179.7 -157.2 28.5 209 VAL -82.9 148.6 -178.7 -172.4 210 ILE -101.6 131.0 179.8 -86.8 51.1 211 GLY 168.8 -19.5 0.0 Alpha Carbon Cartesian Coordinates : Residue Type X Y Z 1 THR 11.179 -140.349 8.031 2 THR 11.566 -139.592 4.359 3 THR 11.733 -136.069 2.944 4 LEU 12.649 -134.885 -0.530 5 ALA 12.826 -131.743 -2.538 6 PHE 13.761 -131.314 -6.130 7 ARG 14.198 -128.372 -8.405 8 PHE 12.828 -128.158 -11.942 9 GLN 11.248 -126.025 -14.680 10 GLY 7.968 -125.337 -12.862 11 GLY 9.687 -124.724 -9.516 12 ILE 10.349 -126.970 -6.538 13 ILE 8.686 -130.145 -5.375 14 VAL 8.756 -130.929 -1.710 15 ALA 7.338 -134.207 -0.560 16 VAL 7.604 -135.696 2.867 17 ASP 6.006 -138.610 4.797 18 SER 4.306 -138.169 8.173 19 ARG 5.270 -140.840 10.677 20 ALA 6.810 -140.329 14.137 21 THR 8.143 -143.233 16.176 22 ALA 9.577 -143.737 19.655 23 GLY 11.460 -147.010 19.227 24 ASN 9.214 -149.562 17.522 25 TRP 6.136 -147.686 18.647 26 VAL 4.403 -145.481 16.092 27 ALA 3.646 -142.283 17.972 28 SER 1.874 -140.493 15.205 29 GLN 0.957 -140.958 11.546 30 THR -0.210 -137.331 11.234 31 VAL 2.941 -135.201 11.677 32 LYS 3.692 -132.192 9.468 33 LYS 7.234 -132.445 8.337 34 VAL 7.121 -129.393 6.151 35 ILE 7.539 -126.278 8.147 36 GLU 5.976 -123.357 6.345 37 ILE 8.633 -120.783 7.241 38 ASN 6.671 -118.038 5.503 39 PRO 4.569 -117.877 2.296 40 PHE 7.639 -118.107 -0.001 41 LEU 9.934 -120.438 1.863 42 LEU 9.642 -124.063 2.925 43 GLY 11.599 -126.113 5.408 44 THR 11.571 -129.874 5.852 45 MET 11.767 -131.772 9.096 46 ALA 14.180 -134.629 9.900 47 GLY 16.273 -135.298 13.002 48 GLY 14.927 -133.481 16.030 49 ALA 11.306 -132.494 15.706 50 ALA 11.468 -129.748 18.221 51 ASP 14.792 -128.650 16.809 52 CYS 13.381 -128.221 13.372 53 GLN 9.914 -126.998 14.271 54 PHE 11.480 -124.500 16.597 55 TRP 14.464 -123.194 14.771 56 GLU 12.674 -123.030 11.498 57 THR 9.639 -121.275 12.947 58 TRP 12.230 -118.878 14.353 59 LEU 13.935 -118.695 10.987 60 GLY 10.537 -117.542 9.820 61 SER 10.661 -114.605 12.179 62 GLN 14.213 -113.607 11.440 63 CYS 13.093 -113.502 7.821 64 ARG 10.179 -111.166 8.440 65 LEU 12.537 -108.891 10.354 66 HIS 14.827 -108.817 7.328 67 GLU 11.957 -107.971 5.045 68 LEU 10.966 -105.074 7.226 69 ARG 14.534 -103.816 7.515 70 GLU 15.256 -104.009 3.794 71 LYS 11.847 -103.877 2.063 72 GLU 12.984 -106.780 -0.185 73 ARG 12.231 -110.582 -0.072 74 ILE 15.059 -112.401 1.690 75 SER 16.962 -114.671 -0.614 76 VAL 16.883 -118.356 0.057 77 ALA 20.675 -118.305 0.311 78 ALA 20.555 -115.736 3.037 79 ALA 17.521 -117.303 4.631 80 SER 19.360 -120.626 4.876 81 LYS 22.656 -119.114 6.142 82 ILE 20.836 -117.704 9.097 83 LEU 19.525 -121.108 10.145 84 SER 22.852 -122.563 9.234 85 ASN 24.968 -120.101 11.178 86 LEU 22.703 -120.359 14.225 87 VAL 22.820 -124.154 14.193 88 TYR 26.601 -124.093 13.873 89 GLN 26.657 -121.884 16.981 90 TYR 25.219 -124.801 18.868 91 LYS 27.570 -127.341 17.333 92 GLY 28.289 -130.042 19.884 93 ALA 25.367 -129.153 22.134 94 GLY 23.513 -132.056 20.593 95 LEU 21.064 -130.505 18.102 96 SER 19.616 -133.006 15.643 97 MET 18.358 -131.766 12.350 98 GLY 18.771 -132.261 8.628 99 THR 16.623 -129.974 6.497 100 MET 16.014 -128.465 3.094 101 ILE 15.330 -124.765 2.901 102 CYS 13.427 -124.290 -0.333 103 GLY 12.591 -121.139 -2.203 104 TYR 11.994 -119.509 -5.555 105 THR 13.073 -115.878 -5.831 106 ARG 13.514 -113.706 -8.920 107 GLU 18.021 -116.689 -7.637 108 GLY 15.389 -118.853 -9.259 109 PRO 14.130 -121.973 -7.462 110 THR 16.639 -122.855 -4.775 111 ILE 17.103 -125.661 -2.273 112 TYR 19.713 -125.687 0.449 113 TYR 20.477 -128.611 2.692 114 VAL 21.337 -127.575 6.184 115 ASP 22.065 -129.835 9.120 116 SER 23.109 -129.660 12.732 117 ASP 26.678 -130.460 11.750 118 GLY 26.677 -127.006 10.161 119 THR 26.590 -128.222 6.631 120 ARG 24.893 -125.989 4.161 121 LEU 24.672 -127.262 0.610 122 LYS 23.112 -126.008 -2.578 123 GLY 21.735 -128.726 -4.837 124 ASP 18.951 -129.901 -7.145 125 ILE 17.678 -133.017 -5.359 126 PHE 17.927 -134.112 -1.784 127 CYS 16.247 -136.742 0.288 128 VAL 16.750 -136.871 3.990 129 GLY 15.661 -139.438 6.527 130 SER 15.892 -143.123 7.336 131 GLY 14.098 -143.781 4.023 132 GLN 16.194 -141.542 1.884 133 THR 17.814 -144.268 -0.192 134 PHE 14.482 -145.557 -1.301 135 ALA 13.355 -142.124 -2.458 136 TYR 16.701 -141.443 -4.122 137 GLY 16.318 -144.673 -6.067 138 VAL 13.110 -143.521 -7.719 139 LEU 14.093 -139.849 -8.149 140 ASP 17.400 -140.617 -9.716 141 SER 15.981 -142.703 -12.546 142 ASN 12.821 -140.748 -13.226 143 TYR 14.098 -137.202 -12.839 144 LYS 14.370 -134.841 -15.842 145 TRP 14.476 -130.984 -15.664 146 ASP 11.905 -130.807 -18.497 147 LEU 9.237 -132.262 -16.255 148 SER 5.775 -130.883 -15.846 149 VAL 4.214 -129.701 -12.587 150 GLU 1.874 -132.717 -12.636 151 ASP 4.511 -135.378 -13.369 152 ALA 7.002 -133.844 -10.965 153 LEU 4.326 -133.801 -8.252 154 TYR 3.696 -137.457 -8.951 155 LEU 7.378 -138.358 -8.993 156 GLY 7.858 -137.013 -5.503 157 LYS 4.622 -138.544 -4.274 158 ARG 5.861 -141.840 -5.631 159 SER 9.401 -141.550 -4.313 160 ILE 8.014 -141.228 -0.815 161 LEU 5.754 -144.194 -1.416 162 ALA 8.716 -146.278 -2.414 163 ALA 10.325 -145.433 0.898 164 ALA 7.120 -145.698 2.908 165 HIS 6.882 -149.237 1.724 166 ARG 10.318 -150.570 2.470 167 ASP 11.363 -148.352 5.357 168 ALA 9.595 -149.159 8.557 169 TYR 10.201 -145.713 9.959 170 SER 8.353 -143.840 7.200 171 GLY 4.735 -144.039 6.143 172 GLY 1.443 -142.576 7.222 173 SER 0.701 -140.227 4.333 174 VAL 2.572 -138.074 1.813 175 ASN 2.420 -134.251 1.880 176 LEU 3.227 -132.422 -1.357 177 TYR 4.270 -128.872 -2.012 178 HIS 5.042 -127.018 -5.187 179 VAL 7.181 -123.957 -4.689 180 THR 6.838 -121.265 -7.365 181 GLU 8.006 -117.664 -7.586 182 ASP 4.665 -116.348 -6.426 183 GLY 5.130 -118.583 -3.396 184 TRP 4.223 -122.219 -2.674 185 ILE 1.116 -124.251 -3.216 186 TYR 0.061 -127.230 -1.167 187 HIS -0.898 -130.294 -3.125 188 GLY -2.634 -132.403 -0.536 189 ASN -2.161 -135.006 2.140 190 HIS -2.203 -138.504 0.668 191 ASP -2.807 -141.496 2.945 192 VAL -0.147 -144.021 2.043 193 GLY -2.555 -146.803 2.835 194 GLU -5.086 -145.858 0.149 195 LEU -2.257 -144.678 -2.072 196 PHE -0.241 -147.912 -2.269 197 TRP -3.163 -149.965 -3.557 198 LYS -4.130 -147.352 -6.136 199 VAL -0.606 -146.905 -7.463 200 LYS 0.004 -150.657 -7.559 201 GLU -3.179 -151.247 -9.520 202 GLU -2.620 -148.388 -12.014 203 GLU 1.166 -148.517 -12.452 204 GLY 1.445 -152.275 -11.981 205 SER 4.460 -152.174 -9.672 206 PHE 4.863 -153.705 -6.205 207 ASN 3.959 -156.885 -7.982 208 ASN 5.319 -159.071 -5.218 209 VAL 2.631 -157.716 -2.932 210 ILE -0.661 -159.497 -2.969 211 GLY -3.833 -157.550 -3.496 Richards-Kundrot Secondary Structure Assignment : 1 2 3 4 5 6 7 8 9 10 0 S S S S S S S S/T T T 10 T/S S S S S S S S S S 20 S/T T T T/S S S S C S S 30 S S S S S S C T T T 40 T/S S S S S S S H H H 50 H H H H H H H H H H 60 H H H H H H H H H H 70 H/S S S S S/H H H H H H 80 H H H H H H H H H H 90 H/T T T T/S S S S S S S/S 100 S S S S S/T T/X X/T T/S S S 110 S S S S S/T T T T/S S S 120 S S S S/S S S S S S S 130 H H H H H H H H H H 140 H H H C C C C H H H 150 H H H H H H H H H H 160 H H H H H H H/T T T T 170 C S S S S S S S S S/T 180 T T T/S S S S S S/S S S 190 S/H H H H H H H H H H 200 H H H H C C C S S S 210 S Kabsch-Sander Secondary Structure Assignment : 1 2 3 4 5 6 7 8 9 10 0 e E E E E E E T T 10 E E E E E E e E 20 E E T T E E E E S 30 e E E E E E T e 40 E E E E e B h H H 50 H H H H H H H H H H 60 H H H H H H H H H H 70 h S h H H H H H 80 H H H H H H H H H h 90 T T t e E E E 100 E E E E E E E E 110 E E E E E e T T E E 120 E E E e E E E E t T 130 h H H H H H H H H H 140 H H h t T T t h H H 150 H H H H H H H H H H 160 H H H H H H h T T t 170 e E E E E E E E E 180 T T E E E E E E E E 190 E H H H H H H H H H 200 H H H h t T T t 210 Buried Surface Area Percentages : Residue Type Buried Area % Buried % Polar Cover 1 THR 81.3 76.0 66.3 2 THR 106.9 100.0 43.8 3 THR 106.7 99.8 41.6 4 LEU 147.8 100.0 31.5 5 ALA 72.6 100.0 32.0 6 PHE 166.5 99.8 28.4 7 ARG 141.2 67.6 58.6 8 PHE 166.4 99.8 42.2 9 GLN 64.2 43.2 64.5 10 GLY 24.9 71.6 57.8 11 GLY 34.8 100.0 50.1 12 ILE 143.5 100.0 34.6 13 ILE 143.5 100.0 33.1 14 VAL 118.8 100.0 26.5 15 ALA 72.6 100.0 38.6 16 VAL 118.8 100.0 46.9 17 ASP 110.5 100.0 48.6 18 SER 82.5 98.7 69.5 19 ARG 161.1 77.1 67.1 20 ALA 39.1 53.9 58.5 21 THR 87.8 82.2 54.8 22 ALA 19.1 26.3 71.6 23 GLY 0.0 0.0 86.2 24 ASN 2.0 1.7 87.8 25 TRP 37.0 18.1 82.2 26 VAL 78.3 65.9 63.0 27 ALA 43.5 59.9 59.2 28 SER 48.8 58.4 65.8 29 GLN 72.4 48.7 68.4 30 THR 13.1 12.3 85.2 31 VAL 84.1 70.8 52.8 32 LYS 34.8 20.0 87.2 33 LYS 167.5 96.6 49.1 34 VAL 116.9 98.4 38.0 35 ILE 125.7 87.6 54.3 36 GLU 68.7 49.5 65.0 37 ILE 143.1 99.7 42.6 38 ASN 92.7 76.7 47.0 39 PRO 32.1 25.8 65.6 40 PHE 111.3 66.7 69.7 41 LEU 146.4 99.1 43.1 42 LEU 147.7 100.0 28.8 43 GLY 34.8 100.0 57.8 44 THR 106.4 99.5 44.4 45 MET 149.7 93.9 43.6 46 ALA 65.8 90.6 53.5 47 GLY 14.8 42.5 75.2 48 GLY 19.2 55.0 71.6 49 ALA 21.0 28.9 70.3 50 ALA 6.4 8.8 78.8 51 ASP 80.8 73.1 47.7 52 CYS 99.2 100.0 55.1 53 GLN 46.2 31.1 68.7 54 PHE 49.6 29.8 66.5 55 TRP 170.1 83.0 36.2 56 GLU 138.6 100.0 35.3 57 THR 25.9 24.2 76.2 58 TRP 137.1 66.9 49.9 59 LEU 147.8 100.0 28.8 60 GLY 32.5 93.3 61.6 61 SER 25.0 29.9 73.2 62 GLN 95.9 64.5 53.3 63 CYS 99.1 99.9 43.6 64 ARG 65.5 31.4 70.2 65 LEU 77.8 52.7 75.9 66 HIS 93.3 62.1 58.0 67 GLU 101.4 73.2 64.1 68 LEU 55.9 37.8 80.8 69 ARG 69.2 33.1 76.1 70 GLU 59.8 43.2 72.9 71 LYS 16.8 9.7 92.8 72 GLU 13.3 9.6 88.4 73 ARG 154.3 73.9 58.4 74 ILE 141.4 98.6 46.9 75 SER 50.5 60.4 63.0 76 VAL 118.8 100.0 45.4 77 ALA 43.0 59.2 77.2 78 ALA 33.9 46.7 66.6 79 ALA 72.6 100.0 33.4 80 SER 83.6 100.0 41.2 81 LYS 63.3 36.5 83.4 82 ILE 93.5 65.2 53.5 83 LEU 147.8 100.0 28.2 84 SER 76.9 92.0 47.8 85 ASN 41.3 34.1 72.9 86 LEU 115.9 78.4 38.2 87 VAL 118.8 100.0 38.4 88 TYR 64.2 35.5 77.5 89 GLN 26.6 17.9 79.4 90 TYR 93.6 51.7 56.3 91 LYS 78.8 45.5 75.1 92 GLY 0.0 0.0 82.8 93 ALA 25.6 35.3 72.2 94 GLY 0.0 0.0 85.3 95 LEU 124.6 84.3 52.3 96 SER 28.0 33.5 71.8 97 MET 159.3 100.0 38.4 98 GLY 28.4 81.6 51.4 99 THR 106.9 100.0 51.0 100 MET 159.4 100.0 39.2 101 ILE 143.5 100.0 33.6 102 CYS 99.2 100.0 33.7 103 GLY 34.8 100.0 43.4 104 TYR 135.6 74.9 55.9 105 THR 94.1 88.0 62.8 106 ARG 7.4 3.5 90.6 107 GLU 92.3 66.6 67.4 108 GLY 20.5 58.9 58.7 109 PRO 110.9 89.1 48.6 110 THR 96.8 90.5 44.5 111 ILE 143.5 100.0 39.3 112 TYR 163.7 90.4 47.0 113 TYR 136.1 75.2 44.1 114 VAL 118.8 100.0 40.6 115 ASP 90.5 81.9 58.6 116 SER 72.9 87.2 55.6 117 ASP 21.5 19.4 85.2 118 GLY 34.5 99.3 64.4 119 THR 58.1 54.4 64.0 120 ARG 161.7 77.4 54.4 121 LEU 56.6 38.3 63.1 122 LYS 54.6 31.5 73.6 123 GLY 19.9 57.2 64.6 124 ASP 46.4 42.0 73.6 125 ILE 117.8 82.1 42.8 126 PHE 134.6 80.7 48.2 127 CYS 99.2 100.0 33.4 128 VAL 98.8 83.2 51.6 129 GLY 24.3 69.8 58.8 130 SER 40.3 48.2 77.2 131 GLY 34.8 100.0 60.8 132 GLN 80.0 53.8 61.0 133 THR 29.9 28.0 66.0 134 PHE 91.6 54.9 66.5 135 ALA 72.6 100.0 41.5 136 TYR 119.6 66.1 62.7 137 GLY 0.0 0.0 80.8 138 VAL 89.0 74.9 62.8 139 LEU 147.8 100.0 31.8 140 ASP 35.7 32.3 68.8 141 SER 18.8 22.5 87.3 142 ASN 33.7 27.9 75.9 143 TYR 146.2 80.8 45.2 144 LYS 55.2 31.8 78.1 145 TRP 97.8 47.7 73.2 146 ASP 8.9 8.0 73.4 147 LEU 121.3 82.1 55.1 148 SER 36.2 43.3 76.6 149 VAL 70.5 59.4 59.5 150 GLU 5.1 3.7 84.1 151 ASP 33.9 30.6 74.3 152 ALA 72.6 100.0 32.9 153 LEU 125.3 84.8 45.1 154 TYR 92.3 51.0 63.5 155 LEU 136.9 92.6 39.0 156 GLY 34.8 100.0 42.3 157 LYS 128.8 74.3 42.0 158 ARG 173.9 83.2 43.9 159 SER 83.6 100.0 38.3 160 ILE 143.5 100.0 38.7 161 LEU 147.4 99.7 32.7 162 ALA 59.2 81.6 58.3 163 ALA 72.6 100.0 51.8 164 ALA 72.4 99.7 45.1 165 HIS 93.4 62.2 55.3 166 ARG 54.2 25.9 77.1 167 ASP 96.4 87.2 58.5 168 ALA 7.8 10.7 80.0 169 TYR 84.8 46.8 76.9 170 SER 83.6 100.0 58.6 171 GLY 31.9 91.7 49.7 172 GLY 32.7 93.9 65.1 173 SER 75.7 90.5 68.6 174 VAL 118.8 100.0 40.1 175 ASN 109.6 90.6 55.7 176 LEU 143.5 97.1 39.9 177 TYR 165.5 91.4 37.8 178 HIS 142.1 94.6 39.3 179 VAL 118.8 100.0 40.0 180 THR 80.0 74.9 53.8 181 GLU 81.0 58.4 64.9 182 ASP 0.0 0.0 84.0 183 GLY 31.3 89.8 67.2 184 TRP 163.4 79.7 50.3 185 ILE 51.3 35.8 75.7 186 TYR 98.4 54.4 63.9 187 HIS 94.5 62.9 53.7 188 GLY 14.3 41.1 61.1 189 ASN 56.0 46.3 79.9 190 HIS 99.4 66.2 63.2 191 ASP 55.4 50.1 71.3 192 VAL 100.8 84.9 47.1 193 GLY 0.0 0.0 79.8 194 GLU 13.2 9.5 80.8 195 LEU 138.0 93.4 40.6 196 PHE 146.1 87.6 35.5 197 TRP 80.4 39.2 68.9 198 LYS 50.3 29.0 80.0 199 VAL 109.4 92.1 48.6 200 LYS 143.7 82.9 61.2 201 GLU 5.4 3.9 83.9 202 GLU 38.9 28.1 74.6 203 GLU 74.4 53.7 76.1 204 GLY 5.6 16.1 85.8 205 SER 48.0 57.4 71.2 206 PHE 139.0 83.3 50.8 207 ASN 8.3 6.8 85.1 208 ASN 0.0 0.0 87.1 209 VAL 78.1 65.7 53.6 210 ILE 7.3 5.1 87.6 211 GLY 15.1 43.3 67.0