Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3koy_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLU 7.A N ARG 4.A O no hydrogen 2.978 N/A ASN 13.A N ASP 10.A OD1 no hydrogen 3.211 N/A ILE 14.A N ASP 10.A O no hydrogen 3.107 N/A ILE 14.A N VAL 11.A O no hydrogen 3.208 N/A LYS 16.A N ASN 13.A O no hydrogen 3.382 N/A LYS 20.A N ASP 17.A O no hydrogen 2.732 N/A TYR 21.A N LEU 18.A O no hydrogen 3.142 N/A TYR 21.A OH ASP 141.A OD2 no hydrogen 2.701 N/A LYS 24.A N ASP 141.A OD2 no hydrogen 3.387 N/A ARG 25.A NE GLU 144.A OE1 no hydrogen 2.656 N/A ARG 25.A NH2 GLU 144.A OE1 no hydrogen 2.948 N/A ARG 25.A NH2 GLU 144.A OE2 no hydrogen 2.604 N/A ARG 25.A NH2 ILE 151.A O no hydrogen 3.220 N/A TRP 28.A N ASP 210.A O no hydrogen 3.006 N/A THR 29.A N ASN 152.A OD1 no hydrogen 2.604 N/A THR 29.A OG1 ASN 152.A OD1 no hydrogen 3.189 N/A ARG 31.A NE ASP 99.A OD1 no hydrogen 3.222 N/A ARG 31.A NE ASP 99.A OD2 no hydrogen 2.896 N/A ARG 31.A NH1 PRO 70.A O no hydrogen 2.760 N/A ARG 31.A NH2 ASP 99.A OD1 no hydrogen 2.847 N/A ALA 34.A N ALA 47.A O no hydrogen 3.149 N/A LEU 37.A N ALA 34.A O no hydrogen 3.152 N/A GLN 38.A NE2 GLY 40.A O no hydrogen 3.116 N/A MET 39.A N PHE 42.A O no hydrogen 2.958 N/A PHE 42.A N MET 39.A O no hydrogen 2.970 N/A TYR 44.A N LEU 37.A O no hydrogen 2.999 N/A LYS 45.A N ASP 356.A OD2 no hydrogen 2.789 N/A LYS 45.A NZ ASN 36.A OD1 no hydrogen 3.151 N/A ASP 46.A N ASP 356.A OD1 no hydrogen 2.700 N/A SER 48.A N GLN 69.A O no hydrogen 2.719 N/A SER 48.A OG GLN 69.A O no hydrogen 2.852 N/A SER 48.A OG PRO 70.A O no hydrogen 2.819 N/A THR 49.A N GLN 32.A O no hydrogen 3.049 N/A GLU 52.A N VAL 147.A O no hydrogen 2.981 N/A ASN 53.A N VAL 147.A O no hydrogen 3.471 N/A ASN 53.A ND2 GLU 146.A O no hydrogen 2.954 N/A SER 54.A OG ASP 67.A OD2 no hydrogen 2.488 N/A VAL 55.A N TRP 95.A O no hydrogen 2.863 N/A ALA 60.A N LEU 57.A O no hydrogen 2.874 N/A LYS 61.A N PRO 58.A O no hydrogen 3.214 N/A PHE 63.A N ALA 60.A O no hydrogen 3.023 N/A GLN 69.A NE2 ASP 67.A OD2 no hydrogen 3.219 N/A VAL 73.A N ASP 322.A O no hydrogen 3.401 N/A ILE 74.A N ASP 99.A OD1 no hydrogen 2.969 N/A THR 75.A N GLN 324.A O no hydrogen 3.351 N/A THR 75.A OG1 HIS 100.A ND1 no hydrogen 2.896 N/A THR 75.A OG1 SER 325.A OG no hydrogen 2.823 N/A THR 76.A N HIS 100.A O no hydrogen 2.850 N/A ILE 78.A N MET 102.A O no hydrogen 3.002 N/A SER 80.A N ASP 86.A OD2 no hydrogen 2.881 N/A SER 80.A OG ASP 86.A OD1 no hydrogen 2.471 N/A ARG 82.A NE GLN 121.A OE1 no hydrogen 2.934 N/A ARG 82.A NH2 GLN 121.A OE1 no hydrogen 2.873 N/A GLU 84.A N GLU 84.A OE1 no hydrogen 2.751 N/A ASP 85.A N ARG 82.A O no hydrogen 2.904 N/A ASP 86.A N ARG 82.A O no hydrogen 3.270 N/A ILE 87.A N PHE 83.A O no hydrogen 2.923 N/A ARG 88.A N ASP 85.A O no hydrogen 2.864 N/A ARG 88.A NH1 GLU 505.A OE2 no hydrogen 3.349 N/A ARG 88.A NH2 ASP 85.A OD1 no hydrogen 3.067 N/A ARG 88.A NH2 GLU 505.A OE1 no hydrogen 3.188 N/A ARG 88.A NH2 GLU 505.A OE2 no hydrogen 3.097 N/A ARG 89.A NE HIS 338.A ND1 no hydrogen 3.088 N/A MET 90.A N ASP 86.A O no hydrogen 2.819 N/A ARG 91.A N ILE 87.A O no hydrogen 3.253 N/A ARG 91.A NE GLU 146.A OE1 no hydrogen 2.757 N/A ARG 91.A NH1 GLU 7.A O no hydrogen 3.226 N/A ARG 91.A NH2 ARG 4.A O no hydrogen 3.354 N/A ARG 91.A NH2 GLU 146.A OE1 no hydrogen 3.030 N/A ARG 91.A NH2 GLU 146.A OE2 no hydrogen 2.762 N/A MET 92.A N ARG 88.A O no hydrogen 3.219 N/A ALA 93.A N ARG 89.A O no hydrogen 2.910 N/A ALA 94.A N MET 90.A O no hydrogen 2.845 N/A TRP 95.A N ARG 91.A O no hydrogen 3.348 N/A TRP 95.A N MET 92.A O no hydrogen 3.088 N/A TRP 95.A NE1 GLU 146.A OE1 no hydrogen 2.786 N/A HIS 96.A N MET 92.A O no hydrogen 3.253 N/A HIS 96.A N ALA 93.A O no hydrogen 2.834 N/A HIS 96.A ND1 ASP 346.A OD1 no hydrogen 2.632 N/A GLY 97.A N ALA 94.A O no hydrogen 3.389 N/A ALA 98.A N ALA 93.A O no hydrogen 3.174 N/A ASP 99.A N ILE 74.A O no hydrogen 3.173 N/A HIS 100.A N ILE 74.A O no hydrogen 3.206 N/A HIS 100.A NE2 HIS 154.A ND1 no hydrogen 2.985 N/A ILE 101.A N ASN 152.A O no hydrogen 3.026 N/A MET 102.A N THR 76.A O no hydrogen 2.926 N/A VAL 103.A N HIS 154.A O no hydrogen 2.567 N/A ARG 105.A NH1 SER 158.A O no hydrogen 2.899 N/A ARG 105.A NH2 SER 158.A O no hydrogen 3.164 N/A THR 106.A N VAL 126.A O no hydrogen 2.975 N/A ALA 107.A N ILE 123.A O no hydrogen 3.051 N/A GLN 109.A N THR 106.A O no hydrogen 3.141 N/A GLN 109.A NE2 ILE 128.A O no hydrogen 3.305 N/A HIS 111.A N GLY 108.A O no hydrogen 3.025 N/A TYR 112.A N GLN 109.A O no hydrogen 3.024 N/A THR 119.A N GLU 481.A OE1 no hydrogen 3.044 N/A THR 119.A OG1 GLU 481.A OE2 no hydrogen 2.969 N/A GLN 121.A N ASP 486.A OD1 no hydrogen 3.158 N/A GLN 121.A NE2 GLY 122.A O no hydrogen 3.343 N/A GLY 122.A N GLY 81.A O no hydrogen 3.029 N/A ILE 123.A N THR 106.A OG1 no hydrogen 3.053 N/A VAL 126.A N ILE 104.A O no hydrogen 2.971 N/A ILE 128.A N GLN 109.A OE1 no hydrogen 3.095 N/A THR 129.A N GLN 132.A OE1 no hydrogen 2.771 N/A THR 129.A OG1 GLY 118.A O no hydrogen 2.742 N/A ARG 130.A NH1 GLU 171.A OE2 no hydrogen 2.481 N/A ARG 130.A NH1 GLU 172.A OE2 no hydrogen 2.868 N/A ARG 130.A NH2 GLU 171.A OE2 no hydrogen 3.027 N/A LYS 131.A NZ ASP 480.A OD1 no hydrogen 3.101 N/A LYS 131.A NZ GLU 481.A OE2 no hydrogen 2.596 N/A GLN 132.A N THR 129.A OG1 no hydrogen 2.964 N/A GLN 132.A NE2 GLN 136.A OE1 no hydrogen 3.095 N/A VAL 133.A N THR 129.A O no hydrogen 3.056 N/A ARG 134.A N ARG 130.A O no hydrogen 3.041 N/A ARG 134.A NE GLU 172.A OE1 no hydrogen 2.819 N/A ARG 134.A NE GLU 172.A OE2 no hydrogen 2.819 N/A ARG 134.A NH1 LEU 18.A O no hydrogen 3.233 N/A ALA 135.A N LYS 131.A O no hydrogen 2.932 N/A GLN 136.A N GLN 132.A O no hydrogen 3.262 N/A GLN 136.A NE2 PHE 83.A O no hydrogen 3.667 N/A ARG 137.A N VAL 133.A O no hydrogen 3.059 N/A ARG 137.A NE ARG 137.A O no hydrogen 3.060 N/A ARG 137.A NH1 ILE 151.A O no hydrogen 2.994 N/A ARG 137.A NH1 ASN 175.A OD1 no hydrogen 3.182 N/A ARG 137.A NH2 GLU 144.A OE2 no hydrogen 2.954 N/A LYS 138.A N ARG 134.A O no hydrogen 2.950 N/A LYS 138.A NZ ILE 14.A O no hydrogen 3.295 N/A LYS 138.A NZ LYS 16.A O no hydrogen 2.920 N/A ALA 139.A N ALA 135.A O no hydrogen 2.967 N/A LEU 140.A N GLN 136.A O no hydrogen 2.791 N/A ASP 141.A N ARG 137.A O no hydrogen 2.790 N/A LEU 142.A N ALA 139.A O no hydrogen 3.030 N/A ILE 143.A N ALA 139.A O no hydrogen 3.017 N/A GLU 144.A N LEU 140.A O no hydrogen 2.654 N/A GLU 145.A N ASP 141.A O no hydrogen 3.258 N/A GLU 146.A N LEU 142.A O no hydrogen 2.854 N/A VAL 147.A N ILE 143.A O no hydrogen 2.916 N/A GLY 148.A N GLU 144.A O no hydrogen 3.121 N/A ARG 149.A NH2 GLY 97.A O no hydrogen 3.281 N/A ILE 151.A N GLU 144.A OE2 no hydrogen 2.783 N/A ASN 152.A N ASP 99.A O no hydrogen 2.657 N/A ASN 152.A ND2 THR 29.A O no hydrogen 2.984 N/A ASN 152.A ND2 ASP 99.A O no hydrogen 3.314 N/A TYR 153.A N ASN 175.A OD1 no hydrogen 2.964 N/A TYR 153.A OH GLN 136.A OE1 no hydrogen 2.234 N/A HIS 154.A N ILE 101.A O no hydrogen 2.973 N/A HIS 154.A NE2 HIS 178.A ND1 no hydrogen 2.823 N/A SER 155.A OG VAL 103.A O no hydrogen 2.963 N/A VAL 157.A N HIS 178.A O no hydrogen 3.070 N/A GLY 159.A N ASN 184.A OD1 no hydrogen 2.868 N/A VAL 160.A N SER 110.A O no hydrogen 2.949 N/A ILE 165.A N ALA 161.A O no hydrogen 3.227 N/A ALA 166.A N GLY 162.A O no hydrogen 2.717 N/A VAL 167.A N PRO 163.A O no hydrogen 3.005 N/A MET 168.A N ASP 164.A O no hydrogen 3.191 N/A PHE 169.A N ILE 165.A O no hydrogen 2.775 N/A ALA 170.A N ALA 166.A O no hydrogen 3.020 N/A GLU 171.A N VAL 167.A O no hydrogen 3.037 N/A GLU 172.A N MET 168.A O no hydrogen 2.883 N/A VAL 174.A N PHE 169.A O no hydrogen 3.122 N/A ASN 175.A N TYR 153.A O no hydrogen 2.937 N/A ASN 175.A ND2 GLY 27.A O no hydrogen 2.884 N/A GLY 176.A N TYR 153.A O no hydrogen 3.132 N/A ALA 177.A N ALA 212.A O no hydrogen 2.950 N/A HIS 178.A N SER 155.A O no hydrogen 3.387 N/A HIS 178.A ND1 HIS 154.A NE2 no hydrogen 2.823 N/A GLN 179.A N ILE 214.A O no hydrogen 3.267 N/A GLN 182.A N ASP 180.A OD1 no hydrogen 3.087 N/A GLN 182.A NE2 ASP 180.A OD1 no hydrogen 3.178 N/A GLN 182.A NE2 ASP 180.A OD2 no hydrogen 3.475 N/A GLN 182.A NE2 GLN 237.A O no hydrogen 2.910 N/A TYR 183.A N ASP 180.A O no hydrogen 2.658 N/A ASN 184.A N PRO 181.A O no hydrogen 3.062 N/A VAL 185.A N PRO 181.A O no hydrogen 3.314 N/A LEU 186.A N GLN 182.A O no hydrogen 2.949 N/A TYR 187.A N TYR 183.A O no hydrogen 3.241 N/A ILE 190.A N ASN 184.A O no hydrogen 2.913 N/A ASN 191.A N ILE 425.A O no hydrogen 2.846 N/A ASN 191.A ND2 ILE 421.A O no hydrogen 2.558 N/A ASN 191.A ND2 GLY 423.A O no hydrogen 2.698 N/A ARG 194.A N ASN 191.A OD1 no hydrogen 3.156 N/A ARG 194.A NE ASP 198.A OD2 no hydrogen 2.793 N/A ARG 194.A NH1 THR 429.A OG1 no hydrogen 3.067 N/A ARG 194.A NH2 VAL 160.A O no hydrogen 2.428 N/A ARG 194.A NH2 ASP 198.A OD2 no hydrogen 3.547 N/A SER 195.A N ASN 191.A O no hydrogen 2.931 N/A SER 195.A OG PRO 181.A O no hydrogen 2.953 N/A PHE 196.A N MET 192.A O no hydrogen 3.354 N/A ILE 197.A N ILE 193.A O no hydrogen 3.083 N/A ASP 198.A N ARG 194.A O no hydrogen 3.097 N/A ALA 199.A N SER 195.A O no hydrogen 3.095 N/A CYS 200.A SG PHE 196.A O no hydrogen 3.365 N/A SER 202.A N ASP 198.A O no hydrogen 2.972 N/A SER 202.A OG ASP 198.A O no hydrogen 3.263 N/A LYS 203.A N ALA 199.A O no hydrogen 2.779 N/A LYS 203.A NZ GLN 179.A OE1 no hydrogen 2.754 N/A LYS 203.A NZ GLN 213.A OE1 no hydrogen 2.827 N/A LYS 203.A NZ ASN 241.A OD1 no hydrogen 3.082 N/A THR 204.A N CYS 200.A O no hydrogen 3.110 N/A THR 204.A OG1 CYS 200.A O no hydrogen 2.727 N/A ILE 205.A N GLU 201.A O no hydrogen 2.909 N/A MET 206.A N SER 202.A O no hydrogen 3.003 N/A ALA 207.A N LYS 203.A O no hydrogen 2.943 N/A ALA 207.A N THR 204.A O no hydrogen 3.182 N/A TRP 208.A N THR 204.A O no hydrogen 3.095 N/A ALA 209.A N ILE 205.A O no hydrogen 3.149 N/A ASP 210.A N ALA 207.A O no hydrogen 3.292 N/A MET 211.A N MET 206.A O no hydrogen 3.192 N/A ALA 212.A N ASN 175.A O no hydrogen 2.955 N/A GLN 213.A N ASN 254.A O no hydrogen 2.829 N/A GLN 213.A NE2 SER 245.A OG no hydrogen 3.333 N/A ILE 214.A N ALA 177.A O no hydrogen 3.076 N/A ASP 215.A N CYS 256.A O no hydrogen 3.178 N/A GLY 216.A N ASP 180.A OD2 no hydrogen 3.085 N/A HIS 218.A ND1 SER 258.A OG no hydrogen 2.938 N/A ASN 219.A N GLY 216.A O no hydrogen 2.737 N/A ASN 219.A ND2 GLY 216.A O no hydrogen 3.147 N/A ALA 220.A N ALA 217.A O no hydrogen 2.751 N/A ASN 221.A ND2 VAL 260.A O no hydrogen 3.464 N/A THR 223.A N ASN 219.A O no hydrogen 3.171 N/A THR 223.A OG1 ASN 219.A O no hydrogen 3.212 N/A ALA 224.A N ASN 221.A O no hydrogen 3.297 N/A ALA 227.A N TYR 297.A OH no hydrogen 3.208 N/A LYS 229.A N GLU 226.A O no hydrogen 3.375 N/A LYS 229.A NZ GLU 226.A OE1 no hydrogen 2.599 N/A VAL 230.A N ALA 227.A O no hydrogen 3.360 N/A LEU 234.A N VAL 230.A O no hydrogen 3.038 N/A MET 235.A N MET 231.A O no hydrogen 3.049 N/A VAL 236.A N PRO 232.A O no hydrogen 3.300 N/A GLN 237.A N GLU 233.A O no hydrogen 2.888 N/A GLN 237.A NE2 TYR 187.A OH no hydrogen 3.461 N/A GLN 237.A NE2 GLU 233.A OE2 no hydrogen 3.093 N/A HIS 238.A N LEU 234.A O no hydrogen 2.765 N/A HIS 238.A NE2 SER 258.A O no hydrogen 2.941 N/A ALA 239.A N MET 235.A O no hydrogen 2.897 N/A LEU 240.A N VAL 236.A O no hydrogen 2.780 N/A ASN 241.A N GLN 237.A O no hydrogen 3.164 N/A SER 242.A N HIS 238.A O no hydrogen 3.179 N/A SER 242.A OG HIS 238.A O no hydrogen 2.510 N/A ILE 243.A N ALA 239.A O no hydrogen 3.028 N/A PHE 244.A N LEU 240.A O no hydrogen 3.200 N/A SER 245.A N ASN 241.A O no hydrogen 2.855 N/A SER 245.A OG GLN 213.A OE1 no hydrogen 3.519 N/A SER 245.A OG ASN 241.A O no hydrogen 2.685 N/A LEU 246.A N SER 242.A O no hydrogen 2.783 N/A LYS 247.A N ILE 243.A O no hydrogen 3.428 N/A VAL 248.A N SER 245.A O no hydrogen 3.245 N/A GLY 249.A N LEU 246.A O no hydrogen 2.878 N/A MET 250.A N SER 245.A O no hydrogen 3.072 N/A LYS 251.A NZ ASP 210.A OD1 no hydrogen 3.259 N/A ASN 254.A N LYS 251.A O no hydrogen 2.802 N/A ASN 254.A ND2 ASP 210.A OD1 no hydrogen 3.244 N/A CYS 256.A N GLN 213.A O no hydrogen 2.693 N/A CYS 256.A SG ASN 254.A O no hydrogen 3.848 N/A LEU 257.A N ARG 288.A O no hydrogen 2.963 N/A SER 258.A N ASP 215.A OD1 no hydrogen 2.945 N/A SER 258.A OG ASP 215.A O no hydrogen 3.542 N/A SER 258.A OG HIS 218.A ND1 no hydrogen 2.938 N/A THR 259.A N ARG 290.A O no hydrogen 3.011 N/A THR 263.A N ASP 273.A OD2 no hydrogen 2.898 N/A THR 263.A OG1 ASP 273.A OD1 no hydrogen 2.853 N/A THR 263.A OG1 ASP 273.A OD2 no hydrogen 3.322 N/A ALA 267.A N ALA 264.A O no hydrogen 2.874 N/A LEU 272.A N PRO 268.A O no hydrogen 3.076 N/A ASP 273.A N SER 269.A O no hydrogen 2.719 N/A LEU 274.A N MET 270.A O no hydrogen 2.753 N/A ALA 277.A N ASP 273.A O no hydrogen 3.146 N/A VAL 278.A N LEU 274.A O no hydrogen 3.036 N/A ALA 279.A N PRO 275.A O no hydrogen 2.734 N/A LEU 280.A N TYR 276.A O no hydrogen 2.755 N/A ARG 281.A N ALA 277.A O no hydrogen 3.069 N/A ARG 281.A NE ARG 320.A O no hydrogen 2.767 N/A ARG 281.A NH1 ALA 277.A O no hydrogen 3.005 N/A ARG 281.A NH2 ARG 320.A O no hydrogen 3.435 N/A GLU 282.A N VAL 278.A O no hydrogen 2.985 N/A MET 283.A N ALA 279.A O no hydrogen 2.857 N/A TYR 287.A N PHE 284.A O no hydrogen 3.063 N/A ARG 288.A N ILE 255.A O no hydrogen 3.083 N/A ARG 288.A NE SER 253.A O no hydrogen 2.836 N/A ARG 288.A NH1 ASP 322.A OD1 no hydrogen 3.362 N/A ARG 288.A NH2 SER 253.A OG no hydrogen 2.945 N/A MET 289.A N ASP 322.A OD2 no hydrogen 2.629 N/A ARG 290.A N LEU 257.A O no hydrogen 2.775 N/A ARG 290.A NE SER 325.A OG no hydrogen 2.819 N/A ARG 290.A NH1 SER 258.A OG no hydrogen 2.645 N/A ARG 290.A NH2 SER 325.A OG no hydrogen 2.790 N/A ALA 291.A N ILE 323.A O no hydrogen 2.855 N/A GLN 292.A N THR 259.A O no hydrogen 2.953 N/A GLN 292.A NE2 GLU 77.A OE2 no hydrogen 3.165 N/A MET 293.A N GLN 292.A OE1 no hydrogen 2.906 N/A ASN 294.A N ASN 312.A OD1 no hydrogen 2.856 N/A ASN 294.A ND2 TYR 297.A O no hydrogen 2.853 N/A LYS 296.A NZ ASN 221.A O no hydrogen 3.214 N/A LYS 296.A NZ ALA 222.A O no hydrogen 2.829 N/A LYS 296.A NZ ALA 224.A O no hydrogen 3.107 N/A TYR 297.A N ASN 294.A OD1 no hydrogen 2.876 N/A SER 301.A OG GLU 549.A OE2 no hydrogen 3.437 N/A GLU 304.A N SER 301.A OG no hydrogen 3.184 N/A ALA 305.A N SER 301.A O no hydrogen 3.286 N/A THR 306.A N THR 302.A O no hydrogen 3.144 N/A THR 306.A N ARG 303.A O no hydrogen 3.279 N/A THR 306.A OG1 THR 302.A O no hydrogen 3.012 N/A VAL 307.A N ARG 303.A O no hydrogen 3.063 N/A THR 308.A N GLU 304.A O no hydrogen 3.069 N/A THR 308.A OG1 GLU 304.A O no hydrogen 3.499 N/A HIS 309.A N ALA 305.A O no hydrogen 3.012 N/A VAL 310.A N THR 306.A O no hydrogen 3.056 N/A LEU 311.A N VAL 307.A O no hydrogen 3.458 N/A ASN 312.A N THR 308.A O no hydrogen 2.939 N/A LEU 313.A N HIS 309.A O no hydrogen 2.807 N/A LEU 314.A N VAL 310.A O no hydrogen 2.760 N/A ILE 315.A N LEU 311.A O no hydrogen 3.016 N/A SER 316.A N ASN 312.A O no hydrogen 3.213 N/A SER 316.A OG ASN 312.A O no hydrogen 3.538 N/A SER 316.A OG GLN 324.A OE1 no hydrogen 2.843 N/A LYS 317.A N LEU 313.A O no hydrogen 2.778 N/A LYS 317.A NZ ASP 46.A OD2 no hydrogen 3.126 N/A LEU 318.A N LEU 314.A O no hydrogen 2.743 N/A THR 319.A N ILE 315.A O no hydrogen 3.063 N/A THR 319.A N SER 316.A O no hydrogen 3.215 N/A THR 319.A OG1 ILE 315.A O no hydrogen 2.813 N/A ARG 320.A NH2 ARG 281.A O no hydrogen 3.390 N/A ILE 323.A N MET 289.A O no hydrogen 3.051 N/A GLN 324.A N VAL 73.A O no hydrogen 2.856 N/A GLN 324.A NE2 SER 325.A O no hydrogen 2.740 N/A SER 325.A N ALA 291.A O no hydrogen 2.897 N/A SER 325.A OG THR 75.A OG1 no hydrogen 2.823 N/A THR 326.A OG1 THR 75.A O no hydrogen 2.454 N/A THR 328.A OG1 ASP 330.A OD1 no hydrogen 2.516 N/A GLU 331.A N THR 328.A O no hydrogen 2.939 N/A ARG 333.A N ASP 330.A O no hydrogen 3.017 N/A ARG 333.A NH2 TYR 340.A OH no hydrogen 3.382 N/A ASN 334.A N ASP 330.A O no hydrogen 3.246 N/A TRP 337.A N ASP 330.A OD2 no hydrogen 3.408 N/A HIS 338.A N VAL 506.A O no hydrogen 2.886 N/A TYR 340.A N TRP 337.A O no hydrogen 3.107 N/A ASN 341.A N TRP 337.A O no hydrogen 3.315 N/A ASN 341.A ND2 THR 76.A OG1 no hydrogen 3.050 N/A ASN 341.A ND2 GLU 77.A O no hydrogen 2.994 N/A ILE 342.A N HIS 338.A O no hydrogen 3.439 N/A GLU 343.A N ILE 339.A O no hydrogen 2.935 N/A ALA 344.A N TYR 340.A O no hydrogen 2.958 N/A CYS 345.A N ASN 341.A O no hydrogen 2.985 N/A CYS 345.A SG ASN 341.A O no hydrogen 3.079 N/A ASP 346.A N ILE 342.A O no hydrogen 3.063 N/A THR 347.A N GLU 343.A O no hydrogen 2.795 N/A THR 347.A OG1 GLU 343.A O no hydrogen 3.130 N/A ALA 348.A N ALA 344.A O no hydrogen 3.074 N/A LYS 349.A N CYS 345.A O no hydrogen 2.975 N/A LYS 349.A NZ VAL 55.A O no hydrogen 3.091 N/A LYS 349.A NZ ASP 67.A OD1 no hydrogen 3.049 N/A LYS 349.A NZ ASP 67.A OD2 no hydrogen 3.569 N/A LYS 349.A NZ HIS 96.A O no hydrogen 3.262 N/A GLN 350.A N ASP 346.A O no hydrogen 2.854 N/A ALA 351.A N THR 347.A O no hydrogen 3.056 N/A LEU 352.A N ALA 348.A O no hydrogen 3.088 N/A ILE 353.A N LYS 349.A O no hydrogen 3.097 N/A GLY 354.A N GLN 350.A O no hydrogen 2.859 N/A MET 355.A N LEU 352.A O no hydrogen 3.054 N/A ASP 356.A N ILE 353.A O no hydrogen 3.139 N/A GLY 357.A N ASP 46.A OD2 no hydrogen 2.778 N/A LEU 358.A N MET 355.A O no hydrogen 2.895 N/A ASP 360.A N GLY 357.A O no hydrogen 3.067 N/A MET 361.A N LEU 358.A O no hydrogen 2.864 N/A VAL 362.A N LEU 358.A O no hydrogen 2.794 N/A ARG 366.A NE GLU 282.A OE1 no hydrogen 2.779 N/A ARG 366.A NH1 ARG 366.A O no hydrogen 3.396 N/A ARG 366.A NH2 GLU 282.A OE1 no hydrogen 3.117 N/A ARG 366.A NH2 GLU 282.A OE2 no hydrogen 2.539 N/A ASP 372.A N GLY 368.A O no hydrogen 3.237 N/A THR 373.A N VAL 369.A O no hydrogen 3.029 N/A THR 373.A OG1 VAL 369.A O no hydrogen 3.131 N/A VAL 374.A N LEU 370.A O no hydrogen 3.025 N/A ARG 375.A N GLY 371.A O no hydrogen 3.088 N/A ARG 375.A NE GLU 379.A OE2 no hydrogen 2.839 N/A ARG 375.A NH2 GLU 379.A OE2 no hydrogen 3.239 N/A GLU 376.A N ASP 372.A O no hydrogen 2.933 N/A LEU 377.A N THR 373.A O no hydrogen 2.870 N/A LYS 378.A N VAL 374.A O no hydrogen 3.240 N/A LYS 378.A NZ GLU 282.A OE2 no hydrogen 3.027 N/A GLU 379.A N ARG 375.A O no hydrogen 2.964 N/A ARG 380.A N GLU 376.A O no hydrogen 2.875 N/A ARG 380.A NE GLU 376.A OE2 no hydrogen 2.564 N/A ARG 380.A NH1 TYR 409.A O no hydrogen 2.735 N/A ARG 380.A NH2 GLU 376.A OE2 no hydrogen 2.729 N/A ALA 381.A N LEU 377.A O no hydrogen 3.111 N/A VAL 382.A N LYS 378.A O no hydrogen 2.893 N/A LEU 383.A N GLU 379.A O no hydrogen 2.771 N/A PHE 384.A N ARG 380.A O no hydrogen 2.960 N/A MET 385.A N ALA 381.A O no hydrogen 2.978 N/A GLU 386.A N VAL 382.A O no hydrogen 3.111 N/A GLU 387.A N LEU 383.A O no hydrogen 2.925 N/A ILE 388.A N PHE 384.A O no hydrogen 3.095 N/A ILE 389.A N MET 385.A O no hydrogen 3.106 N/A GLU 390.A N GLU 386.A O no hydrogen 2.860 N/A GLY 392.A N ILE 389.A O no hydrogen 3.013 N/A GLY 393.A N ILE 388.A O no hydrogen 3.034 N/A ASN 396.A ND2 ALA 391.A O no hydrogen 2.808 N/A ALA 397.A N GLY 393.A O no hydrogen 3.259 N/A VAL 398.A N TYR 394.A O no hydrogen 2.941 N/A GLU 399.A N PHE 395.A O no hydrogen 2.836 N/A GLN 400.A N ALA 397.A O no hydrogen 3.147 N/A GLY 401.A N VAL 398.A O no hydrogen 3.165 N/A PHE 402.A N ALA 397.A O no hydrogen 3.130 N/A VAL 404.A N GLU 233.A OE1 no hydrogen 3.136 N/A VAL 404.A N GLU 233.A OE2 no hydrogen 3.251 N/A SER 406.A N ASP 415.A OD1 no hydrogen 3.158 N/A SER 406.A OG ASP 415.A OD1 no hydrogen 3.522 N/A SER 406.A OG ASP 415.A OD2 no hydrogen 2.471 N/A GLY 407.A N ASP 405.A OD2 no hydrogen 2.759 N/A TYR 408.A N GLU 411.A OE1 no hydrogen 2.874 N/A TYR 409.A OH GLU 387.A OE2 no hydrogen 2.765 N/A GLU 411.A N TYR 408.A O no hydrogen 2.930 N/A ARG 412.A NH1 GLU 387.A OE1 no hydrogen 2.803 N/A ASN 413.A N ASP 405.A OD2 no hydrogen 2.892 N/A ASN 413.A ND2 SER 406.A OG no hydrogen 2.683 N/A GLY 414.A N ASP 405.A OD1 no hydrogen 2.812 N/A ILE 417.A N PHE 403.A O no hydrogen 3.024 N/A ARG 419.A NE VAL 185.A O no hydrogen 2.975 N/A ARG 419.A NH2 LEU 186.A O no hydrogen 2.779 N/A ILE 421.A N GLU 399.A OE2 no hydrogen 2.984 N/A GLY 423.A N GLN 420.A O no hydrogen 2.889 N/A ILE 425.A N ASN 189.A O no hydrogen 2.967 N/A ALA 427.A N GLY 424.A O no hydrogen 2.896 N/A THR 429.A OG1 GLY 426.A O no hydrogen 2.763 N/A ARG 433.A NH1 HIS 444.A NE2 no hydrogen 2.812 N/A ARG 433.A NH2 HIS 444.A NE2 no hydrogen 2.719 N/A ASP 436.A N ASP 436.A OD1 no hydrogen 2.593 N/A TYR 437.A N ASP 434.A O no hydrogen 2.784 N/A ALA 439.A N ASN 448.A OD1 no hydrogen 2.684 N/A VAL 441.A N ALA 439.A O no hydrogen 2.971 N/A THR 442.A OG1 GLU 471.A OE1 no hydrogen 2.585 N/A THR 442.A OG1 GLU 471.A OE2 no hydrogen 2.509 N/A HIS 444.A ND1 GLU 201.A OE2 no hydrogen 2.991 N/A PHE 445.A N GLU 201.A OE1 no hydrogen 2.915 N/A TYR 447.A OH GLU 435.A O no hydrogen 2.714 N/A ASN 448.A ND2 ALA 439.A O no hydrogen 2.838 N/A ASN 449.A N TYR 437.A O no hydrogen 3.027 N/A ASN 449.A ND2 GLU 435.A O no hydrogen 3.051 N/A VAL 450.A N ASN 448.A O no hydrogen 3.049 N/A GLN 452.A NE2 ASP 436.A O no hydrogen 3.012 N/A GLN 452.A NE2 ASN 449.A O no hydrogen 2.930 N/A TYR 453.A N VAL 450.A O no hydrogen 2.707 N/A ASP 454.A N VAL 450.A O no hydrogen 2.998 N/A LEU 457.A N ASP 454.A O no hydrogen 3.159 N/A VAL 458.A N GLU 455.A O no hydrogen 3.356 N/A GLU 460.A N LEU 457.A O no hydrogen 2.923 N/A SER 462.A OG GLU 471.A OE1 no hydrogen 2.999 N/A LYS 463.A N GLU 460.A O no hydrogen 2.745 N/A ILE 465.A N SER 462.A O no hydrogen 3.067 N/A ASP 466.A N LYS 463.A O no hydrogen 2.529 N/A GLY 467.A N SER 462.A O no hydrogen 3.115 N/A CYS 468.A N GLU 471.A OE1 no hydrogen 3.394 N/A CYS 468.A SG THR 442.A OG1 no hydrogen 3.387 N/A CYS 468.A SG GLU 471.A OE1 no hydrogen 3.228 N/A THR 469.A OG1 GLU 171.A OE1 no hydrogen 2.797 N/A GLU 471.A N CYS 468.A O no hydrogen 2.667 N/A VAL 472.A N CYS 468.A O no hydrogen 2.506 N/A LYS 475.A N VAL 472.A O no hydrogen 3.263 N/A ILE 476.A N PRO 473.A O no hydrogen 3.426 N/A ASN 485.A N ASP 483.A OD1 no hydrogen 3.490 N/A ASP 486.A N ASP 483.A OD1 no hydrogen 3.260 N/A ASN 487.A ND2 ASP 483.A O no hydrogen 3.472 N/A VAL 488.A N THR 119.A OG1 no hydrogen 2.579 N/A VAL 490.A N ASN 487.A OD1 no hydrogen 2.988 N/A ARG 491.A N ASN 487.A O no hydrogen 3.173 N/A ARG 491.A NH1 GLU 84.A OE2 no hydrogen 2.629 N/A MET 492.A N VAL 488.A O no hydrogen 3.003 N/A MET 492.A N ASN 489.A O no hydrogen 3.250 N/A GLU 493.A N ASN 489.A O no hydrogen 3.266 N/A GLU 493.A N VAL 490.A O no hydrogen 2.890 N/A GLU 494.A N VAL 490.A O no hydrogen 3.084 N/A THR 495.A N MET 492.A O no hydrogen 3.507 N/A LYS 496.A N GLU 493.A O no hydrogen 3.475 N/A PHE 498.A N THR 495.A O no hydrogen 3.126 N/A ARG 499.A N LYS 496.A O no hydrogen 3.048 N/A ARG 499.A NE GLU 12.A OE1 no hydrogen 3.439 N/A ARG 499.A NH2 GLU 12.A OE1 no hydrogen 3.089 N/A ARG 499.A NH2 MET 492.A O no hydrogen 2.822 N/A SER 500.A OG SER 500.A O no hydrogen 2.384 N/A ILE 502.A N ILE 569.A O no hydrogen 3.230 N/A LYS 503.A NZ VAL 565.A O no hydrogen 3.176 N/A VAL 506.A N ASP 511.A OD1 no hydrogen 2.784 N/A VAL 506.A N ASP 511.A OD2 no hydrogen 3.074 N/A GLU 507.A N ASP 511.A OD2 no hydrogen 2.746 N/A TRP 508.A N ASP 511.A OD2 no hydrogen 2.775 N/A TRP 508.A NE1 SER 80.A OG no hydrogen 3.139 N/A GLN 509.A N ASP 85.A OD1 no hydrogen 2.957 N/A ASP 511.A N TRP 508.A O no hydrogen 2.801 N/A THR 513.A N ASP 511.A OD1 no hydrogen 3.218 N/A THR 513.A OG1 ASP 511.A O no hydrogen 3.404 N/A THR 513.A OG1 ASP 511.A OD1 no hydrogen 3.517 N/A VAL 514.A N GLY 563.A O no hydrogen 3.052 N/A LEU 516.A N LEU 561.A O no hydrogen 2.770 N/A MET 518.A N ILE 559.A O no hydrogen 2.890 N/A LEU 520.A N THR 557.A O no hydrogen 3.138 N/A THR 522.A N LEU 520.A O no hydrogen 2.697 N/A ALA 527.A N SER 523.A O no hydrogen 3.093 N/A GLU 528.A N LYS 524.A O no hydrogen 2.997 N/A GLU 528.A N ARG 525.A O no hydrogen 2.834 N/A PHE 529.A N ARG 525.A O no hydrogen 3.293 N/A ALA 530.A N VAL 526.A O no hydrogen 2.843 N/A ALA 531.A N ALA 527.A O no hydrogen 2.818 N/A ILE 532.A N GLU 528.A O no hydrogen 3.501 N/A GLU 533.A N PHE 529.A O no hydrogen 3.325 N/A PHE 534.A N ALA 530.A O no hydrogen 3.197 N/A ALA 535.A N ALA 531.A O no hydrogen 2.901 N/A LYS 536.A N ILE 532.A O no hydrogen 3.096 N/A LYS 537.A N GLU 533.A O no hydrogen 2.849 N/A MET 538.A N ALA 535.A O no hydrogen 2.991 N/A ASN 539.A N LYS 536.A O no hydrogen 2.652 N/A LEU 540.A N ALA 535.A O no hydrogen 3.211 N/A GLU 541.A N ARG 564.A O no hydrogen 2.736 N/A GLU 544.A N LYS 562.A O no hydrogen 3.015 N/A ILE 546.A N GLU 560.A O no hydrogen 2.892 N/A ASN 547.A ND2 GLU 549.A OE2 no hydrogen 3.562 N/A ASN 547.A ND2 GLU 560.A OE1 no hydrogen 3.080 N/A GLU 549.A N ARG 558.A O no hydrogen 3.074 N/A MET 551.A N GLY 556.A O no hydrogen 3.323 N/A GLN 552.A N GLY 556.A O no hydrogen 3.497 N/A ALA 554.A N GLN 552.A OE1 no hydrogen 2.717 N/A GLU 555.A N GLN 552.A OE1 no hydrogen 3.363 N/A GLY 556.A N GLN 552.A O no hydrogen 3.400 N/A THR 557.A N LEU 520.A O no hydrogen 2.818 N/A THR 557.A OG1 THR 522.A O no hydrogen 2.870 N/A ARG 558.A N GLU 549.A O no hydrogen 2.691 N/A ARG 558.A NE GLU 560.A OE2 no hydrogen 2.805 N/A ILE 559.A N MET 518.A O no hydrogen 2.843 N/A GLU 560.A N ASN 547.A O no hydrogen 2.949 N/A LEU 561.A N LEU 516.A O no hydrogen 2.688 N/A LYS 562.A N GLU 544.A O no hydrogen 2.945 N/A GLY 563.A N VAL 514.A O no hydrogen 3.317 N/A ARG 564.A N GLU 541.A O no hydrogen 2.586 N/A ARG 564.A NE GLU 542.A OE2 no hydrogen 2.849 N/A ARG 564.A NH2 GLU 542.A OE2 no hydrogen 3.438 N/A VAL 565.A N GLY 512.A O no hydrogen 2.772 N/A ASN 572.A N ASP 570.A OD1 no hydrogen 3.215 N/A SER 573.A OG ASP 570.A O no hydrogen 3.416 N/A LEU 574.A N ILE 571.A O no hydrogen 3.241 N/A GLU 584.A N SER 581.A OG no hydrogen 3.209 N/A ILE 585.A N SER 581.A O no hydrogen 3.320 N/A ARG 586.A N GLU 582.A O no hydrogen 3.298 N/A GLU 587.A N ASP 583.A O no hydrogen 3.343 N/A ILE 589.A N ILE 585.A O no hydrogen 3.507 N/A LYS 591.A N GLU 587.A O no hydrogen 3.411 N/A THR 592.A N ASP 588.A O no hydrogen 3.071 N/A LYS 595.A N ASP 650.A OD2 no hydrogen 3.451 N/A LYS 595.A NZ LEU 647.A O no hydrogen 2.571 N/A ILE 596.A N GLU 627.A O no hydrogen 2.617 N/A VAL 597.A N ALA 651.A O no hydrogen 3.083 N/A ALA 599.A N LEU 653.A O no hydrogen 3.044 N/A THR 600.A N GLY 632.A O no hydrogen 3.290 N/A THR 600.A OG1 HIS 606.A O no hydrogen 3.350 N/A GLY 602.A N VAL 635.A O no hydrogen 3.154 N/A ARG 611.A N SER 607.A O no hydrogen 3.129 N/A ARG 611.A NE TYR 630.A OH no hydrogen 3.124 N/A ARG 611.A NH2 TYR 630.A OH no hydrogen 3.336 N/A GLU 612.A N VAL 608.A O no hydrogen 2.762 N/A VAL 613.A N GLY 609.A O no hydrogen 3.260 N/A VAL 613.A N LEU 610.A O no hydrogen 3.090 N/A ILE 614.A N ARG 611.A O no hydrogen 3.043 N/A ASP 615.A N ARG 611.A O no hydrogen 2.891 N/A ILE 616.A N GLU 622.A OE1 no hydrogen 3.121 N/A HIS 618.A ND1 GLU 612.A OE1 no hydrogen 2.938 N/A HIS 618.A ND1 GLU 612.A OE2 no hydrogen 3.050 N/A GLY 619.A N ILE 616.A O no hydrogen 2.726 N/A GLY 620.A N ASP 615.A O no hydrogen 3.273 N/A ILE 621.A N VAL 613.A O no hydrogen 2.927 N/A GLU 622.A N ILE 614.A O no hydrogen 3.215 N/A LYS 623.A N GLY 620.A O no hydrogen 2.624 N/A TYR 624.A N ILE 621.A O no hydrogen 2.962 N/A GLY 625.A N GLU 622.A O no hydrogen 2.901 N/A VAL 626.A N ILE 621.A O no hydrogen 3.499 N/A GLU 627.A N LEU 594.A O no hydrogen 3.215 N/A HIS 629.A N ILE 596.A O no hydrogen 3.066 N/A HIS 629.A NE2 GLU 627.A OE2 no hydrogen 3.012 N/A LEU 631.A N ALA 598.A O no hydrogen 3.032 N/A THR 633.A OG1 GLU 605.A OE2 no hydrogen 2.562 N/A SER 634.A N ASP 604.A O no hydrogen 2.962 N/A LEU 640.A N PRO 636.A O no hydrogen 3.489 N/A ASP 642.A N GLU 638.A O no hydrogen 2.443 N/A ALA 643.A N LYS 639.A O no hydrogen 3.177 N/A ALA 644.A N LEU 640.A O no hydrogen 3.321 N/A GLU 646.A N ASP 642.A O no hydrogen 2.717 N/A LEU 647.A N ALA 643.A O no hydrogen 2.676 N/A LYS 648.A N ILE 645.A O no hydrogen 2.783 N/A ALA 649.A N ALA 644.A O no hydrogen 2.696 N/A ASP 650.A N LYS 595.A O no hydrogen 3.364 N/A ILE 652.A N MET 685.A O no hydrogen 3.083 N/A LEU 653.A N VAL 597.A O no hydrogen 2.938 N/A ALA 654.A N GLY 687.A O no hydrogen 2.954 N/A SER 655.A N ALA 599.A O no hydrogen 3.223 N/A SER 655.A OG GLY 689.A O no hydrogen 2.903 N/A THR 656.A N GLY 689.A O no hydrogen 2.888 N/A ILE 657.A N ASP 604.A OD1 no hydrogen 2.998 N/A ILE 658.A N ASP 604.A OD1 no hydrogen 3.280 N/A ILE 658.A N ASP 604.A OD2 no hydrogen 3.471 N/A ILE 663.A N SER 659.A O no hydrogen 3.144 N/A ILE 663.A N HIS 660.A O no hydrogen 3.194 N/A TYR 665.A OH THR 694.A OG1 no hydrogen 2.692 N/A LYS 666.A N ASP 662.A O no hydrogen 3.164 N/A ASN 667.A N ILE 663.A O no hydrogen 3.242 N/A LYS 669.A N LYS 666.A O no hydrogen 2.700 N/A ILE 671.A N ASN 667.A O no hydrogen 3.177 N/A HIS 672.A N MET 668.A O no hydrogen 3.077 N/A GLU 673.A N LYS 669.A O no hydrogen 2.640 N/A LEU 674.A N ARG 670.A O no hydrogen 2.863 N/A ALA 675.A N HIS 672.A O no hydrogen 3.102 N/A VAL 676.A N HIS 672.A O no hydrogen 3.066 N/A GLU 677.A N GLU 673.A O no hydrogen 2.759 N/A LYS 678.A NZ GLU 638.A OE1 no hydrogen 2.716 N/A GLY 679.A N ALA 675.A O no hydrogen 3.396 N/A ILE 680.A N ALA 675.A O no hydrogen 2.798 N/A ARG 681.A NE HIS 672.A ND1 no hydrogen 3.037 N/A ARG 681.A NH1 ASP 704.A OD2 no hydrogen 3.479 N/A ARG 681.A NH2 GLY 702.A O no hydrogen 3.365 N/A ASP 682.A N ILE 680.A O no hydrogen 2.848 N/A GLY 687.A N ILE 652.A O no hydrogen 2.952 N/A GLY 689.A N ALA 654.A O no hydrogen 3.099 N/A THR 694.A N TYR 665.A OH no hydrogen 2.906 N/A THR 694.A OG1 TYR 665.A OH no hydrogen 2.692 N/A VAL 699.A N GLU 696.A O no hydrogen 3.134 N/A LYS 700.A N GLU 696.A O no hydrogen 3.393 N/A GLN 701.A NE2 VAL 697.A O no hydrogen 3.496 N/A GLY 702.A N VAL 699.A O no hydrogen 3.309 N/A PHE 707.A N CYS 688.A O no hydrogen 3.162 N/A SER 711.A OG GLY 708.A O no hydrogen 2.732 N/A LYS 712.A N HIS 715.A ND1 no hydrogen 2.843 N/A HIS 715.A N LYS 712.A O no hydrogen 3.039 N/A ALA 717.A N GLY 713.A O no hydrogen 3.070 N/A THR 718.A N ILE 714.A O no hydrogen 3.107 N/A PHE 719.A N HIS 715.A O no hydrogen 3.392 N/A LEU 720.A N VAL 716.A O no hydrogen 2.834 N/A VAL 721.A N ALA 717.A O no hydrogen 3.277 N/A LYS 722.A N PHE 719.A O no hydrogen 3.159 N/A LYS 723.A N PHE 719.A O no hydrogen 3.128 N/A LYS 723.A NZ GLU 726.A OE2 no hydrogen 2.982 N/A ARG 724.A NH1 THR 592.A O no hydrogen 3.409 N/A ARG 724.A NH2 THR 592.A O no hydrogen 2.758 N/A ARG 725.A N LYS 722.A O no hydrogen 3.147 N/A