Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3qdk_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LYS 1.A NZ ASP 79.A OD1 no hydrogen 2.974 N/A TYR 2.A N ASP 79.A O no hydrogen 2.602 N/A THR 3.A N ILE 18.A O no hydrogen 3.154 N/A THR 3.A OG1 ALA 475.A O no hydrogen 2.957 N/A ILE 4.A N GLY 82.A O no hydrogen 2.908 N/A GLY 5.A N VAL 16.A O no hydrogen 2.960 N/A VAL 6.A N GLY 84.A O no hydrogen 2.840 N/A ASP 7.A N ARG 14.A O no hydrogen 2.792 N/A TYR 8.A N ASP 86.A O no hydrogen 2.958 N/A TYR 8.A OH TYR 61.A O no hydrogen 2.581 N/A GLY 9.A N SER 12.A O no hydrogen 2.662 N/A GLY 13.A N THR 31.A O no hydrogen 3.091 N/A ARG 14.A N ASP 7.A O no hydrogen 2.959 N/A ARG 14.A NH1 ASP 28.A OD2 no hydrogen 2.797 N/A ALA 15.A N HIS 29.A O no hydrogen 3.007 N/A VAL 16.A N GLY 5.A O no hydrogen 3.069 N/A LEU 17.A N ALA 27.A O no hydrogen 2.934 N/A ILE 18.A N THR 3.A O no hydrogen 2.910 N/A ASP 19.A N GLN 24.A O no hydrogen 2.711 N/A LEU 20.A N LYS 1.A O no hydrogen 2.935 N/A SER 21.A N ASP 19.A OD1 no hydrogen 2.959 N/A SER 21.A OG ASP 19.A OD1 no hydrogen 2.603 N/A GLY 23.A N ASP 19.A O no hydrogen 2.950 N/A GLN 24.A NE2 GLU 25.A O no hydrogen 3.365 N/A LEU 26.A N LEU 17.A O no hydrogen 3.256 N/A HIS 29.A N ALA 15.A O no hydrogen 3.037 N/A HIS 29.A ND1 SER 68.A OG no hydrogen 2.678 N/A THR 31.A N GLY 13.A O no hydrogen 2.730 N/A THR 31.A OG1 GLY 13.A O no hydrogen 3.552 N/A THR 31.A OG1 SER 68.A OG no hydrogen 2.702 N/A TYR 33.A N GLU 11.A O no hydrogen 3.171 N/A TYR 33.A OH GLY 9.A O no hydrogen 2.891 N/A GLY 36.A N TYR 33.A O no hydrogen 2.869 N/A ILE 38.A N LEU 55.A O no hydrogen 2.694 N/A ASN 46.A N THR 45.A OG1 no hydrogen 2.496 N/A ILE 47.A N THR 45.A OG1 no hydrogen 3.273 N/A LEU 49.A N GLN 40.A O no hydrogen 3.257 N/A ALA 54.A N HIS 121.A ND1 no hydrogen 3.117 N/A LEU 55.A N ILE 38.A O no hydrogen 2.992 N/A GLN 56.A N VAL 116.A O no hydrogen 2.981 N/A GLN 56.A NE2 THR 10.A O no hydrogen 2.844 N/A GLN 56.A NE2 GLY 36.A O no hydrogen 3.503 N/A ASP 60.A N HIS 57.A O no hydrogen 2.944 N/A TYR 61.A N PRO 58.A O no hydrogen 2.982 N/A TYR 61.A OH GLN 56.A OE1 no hydrogen 2.688 N/A GLU 63.A N LEU 59.A O no hydrogen 2.885 N/A VAL 64.A N TYR 61.A O no hydrogen 3.212 N/A THR 66.A N VAL 62.A O no hydrogen 3.018 N/A THR 66.A OG1 VAL 62.A O no hydrogen 3.433 N/A THR 66.A OG1 GLU 63.A O no hydrogen 3.461 N/A THR 67.A N VAL 64.A O no hydrogen 3.370 N/A THR 67.A OG1 GLU 63.A O no hydrogen 2.516 N/A SER 68.A N VAL 64.A O no hydrogen 2.667 N/A SER 68.A OG HIS 29.A ND1 no hydrogen 2.678 N/A SER 68.A OG HIS 29.A O no hydrogen 2.798 N/A SER 68.A OG THR 31.A OG1 no hydrogen 2.702 N/A ALA 71.A N THR 67.A O no hydrogen 3.163 N/A VAL 72.A N SER 68.A O no hydrogen 2.951 N/A MET 73.A N VAL 69.A O no hydrogen 3.226 N/A LYS 74.A N PRO 70.A O no hydrogen 3.133 N/A GLU 75.A N ALA 71.A O no hydrogen 3.469 N/A ILE 81.A N TYR 2.A O no hydrogen 3.036 N/A ILE 83.A N ALA 260.A O no hydrogen 3.019 N/A GLY 84.A N ILE 4.A O no hydrogen 2.776 N/A ASP 86.A N VAL 6.A O no hydrogen 3.120 N/A PHE 87.A N ASN 265.A O no hydrogen 2.885 N/A THR 88.A OG1 THR 91.A OG1 no hydrogen 2.739 N/A CYS 90.A SG GLU 153.A O no hydrogen 3.307 N/A THR 91.A N GLU 178.A OE2 no hydrogen 2.879 N/A THR 91.A OG1 THR 88.A O no hydrogen 3.137 N/A THR 91.A OG1 THR 88.A OG1 no hydrogen 2.739 N/A MET 92.A N LYS 117.A O no hydrogen 3.180 N/A LEU 93.A N LEU 177.A O no hydrogen 2.918 N/A VAL 95.A N GLN 175.A O no hydrogen 2.943 N/A ASP 96.A N GLN 100.A O no hydrogen 2.860 N/A GLU 98.A N ASP 96.A OD1 no hydrogen 2.948 N/A GLY 99.A N ASP 96.A O no hydrogen 2.988 N/A GLN 100.A N ASP 96.A OD1 no hydrogen 2.818 N/A GLN 100.A NE2 GLU 98.A O no hydrogen 3.601 N/A GLN 100.A NE2 GLN 186.A OE1 no hydrogen 3.587 N/A LEU 102.A N PRO 94.A O no hydrogen 3.021 N/A LEU 104.A N PRO 101.A O no hydrogen 3.071 N/A LEU 105.A N LEU 102.A O no hydrogen 2.762 N/A LYS 109.A N LEU 105.A O no hydrogen 2.940 N/A ASN 111.A N TYR 108.A O no hydrogen 2.968 N/A HIS 113.A N ASN 111.A OD1 no hydrogen 3.115 N/A SER 114.A N ASN 111.A O no hydrogen 2.992 N/A SER 114.A OG TYR 108.A O no hydrogen 3.172 N/A SER 114.A OG ASN 111.A O no hydrogen 3.223 N/A TRP 115.A N PRO 112.A O no hydrogen 3.275 N/A TRP 115.A NE1 LYS 109.A O no hydrogen 3.278 N/A LYS 117.A N MET 92.A O no hydrogen 2.712 N/A LEU 118.A N ALA 54.A O no hydrogen 3.175 N/A TRP 119.A NE1 THR 10.A OG1 no hydrogen 2.933 N/A HIS 121.A N LEU 118.A O no hydrogen 2.977 N/A GLN 125.A NE2 SER 152.A OG no hydrogen 3.136 N/A LYS 127.A NZ ASP 126.A OD2 no hydrogen 2.908 N/A ALA 128.A N ALA 124.A O no hydrogen 3.092 N/A ASN 129.A N GLN 125.A O no hydrogen 2.763 N/A ALA 130.A N ASP 126.A O no hydrogen 3.021 N/A ILE 131.A N LYS 127.A O no hydrogen 2.876 N/A ASN 132.A N ALA 128.A O no hydrogen 3.149 N/A ASN 132.A ND2 ILE 150.A O no hydrogen 3.310 N/A GLU 133.A N ASN 129.A O no hydrogen 2.833 N/A MET 134.A N ALA 130.A O no hydrogen 2.836 N/A ALA 135.A N ILE 131.A O no hydrogen 3.121 N/A GLU 136.A N ASN 132.A O no hydrogen 3.063 N/A LYS 137.A N GLU 133.A O no hydrogen 2.808 N/A ARG 138.A N MET 134.A O no hydrogen 2.705 N/A ARG 138.A NH1 GLU 140.A OE2 no hydrogen 2.750 N/A GLY 139.A N ALA 135.A O no hydrogen 2.676 N/A GLU 140.A N ALA 135.A O no hydrogen 2.911 N/A LEU 143.A N GLU 140.A O no hydrogen 3.252 N/A ARG 145.A N PHE 142.A O no hydrogen 2.850 N/A ARG 145.A NE GLU 300.A OE2 no hydrogen 3.141 N/A ARG 145.A NH2 GLU 208.A OE1 no hydrogen 2.890 N/A TYR 146.A N LEU 143.A O no hydrogen 3.162 N/A TYR 146.A OH GLY 199.A O no hydrogen 2.732 N/A GLY 147.A N PRO 144.A O no hydrogen 3.418 N/A GLY 148.A N LEU 143.A O no hydrogen 2.913 N/A LYS 149.A N TYR 146.A O no hydrogen 3.161 N/A ILE 150.A N ASN 132.A OD1 no hydrogen 2.859 N/A GLU 153.A N SER 151.A OG no hydrogen 2.962 N/A TRP 154.A N SER 151.A O no hydrogen 3.311 N/A MET 155.A N LYS 201.A O no hydrogen 3.152 N/A LYS 158.A N TRP 154.A O no hydrogen 3.265 N/A LYS 158.A NZ HIS 121.A O no hydrogen 2.896 N/A LYS 158.A NZ SER 152.A O no hydrogen 3.137 N/A LYS 158.A NZ GLU 153.A O no hydrogen 2.790 N/A VAL 159.A N MET 155.A O no hydrogen 2.926 N/A TRP 160.A N ILE 156.A O no hydrogen 3.021 N/A GLN 161.A N ALA 157.A O no hydrogen 2.982 N/A GLN 161.A NE2 HIS 121.A NE2 no hydrogen 3.139 N/A ILE 162.A N LYS 158.A O no hydrogen 3.343 N/A LEU 163.A N VAL 159.A O no hydrogen 2.812 N/A ASP 164.A N TRP 160.A O no hydrogen 3.130 N/A GLU 165.A N GLN 161.A O no hydrogen 2.858 N/A ALA 166.A N ILE 162.A O no hydrogen 2.693 N/A VAL 169.A N ALA 166.A O no hydrogen 2.758 N/A TYR 170.A N ALA 166.A O no hydrogen 3.268 N/A ASN 171.A N GLU 167.A O no hydrogen 3.074 N/A ARG 172.A N ASP 168.A O no hydrogen 3.293 N/A THR 173.A N VAL 169.A O no hydrogen 2.971 N/A THR 173.A N TYR 170.A O no hydrogen 2.837 N/A THR 173.A OG1 VAL 169.A O no hydrogen 2.625 N/A ASP 174.A N VAL 95.A O no hydrogen 2.851 N/A GLN 175.A N VAL 95.A O no hydrogen 3.433 N/A PHE 176.A N LYS 230.A O no hydrogen 2.850 N/A LEU 177.A N LEU 93.A O no hydrogen 2.835 N/A ALA 179.A N THR 91.A O no hydrogen 2.603 N/A THR 180.A OG1 ASN 265.A O no hydrogen 2.873 N/A ASP 181.A N GLU 178.A O no hydrogen 3.021 N/A TRP 182.A N GLU 178.A O no hydrogen 2.916 N/A ILE 183.A N ALA 179.A O no hydrogen 2.999 N/A SER 185.A N ASP 181.A O no hydrogen 3.056 N/A SER 185.A N TRP 182.A O no hydrogen 2.831 N/A SER 185.A OG TRP 182.A O no hydrogen 2.539 N/A GLN 186.A N TRP 182.A O no hydrogen 3.173 N/A GLN 186.A N ILE 183.A O no hydrogen 3.228 N/A GLN 186.A NE2 GLY 99.A O no hydrogen 3.588 N/A GLN 186.A NE2 SER 185.A OG no hydrogen 2.905 N/A MET 187.A N VAL 184.A O no hydrogen 3.203 N/A THR 188.A N VAL 184.A O no hydrogen 2.928 N/A THR 188.A OG1 GLY 244.A O no hydrogen 3.166 N/A GLY 189.A N SER 185.A O no hydrogen 2.681 N/A LYS 193.A NZ TYR 210.A OH no hydrogen 3.521 N/A LYS 193.A NZ LEU 231.A O no hydrogen 3.337 N/A LYS 193.A NZ ARG 232.A O no hydrogen 3.480 N/A ASN 194.A N ASP 181.A OD1 no hydrogen 2.945 N/A SER 195.A OG ASP 312.A O no hydrogen 2.645 N/A CYS 196.A SG GLY 313.A O no hydrogen 3.308 N/A THR 197.A OG1 ASN 194.A OD1 no hydrogen 2.721 N/A GLY 199.A N SER 195.A O no hydrogen 2.920 N/A TYR 200.A N CYS 196.A O no hydrogen 2.899 N/A LYS 201.A N THR 197.A O no hydrogen 2.810 N/A ALA 202.A N THR 197.A O no hydrogen 3.203 N/A ALA 202.A N ALA 198.A O no hydrogen 3.055 N/A TRP 204.A N ALA 198.A O no hydrogen 3.051 N/A HIS 205.A N GLY 209.A O no hydrogen 2.941 N/A LYS 206.A NZ ASP 312.A OD2 no hydrogen 2.681 N/A GLY 209.A N HIS 205.A O no hydrogen 2.823 N/A PHE 215.A N SER 212.A O no hydrogen 3.215 N/A LYS 217.A N ASN 213.A O no hydrogen 3.183 N/A ALA 218.A N GLU 214.A O no hydrogen 3.057 N/A LEU 219.A N PHE 216.A O no hydrogen 2.849 N/A ASP 220.A N PHE 216.A O no hydrogen 3.168 N/A ASP 220.A N LYS 217.A O no hydrogen 3.016 N/A ARG 222.A N ASP 220.A OD2 no hydrogen 2.990 N/A ARG 222.A NE ASP 220.A OD2 no hydrogen 2.834 N/A ARG 222.A NH1 GLU 167.A OE2 no hydrogen 2.740 N/A ARG 222.A NH2 ASP 220.A OD1 no hydrogen 2.790 N/A LEU 223.A N ASP 220.A O no hydrogen 2.721 N/A GLU 224.A N PRO 221.A O no hydrogen 3.052 N/A LEU 226.A N LEU 223.A O no hydrogen 3.126 N/A THR 228.A N HIS 225.A O no hydrogen 3.069 N/A THR 228.A OG1 HIS 225.A O no hydrogen 3.130 N/A THR 229.A N LEU 226.A O no hydrogen 2.957 N/A THR 229.A OG1 HIS 225.A O no hydrogen 2.611 N/A THR 229.A OG1 LEU 226.A O no hydrogen 3.314 N/A LYS 230.A NZ THR 173.A O no hydrogen 3.247 N/A LEU 231.A N LEU 226.A O no hydrogen 2.939 N/A ARG 232.A N THR 229.A O no hydrogen 3.329 N/A ARG 232.A NH1 ASP 174.A O no hydrogen 2.912 N/A ARG 232.A NH1 THR 229.A O no hydrogen 2.721 N/A ARG 232.A NH2 ASP 174.A OD1 no hydrogen 2.926 N/A ARG 232.A NH2 ASP 174.A OD2 no hydrogen 3.550 N/A VAL 236.A N LYS 193.A O no hydrogen 3.023 N/A GLU 240.A N PRO 237.A O no hydrogen 3.343 N/A ALA 242.A N VAL 261.A O no hydrogen 2.735 N/A LEU 245.A N ILE 259.A O no hydrogen 3.172 N/A LEU 246.A N MET 187.A O no hydrogen 2.744 N/A GLU 248.A N GLU 248.A OE1 no hydrogen 2.565 N/A ALA 250.A N LEU 246.A O no hydrogen 2.708 N/A GLU 251.A N PRO 247.A O no hydrogen 3.028 N/A MET 253.A N MET 249.A O no hydrogen 2.979 N/A MET 253.A N ALA 250.A O no hydrogen 3.196 N/A GLY 254.A N ALA 250.A O no hydrogen 3.044 N/A GLY 254.A N GLU 251.A O no hydrogen 3.304 N/A LEU 255.A N ALA 250.A O no hydrogen 3.130 N/A GLY 258.A N LEU 245.A O no hydrogen 2.727 N/A VAL 261.A N GLY 243.A O no hydrogen 3.216 N/A ALA 262.A N ILE 83.A O no hydrogen 3.254 N/A VAL 263.A N GLU 240.A O no hydrogen 3.134 N/A ASN 265.A N VAL 85.A O no hydrogen 2.865 N/A ASN 265.A ND2 VAL 85.A O no hydrogen 3.156 N/A ASP 267.A N PHE 87.A O no hydrogen 2.873 N/A ALA 268.A N ASP 267.A OD1 no hydrogen 2.568 N/A ALA 270.A N VAL 266.A O no hydrogen 2.793 N/A ALA 271.A N ALA 268.A O no hydrogen 2.954 N/A VAL 272.A N HIS 269.A O no hydrogen 3.173 N/A VAL 275.A N VAL 272.A O no hydrogen 3.329 N/A GLY 276.A N PRO 273.A O no hydrogen 3.004 N/A VAL 277.A N VAL 272.A O no hydrogen 3.111 N/A THR 278.A OG1 GLU 493.A OE1 no hydrogen 2.904 N/A LYS 282.A NZ GLU 435.A OE1 no hydrogen 2.757 N/A LYS 282.A NZ TYR 437.A OH no hydrogen 2.598 N/A LEU 283.A N GLU 435.A O no hydrogen 3.006 N/A VAL 284.A N MET 294.A O no hydrogen 2.853 N/A MET 285.A N TYR 437.A O no hydrogen 2.628 N/A ALA 286.A N CYS 292.A O no hydrogen 3.239 N/A MET 287.A N CYS 439.A O no hydrogen 2.851 N/A GLY 288.A N SER 290.A O no hydrogen 2.911 N/A THR 289.A OG1 ASP 330.A OD1 no hydrogen 2.716 N/A THR 289.A OG1 ASP 330.A OD2 no hydrogen 2.861 N/A ILE 291.A N GLN 325.A O no hydrogen 3.254 N/A CYS 292.A N ALA 286.A O no hydrogen 3.156 N/A CYS 292.A SG GLU 322.A OE2 no hydrogen 3.579 N/A HIS 293.A N ALA 323.A O no hydrogen 2.751 N/A MET 294.A N VAL 284.A O no hydrogen 2.903 N/A LEU 295.A N TYR 321.A O no hydrogen 2.828 N/A GLY 297.A N LEU 319.A O no hydrogen 3.064 N/A GLN 301.A N TYR 321.A OH no hydrogen 2.683 N/A GLN 301.A NE2 GLU 300.A O no hydrogen 2.883 N/A VAL 303.A N GLN 301.A O no hydrogen 3.033 N/A MET 306.A N VAL 303.A O no hydrogen 3.298 N/A CYS 307.A N GLU 322.A O no hydrogen 2.751 N/A GLY 308.A N GLU 322.A O no hydrogen 3.247 N/A VAL 310.A N GLY 320.A O no hydrogen 2.971 N/A ASP 312.A N TYR 318.A O no hydrogen 3.099 N/A GLY 313.A N VAL 310.A O no hydrogen 2.964 N/A GLY 317.A N ASP 312.A OD1 no hydrogen 3.005 N/A LEU 319.A N GLY 297.A O no hydrogen 2.940 N/A GLY 320.A N VAL 310.A O no hydrogen 2.917 N/A TYR 321.A N LEU 295.A O no hydrogen 2.731 N/A TYR 321.A OH LYS 299.A O no hydrogen 2.752 N/A GLU 322.A N GLY 308.A O no hydrogen 2.939 N/A ALA 323.A N HIS 293.A O no hydrogen 2.660 N/A GLY 324.A N SER 384.A OG no hydrogen 2.618 N/A GLN 325.A N ILE 291.A O no hydrogen 2.956 N/A GLN 325.A NE2 ASP 377.A OD1 no hydrogen 3.094 N/A GLN 325.A NE2 THR 415.A O no hydrogen 2.721 N/A VAL 328.A N THR 289.A O no hydrogen 3.392 N/A ASP 330.A N THR 289.A O no hydrogen 3.175 N/A PHE 332.A N VAL 328.A O no hydrogen 3.368 N/A ALA 333.A N GLY 329.A O no hydrogen 3.092 N/A TRP 334.A N ASP 330.A O no hydrogen 2.732 N/A PHE 335.A N ILE 331.A O no hydrogen 2.960 N/A VAL 336.A N PHE 332.A O no hydrogen 3.167 N/A LYS 337.A N ALA 333.A O no hydrogen 3.096 N/A HIS 338.A N TRP 334.A O no hydrogen 2.733 N/A GLY 339.A N PHE 335.A O no hydrogen 2.680 N/A PHE 345.A N SER 341.A O no hydrogen 3.368 N/A ASP 346.A N ALA 342.A O no hydrogen 2.776 N/A GLU 347.A N ALA 343.A O no hydrogen 2.920 N/A ALA 348.A N THR 344.A O no hydrogen 3.023 N/A GLN 349.A N PHE 345.A O no hydrogen 3.075 N/A GLU 350.A N ASP 346.A O no hydrogen 2.671 N/A LYS 351.A N GLU 347.A O no hydrogen 3.167 N/A LYS 351.A N ALA 348.A O no hydrogen 3.141 N/A LYS 351.A NZ GLU 347.A OE2 no hydrogen 3.528 N/A GLY 352.A N GLN 349.A O no hydrogen 3.076 N/A VAL 353.A N ALA 348.A O no hydrogen 2.866 N/A LEU 358.A N ASN 354.A O no hydrogen 2.960 N/A LEU 359.A N VAL 355.A O no hydrogen 2.843 N/A GLU 360.A N HIS 356.A O no hydrogen 2.949 N/A GLU 361.A N ALA 357.A O no hydrogen 3.105 N/A LYS 362.A N LEU 358.A O no hydrogen 3.051 N/A LYS 362.A NZ GLU 347.A OE1 no hydrogen 3.277 N/A LYS 362.A NZ GLU 347.A OE2 no hydrogen 2.759 N/A ALA 363.A N LEU 359.A O no hydrogen 3.100 N/A SER 364.A N GLU 360.A O no hydrogen 2.975 N/A SER 364.A N GLU 361.A O no hydrogen 3.194 N/A SER 364.A OG GLU 360.A O no hydrogen 3.343 N/A SER 364.A OG GLU 361.A O no hydrogen 2.618 N/A GLN 365.A N LYS 362.A O no hydrogen 3.421 N/A LEU 366.A N ALA 363.A O no hydrogen 3.395 N/A ARG 367.A N GLU 370.A OE1 no hydrogen 2.747 N/A GLU 370.A N ARG 367.A O no hydrogen 2.825 N/A GLY 372.A N GLY 369.A O no hydrogen 3.309 N/A LEU 373.A N SER 371.A OG no hydrogen 3.119 N/A LEU 374.A N LEU 396.A O no hydrogen 2.780 N/A LEU 376.A N MET 394.A O no hydrogen 2.950 N/A TRP 378.A N LEU 376.A O no hydrogen 2.617 N/A GLY 381.A N TRP 378.A O no hydrogen 2.992 N/A ASN 382.A N ASP 388.A O no hydrogen 2.930 N/A ASN 382.A ND2 SER 384.A O no hydrogen 3.673 N/A ARG 383.A NH1 MET 306.A O no hydrogen 3.214 N/A ARG 383.A NH2 TYR 146.A O no hydrogen 2.825 N/A ARG 383.A NH2 MET 306.A O no hydrogen 3.382 N/A SER 384.A N GLY 324.A O no hydrogen 2.783 N/A SER 384.A OG GLY 305.A O no hydrogen 2.965 N/A LEU 386.A N ASN 382.A OD1 no hydrogen 3.128 N/A VAL 387.A N ARG 383.A O no hydrogen 2.693 N/A ASP 388.A N ASN 382.A O no hydrogen 2.818 N/A THR 389.A OG1 GLU 390.A OE2 no hydrogen 3.130 N/A GLU 390.A N ASP 388.A OD1 no hydrogen 2.654 N/A MET 394.A N LEU 376.A O no hydrogen 3.503 N/A LEU 396.A N LEU 374.A O no hydrogen 2.727 N/A THR 399.A N THR 402.A OG1 no hydrogen 2.989 N/A GLN 401.A N THR 399.A OG1 no hydrogen 3.039 N/A THR 402.A N THR 399.A O no hydrogen 3.033 N/A THR 402.A OG1 THR 399.A O no hydrogen 3.271 N/A LYS 403.A N GLU 406.A OE1 no hydrogen 2.705 N/A GLU 405.A N GLU 405.A OE1 no hydrogen 2.576 N/A GLU 406.A N LYS 403.A O no hydrogen 2.941 N/A ILE 407.A N LYS 403.A O no hydrogen 3.106 N/A TYR 408.A N PRO 404.A O no hydrogen 2.905 N/A ARG 409.A N GLU 405.A O no hydrogen 3.084 N/A ARG 409.A NE GLU 413.A OE1 no hydrogen 2.751 N/A ARG 409.A NE TYR 517.A OH no hydrogen 3.358 N/A ARG 409.A NH1 ALA 363.A O no hydrogen 2.547 N/A ARG 409.A NH2 TYR 517.A OH no hydrogen 2.980 N/A ALA 410.A N GLU 406.A O no hydrogen 3.140 N/A LEU 411.A N ILE 407.A O no hydrogen 3.107 N/A LEU 412.A N TYR 408.A O no hydrogen 3.095 N/A GLU 413.A N ARG 409.A O no hydrogen 2.749 N/A ALA 414.A N ALA 410.A O no hydrogen 2.727 N/A THR 415.A N LEU 411.A O no hydrogen 3.091 N/A THR 415.A OG1 LEU 412.A O no hydrogen 2.749 N/A ALA 416.A N LEU 412.A O no hydrogen 3.229 N/A PHE 417.A N GLU 413.A O no hydrogen 2.960 N/A GLY 418.A N ALA 414.A O no hydrogen 2.982 N/A THR 419.A N THR 415.A O no hydrogen 2.950 N/A THR 419.A OG1 HIS 293.A NE2 no hydrogen 3.366 N/A THR 419.A OG1 GLN 325.A OE1 no hydrogen 2.520 N/A THR 419.A OG1 THR 415.A O no hydrogen 3.400 N/A ARG 420.A N ALA 416.A O no hydrogen 2.849 N/A ARG 420.A NE ASP 424.A OD2 no hydrogen 3.105 N/A ARG 420.A NH1 VAL 456.A O no hydrogen 3.274 N/A ARG 420.A NH1 GLU 518.A OE1 no hydrogen 3.271 N/A ARG 420.A NH2 GLU 518.A OE1 no hydrogen 3.024 N/A ALA 421.A N PHE 417.A O no hydrogen 2.918 N/A ILE 422.A N GLY 418.A O no hydrogen 3.328 N/A VAL 423.A N THR 419.A O no hydrogen 2.889 N/A ASP 424.A N ARG 420.A O no hydrogen 2.851 N/A ALA 425.A N ALA 421.A O no hydrogen 3.103 N/A PHE 426.A N ILE 422.A O no hydrogen 3.287 N/A HIS 427.A N VAL 423.A O no hydrogen 3.016 N/A GLY 428.A N ASP 424.A O no hydrogen 2.849 N/A ARG 429.A N PHE 426.A O no hydrogen 2.885 N/A GLY 430.A N HIS 427.A O no hydrogen 3.172 N/A VAL 431.A N PHE 426.A O no hydrogen 3.032 N/A VAL 433.A N HIS 427.A ND1 no hydrogen 2.920 N/A HIS 434.A N GLY 281.A O no hydrogen 2.763 N/A GLU 435.A N GLY 281.A O no hydrogen 3.116 N/A LEU 436.A N GLU 460.A O no hydrogen 3.031 N/A TYR 437.A N LEU 283.A O no hydrogen 2.716 N/A ALA 438.A N LYS 462.A O no hydrogen 2.743 N/A CYS 439.A N MET 285.A O no hydrogen 2.974 N/A CYS 439.A SG MET 285.A O no hydrogen 3.740 N/A GLN 444.A N GLY 441.A O no hydrogen 2.942 N/A GLN 444.A NE2 GLY 440.A O no hydrogen 3.295 N/A GLN 444.A NE2 ALA 464.A O no hydrogen 3.655 N/A LYS 445.A N GLY 441.A O no hydrogen 3.134 N/A ASN 446.A N LEU 442.A O no hydrogen 2.949 N/A ASN 446.A ND2 TYR 408.A OH no hydrogen 3.075 N/A LEU 448.A N GLU 360.A OE2 no hydrogen 3.210 N/A LEU 449.A N ASN 446.A OD1 no hydrogen 2.857 N/A GLN 451.A N HIS 447.A O no hydrogen 3.131 N/A GLN 451.A N LEU 448.A O no hydrogen 3.111 N/A GLN 451.A NE2 GLN 451.A O no hydrogen 3.385 N/A GLN 451.A NE2 ASP 455.A OD1 no hydrogen 3.439 N/A GLN 451.A NE2 LYS 508.A O no hydrogen 2.881 N/A ILE 452.A N LEU 448.A O no hydrogen 3.063 N/A PHE 453.A N LEU 449.A O no hydrogen 2.940 N/A ALA 454.A N MET 450.A O no hydrogen 2.964 N/A ASP 455.A N GLN 451.A O no hydrogen 2.806 N/A VAL 456.A N ILE 452.A O no hydrogen 2.810 N/A THR 457.A N PHE 453.A O no hydrogen 3.120 N/A THR 457.A OG1 PHE 453.A O no hydrogen 2.885 N/A ARG 459.A N ALA 454.A O no hydrogen 3.398 N/A ARG 459.A NE VAL 433.A O no hydrogen 2.739 N/A ARG 459.A NH1 THR 457.A O no hydrogen 2.631 N/A ARG 459.A NH2 VAL 433.A O no hydrogen 3.057 N/A ILE 461.A N PHE 507.A O no hydrogen 2.851 N/A LYS 462.A N LEU 436.A O no hydrogen 2.952 N/A LYS 462.A NZ GLU 435.A OE2 no hydrogen 2.708 N/A LYS 462.A NZ TYR 437.A OH no hydrogen 3.525 N/A ALA 464.A N ALA 438.A O no hydrogen 2.846 N/A ALA 465.A N ARG 501.A O no hydrogen 3.054 N/A SER 466.A OG THR 469.A OG1 no hydrogen 2.883 N/A LYS 467.A NZ GLN 468.A OE1 no hydrogen 2.585 N/A THR 469.A OG1 SER 466.A OG no hydrogen 2.883 N/A LEU 472.A N GLN 468.A O no hydrogen 3.017 N/A GLY 473.A N THR 469.A O no hydrogen 2.974 N/A ALA 474.A N PRO 470.A O no hydrogen 2.959 N/A ALA 475.A N ALA 471.A O no hydrogen 2.862 N/A MET 476.A N LEU 472.A O no hydrogen 2.777 N/A PHE 477.A N GLY 473.A O no hydrogen 3.019 N/A ALA 478.A N ALA 474.A O no hydrogen 2.865 N/A SER 479.A N ALA 475.A O no hydrogen 3.077 N/A SER 479.A OG MET 476.A O no hydrogen 2.672 N/A VAL 480.A N MET 476.A O no hydrogen 3.192 N/A ALA 481.A N PHE 477.A O no hydrogen 3.057 N/A ALA 482.A N ALA 478.A O no hydrogen 3.035 N/A GLY 483.A N SER 479.A O no hydrogen 3.142 N/A SER 484.A N ASP 490.A OD1 no hydrogen 2.932 N/A GLY 487.A N SER 484.A O no hydrogen 3.000 N/A TYR 489.A N SER 479.A O no hydrogen 3.070 N/A TYR 489.A OH LEU 20.A O no hydrogen 2.533 N/A GLU 494.A N SER 491.A OG no hydrogen 3.121 N/A ALA 495.A N SER 491.A O no hydrogen 3.014 N/A ALA 496.A N ILE 492.A O no hydrogen 2.720 N/A LYS 497.A N GLU 493.A O no hydrogen 3.022 N/A LYS 497.A NZ GLU 494.A OE2 no hydrogen 2.635 N/A LYS 498.A NZ GLU 494.A O no hydrogen 3.437 N/A MET 499.A N ALA 495.A O no hydrogen 2.952 N/A GLY 500.A N ALA 496.A O no hydrogen 2.797 N/A ARG 501.A N ALA 274.A O no hydrogen 3.170 N/A LYS 503.A N VAL 463.A O no hydrogen 2.843 N/A THR 506.A OG1 GLU 460.A OE2 no hydrogen 2.846 N/A PHE 507.A N ILE 461.A O no hydrogen 2.828 N/A ILE 510.A N ASP 455.A OD1 no hydrogen 3.057 N/A VAL 514.A N ILE 510.A O no hydrogen 2.897 N/A ALA 515.A N PRO 511.A O no hydrogen 3.041 N/A ILE 516.A N GLU 512.A O no hydrogen 3.424 N/A TYR 517.A N HIS 513.A O no hydrogen 2.965 N/A TYR 517.A OH GLU 413.A OE1 no hydrogen 2.706 N/A GLU 518.A N VAL 514.A O no hydrogen 3.080 N/A LYS 519.A N ILE 516.A O no hydrogen 2.976 N/A LEU 520.A N ILE 516.A O no hydrogen 3.016 N/A TYR 521.A N TYR 517.A O no hydrogen 2.665 N/A GLN 522.A N GLU 518.A O no hydrogen 3.216 N/A GLN 522.A NE2 GLU 518.A OE2 no hydrogen 2.650 N/A GLU 523.A N LYS 519.A O no hydrogen 3.317 N/A TYR 524.A N LEU 520.A O no hydrogen 3.022 N/A TYR 524.A OH ASP 377.A OD2 no hydrogen 2.684 N/A VAL 525.A N TYR 521.A O no hydrogen 2.762 N/A THR 526.A N GLN 522.A O no hydrogen 3.161 N/A THR 526.A OG1 GLN 522.A O no hydrogen 3.224 N/A LEU 527.A N GLU 523.A O no hydrogen 3.187 N/A HIS 528.A N TYR 524.A O no hydrogen 2.706 N/A HIS 528.A ND1 ASP 529.A OD1 no hydrogen 3.052 N/A ASP 529.A N VAL 525.A O no hydrogen 2.878 N/A TYR 530.A N THR 526.A O no hydrogen 2.909 N/A PHE 531.A N LEU 527.A O no hydrogen 2.884 N/A ARG 533.A N ASP 529.A O no hydrogen 2.985 N/A ARG 533.A NE ASP 529.A OD1 no hydrogen 2.876 N/A ARG 533.A NH1 GLU 304.A OE2 no hydrogen 2.860 N/A ARG 533.A NH2 GLU 304.A OE1 no hydrogen 3.235 N/A ARG 533.A NH2 GLU 304.A OE2 no hydrogen 3.503 N/A ASN 536.A N TYR 530.A O no hydrogen 3.367 N/A ASN 536.A ND2 TYR 530.A OH no hydrogen 3.015 N/A VAL 538.A N ASN 536.A OD1 no hydrogen 2.801 N/A LYS 540.A N ASP 537.A O no hydrogen 2.695 N/A ARG 541.A N ASP 537.A O no hydrogen 3.279 N/A ARG 541.A NH2 ASN 536.A OD1 no hydrogen 3.350 N/A LEU 542.A N VAL 538.A O no hydrogen 2.827 N/A LYS 543.A N MET 539.A O no hydrogen 3.273 N/A ALA 544.A N LYS 540.A O no hydrogen 3.134 N/A LEU 545.A N ARG 541.A O no hydrogen 3.317 N/A LYS 546.A N LEU 542.A O no hydrogen 3.154 N/A