Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4fwh_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): MET 1.A N ALA 542.A O no hydrogen 3.219 N/A LEU 3.A N ILE 540.A O no hydrogen 2.848 N/A SER 4.A OG GLU 6.A OE1 no hydrogen 3.462 N/A TYR 5.A OH GLU 9.A OE1 no hydrogen 2.816 N/A ALA 7.A N SER 4.A OG no hydrogen 2.769 N/A LEU 8.A N SER 4.A O no hydrogen 3.043 N/A GLU 9.A N TYR 5.A O no hydrogen 3.036 N/A TRP 10.A N GLU 9.A OE2 no hydrogen 2.893 N/A TRP 10.A NE1 LEU 525.A O no hydrogen 3.035 N/A ARG 11.A N GLU 9.A OE2 no hydrogen 2.915 N/A ARG 11.A NE GLU 9.A OE2 no hydrogen 2.797 N/A ARG 11.A NH2 GLU 9.A OE1 no hydrogen 2.578 N/A THR 12.A N ASP 290.A OD2 no hydrogen 2.972 N/A THR 12.A OG1 ASP 290.A OD1 no hydrogen 2.645 N/A THR 12.A OG1 ASP 290.A OD2 no hydrogen 3.385 N/A GLU 19.A N ASN 16.A O no hydrogen 3.040 N/A VAL 21.A N LEU 280.A O no hydrogen 2.845 N/A GLN 32.A N PHE 29.A O no hydrogen 2.807 N/A GLN 32.A NE2 SER 256.A O no hydrogen 2.967 N/A ARG 36.A N GLN 32.A O no hydrogen 3.130 N/A GLU 37.A N GLU 33.A O no hydrogen 2.867 N/A ALA 38.A N ARG 34.A O no hydrogen 3.056 N/A LEU 39.A N ALA 35.A O no hydrogen 2.948 N/A GLU 40.A N ARG 36.A O no hydrogen 2.835 N/A LEU 41.A N GLU 37.A O no hydrogen 2.885 N/A ALA 42.A N ALA 38.A O no hydrogen 2.987 N/A ILE 43.A N LEU 39.A O no hydrogen 3.162 N/A ARG 44.A N GLU 40.A O no hydrogen 2.971 N/A GLY 45.A N LEU 41.A O no hydrogen 2.831 N/A PHE 47.A N ALA 42.A O no hydrogen 3.029 N/A ALA 49.A N VAL 227.A O no hydrogen 3.168 N/A TYR 50.A N ILE 251.A O no hydrogen 2.987 N/A LEU 51.A N LEU 229.A O no hydrogen 2.638 N/A VAL 52.A N ALA 253.A O no hydrogen 3.090 N/A GLY 53.A N GLY 231.A O no hydrogen 3.025 N/A LYS 59.A NZ GLY 53.A O no hydrogen 2.836 N/A LYS 59.A NZ PRO 54.A O no hydrogen 3.282 N/A HIS 60.A NE2 ASP 183.A OD1 no hydrogen 2.758 N/A ALA 62.A N GLY 58.A O no hydrogen 3.115 N/A LEU 63.A N LYS 59.A O no hydrogen 3.004 N/A LEU 64.A N HIS 60.A O no hydrogen 2.885 N/A ALA 65.A N GLU 61.A O no hydrogen 3.192 N/A ALA 65.A N ALA 62.A O no hydrogen 3.309 N/A TYR 66.A N ALA 62.A O no hydrogen 2.903 N/A LEU 67.A N LEU 63.A O no hydrogen 2.803 N/A SER 68.A N LEU 64.A O no hydrogen 3.213 N/A SER 68.A OG LEU 64.A O no hydrogen 2.615 N/A THR 69.A OG1 TYR 66.A O no hydrogen 2.741 N/A GLN 70.A N LEU 67.A O no hydrogen 2.972 N/A GLN 70.A NE2 TYR 66.A O no hydrogen 3.570 N/A VAL 72.A N GLY 135.A O no hydrogen 2.486 N/A THR 74.A OG1 SER 133.A O no hydrogen 2.974 N/A LEU 78.A N THR 130.A O no hydrogen 2.919 N/A LEU 79.A N LEU 91.A O no hydrogen 2.869 N/A VAL 81.A N ALA 89.A O no hydrogen 2.946 N/A LEU 83.A N LYS 87.A O no hydrogen 2.980 N/A VAL 88.A N GLU 217.A O no hydrogen 2.993 N/A ALA 89.A N VAL 81.A O no hydrogen 2.759 N/A LEU 91.A N LEU 79.A O no hydrogen 2.366 N/A LEU 93.A N ASP 77.A O no hydrogen 2.979 N/A SER 95.A OG SER 132.A O no hydrogen 2.995 N/A GLN 97.A N ASP 77.A OD2 no hydrogen 2.686 N/A GLN 107.A NE2 THR 92.A O no hydrogen 3.555 N/A ALA 108.A N PHE 105.A O no hydrogen 3.101 N/A LEU 114.A N TYR 111.A O no hydrogen 3.337 N/A TYR 117.A OH LEU 114.A O no hydrogen 2.404 N/A TRP 124.A N ASN 163.A OD1 no hydrogen 3.221 N/A ASN 127.A N TYR 80.A O no hydrogen 3.061 N/A LEU 129.A N LEU 78.A O no hydrogen 2.784 N/A THR 130.A N LEU 78.A O no hydrogen 3.284 N/A SER 134.A OG THR 136.A O no hydrogen 2.737 N/A VAL 141.A N TYR 179.A O no hydrogen 2.450 N/A TYR 142.A OH ASP 183.A OD1 no hydrogen 3.420 N/A TYR 142.A OH ASP 183.A OD2 no hydrogen 2.576 N/A GLU 143.A N ILE 181.A O no hydrogen 3.145 N/A TYR 145.A N GLU 143.A OE2 no hydrogen 3.068 N/A ALA 146.A N SER 186.A OG no hydrogen 2.632 N/A ARG 150.A N THR 147.A OG1 no hydrogen 3.137 N/A ARG 150.A NH1 GLU 143.A OE1 no hydrogen 3.128 N/A LEU 151.A N THR 147.A O no hydrogen 2.795 N/A PHE 152.A N ALA 148.A O no hydrogen 2.685 N/A GLY 153.A N PRO 149.A O no hydrogen 2.785 N/A ARG 154.A N ARG 168.A O no hydrogen 2.789 N/A LEU 155.A N VAL 208.A O no hydrogen 2.813 N/A ASP 156.A N LEU 166.A O no hydrogen 3.208 N/A SER 161.A N LEU 158.A O no hydrogen 2.849 N/A SER 165.A N ASN 163.A OD1 no hydrogen 2.838 N/A SER 165.A OG ASN 163.A OD1 no hydrogen 3.255 N/A LEU 166.A N ASN 163.A O no hydrogen 2.809 N/A ILE 167.A N VAL 164.A O no hydrogen 2.996 N/A ARG 168.A N ARG 154.A O no hydrogen 2.630 N/A ALA 171.A N ARG 150.A O no hydrogen 2.809 N/A VAL 172.A N LEU 151.A O no hydrogen 3.024 N/A HIS 173.A NE2 PHE 152.A O no hydrogen 3.251 N/A ARG 174.A N GLY 170.A O no hydrogen 2.842 N/A ALA 175.A N ALA 171.A O no hydrogen 2.877 N/A GLN 176.A N HIS 173.A O no hydrogen 3.402 N/A GLN 176.A NE2 VAL 172.A O no hydrogen 2.592 N/A GLY 177.A N GLN 224.A O no hydrogen 2.637 N/A GLY 178.A N ALA 175.A O no hydrogen 2.783 N/A TYR 179.A N PRO 139.A O no hydrogen 2.453 N/A LEU 180.A N GLN 226.A O no hydrogen 3.047 N/A ILE 181.A N VAL 141.A O no hydrogen 2.580 N/A LEU 182.A N ILE 228.A O no hydrogen 3.047 N/A ALA 184.A N VAL 230.A O no hydrogen 2.978 N/A SER 186.A OG PRO 144.A O no hydrogen 3.261 N/A LEU 187.A N ASP 183.A O no hydrogen 3.074 N/A LYS 188.A N ALA 184.A O no hydrogen 3.171 N/A LYS 188.A NZ ALA 235.A O no hydrogen 3.403 N/A ARG 189.A N LEU 185.A O no hydrogen 2.770 N/A GLU 190.A N SER 186.A O no hydrogen 2.796 N/A GLY 191.A N LYS 188.A O no hydrogen 2.799 N/A THR 192.A N LEU 187.A O no hydrogen 2.910 N/A THR 192.A OG1 ALA 146.A O no hydrogen 2.995 N/A THR 192.A OG1 LEU 187.A O no hydrogen 3.228 N/A TRP 193.A NE1 ASP 242.A OD2 no hydrogen 2.742 N/A PHE 196.A N THR 192.A O no hydrogen 3.077 N/A LYS 197.A N TRP 193.A O no hydrogen 3.073 N/A LYS 197.A NZ GLU 194.A OE1 no hydrogen 2.924 N/A LYS 197.A NZ ASP 242.A OD2 no hydrogen 3.225 N/A ARG 198.A N GLU 194.A O no hydrogen 3.015 N/A ALA 199.A N ALA 195.A O no hydrogen 3.175 N/A LEU 200.A N PHE 196.A O no hydrogen 3.040 N/A ARG 201.A N LYS 197.A O no hydrogen 2.640 N/A ARG 201.A NH2 GLU 247.A OE2 no hydrogen 3.198 N/A ASN 202.A N ARG 198.A O no hydrogen 3.018 N/A ASN 202.A ND2 GLN 204.A OE1 no hydrogen 3.641 N/A GLN 204.A N ARG 198.A O no hydrogen 2.939 N/A VAL 208.A N GLY 153.A O no hydrogen 3.071 N/A GLU 210.A N TYR 157.A OH no hydrogen 3.063 N/A GLU 217.A N ARG 86.A O no hydrogen 2.922 N/A GLU 219.A N VAL 88.A O no hydrogen 3.123 N/A GLN 224.A N GLN 176.A OE1 no hydrogen 2.504 N/A GLN 226.A N GLY 178.A O no hydrogen 3.155 N/A GLN 226.A NE2 PHE 47.A O no hydrogen 3.175 N/A ILE 228.A N LEU 180.A O no hydrogen 2.795 N/A LEU 229.A N ALA 49.A O no hydrogen 3.069 N/A VAL 230.A N LEU 182.A O no hydrogen 3.098 N/A GLY 231.A N LEU 51.A O no hydrogen 3.071 N/A ALA 235.A N THR 232.A OG1 no hydrogen 3.046 N/A PHE 236.A N THR 232.A O no hydrogen 3.195 N/A PHE 236.A N PRO 233.A O no hydrogen 3.240 N/A GLU 237.A N GLU 234.A O no hydrogen 3.085 N/A GLU 240.A N PHE 236.A O no hydrogen 2.884 N/A GLU 241.A N GLU 237.A O no hydrogen 3.214 N/A ASP 242.A N LEU 239.A O no hydrogen 2.941 N/A ALA 244.A N ASP 242.A OD1 no hydrogen 2.704 N/A PHE 245.A N ASP 242.A O no hydrogen 2.266 N/A GLU 247.A N PRO 243.A O no hydrogen 3.471 N/A LEU 248.A N ALA 244.A O no hydrogen 3.067 N/A PHE 249.A N PHE 245.A O no hydrogen 2.691 N/A ILE 251.A N HIS 48.A O no hydrogen 3.464 N/A ARG 252.A NE GLU 254.A OE1 no hydrogen 2.986 N/A ARG 252.A NH1 GLU 254.A OE1 no hydrogen 2.983 N/A ARG 252.A NH2 TYR 50.A OH no hydrogen 3.403 N/A ALA 253.A N TYR 50.A O no hydrogen 2.863 N/A PHE 255.A N VAL 52.A O no hydrogen 2.952 N/A SER 256.A N GLN 32.A OE1 no hydrogen 2.708 N/A LEU 259.A N MET 302.A O no hydrogen 2.753 N/A ALA 261.A N ASP 300.A O no hydrogen 2.799 N/A ASN 265.A N SER 262.A OG no hydrogen 3.183 N/A ASN 265.A ND2 PRO 260.A O no hydrogen 3.174 N/A CYS 266.A N SER 262.A O no hydrogen 2.909 N/A THR 267.A N PRO 263.A O no hydrogen 2.816 N/A THR 267.A OG1 PRO 263.A O no hydrogen 2.844 N/A ALA 268.A N GLU 264.A O no hydrogen 2.746 N/A LEU 269.A N ASN 265.A O no hydrogen 2.752 N/A GLY 270.A N CYS 266.A O no hydrogen 2.945 N/A GLY 271.A N THR 267.A O no hydrogen 3.129 N/A TRP 272.A N ALA 268.A O no hydrogen 2.941 N/A LEU 273.A N LEU 269.A O no hydrogen 2.772 N/A LEU 274.A N GLY 270.A O no hydrogen 3.065 N/A ALA 275.A N GLY 271.A O no hydrogen 2.930 N/A GLN 276.A N TRP 272.A O no hydrogen 3.081 N/A GLY 277.A N LEU 274.A O no hydrogen 2.866 N/A PHE 278.A N LEU 273.A O no hydrogen 3.329 N/A GLN 279.A NE2 GLY 277.A O no hydrogen 3.255 N/A THR 281.A N LEU 324.A O no hydrogen 3.132 N/A THR 281.A OG1 SER 17.A O no hydrogen 3.052 N/A THR 281.A OG1 LEU 324.A O no hydrogen 3.148 N/A GLN 282.A N GLU 19.A O no hydrogen 3.006 N/A GLY 283.A N SER 17.A O no hydrogen 2.986 N/A GLY 284.A N THR 281.A O no hydrogen 2.842 N/A GLY 284.A N THR 281.A OG1 no hydrogen 2.969 N/A LEU 285.A N THR 281.A O no hydrogen 2.940 N/A THR 286.A N GLN 282.A O no hydrogen 2.918 N/A THR 286.A OG1 GLN 282.A O no hydrogen 2.781 N/A ARG 287.A N GLY 283.A O no hydrogen 3.304 N/A ARG 287.A NE GLU 330.A OE2 no hydrogen 3.163 N/A LEU 288.A N GLY 284.A O no hydrogen 3.344 N/A TYR 289.A N LEU 285.A O no hydrogen 2.866 N/A ASP 290.A N THR 286.A O no hydrogen 2.871 N/A GLU 291.A N ARG 287.A O no hydrogen 2.906 N/A GLU 291.A N LEU 288.A O no hydrogen 3.234 N/A ALA 292.A N LEU 288.A O no hydrogen 3.036 N/A ARG 293.A N TYR 289.A O no hydrogen 3.072 N/A ARG 293.A NE ARG 299.A O no hydrogen 2.929 N/A ARG 293.A NH1 TRP 10.A O no hydrogen 2.630 N/A ARG 293.A NH1 ASP 290.A OD1 no hydrogen 3.279 N/A ARG 293.A NH2 TRP 10.A O no hydrogen 3.064 N/A ARG 293.A NH2 ARG 299.A O no hydrogen 2.738 N/A ARG 294.A N ASP 290.A O no hydrogen 2.806 N/A ARG 294.A NH1 GLU 496.A OE1 no hydrogen 3.506 N/A ARG 294.A NH1 GLU 496.A OE2 no hydrogen 2.473 N/A ARG 294.A NH1 THR 524.A O no hydrogen 2.872 N/A ARG 294.A NH2 GLU 496.A OE1 no hydrogen 2.812 N/A MET 295.A N GLU 291.A O no hydrogen 2.457 N/A ALA 296.A N ALA 292.A O no hydrogen 3.217 N/A ALA 296.A N ARG 293.A O no hydrogen 3.193 N/A GLU 297.A N ARG 294.A O no hydrogen 2.770 N/A GLN 298.A N ARG 293.A O no hydrogen 3.336 N/A ARG 299.A N ALA 521.A O no hydrogen 2.966 N/A ARG 299.A NH1 ALA 7.A O no hydrogen 3.137 N/A ARG 299.A NH2 ALA 7.A O no hydrogen 3.338 N/A ARG 301.A N GLN 298.A O no hydrogen 3.350 N/A ARG 301.A NH1 THR 258.A OG1 no hydrogen 3.201 N/A MET 302.A N LEU 259.A O no hydrogen 2.555 N/A ASP 303.A N ALA 292.A O no hydrogen 3.018 N/A ALA 304.A N PRO 257.A O no hydrogen 2.998 N/A ARG 305.A N ASP 303.A OD1 no hydrogen 3.226 N/A ARG 305.A NE ASP 303.A OD1 no hydrogen 3.059 N/A LEU 306.A N ALA 304.A O no hydrogen 2.728 N/A VAL 307.A N SER 56.A O no hydrogen 3.267 N/A ILE 309.A N ARG 305.A O no hydrogen 3.173 N/A ARG 310.A N LEU 306.A O no hydrogen 2.904 N/A ARG 310.A NH1 GLU 61.A OE1 no hydrogen 3.040 N/A ARG 310.A NH1 GLN 276.A OE1 no hydrogen 2.820 N/A ARG 310.A NH2 GLU 61.A OE2 no hydrogen 3.136 N/A ALA 311.A N VAL 307.A O no hydrogen 2.887 N/A LEU 312.A N GLU 308.A O no hydrogen 3.096 N/A ALA 313.A N ILE 309.A O no hydrogen 2.903 N/A GLU 314.A N ARG 310.A O no hydrogen 2.888 N/A ALA 316.A N LEU 312.A O no hydrogen 2.933 N/A ALA 317.A N ALA 313.A O no hydrogen 2.791 N/A VAL 318.A N GLU 314.A O no hydrogen 3.314 N/A LEU 319.A N GLU 315.A O no hydrogen 3.271 N/A GLY 320.A N ALA 316.A O no hydrogen 2.962 N/A GLY 320.A N ALA 317.A O no hydrogen 2.990 N/A GLY 321.A N VAL 318.A O no hydrogen 3.203 N/A GLY 322.A N ALA 317.A O no hydrogen 2.861 N/A LEU 323.A N GLY 320.A O no hydrogen 3.142 N/A LEU 324.A N GLN 279.A O no hydrogen 2.973 N/A THR 325.A N SER 328.A OG no hydrogen 2.961 N/A THR 325.A OG1 SER 328.A OG no hydrogen 3.355 N/A SER 328.A N THR 325.A OG1 no hydrogen 3.077 N/A SER 328.A OG ALA 316.A O no hydrogen 3.228 N/A SER 328.A OG LEU 323.A O no hydrogen 3.544 N/A SER 328.A OG THR 325.A O no hydrogen 3.189 N/A SER 328.A OG THR 325.A OG1 no hydrogen 3.355 N/A VAL 329.A N THR 325.A O no hydrogen 3.258 N/A GLU 330.A N ALA 326.A O no hydrogen 2.947 N/A GLN 331.A N GLU 327.A O no hydrogen 2.833 N/A ALA 332.A N SER 328.A O no hydrogen 2.715 N/A ILE 333.A N VAL 329.A O no hydrogen 3.112 N/A ALA 334.A N GLU 330.A O no hydrogen 3.106 N/A ALA 335.A N GLN 331.A O no hydrogen 2.950 N/A ARG 336.A N ALA 332.A O no hydrogen 3.327 N/A ARG 336.A NE GLU 315.A OE1 no hydrogen 2.477 N/A ARG 336.A NH2 GLU 315.A OE2 no hydrogen 3.034 N/A GLU 337.A N ILE 333.A O no hydrogen 3.226 N/A HIS 338.A N ALA 334.A O no hydrogen 2.865 N/A ARG 339.A N ALA 335.A O no hydrogen 2.793 N/A ARG 339.A NH2 GLU 315.A OE1 no hydrogen 3.377 N/A SER 340.A N GLU 337.A O no hydrogen 3.378 N/A SER 340.A OG ARG 336.A O no hydrogen 3.567 N/A PHE 341.A N HIS 338.A O no hydrogen 3.294 N/A SER 343.A OG GLU 344.A OE2 no hydrogen 2.909 N/A GLU 345.A N PHE 341.A O no hydrogen 2.780 N/A GLU 346.A N LEU 342.A O no hydrogen 3.023 N/A PHE 347.A N SER 343.A O no hydrogen 3.116 N/A LEU 348.A N GLU 344.A O no hydrogen 2.801 N/A LEU 348.A N GLU 345.A O no hydrogen 3.226 N/A ARG 349.A N GLU 345.A O no hydrogen 3.044 N/A ALA 350.A N GLU 346.A O no hydrogen 3.113 N/A VAL 351.A N PHE 347.A O no hydrogen 3.148 N/A GLN 352.A N LEU 348.A O no hydrogen 2.844 N/A GLN 352.A NE2 ALA 504.A O no hydrogen 3.211 N/A GLU 353.A N ARG 349.A O no hydrogen 2.718 N/A GLY 354.A N VAL 351.A O no hydrogen 3.111 N/A VAL 355.A N ALA 350.A O no hydrogen 2.927 N/A ILE 356.A N ALA 350.A O no hydrogen 3.250 N/A ARG 357.A N GLN 442.A OE1 no hydrogen 3.007 N/A ARG 359.A NH2 THR 361.A O no hydrogen 3.210 N/A ARG 359.A NH2 ARG 363.A O no hydrogen 3.248 N/A ALA 364.A N LEU 469.A O no hydrogen 2.986 N/A GLY 366.A N SER 462.A OG no hydrogen 2.916 N/A VAL 368.A N LEU 386.A O no hydrogen 3.055 N/A ASN 369.A ND2 ARG 359.A O no hydrogen 2.776 N/A SER 370.A N ALA 384.A O no hydrogen 2.993 N/A SER 370.A OG ALA 384.A O no hydrogen 3.089 N/A VAL 372.A N ARG 382.A O no hydrogen 2.926 N/A VAL 374.A N TRP 380.A O no hydrogen 3.006 N/A ALA 376.A N VAL 374.A O no hydrogen 2.934 N/A TYR 379.A N ALA 376.A O no hydrogen 2.641 N/A TRP 380.A NE1 SER 340.A O no hydrogen 3.179 N/A ARG 382.A N VAL 372.A O no hydrogen 2.940 N/A ARG 382.A NE GLU 344.A OE1 no hydrogen 2.698 N/A ARG 382.A NH2 GLU 344.A OE1 no hydrogen 3.293 N/A ARG 382.A NH2 GLU 344.A OE2 no hydrogen 2.520 N/A ALA 384.A N SER 370.A O no hydrogen 2.798 N/A ARG 385.A NE GLU 367.A OE1 no hydrogen 2.937 N/A ARG 385.A NH2 GLU 367.A OE1 no hydrogen 3.455 N/A LEU 386.A N VAL 368.A O no hydrogen 2.893 N/A THR 387.A N ALA 439.A O no hydrogen 2.902 N/A THR 387.A OG1 ALA 439.A O no hydrogen 3.390 N/A THR 387.A OG1 GLU 441.A OE2 no hydrogen 2.984 N/A ALA 388.A N GLY 366.A O no hydrogen 2.778 N/A ARG 389.A N SER 437.A O no hydrogen 2.765 N/A ALA 391.A N THR 435.A O no hydrogen 2.928 N/A GLY 393.A N PRO 433.A O no hydrogen 3.205 N/A HIS 396.A N VAL 434.A O no hydrogen 3.331 N/A ILE 398.A N ILE 436.A O no hydrogen 2.670 N/A ILE 400.A N LEU 438.A O no hydrogen 3.071 N/A ARG 402.A N SER 399.A OG no hydrogen 3.363 N/A GLU 403.A N SER 399.A O no hydrogen 3.041 N/A ALA 404.A N ILE 400.A O no hydrogen 3.072 N/A GLY 405.A N ARG 402.A O no hydrogen 2.710 N/A LEU 406.A N ASP 401.A O no hydrogen 2.697 N/A GLY 407.A N ASP 401.A O no hydrogen 2.883 N/A GLY 408.A N ILE 447.A O no hydrogen 3.047 N/A ILE 410.A N GLU 448.A OE1 no hydrogen 3.294 N/A PHE 411.A N GLU 448.A OE2 no hydrogen 2.772 N/A HIS 412.A N GLY 408.A O no hydrogen 2.826 N/A LYS 413.A N GLN 409.A O no hydrogen 2.628 N/A ALA 414.A N ILE 410.A O no hydrogen 2.861 N/A VAL 415.A N PHE 411.A O no hydrogen 3.230 N/A LEU 416.A N HIS 412.A O no hydrogen 2.983 N/A THR 417.A N LYS 413.A O no hydrogen 2.841 N/A THR 417.A OG1 LYS 413.A O no hydrogen 2.826 N/A LEU 418.A N ALA 414.A O no hydrogen 3.069 N/A LEU 418.A N VAL 415.A O no hydrogen 3.072 N/A ALA 419.A N VAL 415.A O no hydrogen 3.130 N/A GLY 420.A N LEU 416.A O no hydrogen 2.965 N/A TYR 421.A N THR 417.A O no hydrogen 3.046 N/A LEU 422.A N LEU 418.A O no hydrogen 2.978 N/A ARG 423.A N ALA 419.A O no hydrogen 2.988 N/A SER 424.A N GLY 420.A O no hydrogen 3.176 N/A SER 424.A OG GLY 420.A O no hydrogen 3.315 N/A SER 424.A OG TYR 421.A O no hydrogen 3.170 N/A ARG 425.A N TYR 421.A O no hydrogen 2.808 N/A ARG 425.A NH2 GLU 547.A OE2 no hydrogen 2.404 N/A TYR 426.A N LEU 422.A O no hydrogen 3.143 N/A TYR 426.A OH GLN 565.A OE1 no hydrogen 2.799 N/A GLY 430.A N ILE 427.A O no hydrogen 3.046 N/A THR 435.A N ALA 391.A O no hydrogen 2.788 N/A ILE 436.A N HIS 396.A O no hydrogen 2.907 N/A SER 437.A N ARG 389.A O no hydrogen 2.835 N/A LEU 438.A N ILE 398.A O no hydrogen 2.982 N/A ALA 439.A N THR 387.A O no hydrogen 2.889 N/A PHE 440.A N ASP 401.A OD2 no hydrogen 3.031 N/A GLU 441.A N ARG 385.A O no hydrogen 2.849 N/A GLN 442.A NE2 VAL 355.A O no hydrogen 3.444 N/A ASN 443.A N PHE 440.A O no hydrogen 3.040 N/A ASN 443.A ND2 ASP 401.A OD1 no hydrogen 2.765 N/A ASN 443.A ND2 VAL 445.A O no hydrogen 2.850 N/A VAL 445.A N ASN 443.A OD1 no hydrogen 3.075 N/A ILE 447.A N LEU 406.A O no hydrogen 3.233 N/A GLY 449.A N GLU 448.A OE2 no hydrogen 3.086 N/A GLY 453.A N ASP 450.A O no hydrogen 3.065 N/A LEU 454.A N GLY 477.A O no hydrogen 2.988 N/A GLU 456.A N ALA 452.A O no hydrogen 2.741 N/A LEU 457.A N GLY 453.A O no hydrogen 3.053 N/A VAL 458.A N LEU 454.A O no hydrogen 3.106 N/A ALA 459.A N ALA 455.A O no hydrogen 3.025 N/A ALA 460.A N GLU 456.A O no hydrogen 2.950 N/A LEU 461.A N LEU 457.A O no hydrogen 2.854 N/A SER 462.A N VAL 458.A O no hydrogen 2.832 N/A SER 462.A OG LEU 467.A O no hydrogen 2.207 N/A ALA 463.A N ALA 459.A O no hydrogen 2.972 N/A ILE 464.A N ALA 460.A O no hydrogen 2.940 N/A GLY 465.A N LEU 461.A O no hydrogen 2.853 N/A LEU 467.A N SER 462.A O no hydrogen 2.876 N/A LEU 469.A N ALA 364.A O no hydrogen 2.765 N/A ARG 470.A N LEU 553.A O no hydrogen 3.028 N/A ARG 470.A NE ASP 472.A OD1 no hydrogen 3.192 N/A ARG 470.A NH2 ASP 472.A OD2 no hydrogen 3.268 N/A GLN 471.A N GLY 362.A O no hydrogen 2.871 N/A GLN 471.A NE2 GLU 367.A O no hydrogen 3.005 N/A GLN 471.A NE2 LEU 469.A O no hydrogen 2.917 N/A ALA 474.A N GLY 512.A O no hydrogen 3.078 N/A VAL 475.A N ASN 369.A O no hydrogen 2.801 N/A THR 476.A N ILE 514.A O no hydrogen 3.066 N/A THR 476.A OG1 SER 451.A O no hydrogen 3.417 N/A GLY 477.A N SER 451.A O no hydrogen 3.204 N/A ALA 478.A N LEU 486.A O no hydrogen 3.037 N/A ASP 480.A N LYS 484.A O no hydrogen 3.211 N/A THR 482.A N ASP 480.A OD1 no hydrogen 2.595 N/A THR 482.A OG1 ASP 480.A OD1 no hydrogen 2.515 N/A THR 482.A OG1 ASP 480.A OD2 no hydrogen 3.326 N/A GLY 483.A N ASP 480.A O no hydrogen 2.938 N/A LYS 484.A N ASP 480.A OD1 no hydrogen 3.213 N/A VAL 485.A N GLU 544.A O no hydrogen 2.840 N/A LEU 486.A N ALA 478.A O no hydrogen 2.838 N/A VAL 488.A N ASN 519.A OD1 no hydrogen 2.990 N/A ASN 492.A ND2 THR 524.A OG1 no hydrogen 2.577 N/A LYS 494.A N ALA 490.A O no hydrogen 3.068 N/A LYS 494.A NZ SER 451.A OG no hydrogen 3.418 N/A LYS 494.A NZ THR 476.A OG1 no hydrogen 3.362 N/A LYS 494.A NZ GLY 489.A O no hydrogen 2.951 N/A VAL 495.A N ILE 491.A O no hydrogen 3.023 N/A GLU 496.A N ASN 492.A O no hydrogen 3.089 N/A GLY 497.A N ALA 493.A O no hydrogen 2.862 N/A PHE 498.A N LYS 494.A O no hydrogen 3.201 N/A PHE 499.A N VAL 495.A O no hydrogen 3.023 N/A ARG 500.A N GLU 496.A O no hydrogen 3.070 N/A VAL 501.A N GLY 497.A O no hydrogen 3.353 N/A CYS 502.A N PHE 498.A O no hydrogen 2.854 N/A CYS 502.A SG PHE 498.A O no hydrogen 3.395 N/A LYS 503.A N PHE 499.A O no hydrogen 3.014 N/A ALA 504.A N ARG 500.A O no hydrogen 2.951 N/A LEU 505.A N VAL 501.A O no hydrogen 3.068 N/A GLY 506.A N LYS 503.A O no hydrogen 3.014 N/A SER 508.A N GLN 511.A OE1 no hydrogen 2.917 N/A SER 508.A OG THR 510.A OG1 no hydrogen 2.531 N/A THR 510.A N SER 508.A OG no hydrogen 2.671 N/A THR 510.A OG1 ASP 472.A OD2 no hydrogen 2.462 N/A THR 510.A OG1 SER 508.A OG no hydrogen 2.531 N/A GLN 511.A NE2 THR 360.A O no hydrogen 2.661 N/A GLY 512.A N ASP 472.A O no hydrogen 3.116 N/A VAL 513.A N HIS 539.A O no hydrogen 2.991 N/A ILE 514.A N ALA 474.A O no hydrogen 2.628 N/A LEU 515.A N TYR 541.A O no hydrogen 2.839 N/A GLU 517.A N VAL 543.A O no hydrogen 2.872 N/A ASN 519.A N PRO 516.A O no hydrogen 2.683 N/A ASN 519.A ND2 VAL 488.A O no hydrogen 2.821 N/A ASN 519.A ND2 ASN 522.A OD1 no hydrogen 2.967 N/A LEU 520.A N GLU 517.A O no hydrogen 3.066 N/A ASN 522.A N ASN 519.A O no hydrogen 2.908 N/A ASN 522.A ND2 GLU 297.A O no hydrogen 2.818 N/A LEU 523.A N LEU 520.A O no hydrogen 3.372 N/A THR 524.A N ASN 492.A OD1 no hydrogen 2.775 N/A ARG 526.A N GLU 496.A OE2 no hydrogen 2.898 N/A VAL 529.A N ARG 526.A O no hydrogen 3.132 N/A LEU 530.A N ARG 526.A O no hydrogen 3.119 N/A GLU 531.A N ALA 527.A O no hydrogen 2.659 N/A ALA 532.A N GLU 528.A O no hydrogen 3.185 N/A VAL 533.A N VAL 529.A O no hydrogen 3.015 N/A ARG 534.A N LEU 530.A O no hydrogen 2.755 N/A ALA 535.A N GLU 531.A O no hydrogen 2.815 N/A ALA 535.A N ALA 532.A O no hydrogen 3.272 N/A GLY 536.A N VAL 533.A O no hydrogen 3.212 N/A GLN 537.A N ALA 532.A O no hydrogen 2.804 N/A HIS 539.A NE2 GLY 509.A O no hydrogen 2.860 N/A TYR 541.A N VAL 513.A O no hydrogen 3.009 N/A ALA 542.A N MET 1.A O no hydrogen 3.138 N/A VAL 543.A N LEU 515.A O no hydrogen 2.774 N/A GLU 544.A N GLN 548.A OE1 no hydrogen 2.823 N/A ALA 546.A N GLY 483.A O no hydrogen 3.003 N/A GLN 548.A N THR 545.A OG1 no hydrogen 3.145 N/A ALA 549.A N THR 545.A O no hydrogen 3.305 N/A LEU 550.A N ALA 546.A O no hydrogen 2.987 N/A GLU 551.A N GLU 547.A O no hydrogen 2.957 N/A ILE 552.A N GLN 548.A O no hydrogen 3.272 N/A LEU 553.A N ALA 549.A O no hydrogen 3.099 N/A ALA 554.A N LEU 550.A O no hydrogen 2.892 N/A ALA 556.A N GLU 551.A O no hydrogen 2.973 N/A MET 558.A N GLU 551.A OE2 no hydrogen 2.962 N/A LEU 564.A N ARG 557.A O no hydrogen 2.992 N/A GLN 565.A N MET 558.A O no hydrogen 3.136 N/A GLN 565.A NE2 GLU 547.A OE2 no hydrogen 2.817 N/A ILE 568.A N LEU 564.A O no hydrogen 2.943 N/A ARG 569.A N GLN 565.A O no hydrogen 2.956 N/A ALA 570.A N GLU 566.A O no hydrogen 2.768 N/A GLY 571.A N LYS 567.A O no hydrogen 2.865 N/A LEU 572.A N ILE 568.A O no hydrogen 2.888 N/A GLU 573.A N ARG 569.A O no hydrogen 2.813 N/A ALA 574.A N ALA 570.A O no hydrogen 3.158 N/A PHE 575.A N GLY 571.A O no hydrogen 3.025 N/A ALA 576.A N LEU 572.A O no hydrogen 2.718 N/A ARG 577.A N GLU 573.A O no hydrogen 2.848 N/A LEU 578.A N ALA 574.A O no hydrogen 3.019 N/A GLU 579.A N PHE 575.A O no hydrogen 3.105 N/A GLU 580.A N ARG 577.A O no hydrogen 3.241 N/A