Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 6msk_U.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): SER 4.A OG GLY 1.A O no hydrogen 2.377 N/A LEU 5.A N ILE 2.A O no hydrogen 3.163 N/A LEU 6.A N ILE 2.A O no hydrogen 3.317 N/A ASP 7.A N SER 4.A O no hydrogen 3.346 N/A LYS 14.A NZ LEU 6.A O no hydrogen 2.673 N/A LYS 14.A NZ GLU 8.A O no hydrogen 3.062 N/A GLU 15.A N PRO 11.A O no hydrogen 3.336 N/A ALA 17.A N LEU 13.A O no hydrogen 2.918 N/A LEU 18.A N LYS 14.A O no hydrogen 2.719 N/A HIS 19.A N GLU 15.A O no hydrogen 3.172 N/A LEU 21.A N LEU 18.A O no hydrogen 2.985 N/A VAL 24.A N LEU 21.A O no hydrogen 3.362 N/A ASP 27.A N VAL 24.A O no hydrogen 3.416 N/A PHE 28.A N VAL 24.A O no hydrogen 3.069 N/A SER 33.A N ALA 30.A O no hydrogen 3.386 N/A SER 35.A OG SER 35.A O no hydrogen 2.486 N/A LYS 38.A NZ ASP 7.A OD1 no hydrogen 2.701 N/A ILE 39.A N VAL 36.A O no hydrogen 3.110 N/A GLU 40.A N VAL 36.A O no hydrogen 2.997 N/A VAL 41.A N ASP 37.A O no hydrogen 2.984 N/A LEU 42.A N LYS 38.A O no hydrogen 2.852 N/A TYR 43.A N ILE 39.A O no hydrogen 2.588 N/A GLU 44.A N VAL 41.A O no hydrogen 2.470 N/A GLY 47.A N ASP 45.A OD1 no hydrogen 2.829 N/A ALA 54.A N SER 50.A O no hydrogen 3.282 N/A ALA 55.A N ARG 51.A O no hydrogen 3.323 N/A LEU 56.A N GLN 52.A O no hydrogen 3.339 N/A LEU 56.A N PHE 53.A O no hydrogen 2.938 N/A VAL 57.A N PHE 53.A O no hydrogen 3.147 N/A ALA 58.A N ALA 54.A O no hydrogen 3.122 N/A SER 59.A N ALA 55.A O no hydrogen 3.161 N/A SER 59.A OG ALA 55.A O no hydrogen 2.792 N/A SER 59.A OG SER 71.A O no hydrogen 3.066 N/A LYS 60.A N LEU 56.A O no hydrogen 2.866 N/A VAL 61.A N VAL 57.A O no hydrogen 3.157 N/A VAL 61.A N ALA 58.A O no hydrogen 3.222 N/A PHE 62.A N ALA 58.A O no hydrogen 2.987 N/A TYR 63.A N SER 59.A O no hydrogen 3.336 N/A TYR 63.A OH THR 93.A OG1 no hydrogen 3.421 N/A HIS 64.A N VAL 61.A O no hydrogen 3.203 N/A LEU 65.A N VAL 61.A O no hydrogen 3.165 N/A GLU 69.A N GLU 69.A OE1 no hydrogen 2.863 N/A SER 71.A N ALA 67.A O no hydrogen 3.347 N/A SER 71.A OG SER 59.A O no hydrogen 2.758 N/A LEU 72.A N PHE 68.A O no hydrogen 2.970 N/A ASN 73.A N GLU 69.A O no hydrogen 2.704 N/A TYR 74.A N GLU 70.A O no hydrogen 3.274 N/A ALA 75.A N SER 71.A O no hydrogen 2.999 N/A LEU 76.A N LEU 72.A O no hydrogen 3.046 N/A GLY 77.A N ASN 73.A O no hydrogen 3.353 N/A ALA 78.A N ALA 75.A O no hydrogen 3.407 N/A VAL 84.A N ASP 80.A O no hydrogen 3.162 N/A ASN 85.A N PHE 82.A O no hydrogen 3.063 N/A GLU 89.A N GLU 89.A OE1 no hydrogen 2.877 N/A TYR 90.A N SER 88.A OG no hydrogen 2.924 N/A THR 93.A N TYR 90.A O no hydrogen 3.319 N/A THR 93.A OG1 TYR 63.A OH no hydrogen 3.421 N/A THR 93.A OG1 GLU 89.A O no hydrogen 3.356 N/A THR 93.A OG1 TYR 90.A O no hydrogen 2.768 N/A ILE 95.A N VAL 91.A O no hydrogen 3.257 N/A LYS 97.A N THR 93.A O no hydrogen 3.454 N/A ILE 99.A N ILE 95.A O no hydrogen 2.930 N/A ASP 100.A N ALA 96.A O no hydrogen 2.979 N/A HIS 101.A N LYS 97.A O no hydrogen 2.671 N/A TYR 102.A N CYS 98.A O no hydrogen 2.931 N/A THR 103.A N ILE 99.A O no hydrogen 2.741 N/A THR 103.A OG1 GLU 150.A O no hydrogen 3.101 N/A LYS 104.A N ASP 100.A O no hydrogen 3.364 N/A GLN 105.A N TYR 102.A O no hydrogen 3.148 N/A CYS 106.A N TYR 102.A O no hydrogen 3.109 N/A CYS 106.A SG TYR 102.A O no hydrogen 3.722 N/A CYS 106.A SG THR 151.A O no hydrogen 4.015 N/A ASN 109.A N GLN 105.A O no hydrogen 2.702 N/A ALA 110.A N CYS 106.A O no hydrogen 2.671 N/A ASP 111.A N GLU 108.A O no hydrogen 3.243 N/A GLY 115.A N PRO 113.A O no hydrogen 2.842 N/A GLN 122.A N ASP 121.A OD1 no hydrogen 2.648 N/A ARG 123.A NH2 ALA 75.A O no hydrogen 3.029 N/A ARG 123.A NH2 LEU 76.A O no hydrogen 2.547 N/A GLY 126.A N GLN 122.A O no hydrogen 3.198 N/A ILE 127.A N ARG 123.A O no hydrogen 2.964 N/A VAL 128.A N GLU 125.A O no hydrogen 3.216 N/A ASN 129.A N GLU 125.A O no hydrogen 3.267 N/A MET 131.A N ILE 127.A O no hydrogen 2.835 N/A PHE 132.A N VAL 128.A O no hydrogen 2.794 N/A GLN 133.A N ASN 129.A O no hydrogen 2.649 N/A ARG 134.A N LYS 130.A O no hydrogen 2.859 N/A ARG 134.A NH1 ASP 86.A OD2 no hydrogen 2.718 N/A CYS 135.A N MET 131.A O no hydrogen 2.794 N/A CYS 135.A SG MET 131.A O no hydrogen 3.289 N/A CYS 135.A SG LYS 140.A O no hydrogen 3.314 N/A LEU 136.A N PHE 132.A O no hydrogen 2.582 N/A ASP 137.A N GLN 133.A O no hydrogen 3.045 N/A HIS 139.A N CYS 135.A O no hydrogen 3.059 N/A ILE 145.A N TYR 141.A O no hydrogen 3.296 N/A GLY 146.A N GLN 143.A O no hydrogen 3.266 N/A ALA 148.A N ALA 144.A O no hydrogen 3.309 N/A LEU 149.A N ILE 145.A O no hydrogen 3.096 N/A GLU 150.A N GLY 146.A O no hydrogen 3.207 N/A THR 151.A N ILE 147.A O no hydrogen 2.586 N/A ARG 152.A NH1 LEU 149.A O no hydrogen 3.012 N/A GLU 158.A N LEU 154.A O no hydrogen 2.927 N/A LYS 159.A N ASP 155.A O no hydrogen 2.685 N/A THR 160.A N VAL 156.A O no hydrogen 2.933 N/A THR 160.A OG1 VAL 156.A O no hydrogen 2.642 N/A THR 160.A OG1 PHE 157.A O no hydrogen 3.248 N/A LEU 162.A N GLU 158.A O no hydrogen 2.867 N/A ALA 172.A N PRO 168.A O no hydrogen 3.005 N/A TYR 173.A N GLY 169.A O no hydrogen 2.882 N/A SER 174.A N MET 170.A O no hydrogen 2.933 N/A SER 174.A OG LEU 171.A O no hydrogen 2.540 N/A LEU 175.A N LEU 171.A O no hydrogen 2.892 N/A LYS 176.A N ALA 172.A O no hydrogen 3.004 N/A LEU 177.A N TYR 173.A O no hydrogen 3.441 N/A CYS 178.A N LEU 175.A O no hydrogen 3.011 N/A CYS 178.A SG SER 174.A O no hydrogen 3.969 N/A MET 179.A N LYS 176.A O no hydrogen 2.249 N/A SER 180.A N LYS 176.A O no hydrogen 3.143 N/A LEU 181.A N LEU 177.A O no hydrogen 3.202 N/A GLN 186.A N ASN 184.A OD1 no hydrogen 2.932 N/A VAL 191.A N PHE 187.A O no hydrogen 3.152 N/A LEU 192.A N ARG 188.A O no hydrogen 2.771 N/A ARG 193.A N ASN 189.A O no hydrogen 2.620 N/A VAL 194.A N LYS 190.A O no hydrogen 3.066 N/A LEU 195.A N VAL 191.A O no hydrogen 3.285 N/A LYS 197.A NZ ARG 193.A O no hydrogen 2.992 N/A TYR 199.A N LEU 195.A O no hydrogen 3.082 N/A MET 200.A N VAL 196.A O no hydrogen 3.197 N/A ASN 201.A N LYS 197.A O no hydrogen 3.032 N/A LEU 202.A N TYR 199.A O no hydrogen 2.973 N/A PHE 207.A N ASP 206.A OD1 no hydrogen 2.703 N/A VAL 210.A N ASN 209.A OD1 no hydrogen 2.568 N/A CYS 211.A N PHE 207.A O no hydrogen 3.070 N/A CYS 211.A SG ASP 245.A OD2 no hydrogen 3.220 N/A CYS 211.A SG THR 697.A OG1 no hydrogen 2.703 N/A GLN 212.A N ILE 208.A O no hydrogen 2.939 N/A GLN 212.A N ASN 209.A O no hydrogen 2.952 N/A GLN 212.A NE2 LEU 175.A O no hydrogen 3.518 N/A CYS 213.A N ASN 209.A O no hydrogen 2.497 N/A CYS 213.A SG ASN 209.A O no hydrogen 3.221 N/A PHE 216.A N CYS 213.A O no hydrogen 2.834 N/A GLN 221.A N GLN 221.A OE1 no hydrogen 2.749 N/A ALA 222.A N ASP 219.A O no hydrogen 3.341 N/A SER 224.A N PRO 220.A O no hydrogen 3.334 N/A SER 224.A OG PRO 220.A O no hydrogen 3.432 N/A SER 224.A OG GLN 221.A O no hydrogen 2.829 N/A ASP 225.A N GLN 221.A O no hydrogen 3.028 N/A ILE 226.A N ALA 222.A O no hydrogen 3.114 N/A LEU 227.A N VAL 223.A O no hydrogen 3.042 N/A GLU 228.A N SER 224.A O no hydrogen 3.412 N/A LYS 229.A N ASP 225.A O no hydrogen 2.906 N/A LEU 230.A N ILE 226.A O no hydrogen 3.163 N/A VAL 231.A N LEU 227.A O no hydrogen 2.721 N/A LYS 232.A N GLU 228.A O no hydrogen 2.860 N/A GLU 233.A N LYS 229.A O no hydrogen 3.052 N/A ASP 234.A N VAL 231.A O no hydrogen 2.975 N/A ASN 235.A N LEU 230.A O no hydrogen 2.772 N/A GLN 241.A NE2 ILE 856.A O no hydrogen 3.526 N/A ILE 242.A N MET 238.A O no hydrogen 3.117 N/A CYS 243.A N ALA 239.A O no hydrogen 3.400 N/A CYS 243.A SG ALA 239.A O no hydrogen 3.285 N/A ASP 245.A N GLN 241.A O no hydrogen 3.101 N/A LEU 246.A N ILE 242.A O no hydrogen 2.821 N/A TYR 247.A N CYS 243.A O no hydrogen 2.884 N/A GLU 248.A N PHE 244.A O no hydrogen 3.183 N/A SER 249.A N ASP 245.A O no hydrogen 2.985 N/A ALA 250.A N LEU 246.A O no hydrogen 3.063 N/A SER 251.A OG GLN 252.A O no hydrogen 3.342 N/A SER 257.A N GLN 253.A O no hydrogen 3.213 N/A SER 257.A OG GLN 253.A O no hydrogen 3.346 N/A SER 257.A OG PHE 254.A O no hydrogen 2.705 N/A VAL 258.A N PHE 254.A O no hydrogen 2.990 N/A ILE 259.A N LEU 255.A O no hydrogen 3.244 N/A THR 264.A OG1 GLN 260.A O no hydrogen 2.811 N/A GLN 266.A N GLN 266.A OE1 no hydrogen 2.705 N/A LYS 269.A N ASP 265.A O no hydrogen 2.825 N/A MET 270.A N GLN 266.A O no hydrogen 3.212 N/A ILE 271.A N THR 267.A O no hydrogen 2.951 N/A LYS 272.A N LEU 268.A O no hydrogen 3.308 N/A ILE 273.A N LYS 269.A O no hydrogen 3.275 N/A LEU 274.A N MET 270.A O no hydrogen 3.423 N/A SER 275.A N ILE 271.A O no hydrogen 3.060 N/A SER 275.A OG ILE 271.A O no hydrogen 3.112 N/A SER 275.A OG LYS 272.A O no hydrogen 2.603 N/A GLY 276.A N LYS 272.A O no hydrogen 3.045 N/A ILE 280.A N GLU 277.A O no hydrogen 3.007 N/A GLU 281.A N GLU 277.A O no hydrogen 3.480 N/A LEU 282.A N MET 278.A O no hydrogen 3.383 N/A HIS 283.A N ALA 279.A O no hydrogen 3.171 N/A LEU 284.A N ILE 280.A O no hydrogen 2.556 N/A GLN 285.A N GLU 281.A O no hydrogen 2.697 N/A PHE 286.A N LEU 282.A O no hydrogen 3.064 N/A LEU 287.A N HIS 283.A O no hydrogen 3.291 N/A ILE 288.A N LEU 284.A O no hydrogen 3.185 N/A ARG 289.A N GLN 285.A O no hydrogen 2.950 N/A ARG 289.A NE GLN 285.A OE1 no hydrogen 3.485 N/A ASN 292.A N ASN 290.A O no hydrogen 3.091 N/A THR 293.A OG1 ASN 291.A OD1 no hydrogen 3.489 N/A MET 296.A N ASP 294.A OD1 no hydrogen 3.406 N/A LYS 299.A N LEU 295.A O no hydrogen 3.142 N/A ASN 300.A N MET 296.A O no hydrogen 2.543 N/A THR 301.A N ILE 297.A O no hydrogen 2.913 N/A THR 301.A OG1 ILE 297.A O no hydrogen 3.193 N/A THR 301.A OG1 LEU 298.A O no hydrogen 3.171 N/A LYS 302.A N LYS 299.A O no hydrogen 3.092 N/A ASP 303.A N LYS 299.A O no hydrogen 3.271 N/A VAL 305.A N LYS 302.A O no hydrogen 3.118 N/A CYS 310.A N SER 308.A OG no hydrogen 3.291 N/A THR 312.A OG1 VAL 309.A O no hydrogen 2.984 N/A THR 314.A N CYS 310.A O no hydrogen 2.859 N/A THR 314.A OG1 CYS 310.A O no hydrogen 3.284 N/A THR 314.A OG1 HIS 311.A O no hydrogen 2.691 N/A VAL 315.A N HIS 311.A O no hydrogen 3.058 N/A ILE 316.A N THR 312.A O no hydrogen 3.102 N/A ALA 317.A N THR 314.A O no hydrogen 2.975 N/A ASN 318.A N THR 314.A O no hydrogen 3.031 N/A SER 319.A OG VAL 315.A O no hydrogen 3.277 N/A SER 319.A OG ILE 316.A O no hydrogen 3.009 N/A PHE 320.A N ILE 316.A O no hydrogen 3.295 N/A MET 321.A N ALA 317.A O no hydrogen 3.215 N/A CYS 323.A N PHE 320.A O no hydrogen 3.362 N/A CYS 323.A SG VAL 355.A O no hydrogen 3.642 N/A GLY 324.A N VAL 355.A O no hydrogen 3.291 N/A THR 325.A N HIS 322.A O no hydrogen 3.151 N/A THR 326.A N ILE 356.A O no hydrogen 2.816 N/A THR 326.A OG1 THR 325.A O no hydrogen 2.553 N/A SER 327.A OG HIS 322.A ND1 no hydrogen 3.282 N/A ARG 332.A N GLN 329.A O no hydrogen 3.077 N/A ARG 332.A NH1 LEU 331.A O no hydrogen 3.138 N/A ASP 333.A N GLN 329.A O no hydrogen 2.736 N/A GLU 336.A N GLU 336.A OE1 no hydrogen 2.811 N/A ALA 339.A N LEU 335.A O no hydrogen 2.673 N/A ARG 340.A N TRP 337.A O no hydrogen 3.361 N/A THR 348.A N TRP 344.A O no hydrogen 2.962 N/A THR 348.A OG1 TRP 344.A O no hydrogen 2.910 N/A ALA 349.A N ALA 345.A O no hydrogen 2.675 N/A THR 350.A N LYS 346.A O no hydrogen 3.310 N/A THR 350.A OG1 GLN 383.A OE1 no hydrogen 2.746 N/A SER 352.A N THR 348.A O no hydrogen 2.921 N/A SER 352.A OG VAL 315.A O no hydrogen 2.739 N/A SER 352.A OG THR 348.A O no hydrogen 3.017 N/A LEU 353.A N ALA 349.A O no hydrogen 3.117 N/A GLY 354.A N ALA 351.A O no hydrogen 3.173 N/A VAL 355.A N SER 352.A O no hydrogen 3.246 N/A ILE 356.A N SER 352.A O no hydrogen 3.318 N/A HIS 357.A ND1 LEU 353.A O no hydrogen 2.957 N/A LYS 358.A NZ SER 725.A O no hydrogen 3.216 N/A ALA 364.A N HIS 360.A O no hydrogen 2.775 N/A LEU 365.A N LYS 362.A O no hydrogen 3.290 N/A LEU 367.A N GLU 363.A O no hydrogen 2.870 N/A MET 368.A N ALA 364.A O no hydrogen 3.341 N/A ALA 369.A N LEU 365.A O no hydrogen 2.715 N/A THR 370.A N LEU 367.A O no hydrogen 3.380 N/A THR 370.A OG1 GLN 366.A O no hydrogen 2.827 N/A TYR 371.A N LEU 367.A O no hydrogen 3.326 N/A GLY 385.A N ALA 381.A O no hydrogen 2.790 N/A GLY 386.A N TYR 382.A O no hydrogen 3.147 N/A GLY 387.A N GLN 383.A O no hydrogen 2.796 N/A LEU 388.A N GLU 384.A O no hydrogen 3.479 N/A TYR 389.A N GLY 385.A O no hydrogen 3.171 N/A ALA 390.A N GLY 386.A O no hydrogen 2.954 N/A LEU 391.A N GLY 387.A O no hydrogen 3.106 N/A GLY 392.A N LEU 388.A O no hydrogen 3.380 N/A LEU 393.A N TYR 389.A O no hydrogen 3.157 N/A ILE 394.A N ALA 390.A O no hydrogen 3.092 N/A HIS 395.A N LEU 391.A O no hydrogen 3.171 N/A HIS 395.A NE2 GLU 361.A O no hydrogen 2.775 N/A HIS 398.A ND1 ALA 396.A O no hydrogen 2.587 N/A TYR 405.A N ASP 401.A O no hydrogen 2.464 N/A LEU 406.A N ILE 402.A O no hydrogen 2.953 N/A LEU 407.A N ILE 403.A O no hydrogen 2.858 N/A ASN 408.A N ASP 404.A O no hydrogen 3.089 N/A GLN 409.A NE2 TYR 405.A OH no hydrogen 3.089 N/A LEU 410.A N LEU 406.A O no hydrogen 3.225 N/A LYS 411.A N LEU 407.A O no hydrogen 3.271 N/A ASN 415.A N SER 414.A OG no hydrogen 2.595 N/A ARG 419.A NE ASN 445.A OD1 no hydrogen 3.067 N/A GLY 422.A N VAL 418.A O no hydrogen 3.148 N/A SER 423.A N ARG 419.A O no hydrogen 3.207 N/A SER 423.A OG ARG 419.A O no hydrogen 2.699 N/A SER 423.A OG HIS 420.A O no hydrogen 3.085 N/A SER 423.A OG ALA 456.A O no hydrogen 3.338 N/A LEU 424.A N HIS 420.A O no hydrogen 2.795 N/A GLY 425.A N GLY 421.A O no hydrogen 3.031 N/A LEU 426.A N GLY 422.A O no hydrogen 2.926 N/A GLY 427.A N SER 423.A O no hydrogen 2.806 N/A LEU 428.A N LEU 424.A O no hydrogen 3.128 N/A ALA 429.A N GLY 425.A O no hydrogen 3.108 N/A ALA 430.A N LEU 426.A O no hydrogen 3.078 N/A GLY 432.A N LEU 463.A O no hydrogen 2.690 N/A THR 433.A OG1 ALA 430.A O no hydrogen 3.154 N/A ALA 434.A N VAL 464.A O no hydrogen 3.046 N/A ARG 435.A N THR 433.A OG1 no hydrogen 3.166 N/A TYR 439.A N ARG 435.A O no hydrogen 3.216 N/A ASP 440.A N GLN 436.A O no hydrogen 2.824 N/A LEU 441.A N ASP 437.A O no hydrogen 3.405 N/A LEU 442.A N VAL 438.A O no hydrogen 3.272 N/A LYS 443.A N TYR 439.A O no hydrogen 3.315 N/A LYS 443.A N ASP 440.A O no hydrogen 3.067 N/A LYS 443.A NZ TYR 439.A O no hydrogen 3.447 N/A LYS 443.A NZ ASP 440.A OD1 no hydrogen 2.654 N/A THR 444.A N ASP 440.A O no hydrogen 3.237 N/A ASN 445.A N LEU 441.A O no hydrogen 3.022 N/A LEU 446.A N LEU 442.A O no hydrogen 3.013 N/A TYR 447.A N LYS 443.A O no hydrogen 2.872 N/A GLN 448.A N ASN 445.A O no hydrogen 3.390 N/A GLN 448.A NE2 THR 444.A O no hydrogen 2.972 N/A ALA 457.A N THR 453.A O no hydrogen 2.699 N/A GLY 458.A N GLY 454.A O no hydrogen 3.216 N/A LEU 459.A N GLU 455.A O no hydrogen 3.480 N/A LEU 461.A N ALA 457.A O no hydrogen 3.117 N/A LEU 463.A N LEU 459.A O no hydrogen 3.243 N/A VAL 464.A N ALA 460.A O no hydrogen 3.257 N/A MET 465.A N GLY 462.A O no hydrogen 3.008 N/A SER 468.A N VAL 500.A O no hydrogen 2.933 N/A SER 468.A OG MET 465.A O no hydrogen 2.949 N/A LYS 469.A NZ GLU 507.A O no hydrogen 3.139 N/A ALA 471.A N ASN 470.A OD1 no hydrogen 2.643 N/A ASP 476.A N GLN 472.A O no hydrogen 3.018 N/A MET 477.A N ALA 473.A O no hydrogen 3.278 N/A VAL 478.A N ILE 474.A O no hydrogen 2.808 N/A GLY 479.A N GLU 475.A O no hydrogen 2.925 N/A TYR 480.A N ASP 476.A O no hydrogen 3.002 N/A GLN 482.A NE2 VAL 478.A O no hydrogen 2.710 N/A GLU 483.A N GLU 483.A OE1 no hydrogen 2.649 N/A GLN 485.A NE2 HIS 486.A NE2 no hydrogen 3.056 N/A LEU 490.A N GLU 487.A O no hydrogen 3.051 N/A ARG 491.A N GLU 487.A O no hydrogen 2.934 N/A GLY 492.A N LYS 488.A O no hydrogen 3.231 N/A GLY 496.A N GLY 492.A O no hydrogen 3.252 N/A ILE 497.A N LEU 493.A O no hydrogen 3.173 N/A LEU 499.A N GLY 496.A O no hydrogen 3.227 N/A GLY 503.A N MET 533.A O no hydrogen 3.006 N/A ILE 512.A N ALA 508.A O no hydrogen 2.709 N/A GLU 513.A N ASP 509.A O no hydrogen 3.076 N/A SER 514.A N ALA 510.A O no hydrogen 3.133 N/A LEU 515.A N LEU 511.A O no hydrogen 3.096 N/A ARG 517.A N GLU 513.A O no hydrogen 3.398 N/A ARG 517.A NE GLU 513.A OE2 no hydrogen 2.449 N/A ARG 517.A NH2 GLU 513.A OE2 no hydrogen 3.166 N/A LYS 519.A N ASP 518.A OD1 no hydrogen 2.628 N/A ARG 524.A N ASP 520.A O no hydrogen 2.967 N/A ARG 524.A NE ASP 520.A O no hydrogen 3.443 N/A ARG 525.A N PRO 521.A O no hydrogen 3.103 N/A ARG 525.A NH2 GLN 713.A OE1 no hydrogen 3.378 N/A SER 526.A N ILE 522.A O no hydrogen 2.714 N/A SER 526.A OG ALA 494.A O no hydrogen 2.732 N/A GLY 527.A N LEU 523.A O no hydrogen 2.973 N/A MET 528.A N ARG 524.A O no hydrogen 3.314 N/A MET 528.A N ARG 525.A O no hydrogen 3.158 N/A TYR 529.A N ARG 525.A O no hydrogen 3.338 N/A TYR 529.A OH GLU 565.A OE1 no hydrogen 3.403 N/A THR 530.A N SER 526.A O no hydrogen 3.112 N/A THR 530.A OG1 SER 526.A O no hydrogen 2.576 N/A VAL 531.A N GLY 527.A O no hydrogen 2.917 N/A MET 533.A N TYR 529.A O no hydrogen 3.180 N/A ALA 534.A N THR 530.A O no hydrogen 3.034 N/A TYR 535.A N ALA 532.A O no hydrogen 3.420 N/A CYS 536.A SG ALA 532.A O no hydrogen 3.593 N/A CYS 536.A SG MET 533.A O no hydrogen 3.293 N/A GLY 537.A N PHE 569.A O no hydrogen 2.999 N/A ASN 540.A N SER 538.A O no hydrogen 2.881 N/A ILE 544.A N ASN 540.A O no hydrogen 3.108 N/A ARG 545.A N ASN 541.A O no hydrogen 3.039 N/A ARG 546.A N LYS 542.A O no hydrogen 3.143 N/A LEU 547.A N ALA 543.A O no hydrogen 2.792 N/A HIS 549.A N ARG 545.A O no hydrogen 3.052 N/A HIS 549.A N ARG 546.A O no hydrogen 3.235 N/A VAL 550.A N ARG 546.A O no hydrogen 3.306 N/A ALA 551.A N LEU 547.A O no hydrogen 3.192 N/A VAL 552.A N HIS 549.A O no hydrogen 3.253 N/A SER 553.A N HIS 549.A O no hydrogen 3.298 N/A SER 553.A OG HIS 549.A O no hydrogen 3.278 N/A VAL 555.A N ASP 554.A OD1 no hydrogen 2.648 N/A ARG 560.A N ASN 556.A O no hydrogen 3.410 N/A ARG 560.A NH1 VAL 552.A O no hydrogen 2.435 N/A ARG 560.A NH1 ASP 554.A O no hydrogen 2.665 N/A ARG 560.A NH2 VAL 552.A O no hydrogen 3.377 N/A ARG 561.A N ASP 557.A O no hydrogen 3.045 N/A ARG 561.A NE ASP 558.A OD1 no hydrogen 3.343 N/A ARG 561.A NH1 ASP 558.A OD1 no hydrogen 3.062 N/A ALA 562.A N ASP 558.A O no hydrogen 3.352 N/A ALA 563.A N VAL 559.A O no hydrogen 3.089 N/A VAL 564.A N ARG 560.A O no hydrogen 3.296 N/A GLU 565.A N ARG 561.A O no hydrogen 2.577 N/A SER 566.A N ALA 563.A O no hydrogen 3.008 N/A SER 566.A OG MET 528.A O no hydrogen 3.239 N/A SER 566.A OG ALA 562.A O no hydrogen 2.584 N/A ILE 570.A N LEU 567.A O no hydrogen 3.390 N/A CYS 578.A SG LEU 571.A O no hydrogen 3.619 N/A SER 580.A N GLN 577.A O no hydrogen 3.064 N/A SER 580.A OG GLN 577.A O no hydrogen 2.443 N/A VAL 581.A N GLN 577.A O no hydrogen 3.156 N/A VAL 582.A N CYS 578.A O no hydrogen 3.227 N/A SER 586.A OG VAL 582.A O no hydrogen 3.519 N/A SER 586.A OG SER 583.A O no hydrogen 3.120 N/A GLU 587.A N LEU 584.A O no hydrogen 3.062 N/A SER 588.A OG ASN 590.A O no hydrogen 3.113 N/A SER 588.A OG ASN 590.A OD1 no hydrogen 3.144 N/A ARG 594.A NH1 SER 588.A O no hydrogen 2.463 N/A ARG 594.A NH2 TYR 589.A O no hydrogen 3.472 N/A TYR 595.A N PRO 591.A O no hydrogen 2.667 N/A GLY 596.A N HIS 592.A O no hydrogen 3.223 N/A ALA 597.A N VAL 593.A O no hydrogen 2.913 N/A ALA 598.A N ARG 594.A O no hydrogen 3.202 N/A ALA 598.A N TYR 595.A O no hydrogen 2.974 N/A MET 599.A N TYR 595.A O no hydrogen 3.185 N/A ALA 600.A N GLY 596.A O no hydrogen 3.092 N/A LEU 601.A N ALA 597.A O no hydrogen 3.312 N/A ILE 603.A N MET 599.A O no hydrogen 3.036 N/A CYS 604.A N ALA 600.A O no hydrogen 3.157 N/A CYS 604.A SG LEU 571.A O no hydrogen 3.233 N/A CYS 605.A SG PRO 575.A O no hydrogen 3.616 N/A ASN 615.A N LYS 611.A O no hydrogen 3.272 N/A LEU 616.A N GLU 612.A O no hydrogen 3.099 N/A LEU 617.A N ALA 613.A O no hydrogen 2.850 N/A THR 621.A N LEU 617.A O no hydrogen 3.015 N/A ASN 622.A N PRO 619.A O no hydrogen 3.145 N/A VAL 625.A N ASP 623.A OD2 no hydrogen 2.784 N/A ASN 626.A ND2 ASP 668.A OD2 no hydrogen 2.667 N/A ARG 629.A NH1 ASP 623.A O no hydrogen 2.401 N/A ARG 629.A NH1 PRO 624.A O no hydrogen 3.046 N/A GLN 630.A N ASN 626.A O no hydrogen 3.110 N/A GLY 631.A N TYR 627.A O no hydrogen 3.087 N/A ALA 632.A N VAL 628.A O no hydrogen 3.134 N/A LEU 633.A N ARG 629.A O no hydrogen 2.977 N/A ILE 634.A N GLN 630.A O no hydrogen 3.101 N/A ALA 635.A N GLY 631.A O no hydrogen 2.996 N/A SER 636.A N ALA 632.A O no hydrogen 2.994 N/A SER 636.A OG TYR 658.A OH no hydrogen 3.128 N/A ALA 637.A N LEU 633.A O no hydrogen 3.018 N/A LEU 638.A N ILE 634.A O no hydrogen 2.847 N/A ILE 639.A N ALA 635.A O no hydrogen 3.192 N/A GLN 643.A NE2 GLY 607.A O no hydrogen 2.554 N/A THR 647.A N THR 644.A O no hydrogen 3.176 N/A THR 647.A OG1 THR 644.A O no hydrogen 2.380 N/A CYS 648.A N THR 644.A O no hydrogen 3.316 N/A CYS 648.A SG GLN 643.A OE1 no hydrogen 3.275 N/A ASN 652.A N GLU 645.A OE1 no hydrogen 2.895 N/A PHE 654.A N VAL 651.A O no hydrogen 3.129 N/A ARG 655.A N VAL 651.A O no hydrogen 3.107 N/A GLN 656.A N ASN 652.A O no hydrogen 3.475 N/A LEU 657.A N GLN 653.A O no hydrogen 3.283 N/A TYR 658.A N PHE 654.A O no hydrogen 2.672 N/A TYR 658.A OH LEU 633.A O no hydrogen 3.010 N/A SER 659.A N ARG 655.A O no hydrogen 2.913 N/A SER 659.A OG ARG 655.A O no hydrogen 2.782 N/A LYS 660.A N GLN 656.A O no hydrogen 2.798 N/A VAL 661.A N LEU 657.A O no hydrogen 3.257 N/A ILE 662.A N TYR 658.A O no hydrogen 3.109 N/A ASN 663.A N SER 659.A O no hydrogen 3.302 N/A LYS 665.A N ASP 664.A OD1 no hydrogen 2.664 N/A HIS 666.A N ASP 664.A OD1 no hydrogen 3.434 N/A LYS 672.A N ASP 668.A O no hydrogen 2.987 N/A PHE 673.A N VAL 669.A O no hydrogen 2.803 N/A ALA 675.A N LYS 672.A O no hydrogen 3.212 N/A ILE 676.A N LYS 672.A O no hydrogen 3.261 N/A LEU 677.A N PHE 673.A O no hydrogen 3.227 N/A ALA 678.A N GLY 674.A O no hydrogen 2.945 N/A GLN 679.A N ALA 675.A O no hydrogen 3.115 N/A GLY 680.A N ILE 676.A O no hydrogen 3.365 N/A ILE 681.A N LEU 677.A O no hydrogen 3.027 N/A LEU 682.A N ALA 678.A O no hydrogen 3.204 N/A ALA 684.A N ILE 681.A O no hydrogen 3.200 N/A GLY 685.A N PHE 320.A O no hydrogen 3.316 N/A ASN 688.A ND2 ASN 290.A O no hydrogen 2.822 N/A ASN 688.A ND2 GLY 685.A O no hydrogen 3.255 N/A THR 690.A N THR 729.A O no hydrogen 2.727 N/A THR 690.A OG1 ILE 691.A O no hydrogen 3.417 N/A SER 692.A OG GLN 694.A O no hydrogen 3.166 N/A SER 692.A OG THR 729.A OG1 no hydrogen 3.233 N/A GLN 694.A NE2 GLY 698.A O no hydrogen 2.835 N/A SER 695.A N HIS 699.A O no hydrogen 2.927 N/A SER 695.A OG HIS 699.A O no hydrogen 2.477 N/A ARG 696.A NH1 GLY 854.A O no hydrogen 2.792 N/A THR 700.A OG1 LEU 693.A O no hydrogen 2.447 N/A HIS 701.A N LEU 693.A O no hydrogen 3.099 N/A VAL 706.A N MET 702.A O no hydrogen 3.405 N/A GLY 707.A N PRO 703.A O no hydrogen 2.725 N/A VAL 708.A N VAL 705.A O no hydrogen 3.262 N/A LEU 709.A N VAL 705.A O no hydrogen 3.133 N/A VAL 710.A N VAL 706.A O no hydrogen 3.435 N/A THR 712.A N VAL 708.A O no hydrogen 3.060 N/A THR 712.A OG1 LEU 709.A O no hydrogen 2.298 N/A GLN 713.A N VAL 710.A O no hydrogen 3.035 N/A SER 721.A N PHE 718.A O no hydrogen 3.034 N/A SER 721.A OG PHE 718.A O no hydrogen 2.878 N/A PHE 723.A N LEU 720.A O no hydrogen 3.225 N/A SER 725.A N HIS 722.A O no hydrogen 3.357 N/A SER 725.A OG HIS 722.A O no hydrogen 2.964 N/A LEU 726.A N PHE 723.A O no hydrogen 3.339 N/A ALA 727.A N LEU 724.A O no hydrogen 3.006 N/A THR 729.A N THR 690.A O no hydrogen 2.786 N/A THR 729.A OG1 THR 690.A O no hydrogen 3.185 N/A THR 729.A OG1 SER 692.A OG no hydrogen 3.233 N/A THR 731.A N ASN 688.A O no hydrogen 2.926 N/A THR 731.A OG1 GLN 642.A OE1 no hydrogen 3.409 N/A THR 731.A OG1 ASN 688.A O no hydrogen 2.806 N/A VAL 733.A N ALA 827.A O no hydrogen 2.778 N/A LYS 738.A N ASN 737.A OD1 no hydrogen 2.497 N/A LYS 738.A NZ ASP 739.A OD1 no hydrogen 2.512 N/A LYS 741.A NZ GLU 867.A O no hydrogen 2.573 N/A GLN 746.A NE2 LYS 744.A O no hydrogen 3.647 N/A CYS 751.A N SER 749.A OG no hydrogen 3.202 N/A CYS 751.A SG SER 749.A OG no hydrogen 3.066 N/A TYR 758.A OH ASN 290.A O no hydrogen 3.428 N/A TYR 758.A OH ASN 290.A OD1 no hydrogen 2.378 N/A LYS 768.A NZ LYS 766.A O no hydrogen 3.315 N/A LYS 772.A N LYS 770.A O no hydrogen 2.732 N/A THR 781.A OG1 VAL 777.A O no hydrogen 3.155 N/A ALA 782.A N SER 779.A O no hydrogen 3.273 N/A ALA 784.A N THR 781.A O no hydrogen 3.200 N/A LYS 785.A N THR 781.A O no hydrogen 3.036 N/A LYS 787.A N LYS 783.A O no hydrogen 3.340 N/A LYS 789.A N LYS 785.A O no hydrogen 3.091 N/A GLU 790.A N LYS 786.A O no hydrogen 3.215 N/A LYS 791.A N LYS 787.A O no hydrogen 3.228 N/A GLU 792.A N GLU 788.A O no hydrogen 3.278 N/A LYS 793.A N GLU 790.A O no hydrogen 3.275 N/A GLU 795.A N GLU 792.A O no hydrogen 3.220 N/A GLU 796.A N GLU 792.A O no hydrogen 2.735 N/A LYS 807.A NZ GLU 808.A OE1 no hydrogen 3.267 N/A LYS 812.A N GLU 809.A O no hydrogen 3.322 N/A LYS 814.A N GLU 811.A O no hydrogen 3.450 N/A ASN 825.A ND2 PRO 743.A O no hydrogen 2.343 N/A ARG 828.A NH1 HIS 687.A O no hydrogen 3.398 N/A ARG 828.A NH2 HIS 687.A O no hydrogen 2.958 N/A VAL 829.A N THR 731.A O no hydrogen 2.872 N/A GLN 833.A N MET 830.A O no hydrogen 2.798 N/A GLU 841.A N MET 839.A O no hydrogen 2.876 N/A ARG 844.A NE SER 863.A O no hydrogen 2.945 N/A ARG 844.A NH2 GLU 864.A O no hydrogen 3.096 N/A GLN 846.A NE2 CYS 843.A O no hydrogen 3.109 N/A ILE 857.A N ILE 734.A O no hydrogen 2.896 N/A THR 862.A OG1 ARG 844.A O no hydrogen 2.356 N/A