Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 8cmj_Aa.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): THR 5.A OG1 PHE 4.A O no hydrogen 2.215 N/A MET 9.A N THR 5.A O no hydrogen 2.502 N/A ARG 10.A N VAL 6.A O no hydrogen 2.602 N/A ARG 10.A NE ARG 10.A O no hydrogen 2.759 N/A SER 11.A N ASP 7.A O no hydrogen 2.290 N/A SER 11.A OG GLN 8.A O no hydrogen 3.029 N/A LEU 12.A N GLN 8.A O no hydrogen 2.864 N/A MET 13.A N MET 9.A O no hydrogen 2.798 N/A ASP 14.A N ARG 10.A O no hydrogen 2.847 N/A ASP 14.A N SER 11.A O no hydrogen 3.041 N/A THR 17.A OG1 THR 67.A OG1 no hydrogen 2.734 N/A THR 17.A OG1 ASP 68.A OD1 no hydrogen 2.791 N/A ASN 18.A ND2 ASP 68.A O no hydrogen 3.653 N/A ASN 18.A ND2 SER 71.A O no hydrogen 2.391 N/A ARG 20.A N LEU 73.A O no hydrogen 2.328 N/A ARG 20.A NH1 SER 71.A O no hydrogen 3.491 N/A ASN 21.A ND2 GLY 425.A O no hydrogen 3.259 N/A MET 22.A N ASN 75.A O no hydrogen 2.270 N/A SER 23.A N GLY 98.A O no hydrogen 3.302 N/A SER 23.A OG THR 96.A OG1 no hydrogen 2.631 N/A SER 23.A OG GLY 98.A O no hydrogen 3.058 N/A VAL 24.A N ILE 77.A O no hydrogen 3.232 N/A ILE 25.A N LEU 100.A O no hydrogen 2.639 N/A HIS 30.A N HIS 27.A O no hydrogen 3.439 N/A HIS 30.A NE2 GLU 107.A OE1 no hydrogen 2.705 N/A LYS 32.A NZ HIS 27.A O no hydrogen 2.712 N/A SER 33.A OG ASP 78.A OD2 no hydrogen 3.514 N/A THR 36.A OG1 LYS 32.A O no hydrogen 3.241 N/A SER 38.A N THR 34.A O no hydrogen 3.029 N/A LEU 39.A N LEU 35.A O no hydrogen 2.662 N/A VAL 40.A N THR 36.A O no hydrogen 2.984 N/A GLN 41.A N SER 38.A O no hydrogen 3.356 N/A ALA 43.A N VAL 40.A O no hydrogen 3.309 N/A SER 46.A OG GLU 88.A O no hydrogen 3.556 N/A ILE 49.A N LEU 76.A O no hydrogen 2.667 N/A SER 50.A OG ASN 75.A OD1 no hydrogen 3.555 N/A LEU 51.A N ILE 74.A O no hydrogen 2.811 N/A TYR 52.A OH GLU 54.A OE2 no hydrogen 2.875 N/A SER 53.A N PHE 72.A O no hydrogen 3.454 N/A SER 56.A OG GLU 58.A OE1 no hydrogen 2.131 N/A GLU 58.A N GLU 58.A OE1 no hydrogen 2.857 N/A VAL 60.A N SER 56.A O no hydrogen 3.269 N/A LYS 61.A N ASP 57.A O no hydrogen 2.856 N/A THR 67.A OG1 THR 17.A O no hydrogen 2.627 N/A THR 67.A OG1 THR 17.A OG1 no hydrogen 2.734 N/A ASP 68.A N THR 17.A OG1 no hydrogen 3.324 N/A ASN 70.A ND2 MET 55.A O no hydrogen 3.019 N/A ILE 74.A N LEU 51.A O no hydrogen 2.744 N/A ASN 75.A N ARG 20.A O no hydrogen 2.692 N/A ASN 75.A ND2 ASN 21.A OD1 no hydrogen 3.111 N/A LEU 76.A N ILE 49.A O no hydrogen 3.090 N/A ILE 77.A N MET 22.A O no hydrogen 3.255 N/A SER 79.A OG PRO 80.A O no hydrogen 3.404 N/A PHE 85.A N HIS 82.A O no hydrogen 2.931 N/A THR 90.A OG1 LYS 456.A O no hydrogen 3.479 N/A ALA 91.A N SER 87.A O no hydrogen 3.417 N/A ALA 92.A N GLU 88.A O no hydrogen 3.407 N/A LEU 93.A N VAL 89.A O no hydrogen 2.364 N/A THR 96.A N LEU 93.A O no hydrogen 3.422 N/A THR 96.A OG1 SER 23.A OG no hydrogen 2.631 N/A THR 96.A OG1 LEU 93.A O no hydrogen 3.393 N/A THR 96.A OG1 GLY 98.A O no hydrogen 3.444 N/A ALA 99.A N LYS 126.A O no hydrogen 3.258 N/A LEU 100.A N SER 23.A O no hydrogen 2.638 N/A VAL 101.A N VAL 128.A O no hydrogen 3.242 N/A VAL 102.A N ILE 25.A O no hydrogen 2.843 N/A VAL 103.A N VAL 130.A O no hydrogen 3.110 N/A ASP 104.A N HIS 30.A ND1 no hydrogen 3.329 N/A ILE 106.A N ASP 104.A OD1 no hydrogen 3.360 N/A GLY 108.A N ASP 104.A O no hydrogen 2.924 N/A CYS 110.A SG GLU 107.A O no hydrogen 3.745 N/A CYS 110.A SG GLU 107.A OE1 no hydrogen 3.917 N/A CYS 110.A SG GLY 108.A O no hydrogen 3.506 N/A GLN 112.A NE2 ALA 26.A O no hydrogen 3.472 N/A THR 113.A OG1 CYS 110.A O no hydrogen 2.310 N/A GLU 114.A N CYS 110.A O no hydrogen 3.244 N/A THR 115.A N VAL 111.A O no hydrogen 3.331 N/A THR 115.A OG1 GLN 112.A O no hydrogen 2.535 N/A VAL 116.A N GLN 112.A O no hydrogen 3.244 N/A LEU 117.A N THR 113.A O no hydrogen 3.205 N/A ARG 118.A N GLU 114.A O no hydrogen 2.797 N/A ARG 118.A NH2 TYR 166.A OH no hydrogen 3.242 N/A GLN 119.A N THR 115.A O no hydrogen 2.820 N/A ALA 120.A N VAL 116.A O no hydrogen 2.656 N/A LEU 121.A N LEU 117.A O no hydrogen 3.051 N/A GLY 122.A N ARG 118.A O no hydrogen 2.888 N/A GLY 122.A N GLN 119.A O no hydrogen 3.137 N/A GLU 123.A N ALA 120.A O no hydrogen 3.109 N/A ARG 124.A N LEU 121.A O no hydrogen 3.120 N/A ARG 124.A NH1 TYR 325.A O no hydrogen 2.667 N/A ARG 124.A NH1 GLU 328.A OE2 no hydrogen 2.438 N/A ILE 125.A N ALA 120.A O no hydrogen 3.245 N/A LYS 126.A N ASP 97.A O no hydrogen 2.871 N/A LYS 126.A NZ HIS 315.A O no hydrogen 3.206 N/A VAL 128.A N ALA 99.A O no hydrogen 3.166 N/A VAL 129.A N THR 182.A O no hydrogen 2.930 N/A ILE 131.A N ALA 184.A O no hydrogen 3.365 N/A ASN 132.A N VAL 103.A O no hydrogen 3.409 N/A LYS 133.A NZ ASP 29.A O no hydrogen 2.331 N/A LYS 133.A NZ ASP 104.A OD2 no hydrogen 3.123 N/A ALA 137.A N LYS 133.A O no hydrogen 3.167 N/A LEU 138.A N VAL 134.A O no hydrogen 2.604 N/A LEU 139.A N ARG 136.A O no hydrogen 3.302 N/A GLU 140.A N ARG 136.A O no hydrogen 2.759 N/A GLN 142.A NE2 LEU 139.A O no hydrogen 3.397 N/A GLN 150.A N GLU 146.A O no hydrogen 2.405 N/A GLN 150.A NE2 GLU 146.A OE2 no hydrogen 3.215 N/A THR 151.A N ASP 147.A O no hydrogen 2.632 N/A THR 151.A OG1 ASP 147.A O no hydrogen 2.714 N/A THR 151.A OG1 LEU 148.A O no hydrogen 2.817 N/A PHE 152.A N LEU 148.A O no hydrogen 3.135 N/A ALA 153.A N TYR 149.A O no hydrogen 3.179 N/A ARG 154.A N GLN 150.A O no hydrogen 2.818 N/A THR 155.A N THR 151.A O no hydrogen 3.142 N/A THR 155.A OG1 THR 151.A O no hydrogen 3.344 N/A THR 155.A OG1 PHE 152.A O no hydrogen 2.756 N/A VAL 156.A N PHE 152.A O no hydrogen 2.930 N/A GLU 157.A N ALA 153.A O no hydrogen 2.853 N/A SER 158.A N ARG 154.A O no hydrogen 2.896 N/A SER 158.A OG ARG 154.A O no hydrogen 2.480 N/A VAL 159.A N THR 155.A O no hydrogen 2.645 N/A ASN 160.A N VAL 156.A O no hydrogen 2.794 N/A VAL 161.A N GLU 157.A O no hydrogen 3.072 N/A ILE 162.A N SER 158.A O no hydrogen 3.300 N/A VAL 163.A N VAL 159.A O no hydrogen 2.988 N/A SER 164.A N ASN 160.A O no hydrogen 2.994 N/A SER 164.A OG ASN 160.A O no hydrogen 2.999 N/A SER 164.A OG VAL 161.A O no hydrogen 2.777 N/A THR 165.A N VAL 161.A O no hydrogen 2.806 N/A THR 165.A OG1 VAL 161.A O no hydrogen 2.347 N/A TYR 166.A N ILE 162.A O no hydrogen 2.830 N/A LEU 171.A N ASP 168.A O no hydrogen 3.420 N/A GLY 172.A N ASP 168.A O no hydrogen 3.336 N/A ASP 173.A N LEU 171.A O no hydrogen 2.646 N/A GLN 175.A NE2 ASN 160.A O no hydrogen 3.178 N/A GLN 175.A NE2 ASN 160.A OD1 no hydrogen 3.469 N/A TYR 177.A N THR 182.A OG1 no hydrogen 3.063 N/A GLY 181.A N PRO 178.A O no hydrogen 3.024 N/A THR 182.A N TYR 177.A O no hydrogen 3.211 N/A THR 182.A OG1 TYR 177.A O no hydrogen 2.899 N/A PHE 185.A N PHE 194.A O no hydrogen 3.461 N/A SER 187.A N TRP 192.A O no hydrogen 2.537 N/A GLY 188.A N ASN 132.A OD1 no hydrogen 2.263 N/A HIS 190.A N SER 187.A OG no hydrogen 2.955 N/A GLY 191.A N SER 187.A O no hydrogen 2.666 N/A TRP 192.A N SER 187.A O no hydrogen 2.904 N/A ALA 193.A N LEU 302.A O no hydrogen 2.631 N/A PHE 194.A N PHE 185.A O no hydrogen 2.979 N/A THR 195.A OG1 ALA 307.A O no hydrogen 2.938 N/A ARG 197.A NH1 ASP 59.A OD1 no hydrogen 2.606 N/A PHE 199.A N THR 195.A O no hydrogen 2.551 N/A ALA 200.A N ILE 196.A O no hydrogen 2.239 N/A THR 201.A OG1 GLN 198.A O no hydrogen 2.867 N/A ARG 202.A N PHE 199.A O no hydrogen 3.147 N/A LYS 206.A N TYR 203.A O no hydrogen 2.796 N/A PHE 207.A N TYR 203.A O no hydrogen 2.510 N/A GLY 208.A N ALA 204.A O no hydrogen 2.971 N/A LYS 211.A N ASP 210.A OD1 no hydrogen 2.667 N/A LYS 211.A NZ ALA 200.A O no hydrogen 2.244 N/A ALA 212.A N ASP 210.A OD1 no hydrogen 3.411 N/A ARG 217.A N MET 214.A O no hydrogen 3.115 N/A ARG 217.A NH1 ARG 217.A O no hydrogen 2.357 N/A SER 222.A N GLY 220.A O no hydrogen 2.964 N/A SER 222.A OG THR 232.A O no hydrogen 3.157 N/A SER 222.A OG ASN 233.A OD1 no hydrogen 3.250 N/A PHE 223.A N THR 232.A O no hydrogen 2.400 N/A ASN 225.A N GLU 244.A O no hydrogen 3.314 N/A THR 228.A N ASN 225.A O no hydrogen 3.285 N/A THR 228.A OG1 ASN 225.A OD1 no hydrogen 3.078 N/A LYS 229.A N ASN 225.A O no hydrogen 3.198 N/A THR 232.A N LYS 230.A O no hydrogen 2.742 N/A THR 232.A OG1 LYS 234.A O no hydrogen 3.264 N/A LYS 234.A N THR 232.A OG1 no hydrogen 3.397 N/A THR 236.A OG1 ASP 235.A O no hydrogen 2.378 N/A ALA 238.A N ASP 235.A O no hydrogen 3.258 N/A GLY 240.A N ASP 237.A OD2 no hydrogen 3.031 N/A ARG 245.A NE ASN 248.A OD1 no hydrogen 2.642 N/A ARG 245.A NH2 ASN 248.A OD1 no hydrogen 2.538 N/A MET 249.A N ARG 245.A O no hydrogen 3.018 N/A PHE 250.A N ALA 246.A O no hydrogen 2.896 N/A ILE 251.A N PHE 247.A O no hydrogen 3.366 N/A PHE 256.A N LEU 252.A O no hydrogen 3.006 N/A ARG 257.A N ASP 253.A O no hydrogen 3.204 N/A ARG 257.A NE ASP 253.A OD1 no hydrogen 3.323 N/A ARG 257.A NE ASP 253.A OD2 no hydrogen 3.280 N/A LEU 258.A N PRO 254.A O no hydrogen 3.132 N/A PHE 259.A N ILE 255.A O no hydrogen 3.261 N/A THR 260.A N PHE 256.A O no hydrogen 3.172 N/A THR 260.A OG1 ARG 257.A O no hydrogen 2.163 N/A THR 260.A OG1 GLU 269.A OE1 no hydrogen 3.513 N/A ALA 261.A N ARG 257.A O no hydrogen 3.193 N/A ILE 262.A N LEU 258.A O no hydrogen 2.695 N/A MET 263.A N PHE 259.A O no hydrogen 2.366 N/A PHE 265.A N ILE 262.A O no hydrogen 2.850 N/A LYS 266.A N ALA 261.A O no hydrogen 2.524 N/A GLU 269.A N LYS 266.A O no hydrogen 3.437 N/A LEU 274.A N ILE 270.A O no hydrogen 3.226 N/A GLU 275.A N PRO 271.A O no hydrogen 3.343 N/A LYS 276.A N VAL 272.A O no hydrogen 3.336 N/A LEU 277.A N LEU 274.A O no hydrogen 2.821 N/A GLU 278.A N GLU 275.A O no hydrogen 3.243 N/A ILE 279.A N LEU 274.A O no hydrogen 3.496 N/A LYS 286.A NZ LYS 282.A O no hydrogen 2.380 N/A ASP 287.A N ASP 284.A O no hydrogen 3.287 N/A ALA 292.A N GLU 289.A O no hydrogen 3.167 N/A LEU 293.A N GLU 289.A O no hydrogen 2.443 N/A LYS 295.A NZ LYS 291.A O no hydrogen 2.330 N/A VAL 297.A N LEU 293.A O no hydrogen 3.318 N/A MET 298.A N LEU 294.A O no hydrogen 3.384 N/A ARG 299.A N LYS 295.A O no hydrogen 3.101 N/A LYS 300.A N VAL 296.A O no hydrogen 3.187 N/A LYS 300.A NZ VAL 280.A O no hydrogen 2.569 N/A PHE 301.A N VAL 297.A O no hydrogen 2.839 N/A LEU 302.A N MET 298.A O no hydrogen 2.625 N/A ALA 304.A N GLY 191.A O no hydrogen 3.284 N/A ASP 306.A N PRO 303.A O no hydrogen 3.156 N/A ALA 307.A N PRO 303.A O no hydrogen 2.759 N/A LEU 308.A N ALA 304.A O no hydrogen 2.964 N/A ILE 312.A N LEU 308.A O no hydrogen 3.299 N/A VAL 313.A N LEU 309.A O no hydrogen 2.919 N/A LEU 314.A N GLU 310.A O no hydrogen 3.139 N/A HIS 315.A N MET 311.A O no hydrogen 2.787 N/A HIS 315.A ND1 MET 311.A O no hydrogen 3.068 N/A THR 321.A N SER 318.A O no hydrogen 3.120 N/A ALA 322.A N SER 318.A O no hydrogen 3.078 N/A ALA 322.A N PRO 319.A O no hydrogen 3.227 N/A GLN 323.A N PRO 319.A O no hydrogen 2.802 N/A ARG 326.A N GLN 323.A O no hydrogen 3.177 N/A ARG 326.A NH2 ARG 94.A O no hydrogen 3.320 N/A ALA 327.A N GLN 323.A O no hydrogen 2.936 N/A ALA 327.A N ALA 324.A O no hydrogen 3.340 N/A GLU 328.A N GLU 328.A OE1 no hydrogen 2.784 N/A GLN 329.A NE2 GLU 123.A O no hydrogen 2.779 N/A LEU 330.A N ARG 326.A O no hydrogen 2.335 N/A GLU 332.A N GLU 332.A OE1 no hydrogen 2.739 N/A ILE 341.A N ASP 337.A O no hydrogen 3.301 N/A ALA 342.A N ALA 338.A O no hydrogen 2.924 N/A ILE 343.A N ASN 339.A O no hydrogen 2.970 N/A LYS 344.A N CYS 340.A O no hydrogen 3.092 N/A ASN 345.A N ILE 341.A O no hydrogen 2.773 N/A CYS 346.A N ALA 342.A O no hydrogen 2.908 N/A CYS 346.A SG PRO 319.A O no hydrogen 4.019 N/A CYS 346.A SG GLN 323.A OE1 no hydrogen 3.124 N/A CYS 346.A SG ILE 343.A O no hydrogen 3.238 N/A CYS 346.A SG LYS 344.A O no hydrogen 3.436 N/A MET 353.A N ALA 376.A O no hydrogen 3.074 N/A LEU 354.A N LEU 443.A O no hydrogen 2.669 N/A TYR 355.A N ARG 373.A O no hydrogen 3.173 N/A SER 357.A N PHE 371.A O no hydrogen 3.080 N/A SER 357.A OG TYR 355.A O no hydrogen 3.474 N/A LYS 358.A N PHE 371.A O no hydrogen 3.333 N/A LYS 358.A NZ GLU 88.A OE2 no hydrogen 2.600 N/A THR 362.A OG1 THR 362.A O no hydrogen 2.511 N/A LYS 365.A NZ ASP 522.A O no hydrogen 2.867 N/A LYS 365.A NZ ALA 524.A O no hydrogen 3.552 N/A ALA 370.A N LEU 430.A O no hydrogen 3.346 N/A PHE 371.A N LYS 358.A O no hydrogen 2.949 N/A GLY 372.A N ILE 428.A O no hydrogen 2.909 N/A PHE 375.A N MET 353.A O no hydrogen 2.524 N/A GLY 377.A N ASP 347.A O no hydrogen 2.837 N/A THR 378.A OG1 PRO 348.A O no hydrogen 2.174 N/A VAL 379.A N CYS 422.A O no hydrogen 2.268 N/A LYS 380.A NZ THR 378.A O no hydrogen 2.778 N/A SER 381.A OG GLN 406.A O no hydrogen 2.794 N/A VAL 385.A N LYS 403.A O no hydrogen 3.336 N/A ARG 386.A N THR 444.A O no hydrogen 2.859 N/A ARG 386.A NH2 TYR 392.A OH no hydrogen 2.901 N/A GLN 388.A N THR 442.A O no hydrogen 3.069 N/A TYR 392.A N GLY 389.A O no hydrogen 2.940 N/A VAL 393.A N ASP 398.A OD2 no hydrogen 2.708 N/A LEU 400.A N ASP 398.A O no hydrogen 2.638 N/A LYS 403.A NZ ALA 404.A O no hydrogen 2.428 N/A LYS 403.A NZ GLY 432.A O no hydrogen 2.834 N/A ILE 405.A N GLN 383.A O no hydrogen 3.306 N/A GLN 406.A N VAL 431.A O no hydrogen 3.030 N/A ARG 407.A N VAL 431.A O no hydrogen 3.286 N/A VAL 408.A N ILE 419.A O no hydrogen 2.963 N/A VAL 409.A N GLY 429.A O no hydrogen 3.221 N/A ARG 414.A N MET 412.A O no hydrogen 2.487 N/A ILE 419.A N VAL 408.A O no hydrogen 2.714 N/A CYS 422.A N VAL 379.A O no hydrogen 2.948 N/A CYS 422.A SG ASP 421.A O no hydrogen 3.142 N/A GLY 425.A N VAL 374.A O no hydrogen 3.201 N/A ASN 426.A ND2 PRO 423.A O no hydrogen 2.491 N/A ILE 428.A N GLY 372.A O no hydrogen 2.711 N/A GLY 429.A N VAL 409.A O no hydrogen 2.578 N/A LEU 430.A N ALA 370.A O no hydrogen 2.610 N/A VAL 431.A N ARG 407.A O no hydrogen 3.428 N/A GLN 435.A N GLN 435.A OE1 no hydrogen 2.710 N/A LYS 439.A NZ VAL 492.A O no hydrogen 2.597 N/A THR 442.A OG1 LEU 354.A O no hydrogen 2.320 N/A LEU 443.A N LEU 354.A O no hydrogen 2.397 N/A THR 444.A N ARG 386.A O no hydrogen 3.285 N/A THR 444.A OG1 LEU 352.A O no hydrogen 2.568 N/A THR 445.A N LEU 352.A O no hydrogen 3.350 N/A SER 446.A OG ASN 339.A OD1 no hydrogen 3.058 N/A THR 448.A OG1 THR 448.A O no hydrogen 2.475 N/A HIS 450.A N THR 448.A O no hydrogen 3.185 N/A VAL 462.A N GLY 506.A O no hydrogen 3.072 N/A VAL 463.A N GLY 506.A O no hydrogen 3.419 N/A GLN 464.A NE2 PRO 461.A O no hydrogen 2.994 N/A VAL 465.A N VAL 504.A O no hydrogen 3.216 N/A ALA 466.A N SER 531.A O no hydrogen 2.744 N/A VAL 467.A N HIS 502.A O no hydrogen 3.030 N/A ASN 473.A N ASN 471.A OD1 no hydrogen 3.220 N/A ASP 474.A N ASN 471.A O no hydrogen 3.030 N/A VAL 479.A N LEU 475.A O no hydrogen 3.021 N/A GLY 481.A N LYS 477.A O no hydrogen 3.292 N/A LEU 482.A N LEU 478.A O no hydrogen 2.474 N/A LYS 483.A N VAL 479.A O no hydrogen 2.739 N/A ARG 484.A N GLU 480.A O no hydrogen 2.369 N/A LEU 485.A N GLY 481.A O no hydrogen 2.850 N/A SER 486.A OG LEU 482.A O no hydrogen 3.063 N/A SER 486.A OG THR 494.A OG1 no hydrogen 2.440 N/A SER 488.A N LEU 485.A O no hydrogen 2.986 N/A SER 488.A OG LEU 485.A O no hydrogen 2.794 N/A CYS 491.A SG ASP 489.A OD2 no hydrogen 3.498 N/A CYS 491.A SG THR 507.A OG1 no hydrogen 3.405 N/A CYS 491.A SG HIS 511.A NE2 no hydrogen 3.012 N/A VAL 492.A N ASP 489.A O no hydrogen 3.237 N/A LEU 493.A N ALA 505.A O no hydrogen 3.306 N/A THR 494.A OG1 LEU 482.A O no hydrogen 3.029 N/A THR 494.A OG1 SER 486.A OG no hydrogen 2.440 N/A SER 497.A N GLU 501.A O no hydrogen 2.980 N/A SER 499.A N SER 497.A OG no hydrogen 3.351 N/A SER 499.A OG GLU 498.A OE2 no hydrogen 2.467 N/A GLY 500.A N SER 497.A O no hydrogen 3.452 N/A ILE 503.A N TYR 495.A O no hydrogen 2.766 N/A VAL 504.A N VAL 465.A O no hydrogen 3.106 N/A ALA 505.A N LEU 493.A O no hydrogen 2.554 N/A GLY 506.A N VAL 463.A O no hydrogen 3.041 N/A HIS 511.A ND1 ASP 84.A O no hydrogen 2.536 N/A HIS 511.A NE2 ASP 489.A OD2 no hydrogen 2.809 N/A LEU 512.A N GLY 508.A O no hydrogen 3.222 N/A GLU 513.A N GLU 509.A O no hydrogen 3.306 N/A ILE 514.A N LEU 510.A O no hydrogen 2.937 N/A CYS 515.A N HIS 511.A O no hydrogen 2.952 N/A CYS 515.A SG HIS 511.A O no hydrogen 3.137 N/A CYS 515.A SG LEU 512.A O no hydrogen 3.199 N/A LEU 516.A N LEU 512.A O no hydrogen 2.824 N/A GLN 517.A N GLU 513.A O no hydrogen 2.585 N/A ASP 518.A N ILE 514.A O no hydrogen 3.065 N/A ASP 518.A N CYS 515.A O no hydrogen 3.136 N/A LEU 519.A N LEU 516.A O no hydrogen 2.494 N/A GLU 520.A N GLU 520.A OE1 no hydrogen 2.651 N/A HIS 523.A N ASP 518.A O no hydrogen 2.321 N/A GLY 525.A N LEU 519.A O no hydrogen 2.238 N/A LYS 529.A N GLU 468.A O no hydrogen 3.481 N/A SER 531.A N ALA 466.A O no hydrogen 3.433 N/A TYR 537.A OH ASN 748.A OD1 no hydrogen 2.438 N/A ARG 538.A N GLN 698.A O no hydrogen 2.735 N/A ARG 538.A NE GLU 654.A OE2 no hydrogen 2.913 N/A ARG 538.A NH1 TYR 537.A O no hydrogen 3.138 N/A ARG 538.A NH2 GLU 654.A OE2 no hydrogen 2.581 N/A GLU 539.A N GLU 654.A O no hydrogen 3.293 N/A THR 540.A N LYS 696.A O no hydrogen 2.759 N/A THR 540.A OG1 VAL 541.A O no hydrogen 3.351 N/A THR 540.A OG1 ARG 656.A O no hydrogen 2.964 N/A THR 540.A OG1 SER 657.A O no hydrogen 3.425 N/A VAL 541.A N THR 540.A OG1 no hydrogen 2.620 N/A GLU 542.A N ASP 694.A O no hydrogen 3.009 N/A SER 543.A OG GLU 542.A O no hydrogen 2.883 N/A SER 543.A OG ASP 694.A OD2 no hydrogen 3.292 N/A SER 545.A OG GLN 547.A O no hydrogen 3.238 N/A THR 548.A N GLN 547.A OE1 no hydrogen 2.547 N/A SER 551.A OG THR 681.A O no hydrogen 3.487 N/A LYS 552.A NZ LYS 556.A O no hydrogen 2.549 N/A SER 553.A N ASN 558.A O no hydrogen 3.289 N/A SER 553.A OG GLN 677.A O no hydrogen 2.560 N/A SER 553.A OG THR 681.A OG1 no hydrogen 2.374 N/A LYS 556.A N SER 553.A O no hydrogen 2.947 N/A LYS 556.A NZ PRO 554.A O no hydrogen 3.256 N/A HIS 557.A N ASN 555.A OD1 no hydrogen 3.075 N/A ARG 559.A N THR 666.A O no hydrogen 3.007 N/A TYR 561.A N ASP 664.A O no hydrogen 2.973 N/A LYS 563.A NZ GLU 544.A O no hydrogen 2.185 N/A LYS 563.A NZ GLU 565.A OE2 no hydrogen 2.271 N/A GLU 565.A N ARG 659.A O no hydrogen 2.735 N/A ILE 567.A N GLU 565.A O no hydrogen 3.089 N/A GLU 569.A N ASP 568.A OD1 no hydrogen 2.399 N/A GLU 570.A N GLU 570.A OE1 no hydrogen 3.146 N/A SER 572.A N ASP 568.A O no hydrogen 3.102 N/A SER 572.A OG ASP 568.A O no hydrogen 3.457 N/A SER 572.A OG SER 657.A OG no hydrogen 2.190 N/A LEU 573.A N GLU 569.A O no hydrogen 2.425 N/A ALA 574.A N GLU 570.A O no hydrogen 2.711 N/A ILE 575.A N VAL 571.A O no hydrogen 2.738 N/A GLU 576.A N SER 572.A O no hydrogen 3.011 N/A ASN 577.A N LEU 573.A O no hydrogen 2.980 N/A ASN 577.A ND2 LEU 573.A O no hydrogen 2.508 N/A GLY 578.A N ILE 575.A O no hydrogen 3.312 N/A ILE 579.A N ALA 574.A O no hydrogen 2.817 N/A ILE 580.A N ALA 574.A O no hydrogen 3.471 N/A ASP 584.A N ASN 581.A O no hydrogen 3.107 N/A ALA 588.A N ASP 585.A O no hydrogen 3.361 N/A ARG 589.A N ASP 585.A O no hydrogen 2.953 N/A ARG 589.A NH2 ALA 604.A O no hydrogen 3.160 N/A ARG 591.A N ALA 588.A O no hydrogen 3.383 N/A ALA 594.A N ALA 590.A O no hydrogen 2.936 N/A ASP 595.A N ARG 591.A O no hydrogen 2.755 N/A ASP 596.A N ILE 592.A O no hydrogen 2.532 N/A GLY 598.A N ALA 594.A O no hydrogen 3.251 N/A THR 602.A N ASP 600.A OD2 no hydrogen 3.052 N/A THR 602.A OG1 ASP 600.A OD2 no hydrogen 2.492 N/A THR 602.A OG1 ASP 603.A OD1 no hydrogen 3.530 N/A ALA 604.A N ASP 600.A O no hydrogen 3.339 N/A ARG 605.A N THR 602.A O no hydrogen 2.991 N/A ARG 605.A NH2 LYS 587.A O no hydrogen 3.438 N/A LYS 606.A N ASP 603.A O no hydrogen 2.979 N/A LYS 606.A NZ THR 602.A O no hydrogen 2.613 N/A TRP 608.A N VAL 620.A O no hydrogen 3.422 N/A GLY 611.A N ASN 618.A O no hydrogen 2.778 N/A ASN 615.A N PRO 612.A O no hydrogen 3.283 N/A GLY 616.A N PRO 612.A O no hydrogen 2.929 N/A ASN 618.A N GLY 611.A O no hydrogen 2.733 N/A ASN 618.A ND2 MET 655.A O no hydrogen 2.783 N/A LEU 619.A N VAL 658.A O no hydrogen 3.335 N/A ILE 621.A N VAL 660.A O no hydrogen 2.627 N/A ASP 622.A N LYS 606.A O no hydrogen 3.070 N/A GLN 623.A N ILE 662.A O no hydrogen 2.549 N/A GLN 623.A NE2 ASP 603.A OD1 no hydrogen 3.027 N/A THR 624.A N ASP 622.A OD1 no hydrogen 2.903 N/A THR 624.A OG1 ASP 622.A OD1 no hydrogen 2.272 N/A THR 624.A OG1 ASP 622.A OD2 no hydrogen 3.104 N/A ILE 633.A N LEU 630.A O no hydrogen 3.040 N/A VAL 637.A N ILE 633.A O no hydrogen 3.209 N/A VAL 638.A N LYS 634.A O no hydrogen 3.158 N/A ALA 639.A N ASP 635.A O no hydrogen 2.969 N/A ALA 640.A N SER 636.A O no hydrogen 3.362 N/A PHE 641.A N VAL 637.A O no hydrogen 3.023 N/A GLN 642.A N VAL 638.A O no hydrogen 3.273 N/A GLN 642.A NE2 VAL 638.A O no hydrogen 3.042 N/A ALA 644.A N ALA 640.A O no hydrogen 3.148 N/A THR 645.A N PHE 641.A O no hydrogen 3.122 N/A THR 645.A N GLN 642.A O no hydrogen 3.202 N/A THR 645.A OG1 PHE 641.A O no hydrogen 2.378 N/A THR 645.A OG1 GLN 642.A O no hydrogen 2.840 N/A LYS 646.A N GLN 642.A O no hydrogen 2.793 N/A GLU 647.A N TRP 643.A O no hydrogen 3.220 N/A GLY 648.A N GLU 653.A O no hydrogen 2.959 N/A MET 655.A N THR 645.A O no hydrogen 3.118 N/A ARG 656.A N GLU 539.A O no hydrogen 2.729 N/A ARG 656.A NH1 GLU 569.A OE1 no hydrogen 2.978 N/A ARG 656.A NH2 GLU 569.A OE1 no hydrogen 3.403 N/A SER 657.A OG SER 572.A OG no hydrogen 2.190 N/A ARG 659.A N GLU 565.A O no hydrogen 2.644 N/A VAL 660.A N LEU 619.A O no hydrogen 2.976 N/A ASN 661.A N LYS 563.A O no hydrogen 2.734 N/A ILE 662.A N ILE 621.A O no hydrogen 2.414 N/A ASP 664.A N TYR 561.A O no hydrogen 3.167 N/A HIS 668.A N ASN 558.A OD1 no hydrogen 2.430 N/A ASP 670.A N HIS 668.A ND1 no hydrogen 3.126 N/A ILE 672.A N ASP 670.A OD1 no hydrogen 3.446 N/A ARG 673.A NE ALA 669.A O no hydrogen 2.851 N/A ARG 673.A NH2 ALA 669.A O no hydrogen 3.330 N/A GLN 677.A N GLY 674.A O no hydrogen 3.212 N/A ILE 678.A N GLY 674.A O no hydrogen 2.940 N/A ILE 678.A N GLY 675.A O no hydrogen 3.345 N/A ILE 679.A N GLY 675.A O no hydrogen 2.993 N/A THR 681.A OG1 SER 553.A OG no hydrogen 2.374 N/A THR 681.A OG1 GLN 677.A O no hydrogen 2.386 N/A MET 682.A N ILE 678.A O no hydrogen 2.922 N/A ARG 683.A N ILE 679.A O no hydrogen 2.971 N/A ARG 684.A N PRO 680.A O no hydrogen 2.860 N/A ALA 685.A N THR 681.A O no hydrogen 2.785 N/A THR 686.A N MET 682.A O no hydrogen 2.668 N/A THR 686.A OG1 MET 682.A O no hydrogen 2.777 N/A TYR 687.A N ARG 683.A O no hydrogen 2.765 N/A ALA 688.A N ARG 684.A O no hydrogen 2.537 N/A GLY 689.A N ALA 685.A O no hydrogen 2.618 N/A PHE 690.A N THR 686.A O no hydrogen 2.934 N/A LEU 691.A N ALA 688.A O no hydrogen 2.924 N/A LEU 692.A N GLY 689.A O no hydrogen 3.425 N/A LYS 696.A N THR 540.A O no hydrogen 2.587 N/A LYS 696.A NZ GLU 542.A OE1 no hydrogen 2.241 N/A LYS 696.A NZ LEU 777.A O no hydrogen 2.485 N/A LYS 696.A NZ GLY 778.A O no hydrogen 3.241 N/A GLN 698.A N ARG 538.A O no hydrogen 2.386 N/A GLN 698.A NE2 THR 776.A OG1 no hydrogen 2.538 N/A GLU 699.A N SER 775.A O no hydrogen 2.810 N/A VAL 701.A N HIS 773.A O no hydrogen 2.207 N/A PHE 702.A N LEU 745.A O no hydrogen 2.812 N/A LEU 703.A N VAL 770.A O no hydrogen 2.463 N/A VAL 704.A N ALA 743.A O no hydrogen 2.665 N/A GLU 705.A N GLN 768.A O no hydrogen 3.144 N/A ILE 706.A N VAL 741.A O no hydrogen 2.846 N/A GLN 707.A N PHE 766.A O no hydrogen 3.099 N/A CYS 708.A SG PRO 709.A O no hydrogen 3.717 N/A GLN 711.A NE2 GLN 764.A OE1 no hydrogen 2.363 N/A GLY 715.A N ALA 712.A O no hydrogen 3.307 N/A ILE 716.A N VAL 713.A O no hydrogen 2.964 N/A SER 718.A N GLY 714.A O no hydrogen 3.239 N/A SER 718.A OG GLY 714.A O no hydrogen 3.498 N/A SER 718.A OG GLY 715.A O no hydrogen 2.395 N/A VAL 719.A N GLY 715.A O no hydrogen 2.312 N/A LEU 720.A N ILE 716.A O no hydrogen 2.624 N/A LYS 722.A N VAL 719.A O no hydrogen 3.014 N/A LYS 723.A N VAL 719.A O no hydrogen 3.140 N/A LYS 723.A NZ GLU 749.A O no hydrogen 3.015 N/A LYS 723.A NZ PHE 751.A O no hydrogen 3.238 N/A GLY 725.A N LEU 720.A O no hydrogen 2.344 N/A GLN 726.A N TYR 744.A O no hydrogen 2.709 N/A VAL 728.A N LYS 742.A O no hydrogen 2.723 N/A SER 729.A N LYS 742.A O no hydrogen 3.249 N/A ARG 733.A N LEU 738.A O no hydrogen 3.446 N/A PHE 739.A N CYS 708.A O no hydrogen 2.543 N/A THR 740.A N GLU 731.A O no hydrogen 2.402 N/A THR 740.A OG1 PHE 739.A O no hydrogen 2.922 N/A VAL 741.A N ILE 706.A O no hydrogen 3.156 N/A LYS 742.A N SER 729.A O no hydrogen 2.754 N/A LYS 742.A NZ THR 740.A O no hydrogen 2.409 N/A ALA 743.A N VAL 704.A O no hydrogen 2.568 N/A TYR 744.A N GLN 726.A O no hydrogen 2.654 N/A LEU 745.A N PHE 702.A O no hydrogen 3.183 N/A VAL 747.A N PRO 700.A O no hydrogen 3.044 N/A SER 750.A OG SER 750.A O no hydrogen 2.512 N/A GLU 756.A N GLY 752.A O no hydrogen 3.529 N/A LEU 757.A N PHE 753.A O no hydrogen 2.983 N/A ARG 758.A N THR 754.A O no hydrogen 2.326 N/A GLN 759.A N GLY 755.A O no hydrogen 2.252 N/A GLN 759.A NE2 GLN 759.A O no hydrogen 2.366 N/A ALA 760.A N GLU 756.A O no hydrogen 2.467 N/A THR 761.A N LEU 757.A O no hydrogen 3.018 N/A THR 761.A OG1 LEU 757.A O no hydrogen 2.535 N/A GLY 763.A N ARG 758.A O no hydrogen 2.877 N/A GLN 764.A N THR 761.A O no hydrogen 3.248 N/A ALA 765.A N THR 761.A OG1 no hydrogen 3.382 N/A PHE 766.A N GLN 707.A O no hydrogen 3.259 N/A GLN 768.A N GLU 705.A O no hydrogen 3.015 N/A MET 769.A N SER 460.A OG no hydrogen 3.262 N/A VAL 770.A N LEU 703.A O no hydrogen 3.139 N/A ASP 772.A N VAL 701.A O no hydrogen 2.531 N/A HIS 773.A N VAL 701.A O no hydrogen 2.870 N/A SER 775.A N GLU 699.A O no hydrogen 2.700 N/A SER 775.A OG THR 776.A O no hydrogen 3.434 N/A LEU 777.A N ILE 697.A O no hydrogen 2.982 N/A LEU 782.A N ASP 780.A OD2 no hydrogen 2.868 N/A ASP 783.A N ASP 780.A OD2 no hydrogen 2.417 N/A THR 785.A OG1 THR 785.A O no hydrogen 2.596 N/A SER 786.A N ASP 783.A O no hydrogen 2.947 N/A SER 786.A OG ASP 780.A O no hydrogen 2.776 N/A ALA 788.A N SER 779.A OG no hydrogen 2.717 N/A GLY 789.A N SER 786.A O no hydrogen 2.912 N/A ALA 794.A N GLU 790.A O no hydrogen 2.800 N/A ALA 795.A N ILE 791.A O no hydrogen 2.550 N/A ARG 796.A N VAL 792.A O no hydrogen 2.621 N/A ARG 796.A NE LYS 802.A O no hydrogen 3.194 N/A ARG 796.A NH1 ILE 650.A O no hydrogen 2.861 N/A LYS 797.A N LEU 793.A O no hydrogen 2.761 N/A ARG 798.A N ALA 794.A O no hydrogen 2.759 N/A HIS 799.A N ALA 795.A O no hydrogen 2.782 N/A HIS 799.A N ARG 796.A O no hydrogen 3.295 N/A MET 801.A N ARG 796.A O no hydrogen 3.286 N/A