Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 8eub_DC.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): VAL 1.A N GLY 43.A O no hydrogen 2.328 N/A MET 8.A N VAL 5.A O no hydrogen 3.032 N/A ARG 9.A N VAL 5.A O no hydrogen 3.214 N/A SER 10.A N ASP 6.A O no hydrogen 3.101 N/A SER 10.A OG ASP 6.A O no hydrogen 3.548 N/A SER 10.A OG GLN 7.A O no hydrogen 2.551 N/A LEU 11.A N GLN 7.A O no hydrogen 2.730 N/A MET 12.A N MET 8.A O no hydrogen 2.783 N/A ASP 13.A N SER 10.A O no hydrogen 2.998 N/A ASN 17.A ND2 THR 75.A OG1 no hydrogen 2.524 N/A ASN 17.A ND2 GLY 77.A O no hydrogen 3.533 N/A ARG 19.A N LEU 81.A O no hydrogen 2.593 N/A ARG 19.A NE LEU 324.A O no hydrogen 2.332 N/A ARG 19.A NH2 LEU 324.A O no hydrogen 3.022 N/A ASN 20.A ND2 ASP 105.A OD2 no hydrogen 2.854 N/A MET 21.A N ASN 83.A O no hydrogen 3.462 N/A SER 22.A N GLY 106.A O no hydrogen 2.914 N/A ILE 24.A N LEU 108.A O no hydrogen 3.224 N/A THR 33.A OG1 GLY 30.A O no hydrogen 2.938 N/A LEU 34.A N GLY 30.A O no hydrogen 2.766 N/A THR 35.A OG1 LYS 31.A O no hydrogen 2.497 N/A ASP 36.A N SER 32.A O no hydrogen 2.940 N/A SER 37.A N THR 33.A O no hydrogen 2.636 N/A LEU 38.A N LEU 34.A O no hydrogen 2.482 N/A VAL 39.A N THR 35.A O no hydrogen 2.900 N/A GLN 40.A N ASP 36.A O no hydrogen 2.743 N/A ARG 41.A NH2 ASP 314.A OD1 no hydrogen 2.842 N/A LYS 53.A NZ SER 496.A O no hydrogen 3.074 N/A ILE 57.A N LEU 84.A O no hydrogen 3.021 N/A SER 58.A OG ASN 83.A OD1 no hydrogen 2.866 N/A LEU 59.A N ILE 82.A O no hydrogen 2.825 N/A TYR 60.A OH GLU 62.A OE1 no hydrogen 2.631 N/A SER 61.A N PHE 80.A O no hydrogen 3.053 N/A SER 61.A OG SER 61.A O no hydrogen 2.430 N/A SER 61.A OG PHE 80.A O no hydrogen 3.546 N/A MET 63.A N GLU 62.A OE1 no hydrogen 3.219 N/A GLU 66.A N SER 64.A OG no hydrogen 3.315 N/A GLU 70.A N GLU 70.A OE1 no hydrogen 2.501 N/A GLN 73.A NE2 THR 16.A O no hydrogen 2.312 N/A GLN 73.A NE2 THR 16.A OG1 no hydrogen 2.325 N/A GLY 77.A N ASP 76.A OD1 no hydrogen 2.489 N/A ASN 78.A ND2 MET 63.A O no hydrogen 2.493 N/A PHE 80.A N ASN 78.A O no hydrogen 2.724 N/A LEU 81.A N ASN 17.A O no hydrogen 2.635 N/A ILE 82.A N LEU 59.A O no hydrogen 2.875 N/A ASN 83.A N ARG 19.A O no hydrogen 2.730 N/A ASN 83.A ND2 ASN 20.A OD1 no hydrogen 2.763 N/A ASN 83.A ND2 ASN 434.A OD1 no hydrogen 3.377 N/A LEU 84.A N ILE 57.A O no hydrogen 3.180 N/A ILE 85.A N MET 21.A O no hydrogen 3.078 N/A SER 94.A N VAL 91.A O no hydrogen 3.309 N/A SER 94.A OG VAL 91.A O no hydrogen 2.543 N/A THR 98.A N SER 94.A O no hydrogen 3.182 N/A THR 98.A OG1 SER 94.A O no hydrogen 3.257 N/A ALA 99.A N SER 95.A O no hydrogen 2.956 N/A ALA 100.A N GLU 96.A O no hydrogen 3.118 N/A LEU 101.A N VAL 97.A O no hydrogen 2.809 N/A ARG 102.A N ALA 99.A O no hydrogen 3.487 N/A ARG 102.A NE GLU 131.A OE1 no hydrogen 2.854 N/A VAL 103.A N ALA 100.A O no hydrogen 3.164 N/A THR 104.A OG1 ALA 100.A O no hydrogen 2.261 N/A ASP 105.A N ASN 20.A O no hydrogen 2.309 N/A GLY 106.A N ASN 20.A O no hydrogen 2.809 N/A ALA 107.A N LYS 134.A O no hydrogen 3.156 N/A LEU 108.A N SER 22.A O no hydrogen 3.388 N/A VAL 109.A N VAL 136.A O no hydrogen 2.910 N/A VAL 110.A N ILE 24.A O no hydrogen 3.338 N/A VAL 111.A N VAL 138.A O no hydrogen 2.874 N/A THR 113.A N ASN 140.A O no hydrogen 3.179 N/A THR 113.A OG1 LYS 141.A O no hydrogen 3.511 N/A ILE 114.A N ASP 112.A OD1 no hydrogen 2.816 N/A GLY 116.A N ASP 112.A O no hydrogen 3.119 N/A CYS 118.A SG HIS 29.A NE2 no hydrogen 3.377 N/A CYS 118.A SG GLU 115.A O no hydrogen 3.499 N/A CYS 118.A SG GLU 115.A OE1 no hydrogen 3.658 N/A CYS 118.A SG GLY 116.A O no hydrogen 3.627 N/A GLN 120.A N HIS 26.A ND1 no hydrogen 3.107 N/A THR 121.A OG1 VAL 110.A O no hydrogen 3.410 N/A GLU 122.A N VAL 119.A O no hydrogen 3.056 N/A THR 123.A N VAL 119.A O no hydrogen 2.920 N/A THR 123.A OG1 GLN 120.A O no hydrogen 3.293 N/A VAL 124.A N GLN 120.A O no hydrogen 2.982 N/A ARG 126.A N GLU 122.A O no hydrogen 3.305 N/A GLN 127.A N THR 123.A O no hydrogen 3.205 N/A ALA 128.A N VAL 124.A O no hydrogen 2.824 N/A LEU 129.A N LEU 125.A O no hydrogen 2.868 N/A GLY 130.A N ARG 126.A O no hydrogen 2.820 N/A GLU 131.A N GLN 127.A O no hydrogen 3.379 N/A ARG 132.A N LEU 129.A O no hydrogen 3.307 N/A ARG 132.A NE ASP 176.A OD2 no hydrogen 3.030 N/A ARG 132.A NH1 TYR 333.A O no hydrogen 2.844 N/A ARG 132.A NH2 ASP 176.A OD2 no hydrogen 2.602 N/A ILE 133.A N ALA 128.A O no hydrogen 3.308 N/A LYS 134.A NZ HIS 323.A O no hydrogen 2.429 N/A VAL 136.A N ALA 107.A O no hydrogen 2.874 N/A VAL 137.A N THR 190.A O no hydrogen 3.121 N/A VAL 138.A N VAL 109.A O no hydrogen 3.029 N/A ILE 139.A N ALA 192.A O no hydrogen 2.732 N/A ASN 140.A N VAL 111.A O no hydrogen 2.324 N/A ASN 140.A ND2 HIS 29.A O no hydrogen 2.456 N/A LYS 141.A NZ ASP 28.A O no hydrogen 3.461 N/A LEU 147.A N ASP 143.A O no hydrogen 3.359 N/A LEU 149.A N ARG 144.A O no hydrogen 3.151 N/A VAL 151.A N ALA 145.A O no hydrogen 3.446 N/A LYS 153.A NZ ASP 261.A OD1 no hydrogen 2.341 N/A ASP 155.A N SER 152.A OG no hydrogen 3.147 N/A LEU 156.A N SER 152.A O no hydrogen 2.923 N/A TYR 157.A N LYS 153.A O no hydrogen 3.206 N/A GLN 158.A N GLU 154.A O no hydrogen 3.101 N/A THR 159.A N ASP 155.A O no hydrogen 3.203 N/A THR 159.A OG1 ASP 155.A O no hydrogen 3.288 N/A THR 159.A OG1 LEU 156.A O no hydrogen 2.501 N/A PHE 160.A N LEU 156.A O no hydrogen 3.108 N/A ALA 161.A N TYR 157.A O no hydrogen 2.670 N/A ARG 162.A N GLN 158.A O no hydrogen 2.672 N/A ARG 162.A NH1 GLU 165.A OE1 no hydrogen 3.348 N/A THR 163.A N THR 159.A O no hydrogen 3.022 N/A VAL 164.A N PHE 160.A O no hydrogen 3.323 N/A GLU 165.A N ALA 161.A O no hydrogen 3.383 N/A SER 166.A N ARG 162.A O no hydrogen 2.831 N/A SER 166.A OG ARG 162.A O no hydrogen 3.227 N/A VAL 167.A N THR 163.A O no hydrogen 2.982 N/A ASN 168.A N VAL 164.A O no hydrogen 2.785 N/A ASN 168.A ND2 VAL 184.A O no hydrogen 2.404 N/A VAL 169.A N GLU 165.A O no hydrogen 3.097 N/A VAL 171.A N VAL 167.A O no hydrogen 3.016 N/A SER 172.A N ASN 168.A O no hydrogen 3.236 N/A SER 172.A OG ASN 168.A O no hydrogen 2.406 N/A SER 172.A OG VAL 169.A O no hydrogen 3.006 N/A THR 173.A N ILE 170.A O no hydrogen 3.219 N/A TYR 174.A N ILE 170.A O no hydrogen 3.184 N/A ALA 175.A N VAL 171.A O no hydrogen 3.376 N/A GLU 177.A N GLU 177.A OE1 no hydrogen 2.853 N/A VAL 182.A N GLY 180.A O no hydrogen 2.702 N/A VAL 184.A N ASN 168.A OD1 no hydrogen 2.797 N/A GLY 189.A N PRO 186.A O no hydrogen 2.977 N/A THR 190.A N TYR 185.A O no hydrogen 3.186 N/A ALA 192.A N VAL 137.A O no hydrogen 2.887 N/A PHE 193.A N PHE 202.A O no hydrogen 2.724 N/A GLY 194.A N ILE 139.A O no hydrogen 3.345 N/A SER 195.A N TRP 200.A O no hydrogen 2.772 N/A HIS 198.A N SER 195.A OG no hydrogen 3.416 N/A GLY 199.A N SER 195.A O no hydrogen 3.054 N/A TRP 200.A N SER 195.A O no hydrogen 3.163 N/A ALA 201.A N LEU 310.A O no hydrogen 2.734 N/A PHE 202.A N PHE 193.A O no hydrogen 2.733 N/A THR 203.A OG1 VAL 191.A O no hydrogen 2.707 N/A ARG 205.A NH1 ASP 67.A OD2 no hydrogen 3.113 N/A ARG 205.A NH1 GLU 318.A OE2 no hydrogen 3.157 N/A ARG 205.A NH2 ASP 67.A OD2 no hydrogen 3.146 N/A PHE 207.A N THR 203.A O no hydrogen 2.960 N/A PHE 207.A N ILE 204.A O no hydrogen 3.169 N/A ALA 208.A N ILE 204.A O no hydrogen 2.581 N/A THR 209.A N ARG 205.A O no hydrogen 3.085 N/A THR 209.A OG1 ARG 205.A O no hydrogen 2.469 N/A ARG 210.A N PHE 207.A O no hydrogen 3.072 N/A TYR 211.A N ALA 208.A O no hydrogen 3.298 N/A ALA 212.A N THR 209.A O no hydrogen 3.194 N/A LYS 214.A N ARG 210.A O no hydrogen 3.213 N/A GLY 216.A N TYR 211.A O no hydrogen 3.294 N/A MET 222.A N ASP 218.A O no hydrogen 3.490 N/A ASP 224.A N LYS 221.A O no hydrogen 3.047 N/A ARG 225.A N MET 222.A O no hydrogen 3.092 N/A LEU 226.A N MET 222.A O no hydrogen 3.065 N/A PHE 231.A N THR 240.A O no hydrogen 2.520 N/A LYS 237.A N ASN 233.A O no hydrogen 2.610 N/A LYS 238.A NZ THR 240.A OG1 no hydrogen 2.929 N/A THR 240.A N PHE 231.A O no hydrogen 2.840 N/A ASP 245.A N LYS 249.A O no hydrogen 3.111 N/A GLY 248.A N ASP 245.A OD1 no hydrogen 2.568 N/A LYS 249.A NZ PRO 250.A O no hydrogen 3.371 N/A LEU 251.A N ASP 243.A O no hydrogen 2.621 N/A MET 257.A N ARG 253.A O no hydrogen 2.745 N/A PHE 258.A N ALA 254.A O no hydrogen 2.838 N/A ILE 259.A N PHE 255.A O no hydrogen 2.896 N/A LEU 260.A N PHE 255.A O no hydrogen 3.398 N/A ASP 261.A N ASN 256.A O no hydrogen 3.311 N/A PHE 264.A N LEU 260.A O no hydrogen 2.798 N/A ARG 265.A N ASP 261.A O no hydrogen 2.968 N/A ARG 265.A NH1 GLU 277.A OE2 no hydrogen 2.745 N/A PHE 267.A N ILE 263.A O no hydrogen 2.860 N/A THR 268.A N PHE 264.A O no hydrogen 2.682 N/A THR 268.A OG1 PHE 264.A O no hydrogen 2.436 N/A THR 268.A OG1 ARG 265.A O no hydrogen 3.304 N/A ALA 269.A N ARG 265.A O no hydrogen 3.012 N/A ILE 270.A N LEU 266.A O no hydrogen 2.919 N/A MET 271.A N PHE 267.A O no hydrogen 3.254 N/A ASN 272.A N THR 268.A O no hydrogen 2.939 N/A PHE 273.A N ILE 270.A O no hydrogen 3.184 N/A LYS 274.A N ALA 269.A O no hydrogen 3.082 N/A LYS 275.A NZ PHE 273.A O no hydrogen 3.371 N/A ILE 278.A N LYS 274.A O no hydrogen 2.971 N/A VAL 280.A N GLU 277.A O no hydrogen 2.690 N/A LEU 281.A N GLU 277.A O no hydrogen 3.133 N/A LEU 282.A N ILE 278.A O no hydrogen 3.131 N/A LEU 282.A N PRO 279.A O no hydrogen 3.217 N/A LYS 284.A N VAL 280.A O no hydrogen 2.955 N/A LEU 285.A N LEU 281.A O no hydrogen 3.056 N/A GLU 286.A N GLU 283.A O no hydrogen 3.326 N/A ILE 287.A N LEU 282.A O no hydrogen 3.034 N/A GLU 293.A N LYS 290.A O no hydrogen 3.450 N/A LYS 294.A NZ GLY 291.A O no hydrogen 2.482 N/A ASP 295.A N ASP 292.A O no hydrogen 2.945 N/A LEU 296.A N GLU 293.A O no hydrogen 3.338 N/A LEU 301.A N GLU 297.A O no hydrogen 3.382 N/A LEU 302.A N GLY 298.A O no hydrogen 3.299 N/A LYS 303.A N LYS 299.A O no hydrogen 2.987 N/A VAL 304.A N ALA 300.A O no hydrogen 3.206 N/A VAL 305.A N LEU 301.A O no hydrogen 2.864 N/A MET 306.A N LEU 302.A O no hydrogen 3.105 N/A ARG 307.A NE LYS 303.A O no hydrogen 3.049 N/A LYS 308.A N VAL 304.A O no hydrogen 3.274 N/A LYS 308.A NZ GLU 293.A OE1 no hydrogen 3.382 N/A PHE 309.A N MET 306.A O no hydrogen 3.244 N/A LEU 310.A N MET 306.A O no hydrogen 2.796 N/A ALA 312.A N GLY 199.A O no hydrogen 2.978 N/A ALA 315.A N ALA 312.A O no hydrogen 3.176 N/A LEU 316.A N ALA 312.A O no hydrogen 2.935 N/A LEU 317.A N ALA 313.A O no hydrogen 3.098 N/A MET 319.A N ALA 315.A O no hydrogen 2.951 N/A ILE 320.A N LEU 316.A O no hydrogen 2.819 N/A ILE 320.A N LEU 317.A O no hydrogen 3.082 N/A VAL 321.A N LEU 317.A O no hydrogen 3.074 N/A LEU 322.A N GLU 318.A O no hydrogen 3.055 N/A HIS 323.A N ILE 320.A O no hydrogen 3.196 N/A HIS 323.A ND1 MET 319.A O no hydrogen 3.157 N/A LEU 324.A N ILE 320.A O no hydrogen 2.506 N/A ALA 330.A N SER 326.A O no hydrogen 2.997 N/A GLN 331.A N PRO 327.A O no hydrogen 2.914 N/A ALA 332.A N THR 329.A O no hydrogen 3.142 N/A TYR 333.A N ALA 330.A O no hydrogen 3.022 N/A ARG 334.A N ALA 330.A O no hydrogen 2.571 N/A ARG 334.A NH2 ASP 105.A O no hydrogen 3.102 N/A ALA 335.A N GLN 331.A O no hydrogen 3.262 N/A GLN 337.A N ARG 334.A O no hydrogen 2.818 N/A LEU 338.A N ARG 334.A O no hydrogen 2.581 N/A ALA 343.A N GLY 341.A O no hydrogen 2.653 N/A ASP 345.A N PRO 342.A O no hydrogen 3.166 N/A ASN 347.A N ASP 345.A OD2 no hydrogen 3.144 N/A CYS 348.A SG PRO 342.A O no hydrogen 3.223 N/A CYS 348.A SG ALA 343.A O no hydrogen 3.681 N/A CYS 348.A SG CYS 348.A O no hydrogen 2.998 N/A ILE 349.A N ALA 346.A O no hydrogen 3.123 N/A ALA 350.A N ALA 346.A O no hydrogen 3.113 N/A LYS 352.A N ILE 349.A O no hydrogen 2.939 N/A LYS 352.A NZ GLU 336.A OE2 no hydrogen 2.799 N/A ASN 353.A N ILE 349.A O no hydrogen 2.655 N/A CYS 354.A N ALA 350.A O no hydrogen 2.952 N/A LEU 360.A N THR 453.A OG1 no hydrogen 2.754 N/A MET 361.A N ALA 384.A O no hydrogen 2.906 N/A LEU 362.A N LEU 451.A O no hydrogen 3.291 N/A TYR 363.A N ARG 381.A O no hydrogen 3.216 N/A SER 365.A N PHE 379.A O no hydrogen 3.187 N/A THR 370.A OG1 VAL 368.A O no hydrogen 3.363 N/A SER 371.A OG SER 371.A O no hydrogen 2.521 N/A TYR 377.A N VAL 368.A O no hydrogen 3.045 N/A PHE 379.A N LYS 366.A O no hydrogen 3.163 N/A GLY 380.A N ILE 436.A O no hydrogen 3.251 N/A ARG 381.A N TYR 363.A O no hydrogen 3.164 N/A VAL 382.A N ASN 434.A O no hydrogen 2.593 N/A PHE 383.A N MET 361.A O no hydrogen 2.723 N/A ALA 384.A N MET 361.A O no hydrogen 3.328 N/A LYS 388.A NZ THR 386.A OG1 no hydrogen 2.946 N/A SER 389.A OG ILE 427.A O no hydrogen 3.051 N/A GLY 390.A N LYS 388.A O no hydrogen 2.651 N/A GLN 391.A N LYS 388.A O no hydrogen 3.110 N/A VAL 393.A N LYS 411.A O no hydrogen 2.462 N/A ARG 394.A N THR 452.A O no hydrogen 2.578 N/A ARG 394.A NE SER 454.A O no hydrogen 2.606 N/A ARG 394.A NH1 TYR 400.A OH no hydrogen 2.825 N/A ILE 395.A N PHE 409.A O no hydrogen 2.412 N/A GLN 396.A N THR 450.A O no hydrogen 2.649 N/A GLN 396.A NE2 THR 452.A OG1 no hydrogen 2.898 N/A GLN 396.A NE2 ALA 457.A O no hydrogen 3.685 N/A GLY 397.A N ASP 407.A OD1 no hydrogen 2.677 N/A TYR 400.A N GLY 397.A O no hydrogen 3.142 N/A VAL 401.A N ASP 406.A OD1 no hydrogen 3.316 N/A PHE 409.A N ILE 395.A O no hydrogen 3.307 N/A VAL 417.A N GLY 437.A O no hydrogen 2.776 N/A LEU 418.A N GLU 425.A O no hydrogen 2.907 N/A MET 420.A N PHE 423.A O no hydrogen 3.250 N/A GLY 421.A N ALA 56.A O no hydrogen 2.665 N/A ARG 422.A NE ARG 422.A O no hydrogen 2.808 N/A GLU 425.A N LEU 418.A O no hydrogen 3.462 N/A ILE 427.A N VAL 416.A O no hydrogen 2.723 N/A CYS 430.A N ASP 429.A OD1 no hydrogen 2.565 N/A CYS 430.A SG PRO 431.A O no hydrogen 3.690 N/A GLY 433.A N VAL 382.A O no hydrogen 2.753 N/A ASN 434.A N VAL 382.A O no hydrogen 3.170 N/A ILE 436.A N GLY 380.A O no hydrogen 3.085 N/A GLY 437.A N VAL 417.A O no hydrogen 2.944 N/A LEU 438.A N ALA 378.A O no hydrogen 2.801 N/A VAL 439.A N ARG 415.A O no hydrogen 3.253 N/A GLN 443.A N GLN 443.A OE1 no hydrogen 2.388 N/A THR 448.A OG1 LYS 447.A O no hydrogen 2.571 N/A THR 450.A N GLN 396.A O no hydrogen 2.843 N/A LEU 451.A N LEU 362.A O no hydrogen 3.100 N/A THR 452.A N ARG 394.A O no hydrogen 2.757 N/A THR 452.A OG1 ARG 394.A O no hydrogen 3.497 N/A GLU 455.A N SER 454.A OG no hydrogen 2.535 N/A HIS 458.A N TYR 339.A OH no hydrogen 2.532 N/A ASN 459.A ND2 GLY 397.A O no hydrogen 3.599 N/A PHE 465.A N MET 463.A O no hydrogen 2.540 N/A VAL 473.A N VAL 512.A O no hydrogen 3.226 N/A ALA 474.A N SER 539.A O no hydrogen 2.961 N/A VAL 475.A N HIS 510.A O no hydrogen 2.683 N/A GLU 476.A N LYS 537.A O no hydrogen 3.331 N/A LEU 483.A N ALA 480.A O no hydrogen 2.948 N/A LYS 485.A N ASP 482.A O no hydrogen 2.893 N/A LYS 485.A NZ ASN 481.A O no hydrogen 2.993 N/A LEU 486.A N ASP 482.A O no hydrogen 3.144 N/A LEU 490.A N VAL 487.A O no hydrogen 3.192 N/A ARG 492.A N GLU 488.A O no hydrogen 3.168 N/A LEU 493.A N GLY 489.A O no hydrogen 2.355 N/A SER 494.A N LEU 490.A O no hydrogen 2.989 N/A SER 494.A OG LEU 490.A O no hydrogen 2.496 N/A SER 494.A OG THR 502.A OG1 no hydrogen 2.460 N/A LYS 495.A N ARG 492.A O no hydrogen 3.085 N/A LYS 495.A NZ LEU 445.A O no hydrogen 3.030 N/A SER 496.A N ARG 492.A O no hydrogen 3.037 N/A SER 496.A OG ARG 492.A O no hydrogen 3.130 N/A SER 496.A OG HIS 531.A NE2 no hydrogen 2.950 N/A ASP 497.A N LEU 493.A O no hydrogen 3.134 N/A CYS 499.A N ASP 497.A OD1 no hydrogen 3.357 N/A CYS 499.A SG SER 95.A OG no hydrogen 2.936 N/A CYS 499.A SG VAL 467.A O no hydrogen 3.723 N/A LEU 501.A N ALA 513.A O no hydrogen 3.134 N/A THR 502.A OG1 LEU 490.A O no hydrogen 3.184 N/A THR 502.A OG1 SER 494.A OG no hydrogen 2.460 N/A TYR 503.A N ILE 511.A O no hydrogen 3.038 N/A SER 505.A N GLU 509.A O no hydrogen 2.619 N/A SER 505.A OG GLU 509.A O no hydrogen 3.047 N/A GLU 506.A N GLU 506.A OE1 no hydrogen 2.906 N/A GLU 509.A N SER 505.A OG no hydrogen 2.712 N/A ILE 511.A N TYR 503.A O no hydrogen 2.850 N/A VAL 512.A N VAL 473.A O no hydrogen 2.995 N/A ALA 513.A N LEU 501.A O no hydrogen 2.578 N/A GLY 514.A N VAL 471.A O no hydrogen 2.694 N/A THR 515.A OG1 ASP 92.A O no hydrogen 2.874 N/A HIS 519.A N ASP 92.A OD2 no hydrogen 3.242 N/A LEU 520.A N GLY 516.A O no hydrogen 3.020 N/A GLU 521.A N GLU 517.A O no hydrogen 2.673 N/A ILE 522.A N LEU 518.A O no hydrogen 3.018 N/A CYS 523.A N HIS 519.A O no hydrogen 3.180 N/A CYS 523.A SG ASP 497.A OD2 no hydrogen 3.576 N/A CYS 523.A SG HIS 519.A O no hydrogen 3.171 N/A LEU 524.A N LEU 520.A O no hydrogen 2.974 N/A GLN 525.A N GLU 521.A O no hydrogen 3.111 N/A ASP 526.A N ILE 522.A O no hydrogen 3.084 N/A LEU 527.A N CYS 523.A O no hydrogen 3.402 N/A GLU 528.A N LEU 524.A O no hydrogen 3.321 N/A GLU 528.A N GLN 525.A O no hydrogen 3.119 N/A HIS 529.A N GLN 525.A O no hydrogen 3.162 N/A ASP 530.A N ASP 526.A O no hydrogen 2.665 N/A HIS 531.A N ASP 526.A O no hydrogen 2.968 N/A HIS 531.A NE2 SER 496.A OG no hydrogen 2.950 N/A LYS 537.A N GLU 476.A O no hydrogen 3.095 N/A LYS 537.A NZ GLU 476.A OE1 no hydrogen 2.607 N/A SER 539.A N ALA 474.A O no hydrogen 3.301 N/A ARG 546.A N GLN 706.A O no hydrogen 2.994 N/A ARG 546.A NH1 TYR 545.A O no hydrogen 2.388 N/A GLU 547.A N GLU 662.A O no hydrogen 2.990 N/A THR 548.A N LYS 704.A O no hydrogen 3.126 N/A THR 548.A OG1 LYS 704.A O no hydrogen 2.784 N/A GLU 550.A N ALA 701.A O no hydrogen 2.983 N/A SER 551.A N ALA 701.A O no hydrogen 3.032 N/A GLU 552.A N GLU 550.A O no hydrogen 2.881 N/A SER 553.A N ALA 572.A O no hydrogen 3.115 N/A SER 553.A OG GLN 555.A O no hydrogen 3.299 N/A ALA 557.A N LEU 570.A O no hydrogen 2.870 N/A SER 561.A N ASN 566.A O no hydrogen 2.832 N/A SER 561.A OG ASN 563.A OD1 no hydrogen 2.218 N/A ASN 563.A N GLN 685.A OE1 no hydrogen 3.285 N/A LYS 564.A N SER 561.A O no hydrogen 2.723 N/A HIS 565.A N ASN 563.A OD1 no hydrogen 3.411 N/A ASN 566.A N SER 561.A OG no hydrogen 3.268 N/A ARG 567.A N THR 674.A O no hydrogen 3.358 N/A ILE 568.A N SER 559.A O no hydrogen 3.137 N/A TYR 569.A N ASP 672.A O no hydrogen 2.572 N/A LEU 570.A N ALA 557.A O no hydrogen 3.433 N/A LYS 571.A N ASN 669.A O no hydrogen 3.320 N/A LYS 571.A N ASN 669.A OD1 no hydrogen 3.328 N/A GLU 573.A N ARG 667.A O no hydrogen 2.881 N/A ILE 575.A N SER 665.A O no hydrogen 2.702 N/A GLU 578.A N ASP 576.A OD2 no hydrogen 3.293 N/A SER 580.A N ASP 576.A O no hydrogen 2.844 N/A SER 580.A OG ASP 576.A O no hydrogen 3.393 N/A LEU 581.A N GLU 577.A O no hydrogen 2.769 N/A ALA 582.A N GLU 578.A O no hydrogen 3.011 N/A ILE 583.A N VAL 579.A O no hydrogen 3.055 N/A GLU 584.A N SER 580.A O no hydrogen 3.186 N/A ASN 585.A N LEU 581.A O no hydrogen 2.692 N/A ILE 588.A N ALA 582.A O no hydrogen 3.208 N/A ASN 589.A N ASP 592.A OD2 no hydrogen 3.035 N/A ASP 592.A N ASN 589.A O no hydrogen 3.155 N/A ARG 597.A N ASP 593.A O no hydrogen 2.959 N/A ARG 597.A NH1 ASN 589.A O no hydrogen 3.446 N/A ALA 598.A N PHE 594.A O no hydrogen 2.872 N/A ARG 599.A N LYS 595.A O no hydrogen 3.140 N/A ILE 600.A N ALA 596.A O no hydrogen 3.437 N/A MET 601.A N ARG 597.A O no hydrogen 3.156 N/A ALA 602.A N ARG 599.A O no hydrogen 3.175 N/A ASP 604.A N ILE 600.A O no hydrogen 3.189 N/A TRP 607.A N ALA 602.A O no hydrogen 3.240 N/A THR 610.A OG1 ASP 611.A OD1 no hydrogen 3.539 N/A ASP 611.A N ASP 608.A OD1 no hydrogen 3.415 N/A ALA 612.A N ASP 608.A O no hydrogen 3.074 N/A ARG 613.A N VAL 609.A O no hydrogen 3.132 N/A LYS 614.A N ASP 611.A O no hydrogen 3.261 N/A TRP 616.A N VAL 628.A O no hydrogen 2.572 N/A GLY 622.A N GLN 650.A OE1 no hydrogen 2.900 N/A ASN 623.A N PRO 620.A O no hydrogen 2.957 N/A GLY 624.A N PHE 618.A O no hydrogen 2.246 N/A ASN 626.A ND2 GLY 619.A O no hydrogen 3.003 N/A LEU 627.A N VAL 666.A O no hydrogen 3.069 N/A ILE 629.A N VAL 668.A O no hydrogen 2.805 N/A ASP 630.A N ASP 630.A OD1 no hydrogen 2.414 N/A GLN 631.A N ILE 670.A O no hydrogen 2.955 N/A LYS 642.A N HIS 639.A O no hydrogen 3.295 N/A SER 644.A N ILE 641.A O no hydrogen 3.129 N/A SER 644.A OG GLY 683.A O no hydrogen 3.308 N/A VAL 645.A N ILE 641.A O no hydrogen 3.103 N/A VAL 646.A N LYS 642.A O no hydrogen 3.030 N/A ALA 648.A N SER 644.A O no hydrogen 3.268 N/A PHE 649.A N VAL 645.A O no hydrogen 3.021 N/A GLN 650.A N VAL 646.A O no hydrogen 2.893 N/A TRP 651.A N ALA 648.A O no hydrogen 3.000 N/A ALA 652.A N ALA 648.A O no hydrogen 2.777 N/A THR 653.A N PHE 649.A O no hydrogen 3.181 N/A THR 653.A OG1 PHE 649.A O no hydrogen 2.539 N/A GLU 655.A N TRP 651.A O no hydrogen 2.867 N/A PHE 659.A N GLU 547.A OE2 no hydrogen 3.131 N/A GLY 660.A N GLY 656.A O no hydrogen 3.060 N/A GLU 661.A N GLU 547.A OE2 no hydrogen 3.202 N/A MET 663.A N THR 653.A O no hydrogen 2.817 N/A ARG 664.A N GLU 547.A O no hydrogen 3.048 N/A ARG 664.A NH1 GLU 584.A OE2 no hydrogen 2.872 N/A ARG 664.A NH2 GLU 584.A OE1 no hydrogen 2.459 N/A SER 665.A N PRO 625.A O no hydrogen 2.818 N/A SER 665.A OG ARG 664.A O no hydrogen 2.566 N/A VAL 666.A N ASN 626.A OD1 no hydrogen 2.936 N/A ARG 667.A N GLU 573.A O no hydrogen 2.697 N/A VAL 668.A N LEU 627.A O no hydrogen 2.817 N/A ASN 669.A N LYS 571.A O no hydrogen 3.395 N/A ILE 670.A N ILE 629.A O no hydrogen 2.896 N/A ASP 672.A N TYR 569.A O no hydrogen 3.088 N/A THR 674.A N ARG 567.A O no hydrogen 3.068 N/A HIS 676.A N ASN 566.A OD1 no hydrogen 2.847 N/A ASP 678.A N HIS 676.A ND1 no hydrogen 3.132 N/A ARG 681.A NE GLU 640.A OE2 no hydrogen 2.345 N/A ARG 681.A NH1 HIS 676.A O no hydrogen 3.562 N/A GLN 685.A N GLY 682.A O no hydrogen 2.999 N/A ILE 686.A N GLY 682.A O no hydrogen 3.159 N/A ILE 687.A N GLY 683.A O no hydrogen 3.200 N/A THR 689.A N GLN 685.A O no hydrogen 3.346 N/A MET 690.A N ILE 686.A O no hydrogen 2.750 N/A ARG 691.A N ILE 687.A O no hydrogen 2.568 N/A ARG 692.A N PRO 688.A O no hydrogen 2.781 N/A ARG 692.A NH1 LYS 560.A O no hydrogen 2.951 N/A ALA 693.A N THR 689.A O no hydrogen 3.129 N/A THR 694.A N MET 690.A O no hydrogen 3.149 N/A THR 694.A OG1 MET 690.A O no hydrogen 3.078 N/A TYR 695.A N ARG 691.A O no hydrogen 3.298 N/A TYR 695.A OH GLU 655.A O no hydrogen 2.287 N/A ALA 696.A N ARG 692.A O no hydrogen 2.936 N/A GLY 697.A N ALA 693.A O no hydrogen 2.807 N/A PHE 698.A N THR 694.A O no hydrogen 2.797 N/A LEU 699.A N TYR 695.A O no hydrogen 2.902 N/A LEU 700.A N ALA 696.A O no hydrogen 3.237 N/A ALA 701.A N PHE 698.A O no hydrogen 3.419 N/A LYS 704.A N THR 548.A O no hydrogen 2.899 N/A LYS 704.A NZ THR 784.A OG1 no hydrogen 2.241 N/A LYS 704.A NZ LEU 785.A O no hydrogen 2.729 N/A GLN 706.A N ARG 546.A O no hydrogen 2.445 N/A GLN 706.A NE2 GLU 577.A OE1 no hydrogen 3.385 N/A GLN 706.A NE2 TRP 782.A O no hydrogen 2.780 N/A GLU 707.A N SER 783.A O no hydrogen 2.464 N/A VAL 709.A N HIS 781.A O no hydrogen 3.189 N/A PHE 710.A N LEU 753.A O no hydrogen 2.551 N/A LEU 711.A N VAL 778.A O no hydrogen 2.776 N/A VAL 712.A N ALA 751.A O no hydrogen 3.083 N/A GLU 713.A N GLN 776.A O no hydrogen 2.632 N/A ILE 714.A N VAL 749.A O no hydrogen 3.010 N/A GLN 715.A N PHE 774.A O no hydrogen 3.252 N/A CYS 716.A N PHE 747.A O no hydrogen 3.355 N/A CYS 716.A SG PRO 717.A O no hydrogen 3.867 N/A GLN 719.A N GLN 719.A OE1 no hydrogen 2.701 N/A ALA 720.A N PRO 717.A O no hydrogen 3.296 N/A VAL 721.A N GLU 718.A O no hydrogen 2.982 N/A ILE 724.A N ALA 720.A O no hydrogen 3.225 N/A TYR 725.A N VAL 721.A O no hydrogen 3.295 N/A SER 726.A OG GLY 723.A O no hydrogen 3.376 N/A LYS 730.A N SER 726.A O no hydrogen 3.199 N/A LYS 731.A N VAL 727.A O no hydrogen 3.018 N/A LYS 731.A NZ GLU 757.A O no hydrogen 3.166 N/A LYS 731.A NZ PHE 759.A O no hydrogen 3.294 N/A ARG 732.A N ASN 729.A O no hydrogen 3.366 N/A ARG 732.A NE GLU 757.A OE2 no hydrogen 2.572 N/A ARG 732.A NH1 GLU 707.A OE2 no hydrogen 3.035 N/A ARG 732.A NH2 GLU 707.A OE1 no hydrogen 3.293 N/A ARG 732.A NH2 GLU 757.A OE2 no hydrogen 3.301 N/A GLY 733.A N LEU 728.A O no hydrogen 2.582 N/A GLN 734.A N TYR 752.A O no hydrogen 2.920 N/A VAL 736.A N LYS 750.A O no hydrogen 2.880 N/A SER 737.A N LYS 750.A O no hydrogen 3.113 N/A THR 744.A N ARG 741.A O no hydrogen 3.427 N/A PHE 747.A N CYS 716.A O no hydrogen 2.745 N/A THR 748.A N GLU 739.A O no hydrogen 2.748 N/A THR 748.A OG1 GLU 739.A OE2 no hydrogen 2.760 N/A VAL 749.A N ILE 714.A O no hydrogen 2.919 N/A LYS 750.A N SER 737.A O no hydrogen 3.032 N/A ALA 751.A N VAL 712.A O no hydrogen 3.069 N/A TYR 752.A N GLN 734.A O no hydrogen 2.538 N/A LEU 753.A N PHE 710.A O no hydrogen 2.934 N/A VAL 755.A N PRO 708.A O no hydrogen 3.130 N/A SER 758.A N VAL 755.A O no hydrogen 3.097 N/A SER 758.A OG VAL 755.A O no hydrogen 2.718 N/A PHE 761.A N SER 758.A O no hydrogen 3.111 N/A GLU 764.A N GLY 760.A O no hydrogen 3.223 N/A LEU 765.A N PHE 761.A O no hydrogen 3.050 N/A ARG 766.A N THR 762.A O no hydrogen 3.082 N/A GLN 767.A N GLY 763.A O no hydrogen 2.852 N/A ALA 768.A N GLU 764.A O no hydrogen 2.826 N/A THR 769.A OG1 LEU 765.A O no hydrogen 2.249 N/A THR 769.A OG1 GLY 770.A O no hydrogen 3.383 N/A GLN 776.A NE2 SER 468.A OG no hydrogen 3.332 N/A VAL 778.A N LEU 711.A O no hydrogen 3.035 N/A ASP 780.A N VAL 709.A O no hydrogen 3.072 N/A SER 783.A N GLU 707.A O no hydrogen 2.706 N/A THR 784.A OG1 ILE 705.A O no hydrogen 3.005 N/A THR 784.A OG1 LEU 785.A O no hydrogen 3.052 N/A LEU 785.A N THR 784.A OG1 no hydrogen 2.492 N/A THR 793.A N ASP 791.A O no hydrogen 2.792 N/A SER 794.A OG SER 787.A O no hydrogen 2.585 N/A SER 794.A OG ASP 788.A O no hydrogen 3.436 N/A SER 794.A OG ASP 791.A OD1 no hydrogen 3.193 N/A ALA 802.A N GLU 798.A O no hydrogen 3.359 N/A ALA 803.A N ILE 799.A O no hydrogen 2.857 N/A ARG 804.A N VAL 800.A O no hydrogen 2.699 N/A LYS 805.A N LEU 801.A O no hydrogen 2.696 N/A ARG 806.A N ALA 802.A O no hydrogen 2.686 N/A GLY 808.A N ARG 804.A O no hydrogen 2.792 N/A GLY 808.A N LYS 805.A O no hydrogen 3.207 N/A MET 809.A N ARG 804.A O no hydrogen 3.304 N/A GLU 812.A N LYS 810.A O no hydrogen 2.433 N/A GLU 818.A N GLY 815.A O no hydrogen 3.150 N/A TYR 819.A N TRP 816.A O no hydrogen 3.197 N/A