Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 6drd_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ARG 1.A NH1 ASN 111.A OD1 no hydrogen 2.924 N/A THR 2.A OG1 SER 102.A O no hydrogen 3.254 N/A VAL 3.A N THR 2.A OG1 no hydrogen 2.540 N/A THR 5.A N PHE 104.A O no hydrogen 3.316 N/A THR 5.A OG1 THR 103.A OG1 no hydrogen 3.036 N/A SER 11.A N GLN 14.A OE1 no hydrogen 3.228 N/A SER 11.A OG ASP 13.A OD1 no hydrogen 3.563 N/A GLN 14.A N ILE 12.A O no hydrogen 2.745 N/A VAL 15.A N ARG 95.A O no hydrogen 2.993 N/A GLY 16.A N ARG 105.A O no hydrogen 2.686 N/A VAL 17.A N ARG 97.A O no hydrogen 3.157 N/A ILE 21.A N PRO 18.A O no hydrogen 2.906 N/A ALA 22.A N PRO 18.A O no hydrogen 3.128 N/A ASN 24.A N ILE 21.A O no hydrogen 3.216 N/A PHE 27.A N ARG 81.A O no hydrogen 3.456 N/A GLU 29.A N VAL 79.A O no hydrogen 2.534 N/A VAL 31.A N TYR 77.A O no hydrogen 3.051 N/A THR 32.A N ASN 35.A OD1 no hydrogen 2.577 N/A THR 32.A OG1 ASN 35.A OD1 no hydrogen 2.862 N/A ASN 35.A N THR 32.A OG1 no hydrogen 3.203 N/A ASN 35.A ND2 GLU 29.A OE2 no hydrogen 2.547 N/A ASN 35.A ND2 ILE 30.A O no hydrogen 3.294 N/A ARG 38.A N ASN 35.A O no hydrogen 2.863 N/A LEU 39.A N ASN 35.A O no hydrogen 2.680 N/A VAL 43.A N LEU 39.A O no hydrogen 2.771 N/A ARG 44.A N GLN 40.A O no hydrogen 2.968 N/A ARG 45.A N GLU 41.A O no hydrogen 3.109 N/A GLY 52.A N TYR 50.A O no hydrogen 2.711 N/A ALA 53.A N GLY 46.A O no hydrogen 3.144 N/A LYS 54.A N GLU 80.A O no hydrogen 2.888 N/A ILE 56.A N ILE 60.A O no hydrogen 3.392 N/A ILE 57.A N LYS 78.A O no hydrogen 2.648 N/A ILE 60.A N ILE 56.A O no hydrogen 3.134 N/A ARG 63.A N ASP 61.A O no hydrogen 2.799 N/A LYS 67.A NZ ASP 70.A OD2 no hydrogen 3.482 N/A ASP 70.A N LYS 67.A O no hydrogen 2.943 N/A TYR 77.A N GLN 74.A O no hydrogen 3.465 N/A LYS 78.A N ILE 57.A O no hydrogen 2.977 N/A VAL 79.A N GLU 29.A O no hydrogen 2.701 N/A GLU 80.A N TYR 55.A O no hydrogen 3.141 N/A HIS 82.A N GLY 52.A O no hydrogen 3.054 N/A CYS 84.A SG MET 83.A O no hydrogen 3.273 N/A GLY 86.A N VAL 96.A O no hydrogen 2.935 N/A ILE 90.A N HIS 113.A O no hydrogen 3.031 N/A PHE 91.A N MET 92.A O no hydrogen 2.697 N/A HIS 94.A N VAL 89.A O no hydrogen 2.857 N/A VAL 96.A N ASP 87.A O no hydrogen 2.980 N/A ARG 97.A N VAL 15.A O no hydrogen 2.897 N/A THR 103.A OG1 THR 5.A OG1 no hydrogen 3.036 N/A PHE 104.A N VAL 3.A O no hydrogen 3.039 N/A ARG 105.A N GLY 16.A O no hydrogen 3.345 N/A LEU 106.A N THR 5.A O no hydrogen 3.329 N/A ASN 107.A ND2 LEU 10.A O no hydrogen 3.043 N/A MET 110.A N THR 2.A O no hydrogen 3.467 N/A GLN 116.A NE2 THR 26.A O no hydrogen 3.156 N/A GLN 116.A NE2 LEU 114.A O no hydrogen 3.126 N/A GLU 119.A N SER 117.A OG no hydrogen 3.171 N/A ARG 121.A N SER 117.A O no hydrogen 3.085 N/A GLU 123.A N GLU 119.A O no hydrogen 3.045 N/A GLN 125.A N ARG 121.A O no hydrogen 3.084 N/A GLU 126.A N ALA 122.A O no hydrogen 3.251 N/A ALA 128.A N ILE 124.A O no hydrogen 2.813 N/A ARG 132.A N MET 129.A O no hydrogen 2.852 N/A GLN 136.A NE2 ALA 371.A O no hydrogen 2.343 N/A THR 138.A OG1 GLN 270.A OE1 no hydrogen 3.212 N/A LEU 139.A N VAL 135.A O no hydrogen 3.071 N/A THR 140.A N GLN 136.A O no hydrogen 3.018 N/A THR 140.A OG1 GLN 136.A O no hydrogen 3.490 N/A VAL 142.A N THR 138.A O no hydrogen 3.045 N/A ARG 143.A N THR 140.A O no hydrogen 2.831 N/A PHE 145.A N ALA 141.A O no hydrogen 3.000 N/A THR 146.A N ARG 143.A O no hydrogen 3.292 N/A THR 146.A OG1 VAL 142.A O no hydrogen 2.883 N/A ARG 148.A NE ASP 222.A OD1 no hydrogen 2.543 N/A ARG 148.A NH2 ASP 222.A OD1 no hydrogen 3.102 N/A LEU 152.A N TRP 183.A O no hydrogen 2.642 N/A ASN 159.A N GLU 156.A O no hydrogen 3.335 N/A LEU 160.A N GLU 156.A O no hydrogen 2.982 N/A LEU 161.A N VAL 157.A O no hydrogen 2.762 N/A MET 162.A N ASN 159.A O no hydrogen 2.820 N/A PHE 163.A N ASN 159.A O no hydrogen 3.213 N/A SER 165.A OG ASN 268.A OD1 no hydrogen 3.112 N/A ILE 176.A N LEU 182.A O no hydrogen 3.397 N/A TRP 183.A N LEU 152.A O no hydrogen 2.874 N/A TRP 183.A NE1 PRO 172.A O no hydrogen 3.087 N/A GLY 185.A N VAL 150.A O no hydrogen 3.265 N/A LYS 186.A NZ ASP 222.A OD2 no hydrogen 2.325 N/A GLN 187.A N THR 184.A O no hydrogen 3.071 N/A PHE 189.A N GLY 185.A O no hydrogen 3.130 N/A SER 190.A N LYS 186.A O no hydrogen 3.015 N/A SER 190.A OG LYS 186.A O no hydrogen 2.787 N/A LEU 191.A N ILE 188.A O no hydrogen 2.829 N/A CYS 199.A N VAL 227.A O no hydrogen 3.299 N/A CYS 199.A SG GLY 247.A O no hydrogen 3.516 N/A ARG 201.A N VAL 225.A O no hydrogen 3.143 N/A ARG 201.A NH2 LYS 240.A O no hydrogen 3.430 N/A SER 204.A OG VAL 368.A O no hydrogen 2.805 N/A THR 205.A OG1 HIS 203.A NE2 no hydrogen 3.183 N/A HIS 206.A N HIS 203.A O no hydrogen 3.321 N/A GLU 210.A N PRO 207.A O no hydrogen 3.246 N/A SER 212.A OG PRO 214.A O no hydrogen 3.285 N/A SER 219.A OG ILE 218.A O no hydrogen 2.640 N/A SER 219.A OG SER 219.A O no hydrogen 2.422 N/A SER 219.A OG THR 223.A O no hydrogen 3.193 N/A ASP 222.A N SER 219.A O no hydrogen 2.598 N/A LYS 224.A N THR 223.A OG1 no hydrogen 2.417 N/A VAL 227.A N CYS 199.A O no hydrogen 3.049 N/A ASN 229.A N ASN 198.A OD1 no hydrogen 3.068 N/A GLY 230.A N ILE 197.A O no hydrogen 3.162 N/A GLU 231.A N GLU 228.A O no hydrogen 3.089 N/A LEU 232.A N SER 190.A OG no hydrogen 2.601 N/A ILE 233.A N VAL 226.A O no hydrogen 3.279 N/A ILE 236.A N ASP 222.A O no hydrogen 3.090 N/A LYS 239.A N SER 369.A O no hydrogen 3.151 N/A LEU 242.A N LYS 239.A O no hydrogen 3.086 N/A GLY 243.A N LYS 239.A O no hydrogen 2.867 N/A THR 244.A OG1 THR 244.A O no hydrogen 2.607 N/A SER 245.A OG LYS 240.A O no hydrogen 3.405 N/A SER 245.A OG SER 248.A OG no hydrogen 2.646 N/A ILE 252.A N SER 248.A O no hydrogen 2.706 N/A SER 253.A OG SER 253.A O no hydrogen 2.404 N/A SER 253.A OG THR 262.A OG1 no hydrogen 3.340 N/A TYR 254.A N HIS 251.A O no hydrogen 3.049 N/A LEU 255.A N ILE 252.A O no hydrogen 3.060 N/A THR 262.A N HIS 259.A O no hydrogen 3.183 N/A THR 262.A OG1 SER 253.A O no hydrogen 2.209 N/A THR 262.A OG1 SER 253.A OG no hydrogen 3.340 N/A THR 262.A OG1 GLY 258.A O no hydrogen 3.381 N/A ARG 263.A N HIS 259.A O no hydrogen 2.973 N/A TYR 266.A N THR 262.A O no hydrogen 3.030 N/A TYR 266.A N ARG 263.A O no hydrogen 3.302 N/A SER 267.A N ARG 263.A O no hydrogen 3.094 N/A ASN 268.A N LEU 264.A O no hydrogen 2.971 N/A GLN 270.A N TYR 266.A O no hydrogen 2.683 N/A GLN 270.A NE2 ASN 107.A OD1 no hydrogen 3.671 N/A THR 271.A N ASN 268.A O no hydrogen 2.902 N/A THR 271.A OG1 PHE 163.A O no hydrogen 2.958 N/A THR 271.A OG1 ASN 268.A O no hydrogen 2.801 N/A VAL 272.A N ASN 268.A O no hydrogen 2.920 N/A ASN 274.A ND2 GLN 270.A O no hydrogen 3.459 N/A ASN 275.A N THR 271.A O no hydrogen 2.581 N/A ILE 279.A N TRP 276.A O no hydrogen 2.887 N/A GLU 280.A N LEU 277.A O no hydrogen 3.035 N/A GLY 281.A N LEU 277.A O no hydrogen 2.517 N/A HIS 282.A N GLU 280.A O no hydrogen 3.194 N/A GLY 285.A N ASP 288.A OD2 no hydrogen 3.123 N/A ASP 288.A N GLY 285.A O no hydrogen 3.230 N/A SER 289.A N ILE 286.A O no hydrogen 3.218 N/A SER 289.A OG ILE 286.A O no hydrogen 3.324 N/A THR 295.A N ASP 292.A O no hydrogen 3.346 N/A THR 295.A OG1 ASP 292.A O no hydrogen 3.496 N/A THR 295.A OG1 ASP 292.A OD1 no hydrogen 3.256 N/A TYR 296.A N ASP 292.A O no hydrogen 3.111 N/A ILE 299.A N THR 295.A O no hydrogen 2.442 N/A ASN 301.A N GLN 297.A O no hydrogen 3.278 N/A LYS 304.A N GLN 300.A O no hydrogen 2.818 N/A LYS 305.A N THR 302.A O no hydrogen 2.853 N/A ALA 306.A N THR 302.A O no hydrogen 2.869 N/A LYS 307.A N ILE 303.A O no hydrogen 3.182 N/A ASP 309.A N LYS 305.A O no hydrogen 3.064 N/A VAL 310.A N ALA 306.A O no hydrogen 3.196 N/A GLU 312.A N GLN 308.A O no hydrogen 3.046 N/A VAL 313.A N VAL 310.A O no hydrogen 3.254 N/A ILE 314.A N VAL 310.A O no hydrogen 3.116 N/A GLU 315.A N ILE 311.A O no hydrogen 3.240 N/A ALA 317.A N VAL 313.A O no hydrogen 3.100 N/A HIS 318.A N ILE 314.A O no hydrogen 2.755 N/A GLU 321.A N LYS 316.A O no hydrogen 3.201 N/A GLU 323.A N GLU 323.A OE1 no hydrogen 2.841 N/A ASN 328.A N THR 325.A O no hydrogen 3.510 N/A THR 329.A N GLN 332.A OE1 no hydrogen 3.107 N/A THR 329.A OG1 GLN 332.A OE1 no hydrogen 2.483 N/A ARG 331.A N THR 329.A OG1 no hydrogen 3.139 N/A THR 333.A N THR 329.A O no hydrogen 3.319 N/A THR 333.A OG1 THR 329.A O no hydrogen 2.400 N/A PHE 334.A N ARG 331.A O no hydrogen 3.008 N/A GLU 335.A N ARG 331.A O no hydrogen 3.318 N/A ASN 336.A N GLN 332.A O no hydrogen 3.321 N/A VAL 338.A N PHE 334.A O no hydrogen 3.087 N/A VAL 338.A N GLU 335.A O no hydrogen 3.244 N/A ASN 339.A N GLU 335.A O no hydrogen 2.801 N/A ILE 341.A N VAL 338.A O no hydrogen 3.073 N/A ASP 347.A N ASP 344.A O no hydrogen 2.995 N/A LYS 348.A N ASP 344.A O no hydrogen 2.415 N/A THR 349.A N ALA 345.A O no hydrogen 3.328 N/A THR 349.A OG1 ALA 345.A O no hydrogen 2.476 N/A GLY 350.A N ASP 347.A O no hydrogen 3.011 N/A SER 351.A N ASP 347.A O no hydrogen 3.104 N/A SER 352.A OG LYS 348.A O no hydrogen 2.872 N/A LYS 355.A N SER 351.A O no hydrogen 3.272 N/A SER 356.A OG ASP 292.A OD1 no hydrogen 3.371 N/A LEU 357.A N GLN 354.A O no hydrogen 3.450 N/A ASN 361.A N SER 358.A O no hydrogen 3.362 N/A ASN 362.A ND2 ASP 288.A OD2 no hydrogen 2.480 N/A LYS 364.A N ASN 361.A O no hydrogen 2.972 N/A SER 365.A N ASN 361.A O no hydrogen 3.381 N/A MET 366.A N PHE 363.A O no hydrogen 3.086 N/A VAL 367.A N LYS 364.A O no hydrogen 3.385 N/A VAL 368.A N LYS 364.A O no hydrogen 3.020 N/A SER 369.A OG LEU 139.A O no hydrogen 3.119 N/A SER 369.A OG THR 140.A O no hydrogen 3.221 N/A GLY 370.A N VAL 367.A O no hydrogen 2.965 N/A ASN 377.A N SER 374.A O no hydrogen 3.191 N/A ALA 383.A N SER 379.A O no hydrogen 3.466 N/A VAL 385.A N ASN 422.A O no hydrogen 3.436 N/A GLN 387.A NE2 GLN 388.A O no hydrogen 3.253 N/A GLN 388.A NE2 HIS 436.A ND1 no hydrogen 3.335 N/A VAL 390.A N LYS 393.A O no hydrogen 2.867 N/A LYS 393.A N VAL 390.A O no hydrogen 2.894 N/A ILE 395.A N ARG 417.A O no hydrogen 3.022 N/A PHE 399.A N ARG 402.A O no hydrogen 3.408 N/A THR 403.A OG1 SER 416.A O no hydrogen 2.980 N/A PHE 407.A N LEU 404.A O no hydrogen 3.458 N/A SER 416.A OG ASP 411.A OD2 no hydrogen 2.369 N/A SER 416.A OG SER 416.A O no hydrogen 2.377 N/A ARG 417.A NE ILE 395.A O no hydrogen 2.448 N/A ARG 417.A NH2 ILE 395.A O no hydrogen 2.940 N/A VAL 420.A N GLY 386.A O no hydrogen 2.791 N/A ASN 422.A ND2 GLU 432.A OE1 no hydrogen 3.341 N/A SER 423.A OG VAL 381.A O no hydrogen 3.154 N/A SER 423.A OG ILE 382.A O no hydrogen 3.111 N/A TYR 424.A OH HIS 436.A NE2 no hydrogen 2.692 N/A THR 429.A OG1 GLU 432.A OE1 no hydrogen 3.190 N/A PHE 433.A N THR 429.A O no hydrogen 2.879 N/A PHE 434.A N THR 431.A O no hydrogen 2.628 N/A PHE 435.A N THR 431.A O no hydrogen 3.313 N/A HIS 436.A N GLU 432.A O no hydrogen 3.133 N/A HIS 436.A ND1 GLN 388.A OE1 no hydrogen 3.232 N/A ALA 437.A N PHE 433.A O no hydrogen 3.257 N/A MET 438.A N PHE 435.A O no hydrogen 3.061 N/A GLY 439.A N PHE 435.A O no hydrogen 3.106 N/A GLY 440.A N HIS 436.A O no hydrogen 3.236 N/A ARG 441.A N MET 438.A O no hydrogen 3.276 N/A THR 447.A OG1 GLY 443.A O no hydrogen 3.422 N/A VAL 449.A N ILE 445.A O no hydrogen 2.871 N/A VAL 449.A N ASP 446.A O no hydrogen 3.107 N/A LYS 450.A N ASP 446.A O no hydrogen 2.687 N/A ALA 452.A N VAL 449.A O no hydrogen 2.883 N/A THR 454.A OG1 LYS 450.A O no hydrogen 3.218 N/A TYR 456.A N GLU 453.A O no hydrogen 3.333 N/A ILE 457.A N GLU 453.A O no hydrogen 3.125 N/A ARG 460.A N ILE 457.A O no hydrogen 3.054 N/A LEU 461.A N ILE 457.A O no hydrogen 2.676 N/A SER 464.A N ARG 460.A O no hydrogen 3.306 N/A MET 465.A N LEU 461.A O no hydrogen 3.418 N/A MET 469.A N ARG 477.A O no hydrogen 2.708 N/A ALA 474.A N LYS 471.A O no hydrogen 2.877 N/A VAL 476.A N GLN 485.A O no hydrogen 2.627 N/A ARG 477.A N MET 469.A O no hydrogen 3.382 N/A ILE 480.A N SER 479.A OG no hydrogen 2.706 N/A GLN 482.A N ASN 478.A OD1 no hydrogen 3.385 N/A GLN 482.A N ILE 480.A O no hydrogen 2.479 N/A VAL 484.A N VAL 476.A O no hydrogen 2.564 N/A GLN 485.A NE2 ASP 972.A OD2 no hydrogen 2.995 N/A GLY 489.A N GLN 485.A OE1 no hydrogen 3.075 N/A GLU 490.A N ARG 487.A O no hydrogen 3.331 N/A GLY 492.A N TYR 488.A O no hydrogen 2.931 N/A ALA 494.A N ALA 676.A O no hydrogen 2.585 N/A GLU 499.A N LEU 576.A O no hydrogen 3.289 N/A GLN 501.A N VAL 574.A O no hydrogen 2.760 N/A GLN 501.A NE2 CYS 578.A O no hydrogen 2.921 N/A LYS 507.A NZ GLY 570.A O no hydrogen 3.197 N/A ASN 510.A N ASP 894.A O no hydrogen 2.903 N/A ALA 512.A N SER 509.A OG no hydrogen 3.398 N/A PHE 513.A N SER 509.A O no hydrogen 3.214 N/A LYS 515.A N ALA 512.A O no hydrogen 2.897 N/A LYS 516.A N ALA 512.A O no hydrogen 2.586 N/A LYS 516.A NZ GLU 654.A OE2 no hydrogen 3.013 N/A PHE 517.A N PHE 513.A O no hydrogen 3.398 N/A ARG 518.A NH1 ARG 518.A O no hydrogen 3.482 N/A ARG 528.A NH2 GLU 524.A OE2 no hydrogen 2.405 N/A ARG 529.A N ARG 525.A O no hydrogen 3.272 N/A ARG 529.A NH1 ARG 529.A O no hydrogen 3.091 N/A ARG 529.A NH2 ARG 596.A O no hydrogen 2.390 N/A THR 530.A N ALA 526.A O no hydrogen 2.449 N/A THR 530.A OG1 ALA 526.A O no hydrogen 2.836 N/A LEU 535.A N GLN 532.A O no hydrogen 3.335 N/A VAL 539.A N LEU 535.A O no hydrogen 3.122 N/A SER 541.A N LYS 537.A O no hydrogen 2.955 N/A SER 541.A OG LYS 537.A O no hydrogen 3.302 N/A GLN 546.A N ASN 542.A O no hydrogen 3.307 N/A GLN 546.A NE2 VAL 539.A O no hydrogen 2.598 N/A GLN 546.A NE2 LEU 540.A O no hydrogen 3.050 N/A ASN 547.A N ALA 543.A O no hydrogen 2.947 N/A GLU 548.A N ILE 545.A O no hydrogen 3.315 N/A GLU 552.A N GLU 548.A O no hydrogen 2.922 N/A PHE 553.A N LEU 549.A O no hydrogen 3.449 N/A GLU 554.A N GLU 550.A O no hydrogen 2.477 N/A ARG 555.A NH1 ASN 639.A O no hydrogen 3.300 N/A ARG 555.A NH2 ASN 639.A O no hydrogen 3.432 N/A MET 556.A N GLU 552.A O no hydrogen 3.327 N/A ARG 557.A N PHE 553.A O no hydrogen 3.219 N/A GLU 558.A N GLU 554.A O no hydrogen 3.477 N/A ARG 560.A N MET 556.A O no hydrogen 2.848 N/A ARG 560.A NH2 PRO 508.A O no hydrogen 2.616 N/A ARG 560.A NH2 SER 509.A O no hydrogen 2.919 N/A ARG 564.A N ARG 560.A O no hydrogen 3.376 N/A VAL 565.A N VAL 562.A O no hydrogen 3.125 N/A ILE 566.A N VAL 562.A O no hydrogen 3.032 N/A PHE 567.A N LEU 563.A O no hydrogen 3.026 N/A VAL 574.A N GLN 501.A O no hydrogen 2.973 N/A LEU 576.A N GLU 499.A O no hydrogen 3.011 N/A ARG 582.A NH2 GLU 499.A OE2 no hydrogen 2.962 N/A MET 583.A N ASN 579.A O no hydrogen 3.190 N/A TRP 585.A N LEU 581.A O no hydrogen 3.142 N/A ASN 586.A N ARG 582.A O no hydrogen 2.527 N/A LYS 589.A N ASN 586.A O no hydrogen 2.645 N/A LYS 589.A NZ GLU 228.A OE1 no hydrogen 2.862 N/A ILE 590.A N ASN 586.A O no hydrogen 3.245 N/A ARG 596.A N ASN 594.A OD1 no hydrogen 3.287 N/A SER 599.A OG LEU 657.A O no hydrogen 2.855 N/A VAL 606.A N HIS 602.A O no hydrogen 3.346 N/A VAL 607.A N PRO 603.A O no hydrogen 3.406 N/A GLU 608.A N ILE 604.A O no hydrogen 2.701 N/A GLY 609.A N LYS 605.A O no hydrogen 3.044 N/A VAL 610.A N VAL 606.A O no hydrogen 3.207 N/A LYS 611.A N VAL 607.A O no hydrogen 3.260 N/A GLU 612.A N GLU 608.A O no hydrogen 3.117 N/A LEU 613.A N GLY 609.A O no hydrogen 3.242 N/A SER 614.A N VAL 610.A O no hydrogen 2.989 N/A SER 614.A OG ASN 639.A OD1 no hydrogen 2.860 N/A LYS 616.A N LEU 613.A O no hydrogen 2.698 N/A ALA 630.A N LEU 626.A O no hydrogen 3.008 N/A GLN 631.A N ARG 628.A O no hydrogen 3.328 N/A GLN 631.A NE2 LEU 617.A O no hydrogen 3.419 N/A GLU 632.A N ARG 628.A O no hydrogen 3.353 N/A ALA 634.A N GLN 631.A O no hydrogen 2.766 N/A THR 635.A N GLN 631.A O no hydrogen 3.247 N/A ASN 639.A ND2 THR 635.A O no hydrogen 2.548 N/A ILE 640.A N LEU 636.A O no hydrogen 3.229 N/A LEU 642.A N PHE 638.A O no hydrogen 2.926 N/A ARG 643.A N ILE 640.A O no hydrogen 3.338 N/A SER 644.A N ILE 640.A O no hydrogen 3.274 N/A SER 644.A N HIS 641.A O no hydrogen 3.100 N/A SER 644.A OG ILE 640.A O no hydrogen 2.983 N/A THR 645.A N HIS 641.A O no hydrogen 3.257 N/A THR 645.A OG1 HIS 641.A O no hydrogen 3.435 N/A CYS 647.A SG GLU 552.A OE2 no hydrogen 3.311 N/A SER 648.A N GLU 552.A OE2 no hydrogen 3.209 N/A SER 648.A OG GLU 552.A OE1 no hydrogen 3.337 N/A ARG 649.A NE LYS 516.A O no hydrogen 3.283 N/A ARG 649.A NH1 ASP 520.A OD1 no hydrogen 3.368 N/A ARG 650.A NE SER 644.A O no hydrogen 3.163 N/A MET 651.A N CYS 647.A O no hydrogen 3.276 N/A GLU 653.A N ARG 649.A O no hydrogen 2.949 N/A ARG 656.A N MET 651.A O no hydrogen 2.833 N/A ALA 661.A N SER 658.A O no hydrogen 3.055 N/A ALA 661.A N SER 658.A OG no hydrogen 3.287 N/A PHE 662.A N SER 658.A O no hydrogen 3.070 N/A LEU 665.A N ALA 661.A O no hydrogen 2.875 N/A LEU 666.A N PHE 662.A O no hydrogen 3.304 N/A GLU 668.A N LEU 665.A O no hydrogen 3.192 N/A ILE 669.A N LEU 665.A O no hydrogen 3.339 N/A LYS 672.A N ILE 669.A O no hydrogen 2.968 N/A LYS 672.A NZ GLU 668.A OE2 no hydrogen 3.330 N/A PHE 673.A N ILE 669.A O no hydrogen 2.516 N/A ASN 674.A N GLU 670.A O no hydrogen 3.375 N/A ALA 676.A N PHE 673.A O no hydrogen 2.983 N/A ALA 678.A N GLY 492.A O no hydrogen 3.341 N/A GLU 682.A N HIS 679.A O no hydrogen 3.316 N/A ALA 688.A N VAL 684.A O no hydrogen 2.984 N/A ALA 689.A N GLY 685.A O no hydrogen 2.936 N/A GLN 690.A N ALA 686.A O no hydrogen 3.349 N/A SER 691.A OG LEU 687.A O no hydrogen 3.097 N/A GLY 693.A N ALA 689.A O no hydrogen 3.455 N/A THR 697.A OG1 GLU 694.A O no hydrogen 3.040 N/A ARG 706.A N GLY 703.A O no hydrogen 3.242 N/A ARG 706.A NE GLU 950.A OE1 no hydrogen 3.137 N/A ARG 706.A NH2 ASN 929.A O no hydrogen 3.409 N/A ARG 706.A NH2 GLU 950.A OE1 no hydrogen 2.448 N/A LEU 707.A N GLY 703.A O no hydrogen 2.824 N/A LYS 708.A N VAL 704.A O no hydrogen 2.684 N/A GLU 709.A N ARG 706.A O no hydrogen 2.879 N/A SER 714.A N GLU 709.A O no hydrogen 3.293 N/A SER 714.A OG GLU 709.A OE2 no hydrogen 2.944 N/A SER 714.A OG LYS 716.A O no hydrogen 3.196 N/A LYS 718.A N GLU 709.A OE2 no hydrogen 3.213 N/A THR 719.A OG1 LYS 718.A O no hydrogen 2.833 N/A SER 721.A N ASN 929.A OD1 no hydrogen 3.099 N/A VAL 724.A N LEU 905.A O no hydrogen 2.617 N/A ALA 731.A N GLY 728.A O no hydrogen 3.153 N/A ARG 732.A N GLN 729.A O no hydrogen 3.478 N/A LEU 741.A N ALA 737.A O no hydrogen 2.772 N/A CYS 742.A N LYS 738.A O no hydrogen 3.127 N/A CYS 742.A SG LYS 738.A O no hydrogen 3.318 N/A CYS 742.A SG ASP 806.A O no hydrogen 3.907 N/A ARG 743.A N ILE 740.A O no hydrogen 3.414 N/A HIS 746.A N ILE 873.A O no hydrogen 3.333 N/A THR 747.A N GLN 868.A O no hydrogen 3.466 N/A THR 747.A OG1 GLU 745.A O no hydrogen 3.425 N/A ARG 750.A NH2 THR 863.A OG1 no hydrogen 2.748 N/A THR 753.A OG1 LEU 749.A O no hydrogen 2.319 N/A ALA 754.A N GLU 798.A O no hydrogen 2.888 N/A ALA 757.A N ARG 796.A O no hydrogen 3.074 N/A TYR 759.A N LEU 794.A O no hydrogen 2.985 N/A SER 766.A N ASN 763.A O no hydrogen 3.328 N/A SER 766.A OG ASN 763.A O no hydrogen 3.567 N/A THR 767.A OG1 VAL 769.A O no hydrogen 2.497 N/A THR 767.A OG1 ASP 772.A OD1 no hydrogen 3.361 N/A VAL 768.A N ASP 761.A OD2 no hydrogen 2.871 N/A GLN 773.A NE2 PRO 764.A O no hydrogen 2.666 N/A VAL 776.A N ASP 772.A O no hydrogen 2.879 N/A VAL 778.A N GLU 774.A O no hydrogen 3.289 N/A TYR 779.A N TRP 775.A O no hydrogen 3.239 N/A TYR 780.A N ASN 777.A O no hydrogen 2.814 N/A GLU 781.A N ASN 777.A O no hydrogen 2.415 N/A SER 791.A N ILE 844.A O no hydrogen 2.704 N/A SER 791.A OG ASP 850.A OD2 no hydrogen 3.293 N/A LEU 795.A N ILE 842.A O no hydrogen 3.201 N/A ARG 796.A N ALA 757.A O no hydrogen 3.009 N/A ARG 796.A NH1 GLU 798.A OE2 no hydrogen 2.776 N/A VAL 797.A N LEU 840.A O no hydrogen 3.217 N/A GLU 798.A N ASN 755.A O no hydrogen 2.990 N/A LEU 799.A N LEU 838.A O no hydrogen 3.135 N/A ARG 801.A N ASP 800.A OD1 no hydrogen 2.571 N/A ARG 801.A NH1 ASP 800.A O no hydrogen 2.809 N/A THR 805.A N LYS 802.A O no hydrogen 3.182 N/A ASP 806.A N LYS 802.A O no hydrogen 2.802 N/A ARG 807.A NH1 HIS 803.A O no hydrogen 3.345 N/A ARG 807.A NH2 GLU 745.A OE1 no hydrogen 3.556 N/A LEU 809.A N MET 804.A O no hydrogen 2.991 N/A ILE 814.A N THR 810.A O no hydrogen 3.217 N/A ALA 815.A N MET 811.A O no hydrogen 3.237 N/A GLU 816.A N GLU 812.A O no hydrogen 2.471 N/A LYS 817.A NZ LEU 867.A O no hydrogen 2.348 N/A ILE 818.A N ILE 814.A O no hydrogen 3.122 N/A ASN 819.A N ALA 815.A O no hydrogen 3.021 N/A ALA 820.A N GLU 816.A O no hydrogen 2.731 N/A PHE 822.A N ILE 818.A O no hydrogen 2.950 N/A CYS 828.A SG LEU 826.A O no hydrogen 3.302 N/A ILE 829.A N ARG 841.A O no hydrogen 2.624 N/A ASN 831.A ND2 VAL 839.A O no hydrogen 2.940 N/A LEU 840.A N VAL 797.A O no hydrogen 2.997 N/A ARG 841.A N ILE 829.A O no hydrogen 3.039 N/A ILE 842.A N LEU 795.A O no hydrogen 3.145 N/A ARG 843.A N ASN 827.A O no hydrogen 2.757 N/A ARG 843.A NH1 ASP 761.A O no hydrogen 3.304 N/A ARG 843.A NH2 ASP 761.A O no hydrogen 2.793 N/A ASN 846.A N ARG 789.A O no hydrogen 3.196 N/A VAL 852.A N ASP 849.A O no hydrogen 2.923 N/A PHE 853.A N ASP 849.A O no hydrogen 3.247 N/A LEU 854.A N ASP 850.A O no hydrogen 3.060 N/A ARG 855.A N VAL 852.A O no hydrogen 2.917 N/A CYS 856.A N VAL 852.A O no hydrogen 3.148 N/A ILE 857.A N PHE 853.A O no hydrogen 3.204 N/A GLU 858.A N LEU 854.A O no hydrogen 3.021 N/A SER 859.A N ARG 855.A O no hydrogen 2.481 N/A SER 859.A OG ARG 855.A O no hydrogen 2.971 N/A ASN 860.A N CYS 856.A O no hydrogen 3.073 N/A ASN 860.A N ILE 857.A O no hydrogen 3.240 N/A MET 861.A N ILE 857.A O no hydrogen 3.186 N/A LEU 862.A N GLU 858.A O no hydrogen 3.146 N/A THR 863.A N ASN 860.A O no hydrogen 3.201 N/A ASP 864.A N ASN 860.A O no hydrogen 2.636 N/A LEU 867.A N THR 747.A O no hydrogen 2.902 N/A ILE 870.A N LEU 744.A O no hydrogen 3.471 N/A SER 874.A N ASP 908.A O no hydrogen 3.225 N/A LYS 875.A N SER 874.A OG no hydrogen 2.430 N/A VAL 876.A N GLU 745.A OE2 no hydrogen 3.493 N/A TYR 877.A N GLU 906.A O no hydrogen 3.048 N/A THR 883.A OG1 ASN 885.A OD1 no hydrogen 2.325 N/A LYS 886.A NZ GLU 906.A OE2 no hydrogen 3.240 N/A LYS 887.A NZ ASP 884.A OD1 no hydrogen 3.347 N/A LYS 888.A N LEU 900.A O no hydrogen 3.117 N/A ILE 890.A N LYS 898.A O no hydrogen 3.091 N/A THR 892.A N GLU 896.A O no hydrogen 3.103 N/A THR 892.A OG1 GLU 896.A O no hydrogen 3.506 N/A GLY 895.A N THR 892.A O no hydrogen 3.349 N/A LEU 900.A N LYS 888.A O no hydrogen 2.686 N/A TRP 903.A N ALA 731.A O no hydrogen 2.825 N/A ILE 904.A N HIS 879.A O no hydrogen 3.316 N/A LEU 905.A N VAL 724.A O no hydrogen 2.689 N/A THR 907.A N LEU 722.A O no hydrogen 3.368 N/A THR 907.A OG1 LEU 722.A O no hydrogen 3.213 N/A SER 911.A OG SER 911.A O no hydrogen 2.549 N/A LEU 916.A N LEU 912.A O no hydrogen 2.954 N/A SER 917.A N MET 913.A O no hydrogen 3.085 N/A SER 917.A OG MET 913.A O no hydrogen 3.322 N/A SER 917.A OG ARG 914.A O no hydrogen 2.693 N/A LYS 919.A NZ ASP 920.A OD2 no hydrogen 3.488 N/A VAL 924.A N ASP 922.A OD1 no hydrogen 3.045 N/A ARG 925.A N ASP 922.A OD2 no hydrogen 3.283 N/A ARG 925.A NH1 GLU 902.A OE2 no hydrogen 2.792 N/A THR 926.A OG1 ASP 922.A O no hydrogen 2.625 N/A THR 927.A N THR 723.A O no hydrogen 3.423 N/A THR 927.A OG1 ARG 925.A O no hydrogen 3.343 N/A ILE 934.A N ASP 930.A O no hydrogen 2.913 N/A ILE 934.A N ILE 931.A O no hydrogen 3.052 N/A THR 936.A OG1 GLU 933.A O no hydrogen 3.371 N/A VAL 943.A N ILE 940.A O no hydrogen 2.851 N/A ARG 944.A N ILE 940.A O no hydrogen 3.086 N/A ARG 944.A NH1 ARG 944.A O no hydrogen 3.261 N/A LEU 947.A N VAL 943.A O no hydrogen 2.461 N/A LEU 951.A N LEU 947.A O no hydrogen 3.228 N/A TYR 952.A N GLU 948.A O no hydrogen 2.929 N/A HIS 953.A N GLU 950.A O no hydrogen 3.033 N/A VAL 954.A N GLU 950.A O no hydrogen 2.890 N/A SER 956.A N TYR 952.A O no hydrogen 2.956 N/A SER 956.A OG TYR 952.A O no hydrogen 2.853 N/A ASP 958.A N ILE 955.A O no hydrogen 3.167 N/A GLY 959.A N SER 956.A O no hydrogen 3.213 N/A TYR 964.A OH GLU 490.A OE2 no hydrogen 2.936 N/A ARG 965.A NH1 ASP 491.A OD1 no hydrogen 2.850 N/A ARG 965.A NH2 ASP 491.A OD1 no hydrogen 3.015 N/A ARG 965.A NH2 ASP 491.A OD2 no hydrogen 3.313 N/A HIS 966.A N ASN 963.A O no hydrogen 2.924 N/A LEU 967.A N TYR 964.A O no hydrogen 2.913 N/A ALA 968.A N TYR 964.A O no hydrogen 3.067 N/A CYS 971.A N LEU 967.A O no hydrogen 3.133 N/A CYS 971.A SG LEU 967.A O no hydrogen 3.258 N/A THR 973.A OG1 LEU 969.A O no hydrogen 3.153 N/A THR 975.A OG1 CYS 971.A O no hydrogen 2.887 N/A HIS 979.A ND1 ARG 977.A O no hydrogen 3.098 N/A LEU 989.A N ASP 988.A OD1 no hydrogen 2.716 N/A CYS 996.A N ASP 992.A O no hydrogen 3.220 N/A