Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 7ln1_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ARG 3.A NH1 ASN 2.A OD1 no hydrogen 3.103 N/A LEU 4.A N ILE 78.A O no hydrogen 2.918 N/A ILE 5.A N GLU 58.A O no hydrogen 3.299 N/A VAL 6.A N ASP 76.A O no hydrogen 3.120 N/A ASP 7.A N ILE 60.A O no hydrogen 2.667 N/A ASN 14.A ND2 LEU 131.A O no hydrogen 2.487 N/A SER 15.A OG TYR 116.A OH no hydrogen 2.561 N/A VAL 16.A N ASP 13.A O no hydrogen 3.331 N/A SER 18.A OG LEU 19.A O no hydrogen 3.566 N/A SER 18.A OG LEU 50.A O no hydrogen 2.186 N/A LEU 19.A N LEU 50.A O no hydrogen 2.923 N/A SER 20.A OG CYS 55.A O no hydrogen 2.221 N/A LYS 23.A NZ PRO 1.A O no hydrogen 2.908 N/A LYS 23.A NZ GLU 26.A OE2 no hydrogen 3.327 N/A MET 24.A N SER 20.A O no hydrogen 2.741 N/A ASP 25.A N GLN 21.A O no hydrogen 2.937 N/A GLU 26.A N PRO 22.A O no hydrogen 2.878 N/A LEU 27.A N LYS 23.A O no hydrogen 3.003 N/A GLN 28.A N ASP 25.A O no hydrogen 3.106 N/A LEU 29.A N MET 24.A O no hydrogen 2.868 N/A GLY 32.A N VAL 49.A O no hydrogen 3.239 N/A VAL 35.A N CYS 47.A O no hydrogen 2.646 N/A LEU 36.A N GLN 81.A O no hydrogen 2.712 N/A LEU 37.A N ALA 45.A O no hydrogen 2.466 N/A LYS 38.A N SER 79.A O no hydrogen 3.199 N/A GLY 39.A N ARG 43.A O no hydrogen 2.692 N/A ARG 43.A N LYS 40.A O no hydrogen 3.348 N/A ARG 43.A NE ASN 69.A O no hydrogen 2.488 N/A ARG 43.A NH2 ASN 69.A O no hydrogen 3.490 N/A ALA 45.A N LEU 37.A O no hydrogen 2.972 N/A CYS 47.A N VAL 35.A O no hydrogen 3.044 N/A CYS 47.A SG ASN 14.A O no hydrogen 4.028 N/A CYS 47.A SG SER 15.A O no hydrogen 3.181 N/A VAL 49.A N ASP 33.A O no hydrogen 2.861 N/A CYS 55.A SG SER 20.A OG no hydrogen 3.610 N/A CYS 55.A SG SER 56.A O no hydrogen 3.622 N/A CYS 55.A SG LYS 59.A O no hydrogen 3.145 N/A GLU 58.A N GLU 58.A OE1 no hydrogen 2.979 N/A LYS 59.A N SER 56.A O no hydrogen 3.170 N/A ILE 60.A N ILE 5.A O no hydrogen 2.854 N/A ARG 61.A N SER 18.A O no hydrogen 3.278 N/A ARG 61.A NH1 GLU 8.A O no hydrogen 2.744 N/A ARG 61.A NH2 THR 54.A OG1 no hydrogen 2.490 N/A MET 62.A N ASP 7.A O no hydrogen 2.287 N/A ARG 67.A N ASN 63.A O no hydrogen 2.889 N/A ASN 68.A N ARG 64.A O no hydrogen 2.856 N/A ASN 69.A N VAL 65.A O no hydrogen 2.896 N/A ASN 69.A ND2 ILE 129.A O no hydrogen 2.831 N/A LEU 70.A N VAL 66.A O no hydrogen 3.154 N/A ARG 71.A NH1 ASN 68.A O no hydrogen 2.253 N/A VAL 72.A N ARG 67.A O no hydrogen 3.103 N/A ARG 73.A N ASP 76.A OD2 no hydrogen 2.768 N/A ASP 76.A N ARG 73.A O no hydrogen 3.126 N/A ILE 78.A N LEU 4.A O no hydrogen 3.032 N/A ILE 80.A N ASN 2.A O no hydrogen 3.093 N/A GLN 81.A N LEU 36.A O no hydrogen 3.355 N/A CYS 83.A N THR 34.A O no hydrogen 3.220 N/A CYS 83.A SG PRO 84.A O no hydrogen 3.833 N/A LYS 87.A NZ ASP 85.A OD1 no hydrogen 3.560 N/A GLY 89.A N ILE 153.A O no hydrogen 2.930 N/A ARG 91.A NE HIS 161.A ND1 no hydrogen 2.947 N/A HIS 93.A N GLU 145.A O no hydrogen 3.039 N/A HIS 93.A ND1 HIS 161.A NE2 no hydrogen 3.008 N/A LEU 95.A N LYS 142.A O no hydrogen 2.688 N/A ILE 97.A N GLU 140.A O no hydrogen 3.463 N/A ASP 98.A N ILE 167.A O no hydrogen 2.890 N/A THR 100.A N ILE 97.A O no hydrogen 2.934 N/A THR 100.A OG1 ILE 97.A O no hydrogen 2.255 N/A VAL 101.A N ILE 97.A O no hydrogen 3.387 N/A VAL 111.A N ASN 107.A O no hydrogen 3.129 N/A TYR 112.A N LEU 108.A O no hydrogen 2.553 N/A TYR 112.A OH GLY 134.A O no hydrogen 2.983 N/A TYR 112.A OH ARG 137.A O no hydrogen 2.697 N/A LEU 113.A N LEU 108.A O no hydrogen 3.407 N/A LYS 114.A N PHE 109.A O no hydrogen 2.607 N/A TYR 116.A N TYR 112.A O no hydrogen 3.315 N/A TYR 116.A OH ASP 13.A OD2 no hydrogen 2.917 N/A TYR 116.A OH SER 15.A OG no hydrogen 2.561 N/A PHE 117.A N LEU 113.A O no hydrogen 3.097 N/A TYR 121.A N VAL 154.A O no hydrogen 2.959 N/A TYR 121.A OH GLU 119.A OE1 no hydrogen 2.325 N/A ILE 124.A N CYS 152.A O no hydrogen 2.730 N/A ARG 125.A NE TYR 151.A OH no hydrogen 3.179 N/A LYS 126.A NZ SER 149.A OG no hydrogen 3.233 N/A GLY 127.A N VAL 143.A O no hydrogen 3.373 N/A ASP 128.A N ARG 125.A O no hydrogen 3.427 N/A ILE 129.A N ASN 69.A OD1 no hydrogen 2.417 N/A ARG 137.A NH1 ASP 99.A O no hydrogen 3.305 N/A PHE 141.A N PHE 130.A O no hydrogen 3.319 N/A LYS 142.A N LEU 95.A O no hydrogen 2.734 N/A VAL 143.A N ASP 128.A O no hydrogen 3.185 N/A THR 146.A OG1 PRO 150.A O no hydrogen 2.919 N/A ASP 147.A N ARG 91.A O no hydrogen 3.232 N/A CYS 152.A N ILE 124.A O no hydrogen 3.335 N/A CYS 152.A SG ASP 147.A O no hydrogen 3.897 N/A ILE 153.A N LYS 87.A O no hydrogen 2.795 N/A VAL 154.A N ARG 122.A O no hydrogen 3.112 N/A THR 158.A N ALA 155.A O no hydrogen 3.118 N/A THR 158.A OG1 GLY 89.A O no hydrogen 2.378 N/A THR 158.A OG1 LYS 90.A O no hydrogen 3.546 N/A THR 158.A OG1 ALA 155.A O no hydrogen 3.392 N/A ILE 167.A N PRO 96.A O no hydrogen 2.947 N/A LYS 168.A NZ GLU 165.A OE2 no hydrogen 2.661 N/A ARG 169.A NE ARG 169.A O no hydrogen 3.087 N/A GLU 172.A N LYS 168.A O no hydrogen 3.010 N/A GLU 173.A N ARG 169.A O no hydrogen 2.885 N/A GLU 174.A N GLU 170.A O no hydrogen 2.880 N/A SER 175.A N ASP 171.A O no hydrogen 2.911 N/A SER 175.A OG GLU 172.A O no hydrogen 2.175 N/A LEU 176.A N GLU 172.A O no hydrogen 2.926 N/A ASN 177.A N GLU 173.A O no hydrogen 3.049 N/A GLU 178.A N SER 175.A O no hydrogen 3.513 N/A TYR 181.A N GLU 239.A OE2 no hydrogen 3.247 N/A ASP 183.A N GLY 180.A O no hydrogen 3.137 N/A ILE 184.A N TYR 181.A O no hydrogen 3.286 N/A GLN 190.A N GLN 190.A OE1 no hydrogen 2.872 N/A GLN 190.A NE2 ASP 346.A O no hydrogen 3.659 N/A LEU 191.A N CYS 187.A O no hydrogen 2.360 N/A ALA 192.A N ARG 188.A O no hydrogen 2.842 N/A GLN 193.A N LYS 189.A O no hydrogen 2.911 N/A ILE 194.A N GLN 190.A O no hydrogen 2.851 N/A LYS 195.A N LEU 191.A O no hydrogen 2.831 N/A GLU 196.A N ALA 192.A O no hydrogen 2.942 N/A MET 197.A N GLN 193.A O no hydrogen 2.894 N/A VAL 198.A N ILE 194.A O no hydrogen 2.585 N/A GLU 199.A N LYS 195.A O no hydrogen 2.975 N/A LEU 200.A N LYS 195.A O no hydrogen 3.223 N/A LEU 202.A N VAL 198.A O no hydrogen 3.234 N/A ARG 203.A N GLU 199.A O no hydrogen 2.880 N/A ARG 203.A N LEU 200.A O no hydrogen 3.147 N/A HIS 204.A N LEU 200.A O no hydrogen 2.874 N/A LYS 209.A N PRO 205.A O no hydrogen 2.923 N/A GLU 210.A N ALA 206.A O no hydrogen 2.911 N/A ILE 211.A N LEU 207.A O no hydrogen 2.878 N/A GLY 212.A N PHE 208.A O no hydrogen 3.058 N/A GLY 212.A N LYS 209.A O no hydrogen 3.318 N/A LYS 214.A NZ GLN 315.A OE1 no hydrogen 2.911 N/A ARG 217.A NH1 GLY 339.A O no hydrogen 2.905 N/A ILE 219.A N VAL 321.A O no hydrogen 3.223 N/A LEU 220.A N ARG 343.A O no hydrogen 2.716 N/A LEU 221.A N ALA 323.A O no hydrogen 2.953 N/A TYR 222.A N VAL 345.A O no hydrogen 3.109 N/A LYS 229.A NZ PRO 224.A O no hydrogen 2.774 N/A LYS 229.A NZ ASN 326.A OD1 no hydrogen 3.126 N/A ILE 232.A N GLY 228.A O no hydrogen 3.001 N/A ALA 233.A N LYS 229.A O no hydrogen 2.992 N/A ARG 234.A N THR 230.A O no hydrogen 2.869 N/A ALA 235.A N LEU 231.A O no hydrogen 2.952 N/A VAL 236.A N ILE 232.A O no hydrogen 2.890 N/A ALA 237.A N ALA 233.A O no hydrogen 2.832 N/A ASN 238.A N ARG 234.A O no hydrogen 2.939 N/A ASN 238.A ND2 VAL 179.A O no hydrogen 3.493 N/A GLU 239.A N VAL 236.A O no hydrogen 3.195 N/A THR 240.A OG1 VAL 236.A O no hydrogen 2.812 N/A THR 240.A OG1 ALA 237.A O no hydrogen 3.527 N/A PHE 243.A N PRO 276.A O no hydrogen 2.856 N/A PHE 245.A N ILE 278.A O no hydrogen 3.256 N/A ILE 247.A N PHE 280.A O no hydrogen 2.991 N/A ILE 252.A N ASN 248.A O no hydrogen 3.327 N/A MET 253.A N GLY 249.A O no hydrogen 2.994 N/A SER 254.A N PRO 250.A O no hydrogen 2.858 N/A SER 254.A OG PRO 250.A O no hydrogen 2.244 N/A LYS 255.A N GLU 251.A O no hydrogen 3.138 N/A LYS 255.A N ILE 252.A O no hydrogen 3.228 N/A LYS 255.A NZ GLU 251.A OE2 no hydrogen 3.370 N/A GLU 259.A N LEU 256.A O no hydrogen 2.759 N/A SER 260.A OG ILE 252.A O no hydrogen 2.645 N/A GLU 261.A N GLU 261.A OE1 no hydrogen 2.829 N/A ASN 263.A N GLU 259.A O no hydrogen 2.906 N/A LEU 264.A N SER 260.A O no hydrogen 2.935 N/A ARG 265.A N GLU 261.A O no hydrogen 2.883 N/A ARG 265.A NE GLN 305.A OE1 no hydrogen 3.366 N/A LYS 266.A N SER 262.A O no hydrogen 2.888 N/A ALA 267.A N ASN 263.A O no hydrogen 2.921 N/A PHE 268.A N LEU 264.A O no hydrogen 2.941 N/A GLU 269.A N ARG 265.A O no hydrogen 2.872 N/A GLU 270.A N LYS 266.A O no hydrogen 2.877 N/A ALA 271.A N ALA 267.A O no hydrogen 2.905 N/A GLU 272.A N PHE 268.A O no hydrogen 2.908 N/A LYS 273.A N GLU 269.A O no hydrogen 2.889 N/A ASN 274.A N GLU 270.A O no hydrogen 2.948 N/A ILE 278.A N PHE 243.A O no hydrogen 2.853 N/A ILE 279.A N ILE 320.A O no hydrogen 3.050 N/A PHE 280.A N PHE 245.A O no hydrogen 3.330 N/A ILE 281.A N MET 322.A O no hydrogen 2.701 N/A ASP 282.A N ILE 247.A O no hydrogen 2.499 N/A LEU 284.A N ALA 324.A O no hydrogen 3.136 N/A ALA 286.A N GLU 283.A O no hydrogen 2.603 N/A ILE 287.A N LEU 284.A O no hydrogen 3.044 N/A ALA 288.A N LEU 284.A O no hydrogen 2.591 N/A THR 294.A OG1 LYS 290.A O no hydrogen 2.178 N/A ARG 300.A N GLY 296.A O no hydrogen 3.451 N/A ARG 300.A NE GLU 297.A OE1 no hydrogen 3.030 N/A ARG 300.A NH1 ARG 291.A O no hydrogen 2.814 N/A ARG 300.A NH2 GLU 297.A OE1 no hydrogen 3.421 N/A ARG 300.A NH2 GLU 297.A OE2 no hydrogen 2.425 N/A ARG 301.A N GLU 297.A O no hydrogen 2.916 N/A ILE 302.A N VAL 298.A O no hydrogen 2.894 N/A VAL 303.A N GLU 299.A O no hydrogen 2.894 N/A SER 304.A N ARG 300.A O no hydrogen 2.960 N/A SER 304.A OG ARG 300.A O no hydrogen 3.375 N/A GLN 305.A N ARG 301.A O no hydrogen 2.838 N/A LEU 306.A N ILE 302.A O no hydrogen 2.945 N/A LEU 307.A N VAL 303.A O no hydrogen 2.863 N/A THR 308.A N SER 304.A O no hydrogen 2.933 N/A THR 308.A OG1 SER 304.A O no hydrogen 3.430 N/A THR 308.A OG1 GLN 305.A O no hydrogen 2.679 N/A LEU 309.A N GLN 305.A O no hydrogen 2.871 N/A MET 310.A N LEU 306.A O no hydrogen 2.948 N/A ASP 311.A N LEU 307.A O no hydrogen 2.944 N/A GLY 312.A N THR 308.A O no hydrogen 2.900 N/A GLY 312.A N LEU 309.A O no hydrogen 2.989 N/A GLN 315.A NE2 HIS 318.A NE2 no hydrogen 3.001 N/A ARG 316.A NH1 GLY 312.A O no hydrogen 3.358 N/A HIS 318.A N GLN 315.A O no hydrogen 3.046 N/A ILE 320.A N ALA 277.A O no hydrogen 3.147 N/A VAL 321.A N ARG 217.A O no hydrogen 3.050 N/A MET 322.A N ILE 279.A O no hydrogen 2.664 N/A ALA 323.A N ILE 219.A O no hydrogen 3.315 N/A ALA 324.A N ILE 281.A O no hydrogen 3.037 N/A THR 325.A N LEU 221.A O no hydrogen 2.915 N/A THR 325.A OG1 ARG 327.A O no hydrogen 2.790 N/A SER 330.A OG ASP 285.A OD2 no hydrogen 2.375 N/A SER 330.A OG ARG 327.A O no hydrogen 3.130 N/A LEU 335.A N ASP 332.A O no hydrogen 2.983 N/A ARG 336.A N PRO 333.A O no hydrogen 3.170 N/A ARG 336.A NH1 GLU 344.A OE2 no hydrogen 3.308 N/A ARG 336.A NH2 PRO 328.A O no hydrogen 2.999 N/A ARG 337.A NH1 PHE 338.A O no hydrogen 3.220 N/A ARG 340.A N ARG 337.A O no hydrogen 2.976 N/A ARG 340.A NE ASP 311.A OD1 no hydrogen 3.132 N/A ASP 342.A N ARG 340.A O no hydrogen 2.309 N/A VAL 345.A N LEU 220.A O no hydrogen 3.076 N/A ILE 347.A N TYR 222.A O no hydrogen 2.738 N/A GLY 354.A N ASP 351.A OD1 no hydrogen 3.011 N/A ARG 355.A N ASP 351.A O no hydrogen 2.942 N/A ARG 355.A NH1 ALA 378.A O no hydrogen 2.550 N/A ARG 355.A NH2 PRO 350.A O no hydrogen 3.534 N/A LEU 356.A N ALA 352.A O no hydrogen 2.926 N/A GLU 357.A N THR 353.A O no hydrogen 2.906 N/A ILE 358.A N GLY 354.A O no hydrogen 2.928 N/A LEU 359.A N ARG 355.A O no hydrogen 2.844 N/A GLN 360.A N LEU 356.A O no hydrogen 2.933 N/A ILE 361.A N GLU 357.A O no hydrogen 2.902 N/A HIS 362.A N ILE 358.A O no hydrogen 2.910 N/A THR 363.A N LEU 359.A O no hydrogen 2.853 N/A THR 363.A OG1 LEU 359.A O no hydrogen 2.553 N/A THR 363.A OG1 GLN 360.A O no hydrogen 3.489 N/A THR 363.A OG1 GLN 360.A OE1 no hydrogen 3.419 N/A GLU 375.A N ASP 373.A OD2 no hydrogen 3.066 N/A ALA 378.A N LEU 374.A O no hydrogen 2.971 N/A ASN 379.A N GLU 375.A O no hydrogen 2.853 N/A GLU 380.A N GLN 376.A O no hydrogen 2.935 N/A ALA 387.A N GLY 226.A O no hydrogen 3.365 N/A LEU 389.A N VAL 385.A O no hydrogen 2.828 N/A ALA 390.A N GLY 386.A O no hydrogen 2.867 N/A ALA 391.A N ALA 387.A O no hydrogen 2.946 N/A LEU 392.A N ASP 388.A O no hydrogen 2.836 N/A CYS 393.A N LEU 389.A O no hydrogen 2.861 N/A CYS 393.A SG LEU 389.A O no hydrogen 3.368 N/A SER 394.A N ALA 390.A O no hydrogen 2.917 N/A GLU 395.A N ALA 391.A O no hydrogen 2.908 N/A ALA 396.A N LEU 392.A O no hydrogen 2.862 N/A ALA 397.A N CYS 393.A O no hydrogen 2.909 N/A LEU 398.A N SER 394.A O no hydrogen 2.908 N/A GLN 399.A N GLU 395.A O no hydrogen 2.801 N/A GLN 399.A NE2 GLN 399.A O no hydrogen 3.209 N/A ALA 400.A N ALA 396.A O no hydrogen 2.927 N/A ILE 401.A N ALA 397.A O no hydrogen 2.941 N/A ARG 402.A N LEU 398.A O no hydrogen 2.871 N/A LYS 403.A N GLN 399.A O no hydrogen 2.908 N/A LYS 403.A NZ ASP 428.A OD2 no hydrogen 2.584 N/A LYS 403.A NZ ASP 429.A OD1 no hydrogen 3.014 N/A LYS 404.A N ALA 400.A O no hydrogen 3.389 N/A MET 405.A N ARG 402.A O no hydrogen 3.161 N/A ILE 408.A N LYS 404.A O no hydrogen 2.865 N/A GLU 411.A N GLU 411.A OE1 no hydrogen 2.896 N/A ASP 412.A N ASP 409.A O no hydrogen 3.078 N/A GLU 413.A N GLU 413.A OE1 no hydrogen 2.649 N/A GLU 418.A N GLU 418.A OE1 no hydrogen 2.579 N/A MET 420.A N ASP 416.A O no hydrogen 3.147 N/A ASN 421.A N ALA 417.A O no hydrogen 2.906 N/A SER 422.A N GLU 418.A O no hydrogen 2.891 N/A THR 426.A N ASP 429.A OD2 no hydrogen 2.925 N/A ASP 428.A N THR 426.A OG1 no hydrogen 3.179 N/A ASP 429.A N THR 426.A O no hydrogen 3.160 N/A ARG 431.A N MET 427.A O no hydrogen 2.860 N/A TRP 432.A N ASP 428.A O no hydrogen 2.897 N/A TRP 432.A NE1 ASP 428.A OD2 no hydrogen 3.165 N/A ALA 433.A N ASP 429.A O no hydrogen 2.920 N/A LEU 434.A N PHE 430.A O no hydrogen 2.914 N/A SER 435.A N ARG 431.A O no hydrogen 2.898 N/A SER 435.A OG ARG 431.A O no hydrogen 3.294 N/A SER 435.A OG TRP 432.A O no hydrogen 2.216 N/A GLN 436.A N TRP 432.A O no hydrogen 2.926 N/A SER 437.A N ALA 433.A O no hydrogen 2.804 N/A SER 437.A OG ALA 433.A O no hydrogen 2.438 N/A THR 444.A OG1 GLU 446.A OE1 no hydrogen 3.042 N/A ASP 447.A N THR 444.A O no hydrogen 2.785 N/A ILE 448.A N THR 444.A O no hydrogen 3.084 N/A LYS 455.A N LEU 451.A O no hydrogen 2.867 N/A ARG 456.A N GLU 452.A O no hydrogen 2.871 N/A GLU 457.A N ASP 453.A O no hydrogen 2.917 N/A LEU 458.A N VAL 454.A O no hydrogen 2.851 N/A GLN 459.A N LYS 455.A O no hydrogen 2.965 N/A GLN 459.A NE2 LYS 455.A O no hydrogen 3.195 N/A GLU 460.A N ARG 456.A O no hydrogen 2.900 N/A LEU 461.A N GLU 457.A O no hydrogen 2.877 N/A VAL 462.A N LEU 458.A O no hydrogen 2.995 N/A GLN 463.A NE2 GLU 503.A O no hydrogen 3.120 N/A TYR 464.A N GLN 459.A O no hydrogen 2.862 N/A VAL 466.A N GLN 463.A O no hydrogen 3.246 N/A GLU 467.A N GLN 463.A O no hydrogen 2.888 N/A HIS 468.A N TYR 464.A O no hydrogen 2.887 N/A LEU 473.A N PRO 469.A O no hydrogen 2.886 N/A LYS 474.A N ASP 470.A O no hydrogen 2.881 N/A PHE 475.A N LYS 471.A O no hydrogen 2.941 N/A GLY 476.A N PHE 472.A O no hydrogen 2.922 N/A LYS 481.A NZ PRO 479.A O no hydrogen 2.567 N/A VAL 483.A N ILE 588.A O no hydrogen 3.240 N/A LEU 484.A N GLN 610.A O no hydrogen 2.746 N/A PHE 485.A N GLY 590.A O no hydrogen 3.012 N/A TYR 486.A N ILE 612.A O no hydrogen 3.088 N/A GLY 487.A N THR 592.A O no hydrogen 3.404 N/A CYS 491.A SG PRO 488.A O no hydrogen 3.726 N/A CYS 491.A SG PRO 615.A O no hydrogen 3.954 N/A LYS 493.A NZ PRO 488.A O no hydrogen 2.896 N/A LEU 496.A N GLY 492.A O no hydrogen 3.051 N/A ALA 497.A N LYS 493.A O no hydrogen 2.966 N/A LYS 498.A N THR 494.A O no hydrogen 2.904 N/A ALA 499.A N LEU 495.A O no hydrogen 2.841 N/A ILE 500.A N LEU 496.A O no hydrogen 2.992 N/A ALA 501.A N ALA 497.A O no hydrogen 2.959 N/A ASN 502.A N LYS 498.A O no hydrogen 2.931 N/A ASN 502.A ND2 VAL 443.A O no hydrogen 3.667 N/A GLU 503.A N ALA 499.A O no hydrogen 2.853 N/A CYS 504.A N ILE 500.A O no hydrogen 3.014 N/A CYS 504.A SG ILE 500.A O no hydrogen 3.830 N/A GLN 505.A N ASN 502.A O no hydrogen 2.959 N/A ALA 506.A N ALA 501.A O no hydrogen 3.009 N/A ASN 507.A N PRO 540.A O no hydrogen 3.030 N/A ASN 507.A ND2 ALA 538.A O no hydrogen 2.793 N/A ILE 509.A N VAL 542.A O no hydrogen 3.304 N/A ILE 511.A N PHE 544.A O no hydrogen 3.108 N/A GLY 513.A N ASP 546.A O no hydrogen 3.329 N/A GLU 515.A N LYS 512.A O no hydrogen 2.688 N/A LEU 516.A N GLY 513.A O no hydrogen 2.901 N/A LEU 517.A N PRO 514.A O no hydrogen 3.223 N/A ALA 526.A N GLY 522.A O no hydrogen 3.360 N/A ASN 527.A N GLU 523.A O no hydrogen 2.888 N/A ASN 527.A ND2 LEU 516.A O no hydrogen 2.973 N/A VAL 528.A N SER 524.A O no hydrogen 2.986 N/A ARG 529.A N GLU 525.A O no hydrogen 2.919 N/A GLU 530.A N ALA 526.A O no hydrogen 2.858 N/A ILE 531.A N ASN 527.A O no hydrogen 2.950 N/A PHE 532.A N VAL 528.A O no hydrogen 3.076 N/A ASP 533.A N ARG 529.A O no hydrogen 2.922 N/A LYS 534.A N GLU 530.A O no hydrogen 2.862 N/A ALA 535.A N ILE 531.A O no hydrogen 2.926 N/A ARG 536.A N PHE 532.A O no hydrogen 2.994 N/A ARG 536.A NH1 ASP 533.A OD1 no hydrogen 3.482 N/A GLN 537.A N ASP 533.A O no hydrogen 2.910 N/A GLN 537.A NE2 ASP 533.A OD1 no hydrogen 2.806 N/A ALA 538.A N LYS 534.A O no hydrogen 3.065 N/A ALA 539.A N ARG 536.A O no hydrogen 3.238 N/A CYS 541.A SG ASN 507.A O no hydrogen 3.259 N/A VAL 542.A N ASN 507.A O no hydrogen 2.826 N/A LEU 543.A N PHE 587.A O no hydrogen 2.490 N/A PHE 544.A N ILE 509.A O no hydrogen 2.812 N/A PHE 545.A N ILE 589.A O no hydrogen 2.768 N/A ASP 546.A N ILE 511.A O no hydrogen 2.990 N/A GLN 547.A N ASP 546.A OD1 no hydrogen 2.493 N/A LEU 548.A N ALA 591.A O no hydrogen 3.181 N/A SER 550.A N GLN 547.A O no hydrogen 3.138 N/A SER 550.A OG GLN 547.A O no hydrogen 2.677 N/A ALA 552.A N LEU 548.A O no hydrogen 3.108 N/A LYS 553.A NZ ASP 549.A O no hydrogen 2.867 N/A ARG 555.A NH1 ASN 571.A OD1 no hydrogen 2.906 N/A ASN 558.A ND2 ASP 567.A OD1 no hydrogen 3.079 N/A GLY 563.A N GLY 560.A O no hydrogen 2.866 N/A ALA 565.A N ASP 561.A O no hydrogen 2.979 N/A ALA 566.A N GLY 562.A O no hydrogen 2.881 N/A ASP 567.A N GLY 563.A O no hydrogen 2.932 N/A ARG 568.A N GLY 564.A O no hydrogen 2.942 N/A ARG 568.A NE GLU 525.A OE2 no hydrogen 3.151 N/A ARG 568.A NH2 PHE 521.A O no hydrogen 3.005 N/A VAL 569.A N ALA 565.A O no hydrogen 2.972 N/A ILE 570.A N ALA 566.A O no hydrogen 2.956 N/A ASN 571.A N ASP 567.A O no hydrogen 2.963 N/A GLN 572.A N ARG 568.A O no hydrogen 3.018 N/A ILE 573.A N VAL 569.A O no hydrogen 2.963 N/A LEU 574.A N ILE 570.A O no hydrogen 2.916 N/A THR 575.A N ASN 571.A O no hydrogen 2.984 N/A THR 575.A OG1 ASN 571.A O no hydrogen 3.205 N/A GLU 576.A N GLN 572.A O no hydrogen 2.925 N/A MET 577.A N ILE 573.A O no hydrogen 2.880 N/A ASP 578.A N LEU 574.A O no hydrogen 2.997 N/A GLY 579.A N THR 575.A O no hydrogen 2.895 N/A MET 580.A N MET 577.A O no hydrogen 3.031 N/A SER 581.A OG ASP 578.A O no hydrogen 3.514 N/A THR 582.A OG1 GLY 579.A O no hydrogen 3.391 N/A LYS 583.A N MET 580.A O no hydrogen 2.973 N/A LYS 583.A NZ ARG 536.A O no hydrogen 3.367 N/A LYS 584.A NZ MET 477.A O no hydrogen 2.874 N/A PHE 587.A N CYS 541.A O no hydrogen 2.639 N/A ILE 588.A N LYS 481.A O no hydrogen 2.897 N/A ILE 589.A N LEU 543.A O no hydrogen 2.596 N/A GLY 590.A N VAL 483.A O no hydrogen 2.869 N/A ALA 591.A N PHE 545.A O no hydrogen 2.667 N/A THR 592.A N PHE 485.A O no hydrogen 2.881 N/A THR 592.A OG1 ARG 594.A O no hydrogen 2.688 N/A ALA 601.A N ASP 599.A OD2 no hydrogen 2.582 N/A ILE 602.A N ASP 599.A O no hydrogen 2.826 N/A ARG 604.A NH2 ASP 578.A OD1 no hydrogen 3.568 N/A ARG 607.A N ARG 604.A O no hydrogen 3.042 N/A ARG 607.A NE ASP 578.A OD1 no hydrogen 2.810 N/A ARG 607.A NH1 ALA 601.A O no hydrogen 2.595 N/A ARG 607.A NH2 ASP 578.A OD1 no hydrogen 3.560 N/A ARG 607.A NH2 ASP 578.A OD2 no hydrogen 3.103 N/A GLN 610.A N GLY 482.A O no hydrogen 3.424 N/A ILE 612.A N LEU 484.A O no hydrogen 2.709 N/A ILE 614.A N TYR 486.A O no hydrogen 3.390 N/A SER 621.A N ASP 618.A OD1 no hydrogen 3.106 N/A SER 621.A OG ASP 618.A OD1 no hydrogen 2.957 N/A ARG 622.A N ASP 618.A O no hydrogen 2.434 N/A ARG 622.A NE PRO 617.A O no hydrogen 3.137 N/A ARG 622.A NH1 ALA 645.A O no hydrogen 2.988 N/A VAL 623.A N GLU 619.A O no hydrogen 2.907 N/A ALA 624.A N LYS 620.A O no hydrogen 2.935 N/A ILE 625.A N SER 621.A O no hydrogen 2.905 N/A LEU 626.A N ARG 622.A O no hydrogen 2.919 N/A LYS 627.A N VAL 623.A O no hydrogen 2.864 N/A ALA 628.A N ALA 624.A O no hydrogen 2.957 N/A ASN 629.A N ILE 625.A O no hydrogen 2.914 N/A LEU 630.A N LEU 626.A O no hydrogen 2.872 N/A VAL 639.A N ALA 636.A O no hydrogen 3.018 N/A GLU 642.A N GLU 642.A OE1 no hydrogen 2.772 N/A LEU 644.A N ASP 640.A O no hydrogen 3.097 N/A ALA 645.A N LEU 641.A O no hydrogen 2.884 N/A LYS 646.A N GLU 642.A O no hydrogen 2.909 N/A MET 647.A N PHE 643.A O no hydrogen 2.928 N/A THR 648.A N LEU 644.A O no hydrogen 2.958 N/A THR 648.A OG1 LEU 644.A O no hydrogen 3.072 N/A ASP 655.A N SER 652.A OG no hydrogen 3.214 N/A THR 657.A N GLY 653.A O no hydrogen 2.994 N/A GLU 658.A N ALA 654.A O no hydrogen 2.885 N/A ILE 659.A N ASP 655.A O no hydrogen 2.872 N/A CYS 660.A N LEU 656.A O no hydrogen 3.025 N/A CYS 660.A SG LEU 656.A O no hydrogen 3.353 N/A GLN 661.A N THR 657.A O no hydrogen 2.897 N/A ARG 662.A N GLU 658.A O no hydrogen 2.922 N/A ALA 663.A N ILE 659.A O no hydrogen 2.919 N/A CYS 664.A N CYS 660.A O no hydrogen 2.966 N/A CYS 664.A SG SER 633.A OG no hydrogen 2.910 N/A CYS 664.A SG CYS 660.A O no hydrogen 3.457 N/A LYS 665.A N GLN 661.A O no hydrogen 2.907 N/A LEU 666.A N ARG 662.A O no hydrogen 2.954 N/A ALA 667.A N ALA 663.A O no hydrogen 2.883 N/A ILE 668.A N CYS 664.A O no hydrogen 2.913 N/A ARG 669.A N LYS 665.A O no hydrogen 3.019 N/A GLU 670.A N LEU 666.A O no hydrogen 2.925 N/A SER 671.A N ALA 667.A O no hydrogen 2.915 N/A SER 671.A OG ILE 668.A O no hydrogen 2.505 N/A ILE 672.A N ILE 668.A O no hydrogen 2.886 N/A GLU 673.A N ARG 669.A O no hydrogen 2.979 N/A SER 674.A N GLU 670.A O no hydrogen 2.883 N/A GLU 675.A N SER 671.A O no hydrogen 2.880 N/A ILE 676.A N ILE 672.A O no hydrogen 2.961 N/A ARG 677.A N GLU 673.A O no hydrogen 2.879 N/A ARG 678.A N SER 674.A O no hydrogen 2.894 N/A GLU 679.A N GLU 675.A O no hydrogen 2.960 N/A ARG 680.A N ILE 676.A O no hydrogen 2.895 N/A GLU 681.A N ARG 677.A O no hydrogen 2.929 N/A ARG 682.A N ARG 678.A O no hydrogen 2.917 N/A ARG 682.A NH1 GLU 679.A OE1 no hydrogen 3.378 N/A GLN 683.A N GLU 679.A O no hydrogen 3.104 N/A PHE 693.A N ARG 689.A O no hydrogen 3.424 N/A GLU 694.A N ARG 690.A O no hydrogen 2.934 N/A GLU 695.A N ASP 691.A O no hydrogen 2.900 N/A ALA 696.A N HIS 692.A O no hydrogen 2.952 N/A MET 697.A N PHE 693.A O no hydrogen 2.841 N/A ARG 698.A N GLU 694.A O no hydrogen 2.917 N/A PHE 699.A N GLU 695.A O no hydrogen 2.958 N/A ALA 700.A N ALA 696.A O no hydrogen 3.146 N/A ARG 701.A NE PHE 699.A O no hydrogen 3.146 N/A ARG 702.A NE GLY 650.A O no hydrogen 2.557 N/A ARG 702.A NH2 GLY 650.A O no hydrogen 2.571 N/A ARG 710.A N ASP 706.A O no hydrogen 2.926 N/A LYS 711.A N ASN 707.A O no hydrogen 2.894 N/A TYR 712.A N ASP 708.A O no hydrogen 2.930 N/A GLU 713.A N ILE 709.A O no hydrogen 2.931 N/A MET 714.A N ARG 710.A O no hydrogen 2.844 N/A PHE 715.A N LYS 711.A O no hydrogen 2.954 N/A ALA 716.A N TYR 712.A O no hydrogen 2.961 N/A GLN 717.A N GLU 713.A O no hydrogen 2.842 N/A THR 718.A N MET 714.A O no hydrogen 2.924 N/A THR 718.A OG1 MET 714.A O no hydrogen 3.368 N/A THR 718.A OG1 PHE 715.A O no hydrogen 2.399 N/A LEU 719.A N PHE 715.A O no hydrogen 2.932 N/A GLN 720.A N ALA 716.A O no hydrogen 2.933 N/A GLN 721.A N GLN 717.A O no hydrogen 2.866 N/A SER 722.A N THR 718.A O no hydrogen 2.931 N/A ARG 723.A N GLN 720.A O no hydrogen 2.854 N/A PHE 728.A N GLY 726.A O no hydrogen 2.748 N/A