Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3wlw_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLN 2.A N THR 1.A OG1 no hydrogen 2.393 N/A CYS 4.A N VAL 33.A O no hydrogen 2.835 N/A CYS 4.A SG VAL 33.A O no hydrogen 3.666 N/A GLY 6.A N GLN 35.A O no hydrogen 3.002 N/A THR 7.A N ASN 37.A O no hydrogen 3.182 N/A THR 7.A OG1 GLU 39.A OE1 no hydrogen 3.214 N/A ASP 8.A N ASN 407.A O no hydrogen 3.502 N/A MET 9.A N GLU 39.A OE1 no hydrogen 2.924 N/A LYS 10.A NZ ASP 8.A OD1 no hydrogen 2.440 N/A LYS 10.A NZ TYR 61.A OH no hydrogen 2.767 N/A ARG 12.A N MET 9.A O no hydrogen 3.054 N/A ARG 12.A NH1 ASN 407.A OD1 no hydrogen 2.643 N/A ARG 12.A NH2 ASP 8.A O no hydrogen 3.201 N/A ARG 12.A NH2 ASN 407.A OD1 no hydrogen 3.278 N/A SER 16.A OG THR 19.A OG1 no hydrogen 2.683 N/A THR 19.A N SER 16.A O no hydrogen 2.781 N/A THR 19.A OG1 SER 16.A O no hydrogen 2.771 N/A THR 19.A OG1 SER 16.A OG no hydrogen 2.683 N/A HIS 20.A N SER 16.A O no hydrogen 2.731 N/A MET 23.A N THR 19.A O no hydrogen 2.607 N/A LEU 24.A N HIS 20.A O no hydrogen 3.174 N/A ARG 25.A N LEU 21.A O no hydrogen 2.859 N/A ARG 25.A NH1 ASP 22.A OD1 no hydrogen 2.291 N/A HIS 26.A N ASP 22.A O no hydrogen 3.436 N/A HIS 26.A ND1 ASP 22.A O no hydrogen 2.986 N/A LEU 27.A N MET 23.A O no hydrogen 3.235 N/A TYR 28.A N LEU 24.A O no hydrogen 3.046 N/A CYS 31.A N TYR 28.A O no hydrogen 3.012 N/A CYS 31.A SG VAL 33.A O no hydrogen 3.080 N/A GLN 32.A N GLN 2.A O no hydrogen 2.791 N/A VAL 33.A N GLN 2.A O no hydrogen 3.082 N/A VAL 34.A N GLU 57.A O no hydrogen 3.204 N/A GLN 35.A N CYS 4.A O no hydrogen 2.893 N/A ASN 37.A ND2 GLN 84.A OE1 no hydrogen 3.178 N/A LEU 40.A N LEU 63.A O no hydrogen 2.754 N/A TYR 42.A N ALA 65.A O no hydrogen 3.226 N/A TYR 42.A OH LEU 11.A O no hydrogen 3.350 N/A LEU 43.A N ASN 67.A OD1 no hydrogen 2.943 N/A SER 48.A OG SER 50.A OG no hydrogen 2.749 N/A SER 50.A OG SER 48.A OG no hydrogen 2.749 N/A LEU 52.A N LEU 49.A O no hydrogen 3.041 N/A GLN 53.A N SER 50.A O no hydrogen 3.411 N/A GLN 53.A NE2 SER 50.A O no hydrogen 2.700 N/A GLN 56.A N GLN 32.A O no hydrogen 2.595 N/A GLU 57.A N GLN 32.A O no hydrogen 3.378 N/A VAL 58.A N ILE 79.A O no hydrogen 3.158 N/A GLN 59.A N VAL 34.A O no hydrogen 2.954 N/A GLN 59.A NE2 THR 83.A OG1 no hydrogen 3.120 N/A GLY 60.A N GLY 36.A O no hydrogen 2.810 N/A TYR 61.A N ASN 37.A OD1 no hydrogen 3.160 N/A TYR 61.A OH GLU 39.A OE2 no hydrogen 2.861 N/A VAL 62.A N ALA 91.A O no hydrogen 2.909 N/A LEU 63.A N LEU 38.A O no hydrogen 2.801 N/A ILE 64.A N ALA 93.A O no hydrogen 2.907 N/A ALA 65.A N LEU 40.A O no hydrogen 3.143 N/A HIS 66.A N LEU 95.A O no hydrogen 3.088 N/A ASN 67.A N ASN 97.A OD1 no hydrogen 3.143 N/A ASN 67.A ND2 LEU 40.A O no hydrogen 2.775 N/A ASN 67.A ND2 ASN 97.A OD1 no hydrogen 2.945 N/A GLN 68.A N LEU 43.A O no hydrogen 3.083 N/A GLN 68.A NE2 GLY 98.A O no hydrogen 3.443 N/A ARG 70.A NE PRO 103.A O no hydrogen 2.862 N/A ARG 70.A NH2 PRO 103.A O no hydrogen 3.001 N/A LEU 74.A N VAL 72.A O no hydrogen 2.796 N/A ARG 76.A NH1 GLN 53.A O no hydrogen 3.084 N/A ARG 78.A N GLN 56.A O no hydrogen 2.847 N/A ARG 78.A NH2 THR 115.A OG1 no hydrogen 2.519 N/A ILE 79.A N GLN 56.A O no hydrogen 3.424 N/A VAL 80.A N GLU 116.A O no hydrogen 3.107 N/A ARG 81.A N VAL 58.A O no hydrogen 2.879 N/A ARG 81.A NE GLU 57.A OE2 no hydrogen 3.478 N/A ARG 81.A NH1 CYS 224.A O no hydrogen 2.885 N/A ARG 81.A NH2 GLU 57.A OE1 no hydrogen 2.867 N/A ARG 81.A NH2 GLU 57.A OE2 no hydrogen 3.306 N/A ARG 81.A NH2 CYS 224.A O no hydrogen 3.089 N/A GLY 82.A N GLY 60.A O no hydrogen 3.394 N/A THR 83.A N GLN 59.A O no hydrogen 3.046 N/A THR 83.A OG1 GLN 59.A O no hydrogen 2.970 N/A PHE 86.A N TYR 90.A O no hydrogen 2.841 N/A ASP 88.A N LEU 85.A O no hydrogen 2.925 N/A ASN 89.A N PHE 86.A O no hydrogen 2.735 N/A TYR 90.A N PHE 86.A O no hydrogen 2.925 N/A ALA 91.A N GLY 121.A O no hydrogen 2.730 N/A LEU 92.A N GLY 121.A O no hydrogen 3.424 N/A ALA 93.A N VAL 62.A O no hydrogen 2.833 N/A VAL 94.A N LEU 123.A O no hydrogen 3.135 N/A LEU 95.A N ILE 64.A O no hydrogen 3.067 N/A ASP 96.A N GLN 125.A O no hydrogen 3.102 N/A ASN 97.A N ASN 127.A OD1 no hydrogen 3.391 N/A ASN 97.A ND2 ILE 64.A O no hydrogen 3.290 N/A ASN 97.A ND2 ASN 127.A OD1 no hydrogen 2.957 N/A GLY 104.A N ASP 99.A OD2 no hydrogen 3.067 N/A GLY 105.A N GLN 68.A O no hydrogen 3.327 N/A ARG 107.A N ARG 70.A O no hydrogen 3.259 N/A GLN 110.A N TRP 174.A O no hydrogen 3.259 N/A ARG 112.A NE ASP 180.A OD1 no hydrogen 2.636 N/A ARG 112.A NH2 ASP 180.A OD1 no hydrogen 2.948 N/A SER 113.A OG GLN 75.A O no hydrogen 2.635 N/A LEU 114.A N LEU 111.A O no hydrogen 3.400 N/A THR 115.A N ARG 78.A O no hydrogen 3.140 N/A THR 115.A OG1 ALA 211.A O no hydrogen 2.857 N/A GLU 116.A N ARG 78.A O no hydrogen 3.257 N/A ILE 117.A N ILE 141.A O no hydrogen 3.202 N/A LEU 118.A N VAL 80.A O no hydrogen 3.257 N/A GLY 121.A N ASN 89.A O no hydrogen 2.724 N/A LEU 123.A N LEU 92.A O no hydrogen 3.137 N/A ILE 124.A N LEU 152.A O no hydrogen 3.185 N/A GLN 125.A N VAL 94.A O no hydrogen 2.812 N/A ARG 126.A N ASP 154.A OD2 no hydrogen 3.251 N/A ARG 126.A NE ASP 96.A OD1 no hydrogen 2.393 N/A ARG 126.A NH1 GLN 125.A OE1 no hydrogen 3.320 N/A ARG 126.A NH2 ASP 96.A OD2 no hydrogen 3.072 N/A ASN 127.A ND2 VAL 94.A O no hydrogen 3.446 N/A LEU 130.A N ASN 127.A O no hydrogen 3.197 N/A CYS 131.A N ARG 107.A O no hydrogen 2.973 N/A TYR 132.A OH HIS 162.A O no hydrogen 3.290 N/A TYR 132.A OH GLU 176.A OE2 no hydrogen 3.343 N/A GLN 133.A N GLN 133.A OE1 no hydrogen 2.745 N/A GLN 133.A NE2 ASP 154.A O no hydrogen 2.873 N/A THR 135.A N TYR 132.A O no hydrogen 2.885 N/A ILE 136.A N GLN 133.A O no hydrogen 3.164 N/A LEU 137.A N GLN 182.A OE1 no hydrogen 2.617 N/A ASP 140.A N LEU 137.A O no hydrogen 2.955 N/A ILE 141.A N TRP 138.A O no hydrogen 2.756 N/A PHE 142.A N TRP 138.A O no hydrogen 3.006 N/A HIS 143.A N ILE 117.A O no hydrogen 3.063 N/A LYS 144.A NZ GLY 192.A O no hydrogen 3.188 N/A ASN 145.A N HIS 143.A ND1 no hydrogen 3.168 N/A ASN 146.A N HIS 143.A O no hydrogen 3.461 N/A LEU 152.A N VAL 122.A O no hydrogen 2.785 N/A ASP 154.A N ILE 124.A O no hydrogen 2.888 N/A ASN 156.A N ASP 154.A OD1 no hydrogen 2.744 N/A ARG 157.A NH2 ASP 134.A OD1 no hydrogen 3.487 N/A SER 158.A N PRO 128.A O no hydrogen 2.816 N/A SER 158.A OG ARG 157.A O no hydrogen 3.106 N/A MET 167.A N SER 165.A OG no hydrogen 3.159 N/A CYS 168.A N SER 165.A O no hydrogen 2.910 N/A CYS 168.A SG ARG 172.A O no hydrogen 3.979 N/A ARG 172.A NE THR 135.A O no hydrogen 3.280 N/A TRP 174.A N ASP 180.A O no hydrogen 2.472 N/A GLU 176.A N GLU 108.A OE2 no hydrogen 3.305 N/A SER 177.A N ASP 180.A OD2 no hydrogen 3.286 N/A GLU 179.A N SER 177.A OG no hydrogen 2.876 N/A ASP 180.A N SER 177.A O no hydrogen 3.221 N/A CYS 181.A N SER 178.A O no hydrogen 3.199 N/A CYS 181.A SG SER 178.A O no hydrogen 3.426 N/A GLN 182.A N ARG 172.A O no hydrogen 2.787 N/A GLN 182.A NE2 LEU 137.A O no hydrogen 2.969 N/A THR 185.A N ASP 140.A OD1 no hydrogen 2.486 N/A THR 185.A OG1 ASP 140.A OD1 no hydrogen 3.467 N/A ARG 186.A N ASP 140.A OD1 no hydrogen 2.978 N/A ARG 186.A N ASP 140.A OD2 no hydrogen 2.841 N/A ARG 186.A NE LYS 139.A O no hydrogen 3.004 N/A ARG 186.A NH2 LYS 139.A O no hydrogen 3.215 N/A THR 187.A N ASP 140.A OD2 no hydrogen 2.512 N/A THR 187.A OG1 ASP 140.A OD2 no hydrogen 2.635 N/A CYS 189.A SG THR 185.A O no hydrogen 3.108 N/A CYS 189.A SG ARG 186.A O no hydrogen 3.923 N/A CYS 193.A SG ALA 190.A O no hydrogen 3.318 N/A ARG 195.A NE GLU 116.A OE2 no hydrogen 2.809 N/A ARG 195.A NH1 ASP 140.A O no hydrogen 2.797 N/A ARG 195.A NH2 GLU 116.A OE1 no hydrogen 3.159 N/A ARG 195.A NH2 GLU 116.A OE2 no hydrogen 2.710 N/A ARG 195.A NH2 ASP 140.A O no hydrogen 3.563 N/A ARG 195.A NH2 ILE 141.A O no hydrogen 2.852 N/A CYS 196.A N THR 185.A O no hydrogen 3.091 N/A CYS 196.A SG THR 185.A O no hydrogen 3.842 N/A CYS 196.A SG GLY 198.A O no hydrogen 3.372 N/A LYS 197.A N ASP 203.A O no hydrogen 3.449 N/A LEU 200.A N ASP 203.A OD2 no hydrogen 3.253 N/A ASP 203.A N LEU 200.A O no hydrogen 2.714 N/A CYS 204.A N PRO 201.A O no hydrogen 2.933 N/A CYS 204.A SG ALA 190.A O no hydrogen 3.176 N/A CYS 205.A N ARG 195.A O no hydrogen 2.874 N/A GLN 208.A N HIS 206.A ND1 no hydrogen 3.138 N/A GLN 208.A NE2 GLU 207.A OE1 no hydrogen 3.105 N/A CYS 209.A N HIS 206.A O no hydrogen 2.932 N/A CYS 213.A SG ASP 203.A O no hydrogen 3.766 N/A CYS 213.A SG GLY 215.A O no hydrogen 3.195 N/A THR 214.A N ASP 220.A O no hydrogen 2.792 N/A LYS 217.A N ASP 220.A OD2 no hydrogen 3.417 N/A ASP 220.A N LYS 217.A O no hydrogen 2.906 N/A CYS 221.A SG LYS 217.A O no hydrogen 3.671 N/A LEU 222.A N GLY 212.A O no hydrogen 2.892 N/A LEU 225.A N GLN 208.A O no hydrogen 2.878 N/A PHE 227.A N GLU 234.A O no hydrogen 2.928 N/A ASN 228.A N ALA 262.A O no hydrogen 3.102 N/A HIS 229.A N ILE 232.A O no hydrogen 2.884 N/A HIS 229.A ND1 GLU 234.A OE2 no hydrogen 3.084 N/A CYS 233.A N HIS 218.A O no hydrogen 2.813 N/A GLU 234.A N PHE 227.A O no hydrogen 2.842 N/A ASN 244.A N GLU 249.A O no hydrogen 3.196 N/A ASN 244.A ND2 THR 247.A OG1 no hydrogen 2.128 N/A PHE 248.A N ASN 244.A O no hydrogen 2.509 N/A MET 251.A N THR 242.A O no hydrogen 2.868 N/A ASN 253.A N LEU 240.A O no hydrogen 3.251 N/A ASN 253.A ND2 ALA 239.A O no hydrogen 2.368 N/A GLU 255.A N ASN 253.A OD1 no hydrogen 3.237 N/A GLY 256.A N ASN 253.A O no hydrogen 2.918 N/A ARG 257.A N PRO 238.A O no hydrogen 2.926 N/A ARG 257.A NE THR 266.A OG1 no hydrogen 3.100 N/A ARG 257.A NH1 GLU 255.A OE1 no hydrogen 3.340 N/A TYR 258.A N VAL 265.A O no hydrogen 2.649 N/A THR 259.A N GLY 278.A O no hydrogen 2.856 N/A PHE 260.A N SER 263.A O no hydrogen 3.172 N/A SER 263.A N PHE 260.A O no hydrogen 3.068 N/A SER 263.A OG PHE 260.A O no hydrogen 2.751 N/A CYS 264.A N ASN 228.A O no hydrogen 2.975 N/A VAL 265.A N TYR 258.A O no hydrogen 2.671 N/A TYR 272.A N PRO 269.A O no hydrogen 2.945 N/A LEU 273.A N THR 281.A O no hydrogen 3.031 N/A CYS 280.A N THR 259.A O no hydrogen 3.129 N/A CYS 280.A SG THR 259.A O no hydrogen 3.613 N/A THR 281.A N LEU 273.A O no hydrogen 2.910 N/A ASN 288.A ND2 PRO 285.A O no hydrogen 3.164 N/A GLN 289.A N GLU 301.A O no hydrogen 2.785 N/A VAL 291.A N ARG 299.A O no hydrogen 2.790 N/A THR 292.A OG1 VAL 291.A O no hydrogen 2.679 N/A THR 297.A N ASP 295.A OD1 no hydrogen 3.421 N/A THR 297.A OG1 ASP 295.A OD1 no hydrogen 2.708 N/A GLN 298.A NE2 GLU 290.A OE2 no hydrogen 2.803 N/A GLN 298.A NE2 VAL 291.A O no hydrogen 3.676 N/A CYS 300.A N SER 274.A O no hydrogen 2.946 N/A GLU 301.A N GLN 289.A O no hydrogen 3.305 N/A CYS 303.A SG HIS 287.A O no hydrogen 3.671 N/A CYS 307.A SG ASN 288.A O no hydrogen 3.908 N/A CYS 311.A SG GLU 332.A O no hydrogen 3.285 N/A GLY 313.A N PHE 340.A O no hydrogen 2.697 N/A LEU 314.A N SER 342.A O no hydrogen 2.739 N/A GLY 315.A N LEU 319.A O no hydrogen 3.471 N/A LEU 319.A N GLU 317.A O no hydrogen 2.923 N/A VAL 322.A N LEU 319.A O no hydrogen 2.825 N/A ARG 323.A NE GLU 348.A OE1 no hydrogen 3.536 N/A VAL 325.A N ALA 344.A O no hydrogen 2.958 N/A THR 326.A N ASN 329.A OD1 no hydrogen 3.038 N/A SER 327.A OG ALA 359.A O no hydrogen 2.637 N/A ASN 329.A N THR 326.A O no hydrogen 2.491 N/A ILE 330.A N THR 326.A O no hydrogen 2.753 N/A GLU 332.A N ASN 329.A O no hydrogen 2.844 N/A PHE 333.A N ILE 330.A O no hydrogen 3.223 N/A ALA 334.A N GLN 331.A O no hydrogen 2.868 N/A CYS 336.A SG ALA 334.A O no hydrogen 3.929 N/A LYS 338.A NZ GLU 290.A OE2 no hydrogen 2.969 N/A LYS 338.A NZ GLU 374.A OE1 no hydrogen 3.226 N/A LYS 338.A NZ GLU 374.A OE2 no hydrogen 3.026 N/A ILE 339.A N GLU 374.A O no hydrogen 2.830 N/A PHE 340.A N CYS 311.A O no hydrogen 3.136 N/A GLY 341.A N THR 376.A OG1 no hydrogen 2.852 N/A SER 342.A N LEU 314.A O no hydrogen 3.024 N/A LEU 343.A N TYR 378.A O no hydrogen 3.198 N/A PHE 345.A N TYR 380.A O no hydrogen 2.780 N/A LEU 346.A N SER 349.A OG no hydrogen 2.857 N/A SER 349.A N LEU 346.A O no hydrogen 2.749 N/A SER 349.A OG VAL 325.A O no hydrogen 2.956 N/A SER 349.A OG LEU 346.A O no hydrogen 2.931 N/A ASP 351.A N PRO 347.A O no hydrogen 3.076 N/A ASP 353.A N THR 358.A O no hydrogen 3.162 N/A SER 356.A N ASP 353.A O no hydrogen 3.135 N/A ASN 357.A N PRO 354.A O no hydrogen 3.305 N/A THR 358.A N ASP 353.A O no hydrogen 3.342 N/A LEU 361.A N SER 349.A O no hydrogen 3.273 N/A GLN 362.A N GLN 365.A OE1 no hydrogen 3.169 N/A GLN 365.A N GLN 362.A O no hydrogen 2.850 N/A GLN 367.A N GLU 364.A O no hydrogen 3.431 N/A VAL 368.A N GLN 365.A O no hydrogen 3.120 N/A PHE 369.A N LEU 366.A O no hydrogen 3.298 N/A GLU 370.A N GLN 367.A O no hydrogen 2.924 N/A LEU 372.A N PHE 369.A O no hydrogen 2.947 N/A GLU 373.A N LYS 337.A O no hydrogen 3.176 N/A GLU 374.A N LYS 337.A O no hydrogen 2.980 N/A ILE 375.A N VAL 399.A O no hydrogen 2.929 N/A THR 376.A N ILE 339.A O no hydrogen 3.048 N/A THR 376.A OG1 ILE 339.A O no hydrogen 3.234 N/A GLY 377.A N GLY 341.A O no hydrogen 2.659 N/A TYR 378.A N ILE 404.A O no hydrogen 3.149 N/A LEU 379.A N SER 411.A O no hydrogen 2.843 N/A TYR 380.A N LEU 343.A O no hydrogen 3.011 N/A ILE 381.A N THR 413.A O no hydrogen 2.680 N/A SER 382.A N PHE 345.A O no hydrogen 3.044 N/A SER 382.A OG PHE 345.A O no hydrogen 3.081 N/A ALA 383.A N PHE 345.A O no hydrogen 3.434 N/A TRP 384.A NE1 ASP 390.A O no hydrogen 2.905 N/A LEU 388.A N PRO 385.A O no hydrogen 3.218 N/A SER 392.A OG ASP 390.A OD1 no hydrogen 2.811 N/A SER 392.A OG ASP 390.A OD2 no hydrogen 2.417 N/A GLN 395.A N SER 392.A O no hydrogen 2.494 N/A GLN 395.A NE2 SER 392.A O no hydrogen 3.144 N/A ASN 396.A ND2 GLU 370.A O no hydrogen 2.558 N/A LEU 397.A N PHE 394.A O no hydrogen 3.229 N/A GLN 398.A N GLU 373.A O no hydrogen 3.034 N/A ILE 400.A N GLU 429.A O no hydrogen 3.131 N/A ARG 401.A N ILE 375.A O no hydrogen 2.812 N/A ARG 401.A NE GLU 374.A OE1 no hydrogen 2.651 N/A ARG 401.A NH2 GLU 374.A OE1 no hydrogen 3.425 N/A ARG 403.A NE ASN 271.A O no hydrogen 3.121 N/A ARG 403.A NH2 GLN 298.A OE1 no hydrogen 2.996 N/A HIS 406.A N TYR 410.A O no hydrogen 2.965 N/A GLY 408.A N LEU 405.A O no hydrogen 3.219 N/A ALA 409.A N HIS 406.A O no hydrogen 2.880 N/A TYR 410.A N HIS 406.A O no hydrogen 2.941 N/A SER 411.A OG SER 432.A O no hydrogen 2.726 N/A THR 413.A N LEU 379.A O no hydrogen 3.034 N/A LEU 414.A N LEU 436.A O no hydrogen 3.180 N/A GLN 415.A N ILE 381.A O no hydrogen 3.046 N/A GLY 416.A N HIS 438.A O no hydrogen 3.301 N/A LEU 417.A N ASN 440.A OD1 no hydrogen 2.524 N/A SER 420.A N PRO 389.A O no hydrogen 2.713 N/A TRP 421.A N PRO 389.A O no hydrogen 3.355 N/A GLY 423.A N TRP 490.A O no hydrogen 2.777 N/A LEU 427.A N LEU 424.A O no hydrogen 3.450 N/A ARG 428.A N GLN 398.A O no hydrogen 3.141 N/A ARG 428.A NE GLN 398.A OE1 no hydrogen 2.919 N/A LEU 430.A N LEU 454.A O no hydrogen 3.041 N/A GLY 431.A N ILE 400.A O no hydrogen 2.565 N/A SER 432.A OG ARG 401.A O no hydrogen 2.669 N/A LEU 434.A N ALA 409.A O no hydrogen 3.148 N/A ALA 435.A N ALA 461.A O no hydrogen 3.087 N/A LEU 436.A N LEU 412.A O no hydrogen 2.885 N/A ILE 437.A N LEU 463.A O no hydrogen 3.027 N/A HIS 438.A N LEU 414.A O no hydrogen 3.156 N/A HIS 438.A ND1 HIS 439.A ND1 no hydrogen 2.901 N/A HIS 438.A NE2 GLN 415.A OE1 no hydrogen 2.881 N/A HIS 439.A N THR 465.A O no hydrogen 2.861 N/A HIS 439.A ND1 HIS 438.A ND1 no hydrogen 2.901 N/A ASN 440.A N ASN 467.A OD1 no hydrogen 2.915 N/A ASN 440.A ND2 LEU 414.A O no hydrogen 3.522 N/A ASN 440.A ND2 ASN 467.A OD1 no hydrogen 3.207 N/A LEU 443.A N ASN 440.A O no hydrogen 3.401 N/A CYS 444.A N SER 420.A O no hydrogen 3.234 N/A THR 448.A OG1 PHE 445.A O no hydrogen 2.494 N/A THR 448.A OG1 CYS 489.A O no hydrogen 3.313 N/A GLN 453.A N PRO 450.A O no hydrogen 2.823 N/A PHE 455.A N TRP 451.A O no hydrogen 3.489 N/A ARG 456.A N GLN 460.A OE1 no hydrogen 2.644 N/A ARG 456.A NE PHE 455.A O no hydrogen 3.221 N/A ARG 456.A NH1 GLU 429.A OE2 no hydrogen 2.476 N/A ARG 456.A NH2 GLN 453.A O no hydrogen 2.967 N/A ASN 457.A N GLN 460.A OE1 no hydrogen 2.640 N/A HIS 459.A N ASN 457.A OD1 no hydrogen 2.792 N/A GLN 460.A NE2 LEU 430.A O no hydrogen 3.603 N/A GLN 460.A NE2 GLY 433.A O no hydrogen 2.410 N/A LEU 463.A N ALA 435.A O no hydrogen 2.671 N/A THR 465.A N ILE 437.A O no hydrogen 3.344 N/A ASN 467.A ND2 ILE 437.A O no hydrogen 3.041 N/A ARG 468.A NE GLU 472.A OE2 no hydrogen 3.205 N/A GLU 472.A N PRO 469.A O no hydrogen 2.832 N/A CYS 473.A N GLU 470.A O no hydrogen 2.612 N/A CYS 473.A SG PRO 469.A O no hydrogen 3.749 N/A VAL 474.A N GLU 470.A O no hydrogen 2.770 N/A GLY 475.A N ASP 471.A O no hydrogen 2.917 N/A GLU 476.A N GLU 472.A O no hydrogen 3.444 N/A GLY 477.A N VAL 474.A O no hydrogen 3.225 N/A CYS 480.A SG GLY 487.A O no hydrogen 3.084 N/A LEU 483.A N HIS 481.A ND1 no hydrogen 3.027 N/A CYS 484.A N HIS 481.A O no hydrogen 2.937 N/A CYS 484.A SG HIS 481.A O no hydrogen 3.194 N/A CYS 484.A SG GLY 493.A O no hydrogen 3.775 N/A ALA 485.A N ASN 499.A O no hydrogen 2.834 N/A GLY 487.A N CYS 484.A O no hydrogen 3.069 N/A HIS 488.A N ALA 485.A O no hydrogen 3.515 N/A CYS 489.A SG GLY 491.A O no hydrogen 3.359 N/A TRP 490.A N GLN 496.A O no hydrogen 3.014 N/A THR 495.A OG1 GLN 496.A OE1 no hydrogen 2.933 N/A THR 495.A OG1 GLN 507.A O no hydrogen 3.502 N/A VAL 498.A N HIS 488.A O no hydrogen 3.022 N/A CYS 500.A SG PHE 503.A O no hydrogen 3.316 N/A SER 501.A N LEU 483.A O no hydrogen 3.471 N/A SER 501.A OG LEU 483.A O no hydrogen 2.817 N/A PHE 503.A N VAL 510.A O no hydrogen 3.090 N/A LEU 504.A N ARG 527.A O no hydrogen 2.911 N/A ARG 505.A N GLU 508.A O no hydrogen 2.989 N/A ARG 505.A NH1 GLU 522.A OE2 no hydrogen 3.229 N/A CYS 509.A N PRO 494.A O no hydrogen 2.975 N/A CYS 509.A SG PRO 494.A O no hydrogen 3.418 N/A VAL 510.A N PHE 503.A O no hydrogen 3.165 N/A CYS 513.A SG HIS 528.A O no hydrogen 3.265 N/A ARG 514.A NH1 GLU 522.A OE1 no hydrogen 2.996 N/A VAL 515.A N CYS 513.A O no hydrogen 2.973 N/A TYR 523.A N LEU 530.A O no hydrogen 3.322 N/A HIS 528.A ND1 ALA 526.A O no hydrogen 2.492 N/A LEU 530.A N TYR 523.A O no hydrogen 3.167 N/A CYS 532.A SG GLY 547.A O no hydrogen 3.163 N/A CYS 536.A SG GLN 537.A OE1 no hydrogen 3.330 N/A CYS 536.A SG CYS 553.A O no hydrogen 3.898 N/A GLN 537.A NE2 VAL 554.A O no hydrogen 2.774 N/A CYS 545.A N VAL 543.A O no hydrogen 3.080 N/A CYS 545.A SG GLY 547.A O no hydrogen 3.506 N/A GLU 549.A N GLN 552.A OE1 no hydrogen 3.143 N/A ALA 550.A N GLU 549.A OE2 no hydrogen 3.439 N/A CYS 553.A SG GLU 549.A O no hydrogen 3.134 N/A