Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1nql_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): CYS 5.A N VAL 34.A O no hydrogen 2.981 N/A CYS 5.A SG VAL 34.A O no hydrogen 3.761 N/A THR 8.A N ASN 38.A O no hydrogen 2.802 N/A THR 8.A OG1 GLU 40.A OE1 no hydrogen 2.825 N/A ASN 10.A N THR 8.A OG1 no hydrogen 3.158 N/A ASN 10.A N GLU 40.A OE1 no hydrogen 2.365 N/A THR 13.A N ASN 10.A O no hydrogen 2.705 N/A GLN 14.A NE2 GLY 16.A O no hydrogen 3.398 N/A LEU 15.A N HIS 21.A ND1 no hydrogen 3.080 N/A THR 17.A N ASP 20.A OD2 no hydrogen 2.824 N/A ASP 20.A N THR 17.A OG1 no hydrogen 3.227 N/A HIS 21.A N THR 17.A O no hydrogen 2.931 N/A HIS 21.A NE2 THR 42.A OG1 no hydrogen 3.182 N/A PHE 22.A N PHE 18.A O no hydrogen 2.832 N/A LEU 23.A N GLU 19.A O no hydrogen 2.888 N/A SER 24.A N ASP 20.A O no hydrogen 3.066 N/A SER 24.A N HIS 21.A O no hydrogen 3.240 N/A SER 24.A OG ASP 20.A O no hydrogen 2.758 N/A SER 24.A OG HIS 21.A O no hydrogen 3.483 N/A LEU 25.A N HIS 21.A O no hydrogen 3.099 N/A GLN 26.A N PHE 22.A O no hydrogen 2.923 N/A ARG 27.A N LEU 23.A O no hydrogen 2.966 N/A MET 28.A N SER 24.A O no hydrogen 2.817 N/A MET 28.A N LEU 25.A O no hydrogen 3.010 N/A PHE 29.A N LEU 25.A O no hydrogen 2.854 N/A ASN 30.A N GLN 26.A O no hydrogen 2.804 N/A CYS 32.A N PHE 29.A O no hydrogen 2.898 N/A CYS 32.A SG VAL 34.A O no hydrogen 3.395 N/A GLU 33.A N LYS 3.A O no hydrogen 3.150 N/A VAL 34.A N LYS 3.A O no hydrogen 3.033 N/A VAL 35.A N GLU 58.A O no hydrogen 2.790 N/A LEU 36.A N CYS 5.A O no hydrogen 3.043 N/A ASN 38.A ND2 THR 8.A O no hydrogen 2.712 N/A LEU 39.A N TYR 62.A O no hydrogen 3.019 N/A ILE 41.A N LEU 64.A O no hydrogen 2.619 N/A THR 42.A OG1 HIS 21.A NE2 no hydrogen 3.182 N/A TYR 43.A OH LEU 12.A O no hydrogen 2.589 N/A VAL 44.A N ASN 68.A OD1 no hydrogen 3.315 N/A GLN 45.A NE2 TYR 43.A O no hydrogen 2.620 N/A LYS 54.A N SER 51.A O no hydrogen 2.841 N/A LYS 54.A NZ GLU 76.A OE2 no hydrogen 3.443 N/A THR 55.A N PHE 52.A O no hydrogen 2.957 N/A ILE 56.A N LEU 53.A O no hydrogen 3.447 N/A GLN 57.A N GLU 33.A O no hydrogen 2.702 N/A GLU 58.A N GLU 33.A O no hydrogen 3.097 N/A VAL 59.A N ILE 80.A O no hydrogen 3.055 N/A ALA 60.A N VAL 35.A O no hydrogen 2.832 N/A GLY 61.A N GLY 37.A O no hydrogen 2.667 N/A TYR 62.A N ASN 38.A OD1 no hydrogen 3.340 N/A TYR 62.A OH GLU 40.A OE2 no hydrogen 2.713 N/A VAL 63.A N ALA 92.A O no hydrogen 2.811 N/A LEU 64.A N LEU 39.A O no hydrogen 2.825 N/A ILE 65.A N ALA 94.A O no hydrogen 3.053 N/A ALA 66.A N ILE 41.A O no hydrogen 3.142 N/A LEU 67.A N LEU 96.A O no hydrogen 3.324 N/A LEU 67.A N SER 97.A O no hydrogen 2.714 N/A ASN 68.A N ASN 98.A OD1 no hydrogen 3.107 N/A ASN 68.A ND2 ILE 41.A O no hydrogen 3.061 N/A ASN 68.A ND2 ASN 98.A OD1 no hydrogen 2.521 N/A THR 69.A N VAL 44.A O no hydrogen 2.808 N/A ILE 73.A N GLU 108.A O no hydrogen 2.893 N/A LEU 75.A N ILE 73.A O no hydrogen 2.966 N/A GLU 76.A N PRO 74.A O no hydrogen 2.673 N/A LEU 78.A N LEU 75.A O no hydrogen 3.294 N/A GLN 79.A N GLN 57.A O no hydrogen 2.571 N/A ILE 80.A N GLN 57.A O no hydrogen 3.271 N/A ILE 81.A N GLU 116.A O no hydrogen 2.997 N/A ARG 82.A N VAL 59.A O no hydrogen 2.858 N/A ARG 82.A NH1 CYS 225.A O no hydrogen 2.950 N/A ARG 82.A NH2 GLU 58.A OE2 no hydrogen 2.490 N/A ARG 82.A NH2 CYS 225.A O no hydrogen 2.791 N/A ASN 84.A N ALA 60.A O no hydrogen 2.875 N/A TYR 87.A N TYR 91.A O no hydrogen 2.732 N/A SER 90.A N TYR 87.A O no hydrogen 3.217 N/A SER 90.A OG GLU 88.A O no hydrogen 3.314 N/A TYR 91.A N TYR 87.A O no hydrogen 2.945 N/A ALA 92.A N ALA 121.A O no hydrogen 2.832 N/A LEU 93.A N ALA 121.A O no hydrogen 3.340 N/A ALA 94.A N VAL 63.A O no hydrogen 3.004 N/A VAL 95.A N ARG 123.A O no hydrogen 2.694 N/A LEU 96.A N ILE 65.A O no hydrogen 3.009 N/A SER 97.A N SER 125.A O no hydrogen 2.644 N/A ASN 98.A N ASN 126.A O no hydrogen 3.101 N/A ASN 98.A ND2 ILE 65.A O no hydrogen 3.275 N/A LYS 103.A N ASP 100.A O no hydrogen 3.042 N/A LEU 106.A N ASN 98.A O no hydrogen 3.129 N/A LYS 107.A N GLU 71.A O no hydrogen 2.804 N/A GLU 108.A N GLU 71.A O no hydrogen 2.751 N/A ASN 113.A ND2 GLU 76.A O no hydrogen 2.491 N/A LEU 114.A N MET 111.A O no hydrogen 2.805 N/A GLN 115.A N GLN 79.A O no hydrogen 3.056 N/A ILE 117.A N ILE 141.A O no hydrogen 2.889 N/A LEU 118.A N ILE 81.A O no hydrogen 3.023 N/A ALA 121.A N SER 90.A O no hydrogen 2.909 N/A ARG 123.A N LEU 93.A O no hydrogen 2.880 N/A ARG 123.A NE SER 151.A OG no hydrogen 2.889 N/A PHE 124.A N SER 151.A O no hydrogen 2.783 N/A SER 125.A N VAL 95.A O no hydrogen 3.183 N/A ASN 126.A N ASP 153.A OD2 no hydrogen 3.335 N/A ASN 127.A ND2 VAL 95.A O no hydrogen 3.615 N/A LEU 130.A N ASN 127.A O no hydrogen 3.250 N/A CYS 131.A N LYS 107.A O no hydrogen 2.808 N/A CYS 131.A SG ALA 129.A O no hydrogen 4.035 N/A ASN 132.A N GLU 134.A OE1 no hydrogen 3.065 N/A VAL 133.A N CYS 131.A O no hydrogen 2.575 N/A SER 135.A N ASN 132.A O no hydrogen 2.579 N/A SER 135.A OG ASN 132.A O no hydrogen 2.813 N/A SER 135.A OG GLY 171.A O no hydrogen 3.533 N/A SER 135.A OG CYS 173.A O no hydrogen 3.068 N/A ILE 136.A N VAL 133.A O no hydrogen 3.124 N/A GLN 137.A N GLN 182.A OE1 no hydrogen 2.772 N/A ASP 140.A N GLN 137.A O no hydrogen 2.980 N/A ILE 141.A N TRP 138.A O no hydrogen 2.896 N/A VAL 142.A N TRP 138.A O no hydrogen 2.892 N/A SER 143.A OG LEU 118.A O no hydrogen 3.490 N/A PHE 146.A N SER 143.A O no hydrogen 2.926 N/A LEU 147.A N SER 144.A O no hydrogen 3.188 N/A ASN 149.A N PHE 146.A O no hydrogen 3.153 N/A CYS 164.A SG ASN 132.A OD1 no hydrogen 3.935 N/A CYS 164.A SG GLY 171.A O no hydrogen 3.875 N/A SER 167.A N ASP 165.A OD1 no hydrogen 3.255 N/A SER 167.A OG ASP 165.A OD1 no hydrogen 2.727 N/A CYS 168.A SG ASP 165.A O no hydrogen 3.147 N/A SER 172.A N PRO 169.A O no hydrogen 2.853 N/A SER 172.A OG PRO 169.A O no hydrogen 2.689 N/A SER 172.A OG GLN 182.A OE1 no hydrogen 3.498 N/A CYS 173.A N SER 135.A OG no hydrogen 2.826 N/A CYS 173.A SG GLY 175.A O no hydrogen 3.054 N/A TRP 174.A N ASN 180.A O no hydrogen 3.077 N/A ASN 180.A N GLY 177.A O no hydrogen 3.229 N/A ASN 180.A ND2 ALA 176.A O no hydrogen 2.814 N/A CYS 181.A N GLU 178.A O no hydrogen 2.938 N/A CYS 181.A SG SER 167.A O no hydrogen 3.176 N/A GLN 182.A N SER 172.A O no hydrogen 3.054 N/A GLN 182.A NE2 GLN 137.A O no hydrogen 3.303 N/A THR 185.A N ASP 140.A OD1 no hydrogen 2.846 N/A THR 185.A OG1 ALA 212.A O no hydrogen 2.949 N/A LYS 186.A NZ ARG 139.A O no hydrogen 3.512 N/A ILE 187.A N ASP 140.A OD2 no hydrogen 2.604 N/A CYS 193.A N ALA 190.A O no hydrogen 2.585 N/A ARG 196.A NE GLU 116.A OE2 no hydrogen 2.781 N/A ARG 196.A NH1 THR 185.A OG1 no hydrogen 2.865 N/A ARG 196.A NH2 ASP 140.A O no hydrogen 2.558 N/A CYS 197.A N THR 185.A O no hydrogen 3.149 N/A CYS 197.A SG ILE 188.A O no hydrogen 3.120 N/A ARG 198.A N ASP 204.A O no hydrogen 2.945 N/A SER 201.A N ASP 204.A OD2 no hydrogen 3.148 N/A ASP 204.A N SER 201.A O no hydrogen 3.091 N/A CYS 205.A N PRO 202.A O no hydrogen 3.361 N/A CYS 205.A SG PRO 202.A O no hydrogen 3.596 N/A CYS 206.A N ARG 196.A O no hydrogen 2.758 N/A GLN 209.A NE2 ASN 208.A OD1 no hydrogen 3.395 N/A GLN 209.A NE2 ASP 236.A OD1 no hydrogen 2.839 N/A CYS 210.A N HIS 207.A O no hydrogen 3.198 N/A CYS 210.A SG HIS 207.A O no hydrogen 3.571 N/A ALA 211.A N VAL 224.A O no hydrogen 2.738 N/A CYS 214.A SG GLY 216.A O no hydrogen 3.288 N/A THR 215.A N ASP 221.A O no hydrogen 2.747 N/A ARG 218.A N ASP 221.A OD2 no hydrogen 3.476 N/A CYS 222.A SG GLU 219.A O no hydrogen 3.964 N/A LEU 223.A N GLY 213.A O no hydrogen 2.916 N/A CYS 225.A SG PHE 228.A O no hydrogen 3.756 N/A ARG 226.A N GLN 209.A O no hydrogen 3.044 N/A PHE 228.A N LYS 235.A O no hydrogen 2.871 N/A ARG 229.A N ALA 263.A O no hydrogen 2.786 N/A ASP 230.A N THR 233.A O no hydrogen 2.980 N/A THR 233.A N ASP 230.A O no hydrogen 3.231 N/A CYS 234.A N GLU 219.A O no hydrogen 3.325 N/A CYS 234.A SG GLN 209.A O no hydrogen 3.863 N/A CYS 234.A SG GLU 219.A O no hydrogen 3.664 N/A LYS 235.A N PHE 228.A O no hydrogen 2.743 N/A LYS 235.A NZ ASP 230.A OD2 no hydrogen 3.082 N/A CYS 238.A SG TYR 259.A O no hydrogen 3.475 N/A CYS 238.A SG THR 264.A O no hydrogen 3.856 N/A LEU 243.A N ASP 252.A O no hydrogen 2.683 N/A TYR 244.A N MET 574.A O no hydrogen 2.859 N/A TYR 244.A OH ASP 561.A OD2 no hydrogen 2.485 N/A ASN 245.A N GLN 250.A O no hydrogen 2.864 N/A THR 248.A N ASN 245.A O no hydrogen 3.035 N/A THR 248.A OG1 ASN 245.A O no hydrogen 3.270 N/A THR 248.A OG1 GLN 250.A O no hydrogen 3.299 N/A TYR 249.A N ASN 245.A O no hydrogen 2.662 N/A GLN 250.A N THR 248.A OG1 no hydrogen 3.319 N/A ASP 252.A N LEU 243.A O no hydrogen 2.548 N/A ASN 254.A N LEU 241.A O no hydrogen 2.867 N/A ASN 254.A ND2 PRO 240.A O no hydrogen 2.617 N/A GLU 256.A N ASN 254.A OD1 no hydrogen 2.974 N/A GLY 257.A N ASN 254.A O no hydrogen 2.791 N/A LYS 258.A N PRO 239.A O no hydrogen 2.833 N/A PHE 261.A N THR 264.A O no hydrogen 2.777 N/A THR 264.A N PHE 261.A O no hydrogen 2.835 N/A CYS 265.A N ARG 229.A O no hydrogen 3.238 N/A VAL 266.A N TYR 259.A O no hydrogen 3.296 N/A VAL 274.A N VAL 282.A O no hydrogen 3.024 N/A VAL 275.A N ARG 298.A O no hydrogen 2.938 N/A THR 276.A N SER 280.A O no hydrogen 3.023 N/A THR 276.A OG1 SER 280.A O no hydrogen 3.225 N/A GLY 279.A N THR 276.A O no hydrogen 2.679 N/A CYS 281.A N SER 260.A O no hydrogen 2.814 N/A VAL 282.A N VAL 274.A O no hydrogen 2.953 N/A TYR 290.A N LYS 301.A O no hydrogen 3.038 N/A CYS 300.A N VAL 275.A O no hydrogen 2.752 N/A LYS 302.A NZ SER 289.A OG no hydrogen 3.221 N/A CYS 307.A SG ALA 287.A O no hydrogen 3.996 N/A LYS 309.A N THR 337.A OG1 no hydrogen 2.961 N/A CYS 311.A N SER 338.A O no hydrogen 2.993 N/A CYS 311.A SG HIS 332.A O no hydrogen 3.713 N/A ILE 314.A N ASP 342.A O no hydrogen 2.961 N/A GLY 315.A N PHE 319.A O no hydrogen 3.462 N/A LYS 320.A N GLY 317.A O no hydrogen 3.092 N/A SER 324.A OG ILE 325.A O no hydrogen 2.911 N/A ILE 325.A N HIS 344.A O no hydrogen 3.166 N/A ILE 330.A N ASN 326.A O no hydrogen 3.203 N/A HIS 332.A N ASN 329.A O no hydrogen 3.131 N/A PHE 333.A N LYS 331.A O no hydrogen 2.534 N/A THR 337.A N LYS 309.A O no hydrogen 3.222 N/A THR 337.A OG1 LYS 309.A O no hydrogen 3.501 N/A SER 338.A N LYS 309.A O no hydrogen 3.301 N/A SER 338.A OG GLU 374.A OE1 no hydrogen 3.093 N/A ILE 339.A N GLU 374.A O no hydrogen 2.838 N/A SER 340.A N CYS 311.A O no hydrogen 2.697 N/A LEU 343.A N PHE 378.A O no hydrogen 2.814 N/A ILE 345.A N LEU 380.A O no hydrogen 2.656 N/A ALA 349.A N LEU 346.A O no hydrogen 2.782 N/A ARG 351.A N PRO 347.A O no hydrogen 3.124 N/A GLY 352.A N VAL 348.A O no hydrogen 2.793 N/A ASP 353.A N THR 358.A O no hydrogen 3.002 N/A PHE 355.A N ASP 353.A OD1 no hydrogen 3.178 N/A THR 356.A OG1 THR 358.A OG1 no hydrogen 3.211 N/A HIS 357.A N SER 354.A O no hydrogen 3.379 N/A THR 358.A N ASP 353.A O no hydrogen 3.048 N/A THR 358.A OG1 THR 356.A O no hydrogen 2.726 N/A THR 358.A OG1 THR 356.A OG1 no hydrogen 3.211 N/A LEU 361.A N ALA 349.A O no hydrogen 3.339 N/A GLN 364.A N ASP 362.A OD2 no hydrogen 3.087 N/A GLU 365.A N ASP 362.A O no hydrogen 2.975 N/A ASP 367.A N GLN 364.A O no hydrogen 3.313 N/A ILE 368.A N GLU 365.A O no hydrogen 2.881 N/A LEU 369.A N LEU 366.A O no hydrogen 3.331 N/A LYS 370.A N ASP 367.A O no hydrogen 3.305 N/A THR 371.A OG1 LYS 334.A O no hydrogen 3.072 N/A THR 371.A OG1 CYS 336.A O no hydrogen 2.611 N/A VAL 372.A N LEU 369.A O no hydrogen 3.135 N/A LYS 373.A N THR 337.A O no hydrogen 2.550 N/A GLU 374.A N THR 337.A O no hydrogen 3.095 N/A ILE 375.A N ILE 399.A O no hydrogen 2.972 N/A THR 376.A N ILE 339.A O no hydrogen 2.969 N/A GLY 377.A N GLY 341.A O no hydrogen 3.043 N/A PHE 378.A N ASP 342.A OD1 no hydrogen 2.812 N/A LEU 379.A N SER 411.A O no hydrogen 2.705 N/A LEU 380.A N LEU 343.A O no hydrogen 2.741 N/A ILE 381.A N ALA 413.A O no hydrogen 2.968 N/A GLN 382.A N ILE 345.A O no hydrogen 2.700 N/A TRP 384.A NE1 ASP 390.A O no hydrogen 2.817 N/A ARG 388.A N PRO 385.A O no hydrogen 3.049 N/A ARG 388.A NH1 ASP 367.A OD2 no hydrogen 3.001 N/A ARG 388.A NH2 ASP 367.A OD2 no hydrogen 3.108 N/A THR 389.A OG1 THR 420.A OG1 no hydrogen 2.460 N/A PHE 394.A N LEU 391.A O no hydrogen 3.033 N/A GLU 395.A N HIS 392.A O no hydrogen 2.938 N/A ASN 396.A ND2 LYS 370.A O no hydrogen 2.515 N/A LEU 397.A N PHE 394.A O no hydrogen 3.020 N/A GLU 398.A N LYS 373.A O no hydrogen 2.746 N/A ILE 399.A N LYS 373.A O no hydrogen 3.170 N/A ILE 400.A N GLU 429.A O no hydrogen 2.832 N/A ARG 401.A N ILE 375.A O no hydrogen 3.013 N/A ARG 401.A NH2 GLU 374.A OE2 no hydrogen 2.934 N/A GLY 402.A N GLY 377.A O no hydrogen 2.938 N/A ARG 403.A N THR 376.A O no hydrogen 3.183 N/A THR 404.A OG1 ASP 342.A OD2 no hydrogen 3.395 N/A GLN 406.A N PHE 410.A O no hydrogen 2.640 N/A GLY 408.A N LYS 405.A O no hydrogen 2.780 N/A GLN 409.A N GLN 406.A O no hydrogen 2.954 N/A GLN 409.A NE2 ASP 434.A OD2 no hydrogen 2.777 N/A PHE 410.A N GLN 406.A O no hydrogen 3.164 N/A SER 411.A N ASP 434.A O no hydrogen 2.976 N/A ALA 413.A N LEU 379.A O no hydrogen 3.079 N/A VAL 414.A N ILE 436.A O no hydrogen 2.616 N/A VAL 415.A N ILE 381.A O no hydrogen 3.228 N/A SER 416.A N SER 438.A O no hydrogen 2.785 N/A LEU 417.A N ASN 440.A OD1 no hydrogen 3.237 N/A THR 420.A N THR 389.A O no hydrogen 3.067 N/A THR 420.A OG1 THR 389.A O no hydrogen 2.743 N/A THR 420.A OG1 THR 389.A OG1 no hydrogen 2.460 N/A ARG 425.A N GLY 423.A O no hydrogen 2.774 N/A SER 426.A OG GLU 395.A O no hydrogen 2.451 N/A LEU 427.A N LEU 424.A O no hydrogen 3.048 N/A LYS 428.A N GLU 398.A O no hydrogen 2.969 N/A ILE 430.A N LEU 454.A O no hydrogen 2.872 N/A SER 431.A N ILE 400.A O no hydrogen 3.286 N/A ASP 434.A N GLN 409.A O no hydrogen 2.758 N/A VAL 435.A N LYS 461.A O no hydrogen 3.366 N/A ILE 436.A N LEU 412.A O no hydrogen 2.912 N/A SER 438.A N VAL 414.A O no hydrogen 2.812 N/A ASN 440.A N ASN 467.A OD1 no hydrogen 3.184 N/A ASN 440.A ND2 VAL 414.A O no hydrogen 2.955 N/A ASN 440.A ND2 ASN 467.A OD1 no hydrogen 2.862 N/A LYS 441.A N GLY 439.A O no hydrogen 2.984 N/A LEU 443.A N ASN 440.A O no hydrogen 2.938 N/A CYS 444.A N THR 420.A O no hydrogen 3.065 N/A CYS 444.A SG ASN 442.A O no hydrogen 3.774 N/A THR 448.A N TYR 445.A O no hydrogen 2.736 N/A THR 448.A OG1 TYR 445.A O no hydrogen 2.779 N/A TRP 451.A NE1 ALA 446.A O no hydrogen 2.959 N/A LYS 453.A N ASN 450.A O no hydrogen 2.650 N/A LEU 454.A N TRP 451.A O no hydrogen 2.947 N/A GLY 456.A N SER 431.A O no hydrogen 3.134 N/A THR 457.A OG1 SER 431.A O no hydrogen 2.782 N/A THR 457.A OG1 ASP 432.A OD2 no hydrogen 2.980 N/A GLY 459.A N THR 457.A O no hydrogen 2.860 N/A GLN 460.A N THR 457.A O no hydrogen 3.495 N/A LYS 461.A N ASP 434.A OD1 no hydrogen 2.936 N/A ILE 465.A N ILE 437.A O no hydrogen 3.447 N/A ASN 467.A ND2 ILE 437.A O no hydrogen 3.322 N/A SER 472.A N GLY 469.A O no hydrogen 3.026 N/A SER 472.A N ASN 471.A OD1 no hydrogen 2.732 N/A CYS 473.A SG CYS 444.A O no hydrogen 3.835 N/A CYS 473.A SG GLY 469.A O no hydrogen 3.949 N/A LYS 474.A N GLU 470.A O no hydrogen 3.313 N/A ALA 475.A N ASN 471.A O no hydrogen 3.022 N/A THR 476.A N SER 472.A O no hydrogen 2.777 N/A THR 476.A OG1 SER 472.A O no hydrogen 2.404 N/A GLY 477.A N LYS 474.A O no hydrogen 3.134 N/A GLN 478.A N CYS 473.A O no hydrogen 2.782 N/A CYS 484.A N HIS 481.A O no hydrogen 3.005 N/A SER 485.A N SER 499.A O no hydrogen 3.343 N/A SER 485.A OG SER 499.A O no hydrogen 2.810 N/A SER 485.A OG SER 499.A OG no hydrogen 2.831 N/A GLY 488.A N SER 485.A O no hydrogen 3.318 N/A CYS 489.A N THR 448.A OG1 no hydrogen 3.096 N/A CYS 489.A SG GLY 491.A O no hydrogen 3.593 N/A TRP 490.A N ASP 496.A O no hydrogen 2.696 N/A ASP 496.A N GLU 493.A O no hydrogen 3.211 N/A CYS 497.A SG PRO 494.A O no hydrogen 3.467 N/A VAL 498.A N GLY 488.A O no hydrogen 3.494 N/A SER 499.A OG SER 485.A OG no hydrogen 2.831 N/A ARG 501.A N LEU 483.A O no hydrogen 3.304 N/A SER 504.A N SER 527.A O no hydrogen 3.042 N/A SER 504.A OG SER 527.A O no hydrogen 3.065 N/A ARG 505.A N GLU 508.A O no hydrogen 2.985 N/A ARG 505.A NE GLU 522.A OE2 no hydrogen 2.559 N/A ARG 505.A NH2 GLU 522.A OE1 no hydrogen 2.922 N/A ARG 507.A N ARG 505.A O no hydrogen 2.656 N/A GLU 508.A N ARG 505.A O no hydrogen 3.393 N/A CYS 509.A N PRO 494.A O no hydrogen 3.446 N/A CYS 509.A SG PRO 494.A O no hydrogen 3.988 N/A VAL 510.A N VAL 503.A O no hydrogen 2.975 N/A LYS 512.A NZ GLU 517.A OE2 no hydrogen 3.481 N/A CYS 513.A SG GLU 528.A O no hydrogen 3.799 N/A LYS 514.A N GLU 522.A OE1 no hydrogen 2.403 N/A ARG 521.A NE GLY 518.A O no hydrogen 3.282 N/A GLU 522.A N LYS 514.A O no hydrogen 3.253 N/A PHE 523.A N ILE 530.A O no hydrogen 3.014 N/A GLU 525.A N GLU 528.A O no hydrogen 3.266 N/A GLU 528.A N GLU 525.A O no hydrogen 3.376 N/A CYS 529.A N SER 504.A O no hydrogen 2.737 N/A CYS 529.A SG SER 504.A O no hydrogen 3.549 N/A ILE 530.A N PHE 523.A O no hydrogen 3.048 N/A CYS 532.A N ARG 521.A O no hydrogen 2.721 N/A CYS 536.A N HIS 533.A O no hydrogen 3.046 N/A CYS 536.A SG HIS 533.A O no hydrogen 3.217 N/A LEU 537.A N GLN 555.A O no hydrogen 2.788 N/A GLN 539.A N THR 544.A OG1 no hydrogen 2.922 N/A GLN 539.A NE2 LEU 537.A O no hydrogen 2.713 N/A ASN 542.A N GLN 539.A O no hydrogen 3.278 N/A CYS 545.A SG GLY 547.A O no hydrogen 3.889 N/A THR 546.A N ASN 552.A O no hydrogen 2.593 N/A THR 546.A OG1 ASN 552.A O no hydrogen 3.259 N/A THR 546.A OG1 ASN 552.A OD1 no hydrogen 2.708 N/A ARG 548.A NH1 GLU 525.A OE1 no hydrogen 2.907 N/A ASN 552.A ND2 ARG 548.A O no hydrogen 2.507 N/A CYS 553.A SG PRO 550.A O no hydrogen 4.002 N/A ILE 554.A N THR 544.A O no hydrogen 3.264 N/A ALA 557.A N GLU 535.A O no hydrogen 2.532 N/A TYR 559.A N VAL 566.A O no hydrogen 2.952 N/A ILE 560.A N HIS 589.A O no hydrogen 2.754 N/A ASP 561.A N HIS 564.A O no hydrogen 3.130 N/A HIS 564.A N ASP 561.A O no hydrogen 3.045 N/A HIS 564.A ND1 ASP 551.A OD1 no hydrogen 2.748 N/A HIS 564.A NE2 THR 248.A O no hydrogen 3.166 N/A CYS 565.A N PRO 550.A O no hydrogen 3.196 N/A CYS 565.A SG PRO 550.A O no hydrogen 3.659 N/A VAL 566.A N TYR 559.A O no hydrogen 2.839 N/A CYS 569.A SG TYR 584.A O no hydrogen 3.937 N/A GLY 572.A N VAL 581.A O no hydrogen 2.968 N/A VAL 573.A N VAL 581.A O no hydrogen 3.216 N/A GLY 575.A N THR 579.A O no hydrogen 3.168 N/A VAL 581.A N VAL 573.A O no hydrogen 2.737 N/A LYS 583.A N PRO 570.A O no hydrogen 3.117 N/A LYS 583.A NZ TYR 244.A OH no hydrogen 3.535 N/A LYS 583.A NZ ASP 561.A OD1 no hydrogen 3.012 N/A TYR 584.A N HIS 592.A O no hydrogen 2.988 N/A ASP 586.A N VAL 590.A O no hydrogen 2.806 N/A HIS 589.A N ASP 586.A O no hydrogen 2.439 N/A VAL 590.A N ASP 586.A OD1 no hydrogen 2.405 N/A CYS 591.A N ILE 560.A O no hydrogen 2.610 N/A CYS 591.A SG ILE 560.A O no hydrogen 3.260 N/A HIS 592.A N TYR 584.A O no hydrogen 3.074 N/A CYS 594.A N TRP 582.A O no hydrogen 2.615 N/A CYS 594.A SG TRP 582.A O no hydrogen 3.450 N/A CYS 598.A N HIS 595.A O no hydrogen 3.151 N/A CYS 598.A SG GLY 601.A O no hydrogen 3.920 N/A CYS 602.A SG GLY 604.A O no hydrogen 3.099 N/A THR 603.A OG1 GLY 609.A O no hydrogen 3.230 N/A GLY 609.A N GLY 606.A O no hydrogen 3.107 N/A