Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 8ptx_B.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLU 7.A N ARG 794.A O no hydrogen 3.094 N/A SER 9.A N ILE 792.A O no hydrogen 2.998 N/A PHE 12.A N VAL 790.A O no hydrogen 3.176 N/A CYS 14.A SG PRO 15.A O no hydrogen 3.466 N/A CYS 14.A SG GLY 386.A O no hydrogen 3.865 N/A CYS 14.A SG HIS 387.A O no hydrogen 3.301 N/A ASN 16.A N GLY 35.A O no hydrogen 3.147 N/A ASN 16.A ND2 VAL 61.A O no hydrogen 3.538 N/A ARG 19.A NE ASN 287.A OD1 no hydrogen 3.052 N/A ARG 19.A NH2 ASN 287.A OD1 no hydrogen 3.139 N/A ASN 23.A N ALA 33.A O no hydrogen 2.942 N/A TRP 24.A N GLN 348.A OE1 no hydrogen 3.028 N/A SER 25.A N LEU 31.A O no hydrogen 3.229 N/A SER 25.A OG SER 26.A O no hydrogen 3.113 N/A LEU 32.A N TYR 43.A O no hydrogen 2.933 N/A ALA 33.A N ASN 23.A O no hydrogen 2.923 N/A PHE 34.A N VAL 41.A O no hydrogen 3.044 N/A THR 36.A N SER 39.A O no hydrogen 2.913 N/A THR 36.A OG1 CYS 14.A O no hydrogen 3.112 N/A SER 37.A N ASN 16.A OD1 no hydrogen 2.996 N/A CYS 38.A SG SER 37.A OG no hydrogen 3.618 N/A CYS 38.A SG ALA 59.A O no hydrogen 3.159 N/A SER 39.A N THR 36.A O no hydrogen 2.900 N/A VAL 40.A N LEU 54.A O no hydrogen 2.900 N/A VAL 41.A N PHE 34.A O no hydrogen 2.853 N/A LEU 42.A N THR 52.A O no hydrogen 2.997 N/A TYR 43.A N LEU 32.A O no hydrogen 2.858 N/A ASP 44.A N VAL 49.A O no hydrogen 3.033 N/A ARG 48.A N PRO 45.A O no hydrogen 3.196 N/A VAL 49.A N ASP 44.A O no hydrogen 3.424 N/A VAL 51.A N LEU 42.A O no hydrogen 3.128 N/A THR 52.A OG1 ASN 53.A O no hydrogen 3.437 N/A LEU 54.A N VAL 40.A O no hydrogen 2.880 N/A ASN 55.A ND2 GLN 748.A O no hydrogen 2.787 N/A HIS 57.A ND1 ASP 84.A OD2 no hydrogen 3.184 N/A THR 58.A N ASP 84.A OD2 no hydrogen 3.095 N/A THR 58.A OG1 ASP 84.A OD2 no hydrogen 3.232 N/A ARG 60.A NE ASN 62.A OD1 no hydrogen 3.441 N/A VAL 61.A N SER 37.A O no hydrogen 3.070 N/A ASN 62.A N GLY 81.A O no hydrogen 2.969 N/A ASN 62.A ND2 VAL 110.A O no hydrogen 2.955 N/A GLN 65.A N VAL 79.A O no hydrogen 3.163 N/A ILE 67.A N GLU 77.A O no hydrogen 2.994 N/A CYS 68.A SG LYS 69.A O no hydrogen 3.546 N/A SER 75.A OG ILE 67.A O no hydrogen 2.296 N/A SER 75.A OG GLU 77.A O no hydrogen 3.471 N/A VAL 79.A N GLN 65.A O no hydrogen 3.131 N/A SER 80.A N ILE 88.A O no hydrogen 2.907 N/A SER 80.A OG CYS 63.A O no hydrogen 3.300 N/A GLY 81.A N CYS 63.A O no hydrogen 3.181 N/A GLY 82.A N GLN 86.A O no hydrogen 3.043 N/A SER 83.A N ARG 60.A O no hydrogen 2.773 N/A SER 83.A OG ARG 60.A O no hydrogen 3.027 N/A VAL 87.A N LEU 103.A O no hydrogen 2.988 N/A ILE 88.A N SER 80.A O no hydrogen 2.890 N/A HIS 89.A N VAL 101.A O no hydrogen 2.902 N/A TRP 90.A N LEU 78.A O no hydrogen 2.948 N/A GLU 91.A N LYS 99.A O no hydrogen 2.934 N/A ILE 92.A N THR 76.A O no hydrogen 3.051 N/A GLU 93.A N GLN 96.A O no hydrogen 3.264 N/A LEU 98.A N GLU 91.A O no hydrogen 3.051 N/A VAL 101.A N HIS 89.A O no hydrogen 2.923 N/A LEU 103.A N VAL 87.A O no hydrogen 2.860 N/A HIS 106.A NE2 SER 132.A OG no hydrogen 2.984 N/A GLU 107.A N ASP 136.A OD2 no hydrogen 3.238 N/A VAL 110.A N GLY 82.A O no hydrogen 3.412 N/A TYR 111.A N ALA 133.A O no hydrogen 2.821 N/A ALA 112.A N ALA 133.A O no hydrogen 2.957 N/A HIS 114.A N VAL 131.A O no hydrogen 2.957 N/A VAL 116.A N LEU 129.A O no hydrogen 2.923 N/A TYR 117.A OH GLU 77.A OE2 no hydrogen 2.878 N/A GLN 118.A N CYS 127.A O no hydrogen 3.017 N/A THR 121.A OG1 THR 121.A O no hydrogen 2.542 N/A CYS 127.A SG GLN 118.A OE1 no hydrogen 3.314 N/A THR 128.A OG1 LEU 126.A O no hydrogen 3.255 N/A LEU 129.A N VAL 116.A O no hydrogen 2.917 N/A ILE 130.A N TRP 142.A O no hydrogen 2.933 N/A VAL 131.A N HIS 114.A O no hydrogen 2.891 N/A SER 132.A N ARG 140.A O no hydrogen 2.956 N/A SER 132.A OG HIS 106.A NE2 no hydrogen 2.984 N/A ALA 133.A N ALA 112.A O no hydrogen 2.892 N/A ALA 135.A N PRO 109.A O no hydrogen 2.903 N/A ASP 136.A N ASP 136.A OD1 no hydrogen 2.471 N/A SER 137.A OG GLY 160.A O no hydrogen 2.549 N/A VAL 139.A N LEU 155.A O no hydrogen 2.909 N/A ARG 140.A N SER 132.A O no hydrogen 2.904 N/A LEU 141.A N GLN 153.A O no hydrogen 2.966 N/A TRP 142.A N ILE 130.A O no hydrogen 2.865 N/A SER 143.A N MET 150.A O no hydrogen 3.136 N/A LYS 144.A N THR 128.A O no hydrogen 3.127 N/A LYS 144.A NZ GLY 146.A O no hydrogen 3.125 N/A LYS 145.A N GLU 148.A O no hydrogen 2.965 N/A GLU 148.A N LYS 145.A O no hydrogen 3.146 N/A MET 150.A N SER 143.A O no hydrogen 3.212 N/A CYS 151.A SG LEU 141.A O no hydrogen 3.743 N/A CYS 151.A SG GLN 153.A O no hydrogen 3.898 N/A LEU 152.A N LEU 141.A O no hydrogen 3.158 N/A GLN 153.A NE2 PHE 197.A O no hydrogen 3.699 N/A LEU 155.A N VAL 139.A O no hydrogen 2.849 N/A PHE 157.A N SER 137.A O no hydrogen 3.345 N/A GLY 158.A N ASN 156.A OD1 no hydrogen 2.841 N/A GLY 160.A N PHE 157.A O no hydrogen 3.046 N/A PHE 161.A N ASP 183.A OD2 no hydrogen 2.652 N/A LEU 163.A N GLY 181.A O no hydrogen 2.886 N/A SER 168.A N ILE 177.A O no hydrogen 3.211 N/A PHE 169.A N SER 168.A OG no hydrogen 2.683 N/A LEU 170.A N VAL 175.A O no hydrogen 3.041 N/A ASP 174.A N THR 173.A OG1 no hydrogen 2.679 N/A ILE 177.A N SER 168.A O no hydrogen 2.680 N/A LEU 178.A N PHE 190.A O no hydrogen 2.898 N/A ALA 179.A N CYS 166.A O no hydrogen 3.291 N/A CYS 180.A N HIS 188.A O no hydrogen 2.918 N/A GLY 181.A N ALA 164.A O no hydrogen 3.300 N/A ASN 182.A ND2 HIS 188.A ND1 no hydrogen 2.914 N/A CYS 185.A SG ASP 183.A O no hydrogen 3.876 N/A ILE 187.A N LEU 203.A O no hydrogen 2.946 N/A HIS 188.A N CYS 180.A O no hydrogen 2.912 N/A ILE 189.A N LEU 201.A O no hydrogen 2.938 N/A PHE 190.A N LEU 178.A O no hydrogen 2.894 N/A ALA 191.A N GLN 198.A O no hydrogen 3.079 N/A GLN 192.A N PRO 176.A O no hydrogen 3.310 N/A GLN 196.A NE2 ASP 195.A O no hydrogen 2.900 N/A PHE 197.A N GLN 153.A OE1 no hydrogen 3.085 N/A GLN 198.A N ALA 191.A O no hydrogen 3.012 N/A VAL 200.A N ILE 189.A O no hydrogen 3.088 N/A LEU 203.A N ILE 187.A O no hydrogen 2.865 N/A GLU 207.A N ASP 230.A OD2 no hydrogen 2.719 N/A TRP 209.A N ASP 208.A OD1 no hydrogen 2.527 N/A ARG 211.A N CYS 227.A O no hydrogen 3.205 N/A GLU 214.A N ALA 225.A O no hydrogen 2.952 N/A ALA 216.A N PHE 223.A O no hydrogen 2.906 N/A PHE 218.A N ASP 221.A O no hydrogen 2.951 N/A ASP 221.A N PHE 218.A O no hydrogen 2.914 N/A LEU 222.A N LEU 238.A O no hydrogen 2.974 N/A PHE 223.A N ALA 216.A O no hydrogen 2.856 N/A ALA 225.A N GLU 214.A O no hydrogen 2.911 N/A SER 226.A N ARG 234.A O no hydrogen 2.920 N/A SER 226.A OG HIS 206.A NE2 no hydrogen 3.207 N/A CYS 227.A N GLY 212.A O no hydrogen 3.185 N/A CYS 227.A SG ARG 211.A O no hydrogen 3.332 N/A CYS 227.A SG GLY 212.A O no hydrogen 3.842 N/A SER 228.A OG TRP 209.A O no hydrogen 2.457 N/A GLN 229.A N TRP 209.A O no hydrogen 2.973 N/A ASP 230.A N SER 228.A OG no hydrogen 3.184 N/A CYS 231.A SG GLN 229.A O no hydrogen 3.905 N/A CYS 231.A SG GLU 283.A O no hydrogen 3.040 N/A CYS 231.A SG ASN 284.A O no hydrogen 3.058 N/A ARG 234.A N SER 226.A O no hydrogen 2.907 N/A ILE 235.A N THR 277.A O no hydrogen 3.387 N/A TRP 236.A N LEU 224.A O no hydrogen 2.910 N/A LEU 238.A N LEU 222.A O no hydrogen 2.867 N/A TYR 239.A N ALA 272.A O no hydrogen 2.940 N/A TYR 239.A OH GLU 257.A OE2 no hydrogen 2.890 N/A LYS 241.A N ALA 270.A O no hydrogen 3.026 N/A THR 243.A OG1 THR 243.A O no hydrogen 2.472 N/A THR 247.A OG1 LEU 245.A O no hydrogen 3.000 N/A ASP 250.A N GLN 248.A O no hydrogen 3.032 N/A ASN 258.A N VAL 273.A O no hydrogen 2.985 N/A PHE 260.A N PHE 271.A O no hydrogen 2.966 N/A ILE 262.A N ILE 269.A O no hydrogen 2.884 N/A ASN 264.A N VAL 267.A O no hydrogen 2.879 N/A SER 266.A OG GLU 265.A O no hydrogen 2.627 N/A ILE 269.A N ILE 262.A O no hydrogen 2.978 N/A PHE 271.A N PHE 260.A O no hydrogen 2.885 N/A ALA 272.A N TYR 239.A O no hydrogen 2.926 N/A VAL 273.A N ASN 258.A O no hydrogen 2.841 N/A THR 274.A N LYS 237.A O no hydrogen 2.938 N/A THR 274.A OG1 VAL 273.A O no hydrogen 2.826 N/A GLU 276.A N ILE 235.A O no hydrogen 2.890 N/A THR 277.A N ILE 235.A O no hydrogen 3.437 N/A LEU 279.A N ILE 233.A O no hydrogen 2.901 N/A HIS 282.A NE2 SER 309.A OG no hydrogen 2.996 N/A GLU 283.A N ASP 313.A OD2 no hydrogen 3.009 N/A ASN 284.A N ASP 313.A OD2 no hydrogen 3.202 N/A ASN 287.A N ALA 310.A O no hydrogen 2.947 N/A ASN 287.A ND2 PHE 344.A O no hydrogen 2.458 N/A HIS 290.A N LEU 308.A O no hydrogen 3.269 N/A HIS 290.A ND1 GLU 214.A OE1 no hydrogen 2.807 N/A PHE 295.A N GLN 302.A O no hydrogen 3.501 N/A LYS 297.A N VAL 300.A O no hydrogen 2.889 N/A VAL 300.A N LYS 297.A O no hydrogen 2.944 N/A GLN 302.A N PHE 295.A O no hydrogen 2.916 N/A ARG 306.A NE GLN 292.A OE1 no hydrogen 3.058 N/A LEU 307.A N TRP 319.A O no hydrogen 2.926 N/A LEU 308.A N HIS 290.A O no hydrogen 3.183 N/A SER 309.A N ILE 317.A O no hydrogen 2.968 N/A SER 309.A OG HIS 282.A NE2 no hydrogen 2.996 N/A SER 309.A OG ILE 317.A O no hydrogen 3.454 N/A SER 311.A N THR 315.A O no hydrogen 2.986 N/A SER 311.A OG TRP 285.A O no hydrogen 2.546 N/A SER 311.A OG ASP 313.A OD1 no hydrogen 2.615 N/A MET 312.A N TRP 285.A O no hydrogen 2.913 N/A ASP 313.A N SER 311.A OG no hydrogen 3.228 N/A MET 316.A N VAL 334.A O no hydrogen 2.880 N/A ILE 317.A N SER 309.A O no hydrogen 2.913 N/A LEU 318.A N VAL 332.A O no hydrogen 2.994 N/A TRP 319.A N LEU 307.A O no hydrogen 2.876 N/A TRP 319.A NE1 SER 309.A OG no hydrogen 3.296 N/A ALA 320.A N LEU 329.A O no hydrogen 3.437 N/A ASP 322.A N VAL 327.A O no hydrogen 2.924 N/A GLU 323.A N GLU 323.A OE1 no hydrogen 2.633 N/A GLU 324.A N GLU 324.A OE1 no hydrogen 2.570 N/A SER 325.A N ASP 322.A OD1 no hydrogen 2.372 N/A SER 325.A OG ASP 322.A OD1 no hydrogen 3.028 N/A LEU 329.A N ALA 320.A O no hydrogen 3.098 N/A GLN 331.A N LEU 318.A O no hydrogen 2.979 N/A ARG 333.A NH1 GLY 281.A O no hydrogen 3.460 N/A ARG 333.A NH1 GLU 330.A OE1 no hydrogen 3.246 N/A ARG 333.A NH2 GLY 281.A O no hydrogen 3.197 N/A VAL 334.A N MET 316.A O no hydrogen 2.917 N/A PHE 344.A N SER 311.A O no hydrogen 3.139 N/A TYR 345.A N HIS 359.A O no hydrogen 2.884 N/A GLN 348.A N ILE 357.A O no hydrogen 2.910 N/A GLN 348.A NE2 CYS 347.A O no hydrogen 3.580 N/A GLU 351.A N ASN 350.A OD1 no hydrogen 2.541 N/A SER 354.A N ASP 352.A OD1 no hydrogen 3.130 N/A SER 354.A OG ASP 352.A OD1 no hydrogen 2.903 N/A SER 354.A OG ASP 352.A OD2 no hydrogen 3.007 N/A ILE 356.A N TRP 368.A O no hydrogen 2.929 N/A ILE 357.A N GLN 348.A O no hydrogen 2.961 N/A ALA 358.A N HIS 366.A O no hydrogen 2.898 N/A HIS 359.A N ASP 346.A O no hydrogen 2.919 N/A ALA 360.A N ALA 364.A O no hydrogen 2.876 N/A HIS 366.A N ALA 358.A O no hydrogen 2.948 N/A TRP 368.A N ILE 356.A O no hydrogen 2.909 N/A LYS 369.A N THR 379.A O no hydrogen 2.898 N/A LYS 369.A NZ GLN 370.A O no hydrogen 3.394 N/A GLN 370.A N SER 354.A O no hydrogen 3.192 N/A GLN 370.A NE2 PRO 375.A O no hydrogen 2.628 N/A ASN 371.A N GLU 377.A O no hydrogen 3.178 N/A ASN 374.A ND2 GLU 377.A OE1 no hydrogen 2.947 N/A THR 379.A N LYS 369.A O no hydrogen 2.904 N/A THR 379.A OG1 PRO 380.A O no hydrogen 3.486 N/A GLU 381.A N LEU 367.A O no hydrogen 2.925 N/A SER 385.A OG GLU 430.A OE1 no hydrogen 2.977 N/A HIS 387.A ND1 ASP 409.A OD1 no hydrogen 3.340 N/A HIS 387.A NE2 THR 405.A OG1 no hydrogen 2.679 N/A GLY 390.A N ASP 389.A OD1 no hydrogen 2.665 N/A VAL 391.A N GLY 785.A O no hydrogen 3.324 N/A GLN 392.A N VAL 406.A O no hydrogen 2.912 N/A LEU 394.A N ASP 393.A OD1 no hydrogen 3.014 N/A VAL 395.A N ILE 404.A O no hydrogen 3.301 N/A TRP 396.A NE1 CYS 760.A O no hydrogen 3.003 N/A ASP 397.A N PHE 402.A O no hydrogen 3.053 N/A GLU 399.A N ASP 397.A OD1 no hydrogen 3.417 N/A GLY 400.A N ASP 397.A O no hydrogen 2.927 N/A GLU 401.A N ASP 397.A OD2 no hydrogen 3.162 N/A ILE 403.A N PHE 415.A O no hydrogen 2.935 N/A ILE 404.A N VAL 395.A O no hydrogen 3.496 N/A THR 405.A N ARG 413.A O no hydrogen 2.911 N/A THR 405.A OG1 HIS 387.A NE2 no hydrogen 2.679 N/A THR 408.A N GLY 390.A O no hydrogen 2.899 N/A THR 408.A OG1 THR 408.A O no hydrogen 2.500 N/A ASP 409.A N ASP 409.A OD1 no hydrogen 2.419 N/A GLN 410.A N GLY 407.A O no hydrogen 3.296 N/A GLN 410.A NE2 ASP 440.A OD1 no hydrogen 3.241 N/A THR 412.A OG1 GLN 435.A OE1 no hydrogen 3.498 N/A ARG 413.A N THR 405.A O no hydrogen 2.941 N/A ARG 413.A NH1 GLU 430.A OE2 no hydrogen 3.372 N/A LEU 414.A N ALA 432.A O no hydrogen 2.897 N/A PHE 415.A N ILE 403.A O no hydrogen 2.918 N/A ALA 416.A N HIS 429.A O no hydrogen 3.176 N/A TRP 418.A N THR 427.A O no hydrogen 2.779 N/A THR 427.A OG1 HIS 429.A NE2 no hydrogen 2.774 N/A HIS 429.A N ALA 416.A O no hydrogen 3.020 N/A HIS 429.A NE2 THR 427.A OG1 no hydrogen 2.774 N/A ILE 431.A N LEU 414.A O no hydrogen 3.279 N/A ARG 433.A NH2 GLU 522.A OE2 no hydrogen 2.314 N/A GLN 435.A N ARG 433.A O no hydrogen 2.846 N/A HIS 437.A N GLN 410.A O no hydrogen 3.241 N/A TYR 439.A N HIS 437.A ND1 no hydrogen 3.141 N/A LYS 442.A N GLY 455.A O no hydrogen 2.986 N/A CYS 443.A N GLY 455.A O no hydrogen 2.946 N/A CYS 443.A SG PHE 545.A O no hydrogen 3.135 N/A LEU 444.A N ASP 393.A OD2 no hydrogen 3.200 N/A ALA 445.A N VAL 453.A O no hydrogen 2.909 N/A ILE 447.A N GLN 451.A O no hydrogen 3.183 N/A ASN 448.A N GLN 451.A O no hydrogen 3.235 N/A ARG 449.A NH1 GLU 401.A OE1 no hydrogen 3.529 N/A PHE 452.A N PHE 464.A O no hydrogen 2.946 N/A VAL 453.A N ALA 445.A O no hydrogen 2.908 N/A SER 454.A N ARG 462.A O no hydrogen 2.884 N/A GLY 455.A N CYS 443.A O no hydrogen 2.912 N/A ASP 457.A N ASP 440.A O no hydrogen 2.852 N/A GLU 458.A N ALA 456.A O no hydrogen 2.722 N/A LEU 461.A N LEU 537.A O no hydrogen 3.450 N/A ARG 462.A N SER 454.A O no hydrogen 2.973 N/A ARG 462.A NE GLU 458.A OE2 no hydrogen 2.879 N/A ARG 462.A NH1 LEU 504.A O no hydrogen 3.270 N/A ARG 462.A NH2 GLU 458.A OE1 no hydrogen 3.110 N/A ARG 462.A NH2 GLU 458.A OE2 no hydrogen 2.900 N/A PHE 464.A N PHE 452.A O no hydrogen 2.913 N/A SER 465.A N PRO 532.A O no hydrogen 3.226 N/A VAL 471.A N ARG 468.A O no hydrogen 2.962 N/A GLU 472.A N ARG 468.A O no hydrogen 3.388 N/A ASN 473.A N ASN 469.A O no hydrogen 2.924 N/A PHE 474.A N PHE 470.A O no hydrogen 2.852 N/A CYS 475.A N VAL 471.A O no hydrogen 2.922 N/A CYS 475.A SG VAL 471.A O no hydrogen 3.359 N/A CYS 475.A SG GLU 472.A O no hydrogen 3.096 N/A ALA 476.A N GLU 472.A O no hydrogen 2.917 N/A ILE 477.A N ASN 473.A O no hydrogen 2.917 N/A THR 478.A N PHE 474.A O no hydrogen 2.944 N/A SER 481.A OG ASN 483.A OD1 no hydrogen 2.581 N/A VAL 485.A N SER 481.A O no hydrogen 2.901 N/A LEU 486.A N LEU 482.A O no hydrogen 3.322 N/A CYS 487.A N ASN 483.A O no hydrogen 3.316 N/A CYS 487.A SG HIS 484.A O no hydrogen 3.079 N/A GLN 489.A N LEU 486.A O no hydrogen 3.096 N/A SER 491.A OG ASP 490.A O no hydrogen 2.642 N/A SER 491.A OG ASP 492.A OD1 no hydrogen 3.044 N/A THR 498.A N LYS 507.A O no hydrogen 3.014 N/A SER 505.A OG ASN 506.A O no hydrogen 3.292 N/A SER 505.A OG GLU 533.A OE1 no hydrogen 3.420 N/A ASN 506.A ND2 TRP 531.A O no hydrogen 2.303 N/A LYS 507.A N THR 498.A O no hydrogen 3.408 N/A VAL 509.A N GLY 496.A O no hydrogen 3.440 N/A SER 514.A OG GLN 512.A O no hydrogen 3.471 N/A HIS 524.A N THR 521.A O no hydrogen 3.263 N/A LEU 525.A N THR 521.A O no hydrogen 3.370 N/A ASN 528.A N HIS 524.A O no hydrogen 3.354 N/A ASN 528.A ND2 HIS 524.A ND1 no hydrogen 3.103 N/A THR 529.A OG1 HIS 524.A O no hydrogen 3.204 N/A VAL 534.A N VAL 463.A O no hydrogen 3.233 N/A LEU 537.A N LEU 461.A O no hydrogen 3.184 N/A ILE 544.A N GLU 458.A O no hydrogen 3.320 N/A PHE 545.A N ALA 559.A O no hydrogen 3.034 N/A CYS 546.A SG THR 592.A O no hydrogen 3.737 N/A CYS 549.A SG ASN 550.A O no hydrogen 3.360 N/A CYS 549.A SG ASN 550.A OD1 no hydrogen 3.868 N/A CYS 549.A SG LEU 555.A O no hydrogen 3.620 N/A ASN 550.A ND2 THR 554.A O no hydrogen 3.567 N/A SER 551.A OG GLU 600.A OE2 no hydrogen 3.396 N/A SER 552.A OG THR 554.A OG1 no hydrogen 3.326 N/A LYS 553.A N ASN 550.A O no hydrogen 3.420 N/A LYS 553.A NZ MET 446.A O no hydrogen 3.385 N/A THR 554.A OG1 SER 552.A OG no hydrogen 3.326 N/A ALA 557.A N THR 548.A O no hydrogen 3.423 N/A SER 558.A OG HIS 540.A NE2 no hydrogen 2.434 N/A CYS 560.A SG HIS 540.A ND1 no hydrogen 3.596 N/A CYS 560.A SG LYS 561.A O no hydrogen 3.845 N/A CYS 560.A SG HIS 567.A O no hydrogen 3.356 N/A LYS 561.A N GLU 543.A O no hydrogen 3.159 N/A LYS 564.A NZ GLU 566.A OE2 no hydrogen 3.378 N/A GLU 566.A N GLU 566.A OE1 no hydrogen 2.435 N/A ILE 570.A N LEU 584.A O no hydrogen 3.201 N/A LEU 572.A N GLN 582.A O no hydrogen 3.467 N/A TRP 573.A N LEU 556.A O no hydrogen 3.043 N/A THR 575.A OG1 LYS 553.A O no hydrogen 3.061 N/A THR 576.A N ASN 574.A OD1 no hydrogen 2.774 N/A THR 576.A OG1 ASN 574.A OD1 no hydrogen 2.863 N/A VAL 581.A N LEU 572.A O no hydrogen 2.829 N/A LEU 584.A N ILE 570.A O no hydrogen 3.085 N/A HIS 587.A ND1 ASP 609.A OD2 no hydrogen 3.296 N/A HIS 587.A NE2 SER 613.A OG no hydrogen 3.093 N/A THR 592.A N VAL 606.A O no hydrogen 2.901 N/A THR 592.A OG1 VAL 606.A O no hydrogen 3.156 N/A THR 592.A OG1 ILE 646.A O no hydrogen 3.218 N/A ALA 595.A N LEU 604.A O no hydrogen 3.344 N/A ASN 599.A N SER 655.A OG no hydrogen 2.817 N/A GLU 600.A N SER 597.A O no hydrogen 2.988 N/A LYS 601.A NZ THR 676.A OG1 no hydrogen 2.723 N/A LEU 603.A N TRP 615.A O no hydrogen 3.195 N/A LEU 604.A N ALA 595.A O no hydrogen 3.210 N/A ALA 605.A N SER 613.A O no hydrogen 3.210 N/A VAL 606.A N GLN 593.A O no hydrogen 3.283 N/A SER 607.A OG LEU 589.A O no hydrogen 3.199 N/A SER 607.A OG THR 590.A O no hydrogen 2.595 N/A ARG 608.A N THR 590.A O no hydrogen 3.034 N/A THR 611.A N ASP 609.A OD1 no hydrogen 3.280 N/A THR 611.A OG1 HIS 587.A ND1 no hydrogen 3.252 N/A THR 611.A OG1 ASP 609.A OD1 no hydrogen 2.538 N/A SER 613.A N ALA 605.A O no hydrogen 3.284 N/A SER 613.A OG HIS 587.A NE2 no hydrogen 3.093 N/A LEU 614.A N ALA 633.A O no hydrogen 3.024 N/A TRP 615.A N LEU 603.A O no hydrogen 2.990 N/A TRP 615.A NE1 SER 613.A OG no hydrogen 3.112 N/A LYS 616.A N SER 630.A O no hydrogen 2.884 N/A LYS 617.A NZ GLU 600.A O no hydrogen 3.489 N/A GLN 618.A N VAL 628.A O no hydrogen 2.940 N/A GLU 624.A N GLU 624.A OE1 no hydrogen 2.575 N/A PHE 625.A N SER 622.A O no hydrogen 2.827 N/A PHE 629.A N GLN 582.A OE1 no hydrogen 2.918 N/A SER 630.A N LYS 616.A O no hydrogen 2.951 N/A PHE 632.A N LEU 614.A O no hydrogen 2.924 N/A ALA 633.A N LEU 614.A O no hydrogen 3.385 N/A THR 639.A N ASN 636.A OD1 no hydrogen 2.635 N/A THR 639.A OG1 ASN 636.A OD1 no hydrogen 2.675 N/A SER 640.A N ASN 636.A O no hydrogen 3.140 N/A SER 640.A OG ARG 610.A O no hydrogen 2.567 N/A SER 640.A OG HIS 642.A O no hydrogen 3.386 N/A HIS 642.A ND1 ASP 664.A OD1 no hydrogen 3.175 N/A HIS 642.A NE2 THR 660.A OG1 no hydrogen 2.792 N/A TRP 647.A N GLY 661.A O no hydrogen 2.965 N/A SER 648.A N GLY 661.A O no hydrogen 2.976 N/A SER 648.A OG GLN 593.A OE1 no hydrogen 3.285 N/A ASP 650.A N PHE 659.A O no hydrogen 2.933 N/A TRP 651.A N ASP 650.A OD1 no hydrogen 2.529 N/A SER 652.A N TYR 657.A O no hydrogen 3.072 N/A SER 652.A OG ASP 654.A OD1 no hydrogen 2.907 N/A SER 652.A OG TYR 657.A O no hydrogen 3.081 N/A SER 655.A N SER 652.A O no hydrogen 3.059 N/A LYS 656.A N SER 652.A OG no hydrogen 2.839 N/A LYS 656.A NZ ASP 674.A OD1 no hydrogen 3.135 N/A LYS 656.A NZ ASP 674.A OD2 no hydrogen 3.202 N/A TYR 657.A N SER 652.A OG no hydrogen 2.930 N/A PHE 658.A N TRP 670.A O no hydrogen 2.898 N/A PHE 659.A N ASP 650.A O no hydrogen 2.890 N/A THR 660.A N VAL 668.A O no hydrogen 2.909 N/A THR 660.A OG1 HIS 642.A NE2 no hydrogen 2.792 N/A THR 660.A OG1 VAL 668.A O no hydrogen 3.565 N/A GLY 661.A N SER 648.A O no hydrogen 2.888 N/A SER 662.A OG ARG 644.A O no hydrogen 3.120 N/A SER 662.A OG ILE 645.A O no hydrogen 2.243 N/A ARG 663.A N ILE 645.A O no hydrogen 3.011 N/A VAL 668.A N THR 660.A O no hydrogen 2.940 N/A TRP 670.A N PHE 658.A O no hydrogen 2.913 N/A TRP 670.A NE1 THR 660.A OG1 no hydrogen 3.194 N/A CYS 673.A N LYS 656.A O no hydrogen 3.152 N/A ASP 674.A N ASP 674.A OD1 no hydrogen 2.561 N/A SER 675.A OG ASP 674.A O no hydrogen 2.445 N/A ASP 678.A N ASP 677.A OD1 no hydrogen 2.709 N/A CYS 679.A SG SER 675.A O no hydrogen 3.710 N/A CYS 679.A SG SER 675.A OG no hydrogen 3.218 N/A CYS 687.A N VAL 669.A O no hydrogen 3.036 N/A CYS 687.A SG GLY 685.A O no hydrogen 3.700 N/A SER 688.A OG CYS 687.A O no hydrogen 2.711 N/A SER 689.A N ASP 739.A OD2 no hydrogen 3.285 N/A SER 689.A OG GLU 736.A O no hydrogen 3.567 N/A SER 689.A OG ASP 739.A OD1 no hydrogen 3.227 N/A SER 689.A OG ASP 739.A OD2 no hydrogen 2.931 N/A VAL 693.A N LYS 665.A O no hydrogen 3.117 N/A VAL 697.A N SER 662.A O no hydrogen 3.348 N/A THR 698.A N GLY 717.A O no hydrogen 3.347 N/A THR 698.A OG1 ILE 756.A O no hydrogen 2.312 N/A SER 701.A N ALA 715.A O no hydrogen 3.303 N/A VAL 702.A N ASP 650.A OD2 no hydrogen 3.109 N/A SER 709.A N HIS 707.A ND1 no hydrogen 2.937 N/A SER 709.A OG HIS 707.A ND1 no hydrogen 2.710 N/A GLN 710.A N HIS 707.A O no hydrogen 2.798 N/A TYR 712.A N TRP 728.A O no hydrogen 3.372 N/A VAL 714.A N TYR 726.A O no hydrogen 3.457 N/A ALA 715.A N SER 701.A O no hydrogen 2.974 N/A VAL 716.A N CYS 724.A O no hydrogen 2.903 N/A GLY 717.A N ALA 699.A O no hydrogen 3.253 N/A LEU 718.A N LYS 722.A O no hydrogen 3.337 N/A GLU 719.A N ALA 696.A O no hydrogen 3.164 N/A LYS 722.A N CYS 720.A O no hydrogen 2.463 N/A LYS 722.A NZ GLU 745.A OE2 no hydrogen 2.438 N/A CYS 724.A N VAL 716.A O no hydrogen 2.931 N/A LEU 725.A N VAL 744.A O no hydrogen 2.898 N/A TYR 726.A N VAL 714.A O no hydrogen 3.131 N/A THR 727.A N THR 741.A O no hydrogen 2.944 N/A TRP 728.A N TYR 712.A O no hydrogen 2.813 N/A LYS 729.A N ASP 739.A O no hydrogen 3.215 N/A LYS 729.A NZ LYS 730.A O no hydrogen 2.518 N/A LYS 730.A NZ CYS 687.A O no hydrogen 2.836 N/A THR 731.A OG1 GLN 733.A O no hydrogen 2.840 N/A THR 731.A OG1 PRO 735.A O no hydrogen 3.050 N/A GLN 733.A N THR 731.A OG1 no hydrogen 3.162 N/A TRP 740.A NE1 SER 689.A O no hydrogen 2.366 N/A THR 741.A N THR 727.A O no hydrogen 3.380 N/A THR 741.A OG1 THR 727.A O no hydrogen 2.815 N/A CYS 743.A N LEU 725.A O no hydrogen 3.045 N/A VAL 744.A N LEU 725.A O no hydrogen 2.982 N/A THR 746.A N ILE 723.A O no hydrogen 3.258 N/A GLN 750.A N SER 747.A OG no hydrogen 3.344 N/A GLN 750.A NE2 LEU 6.A O no hydrogen 3.654 N/A SER 751.A OG HIS 752.A O no hydrogen 3.183 N/A HIS 752.A N GLY 721.A O no hydrogen 2.702 N/A HIS 752.A ND1 ASP 787.A OD1 no hydrogen 3.026 N/A HIS 752.A ND1 ASP 787.A OD2 no hydrogen 2.649 N/A THR 753.A N ASP 787.A OD2 no hydrogen 3.288 N/A ARG 757.A N CYS 784.A O no hydrogen 3.214 N/A ARG 757.A NE GLU 786.A OE2 no hydrogen 3.155 N/A ARG 757.A NH2 GLU 786.A OE2 no hydrogen 3.379 N/A LYS 758.A NZ LEU 394.A O no hydrogen 3.425 N/A CYS 760.A N ALA 782.A O no hydrogen 3.350 N/A CYS 760.A SG TRP 761.A O no hydrogen 3.445 N/A LYS 762.A N HIS 780.A O no hydrogen 3.370 N/A CYS 764.A N LYS 762.A O no hydrogen 2.954 N/A CYS 764.A SG GLU 399.A O no hydrogen 3.516 N/A SER 765.A N ASN 763.A O no hydrogen 2.703 N/A THR 768.A OG1 SER 765.A O no hydrogen 3.151 N/A LYS 771.A NZ GLU 769.A O no hydrogen 3.312 N/A GLU 774.A N GLU 774.A OE1 no hydrogen 2.609 N/A LEU 779.A N VAL 795.A O no hydrogen 2.885 N/A PHE 781.A N HIS 793.A O no hydrogen 2.963 N/A ALA 782.A N CYS 760.A O no hydrogen 3.289 N/A SER 783.A N LYS 791.A O no hydrogen 2.889 N/A GLU 786.A N ALA 755.A O no hydrogen 3.060 N/A THR 789.A N ASP 787.A OD1 no hydrogen 3.299 N/A THR 789.A OG1 ASP 787.A O no hydrogen 2.585 N/A VAL 790.A N PHE 12.A O no hydrogen 3.491 N/A LYS 791.A N SER 783.A O no hydrogen 2.932 N/A LYS 791.A NZ GLN 750.A O no hydrogen 3.515 N/A LYS 791.A NZ SER 751.A O no hydrogen 2.592 N/A ILE 792.A N HIS 10.A O no hydrogen 3.233 N/A HIS 793.A N PHE 781.A O no hydrogen 2.874 N/A ARG 794.A N GLU 7.A O no hydrogen 2.921 N/A VAL 795.A N LEU 779.A O no hydrogen 2.902 N/A LYS 797.A N GLU 777.A O no hydrogen 2.702 N/A LEU 800.A N LYS 797.A O no hydrogen 3.047 N/A