Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 2qj1_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ASP 1.A N ASP 1.A OD1 no hydrogen 2.718 N/A LYS 9.A NZ VAL 10.A O no hydrogen 2.740 N/A SER 20.A OG SER 22.A OG no hydrogen 3.148 N/A SER 22.A OG SER 20.A OG no hydrogen 3.148 N/A ARG 23.A N SER 20.A O no hydrogen 3.131 N/A LEU 24.A N SER 20.A O no hydrogen 3.132 N/A ALA 25.A N PRO 21.A O no hydrogen 2.854 N/A PHE 27.A N ARG 23.A O no hydrogen 2.990 N/A LEU 28.A N LEU 24.A O no hydrogen 3.195 N/A ARG 29.A N ALA 25.A O no hydrogen 3.186 N/A GLU 30.A N LYS 26.A O no hydrogen 2.829 N/A ASN 31.A N PHE 27.A O no hydrogen 2.988 N/A ASN 31.A ND2 PHE 27.A O no hydrogen 2.744 N/A GLY 32.A N ARG 29.A O no hydrogen 3.118 N/A TYR 33.A N LEU 28.A O no hydrogen 2.899 N/A TYR 33.A OH LYS 444.A O no hydrogen 2.713 N/A LEU 36.A N GLN 442.A O no hydrogen 2.855 N/A ARG 39.A NE LEU 763.A O no hydrogen 3.506 N/A ARG 39.A NH2 SER 435.A OG no hydrogen 2.777 N/A SER 40.A OG GLU 78.A OE1 no hydrogen 3.392 N/A SER 40.A OG GLU 78.A OE2 no hydrogen 3.493 N/A LEU 41.A N TYR 79.A O no hydrogen 2.824 N/A GLU 43.A N GLN 77.A O no hydrogen 3.009 N/A ASN 44.A ND2 PRO 227.A O no hydrogen 2.880 N/A GLU 45.A N LEU 72.A O no hydrogen 2.847 N/A TYR 47.A N LEU 70.A O no hydrogen 2.827 N/A THR 49.A N PRO 68.A O no hydrogen 3.153 N/A THR 49.A OG1 LYS 67.A O no hydrogen 2.109 N/A LEU 53.A N THR 49.A O no hydrogen 3.389 N/A THR 69.A OG1 GLU 46.A OE1 no hydrogen 3.197 N/A LEU 70.A N TYR 47.A O no hydrogen 2.627 N/A SER 71.A N GLU 239.A OE2 no hydrogen 3.130 N/A LEU 72.A N GLU 45.A O no hydrogen 3.015 N/A ILE 74.A N LEU 72.A O no hydrogen 2.782 N/A GLY 75.A N GLU 43.A O no hydrogen 2.794 N/A TYR 79.A N LEU 41.A O no hydrogen 2.928 N/A TYR 83.A N MET 439.A O no hydrogen 2.785 N/A ARG 88.A N SER 139.A OG no hydrogen 3.363 N/A SER 90.A N LYS 93.A O no hydrogen 3.246 N/A ASP 100.A N ALA 564.A O no hydrogen 2.798 N/A ILE 101.A N PRO 99.A O no hydrogen 2.916 N/A LEU 103.A N ASP 100.A OD1 no hydrogen 3.319 N/A LEU 104.A N ASP 100.A O no hydrogen 3.164 N/A LYS 105.A N ILE 101.A O no hydrogen 2.818 N/A GLN 106.A N ALA 102.A O no hydrogen 3.065 N/A MET 107.A N LEU 103.A O no hydrogen 3.042 N/A ILE 108.A N LEU 104.A O no hydrogen 2.852 N/A TYR 109.A N LYS 105.A O no hydrogen 2.815 N/A LEU 110.A N GLN 106.A O no hydrogen 2.823 N/A PHE 111.A N MET 107.A O no hydrogen 2.850 N/A LEU 112.A N ILE 108.A O no hydrogen 3.116 N/A GLN 113.A N TYR 109.A O no hydrogen 3.240 N/A VAL 114.A N PHE 111.A O no hydrogen 3.295 N/A LYS 122.A N ASN 118.A O no hydrogen 3.417 N/A LYS 122.A NZ GLU 119.A OE2 no hydrogen 2.844 N/A ASP 123.A N GLU 119.A O no hydrogen 2.640 N/A GLU 124.A N LEU 121.A O no hydrogen 3.070 N/A THR 126.A N LYS 122.A O no hydrogen 2.877 N/A THR 126.A OG1 LYS 122.A O no hydrogen 3.329 N/A LEU 127.A N ASP 123.A O no hydrogen 2.987 N/A LEU 128.A N GLU 124.A O no hydrogen 2.916 N/A THR 129.A N VAL 125.A O no hydrogen 2.882 N/A THR 129.A OG1 VAL 125.A O no hydrogen 3.045 N/A GLN 130.A N THR 126.A O no hydrogen 2.784 N/A ASN 131.A N LEU 127.A O no hydrogen 3.006 N/A ILE 132.A N LEU 128.A O no hydrogen 3.284 N/A ARG 133.A N THR 129.A O no hydrogen 2.936 N/A ARG 133.A NH2 LEU 5.A O no hydrogen 2.639 N/A ASP 134.A N GLN 130.A O no hydrogen 2.895 N/A LYS 135.A N ASN 131.A O no hydrogen 2.786 N/A ALA 136.A N TYR 291.A O no hydrogen 2.733 N/A GLY 138.A N GLU 289.A O no hydrogen 3.031 N/A SER 139.A N ARG 88.A O no hydrogen 2.672 N/A SER 139.A OG THR 86.A O no hydrogen 3.555 N/A SER 139.A OG ARG 88.A O no hydrogen 3.549 N/A THR 141.A OG1 TRP 296.A O no hydrogen 3.110 N/A MET 143.A N ASP 16.A OD1 no hydrogen 3.029 N/A GLY 144.A N THR 141.A OG1 no hydrogen 3.029 N/A GLN 145.A N THR 141.A O no hydrogen 2.851 N/A ALA 146.A N TYR 142.A O no hydrogen 2.727 N/A ASN 147.A N MET 143.A O no hydrogen 2.981 N/A ARG 148.A N GLY 144.A O no hydrogen 3.130 N/A LEU 149.A N GLN 145.A O no hydrogen 2.877 N/A VAL 150.A N ALA 146.A O no hydrogen 3.125 N/A ALA 151.A N ASN 147.A O no hydrogen 3.133 N/A MET 152.A N ARG 148.A O no hydrogen 3.110 N/A MET 152.A N LEU 149.A O no hydrogen 2.971 N/A LYS 153.A N LEU 149.A O no hydrogen 2.913 N/A LYS 153.A NZ ASN 31.A O no hydrogen 2.965 N/A LYS 153.A NZ GLU 154.A OE1 no hydrogen 3.214 N/A GLU 154.A N VAL 150.A O no hydrogen 2.947 N/A VAL 155.A N MET 152.A O no hydrogen 2.962 N/A ALA 156.A N MET 152.A O no hydrogen 2.901 N/A THR 157.A N LYS 153.A O no hydrogen 2.950 N/A THR 157.A OG1 LYS 153.A O no hydrogen 2.819 N/A ARG 159.A N GLU 154.A O no hydrogen 3.397 N/A ARG 159.A NH1 GLU 487.A OE2 no hydrogen 2.769 N/A ARG 159.A NH2 GLU 487.A OE1 no hydrogen 3.309 N/A ASN 160.A ND2 GLU 487.A O no hydrogen 2.628 N/A ASN 160.A ND2 ASN 493.A OD1 no hydrogen 3.203 N/A ASN 162.A N ALA 156.A O no hydrogen 2.929 N/A ASN 162.A ND2 ALA 388.A O no hydrogen 2.751 N/A LYS 163.A NZ ASP 488.A O no hydrogen 3.422 N/A LEU 166.A N ASP 164.A OD1 no hydrogen 3.302 N/A LYS 167.A N ASP 164.A O no hydrogen 3.187 N/A LEU 168.A N PRO 165.A O no hydrogen 2.966 N/A TYR 170.A OH ASP 468.A OD1 no hydrogen 2.562 N/A THR 171.A N SER 174.A OG no hydrogen 3.158 N/A THR 171.A OG1 TYR 691.A OH no hydrogen 2.969 N/A SER 174.A N THR 171.A OG1 no hydrogen 3.023 N/A ILE 175.A N THR 171.A O no hydrogen 2.813 N/A ALA 176.A N PHE 172.A O no hydrogen 2.920 N/A GLN 177.A N GLU 173.A O no hydrogen 2.735 N/A LEU 178.A N SER 174.A O no hydrogen 3.277 N/A LEU 179.A N ILE 175.A O no hydrogen 2.826 N/A ASP 180.A N ALA 176.A O no hydrogen 2.930 N/A ILE 181.A N LEU 178.A O no hydrogen 2.969 N/A THR 182.A N LEU 178.A O no hydrogen 3.382 N/A THR 182.A OG1 THR 464.A OG1 no hydrogen 2.877 N/A LEU 183.A N LEU 179.A O no hydrogen 2.801 N/A GLY 186.A N SER 325.A OG no hydrogen 2.953 N/A GLY 189.A N PRO 320.A O no hydrogen 2.554 N/A SER 203.A N ASN 245.A OD1 no hydrogen 3.406 N/A ARG 204.A N VAL 201.A O no hydrogen 3.008 N/A MET 205.A N PRO 202.A O no hydrogen 3.173 N/A GLU 212.A N VAL 207.A O no hydrogen 2.799 N/A TYR 214.A N MET 205.A O no hydrogen 2.845 N/A SER 222.A OG ASN 219.A OD1 no hydrogen 3.153 N/A SER 224.A N ARG 231.A O no hydrogen 3.057 N/A SER 224.A OG THR 236.A OG1 no hydrogen 3.003 N/A SER 224.A OG SER 308.A OG no hydrogen 3.335 N/A TYR 228.A N GLY 225.A O no hydrogen 2.753 N/A TYR 228.A OH SER 71.A O no hydrogen 2.564 N/A ARG 231.A N TYR 228.A O no hydrogen 3.293 N/A THR 232.A N GLU 235.A OE1 no hydrogen 3.138 N/A THR 232.A OG1 GLU 235.A OE1 no hydrogen 2.684 N/A LYS 233.A N SER 222.A O no hydrogen 3.118 N/A GLU 235.A N THR 232.A O no hydrogen 3.149 N/A THR 236.A N LYS 233.A O no hydrogen 3.337 N/A THR 236.A OG1 SER 224.A OG no hydrogen 3.003 N/A THR 236.A OG1 THR 232.A O no hydrogen 2.993 N/A THR 236.A OG1 LYS 233.A O no hydrogen 3.523 N/A GLU 239.A N GLU 239.A OE1 no hydrogen 2.738 N/A MET 240.A N THR 236.A O no hydrogen 2.851 N/A ILE 241.A N ILE 237.A O no hydrogen 3.250 N/A ALA 242.A N GLY 238.A O no hydrogen 2.851 N/A ILE 243.A N GLU 239.A O no hydrogen 3.065 N/A SER 244.A OG MET 240.A O no hydrogen 2.688 N/A SER 244.A OG PRO 309.A O no hydrogen 3.516 N/A ASN 245.A N ILE 241.A O no hydrogen 3.114 N/A GLN 246.A N ALA 242.A O no hydrogen 3.118 N/A PHE 247.A N ILE 243.A O no hydrogen 2.967 N/A LEU 248.A N SER 244.A O no hydrogen 2.945 N/A ARG 249.A N ASN 245.A O no hydrogen 2.748 N/A GLU 250.A N GLN 246.A O no hydrogen 3.052 N/A LEU 251.A N PHE 247.A O no hydrogen 3.208 N/A LEU 251.A N LEU 248.A O no hydrogen 3.063 N/A SER 252.A N LEU 248.A O no hydrogen 3.010 N/A SER 252.A OG ARG 249.A O no hydrogen 3.207 N/A THR 253.A N ARG 249.A O no hydrogen 3.175 N/A THR 253.A OG1 ARG 249.A O no hydrogen 2.956 N/A LEU 254.A N GLU 250.A O no hydrogen 3.360 N/A LEU 255.A N LEU 251.A O no hydrogen 2.900 N/A LYS 256.A N SER 252.A O no hydrogen 2.796 N/A GLY 258.A N LEU 254.A O no hydrogen 3.460 N/A THR 261.A N ALA 259.A O no hydrogen 2.523 N/A THR 261.A OG1 SER 264.A OG no hydrogen 3.145 N/A SER 264.A N THR 261.A O no hydrogen 2.879 N/A SER 264.A OG THR 261.A O no hydrogen 2.604 N/A LYS 266.A N GLY 263.A O no hydrogen 3.256 N/A LEU 269.A N ASN 265.A O no hydrogen 2.810 N/A LEU 270.A N LYS 266.A O no hydrogen 2.979 N/A SER 271.A N LYS 267.A O no hydrogen 3.196 N/A MET 272.A N LYS 268.A O no hydrogen 3.136 N/A LEU 273.A N LEU 269.A O no hydrogen 3.184 N/A SER 274.A N LEU 270.A O no hydrogen 3.387 N/A SER 274.A OG LEU 270.A O no hydrogen 2.876 N/A SER 274.A OG ALA 762.A O no hydrogen 2.463 N/A ASP 275.A N SER 271.A O no hydrogen 2.877 N/A TYR 276.A N MET 272.A O no hydrogen 3.067 N/A TYR 276.A OH GLU 250.A OE1 no hydrogen 3.343 N/A TYR 276.A OH GLU 250.A OE2 no hydrogen 3.395 N/A TRP 277.A N SER 274.A O no hydrogen 3.285 N/A TRP 277.A NE1 SER 40.A O no hydrogen 2.954 N/A LEU 279.A N TYR 276.A O no hydrogen 3.158 N/A SER 280.A N TRP 277.A O no hydrogen 2.712 N/A CYS 281.A N TYR 278.A O no hydrogen 3.267 N/A GLY 282.A N SER 435.A O no hydrogen 3.119 N/A LEU 283.A N SER 305.A O no hydrogen 3.186 N/A LEU 284.A N LEU 437.A O no hydrogen 3.468 N/A PHE 285.A N ILE 303.A O no hydrogen 2.825 N/A LYS 287.A N ARG 301.A O no hydrogen 2.812 N/A ARG 290.A NE TYR 565.A O no hydrogen 2.793 N/A ARG 290.A NH1 GLU 637.A OE1 no hydrogen 3.246 N/A ARG 290.A NH1 GLU 637.A OE2 no hydrogen 3.348 N/A ARG 290.A NH2 TYR 565.A O no hydrogen 2.790 N/A ARG 290.A NH2 GLU 637.A OE2 no hydrogen 2.689 N/A TYR 291.A N ALA 136.A O no hydrogen 2.836 N/A TYR 291.A OH LYS 287.A O no hydrogen 2.530 N/A LYS 293.A N ASP 134.A O no hydrogen 2.941 N/A LYS 293.A NZ ILE 132.A O no hydrogen 3.232 N/A LYS 293.A NZ ARG 133.A O no hydrogen 2.927 N/A THR 295.A N ASP 292.A O no hydrogen 3.174 N/A THR 295.A OG1 ASP 292.A O no hydrogen 3.433 N/A TRP 296.A N LYS 293.A O no hydrogen 3.227 N/A LYS 299.A N THR 295.A O no hydrogen 3.114 N/A THR 300.A N GLY 144.A O no hydrogen 3.146 N/A ARG 301.A N TYR 291.A OH no hydrogen 3.010 N/A ILE 303.A N PHE 285.A O no hydrogen 2.628 N/A TRP 304.A N SER 450.A O no hydrogen 2.968 N/A TRP 304.A NE1 THR 445.A OG1 no hydrogen 2.949 N/A SER 305.A N LEU 283.A O no hydrogen 2.886 N/A SER 308.A N SER 224.A O no hydrogen 3.231 N/A SER 308.A OG SER 224.A OG no hydrogen 3.335 N/A THR 310.A OG1 LEU 279.A O no hydrogen 2.876 N/A HIS 311.A N PRO 307.A O no hydrogen 3.004 N/A LEU 312.A N SER 308.A O no hydrogen 2.880 N/A MET 313.A N PRO 309.A O no hydrogen 3.291 N/A ILE 314.A N THR 310.A O no hydrogen 2.865 N/A SER 315.A N HIS 311.A O no hydrogen 2.869 N/A SER 315.A OG HIS 311.A O no hydrogen 2.732 N/A SER 315.A OG LEU 312.A O no hydrogen 3.191 N/A MET 316.A N LEU 312.A O no hydrogen 3.115 N/A THR 318.A OG1 ILE 314.A O no hydrogen 3.368 N/A TRP 319.A N SER 315.A O no hydrogen 2.651 N/A VAL 321.A N THR 318.A O no hydrogen 2.906 N/A MET 322.A N THR 318.A O no hydrogen 2.786 N/A SER 323.A N TRP 319.A O no hydrogen 2.910 N/A SER 323.A OG TRP 319.A O no hydrogen 3.088 N/A SER 323.A OG PRO 320.A O no hydrogen 3.486 N/A ASN 324.A ND2 PRO 187.A O no hydrogen 2.753 N/A SER 325.A N MET 322.A O no hydrogen 3.419 N/A SER 325.A OG VAL 321.A O no hydrogen 2.741 N/A ASN 327.A ND2 PRO 184.A O no hydrogen 3.431 N/A ASN 327.A ND2 ASN 669.A O no hydrogen 2.755 N/A ASN 328.A N ASN 331.A OD1 no hydrogen 2.933 N/A ASN 328.A ND2 TYR 339.A O no hydrogen 3.158 N/A VAL 329.A N SER 337.A O no hydrogen 2.908 N/A LEU 330.A N ASN 328.A OD1 no hydrogen 2.991 N/A ASN 331.A N ASN 328.A O no hydrogen 3.240 N/A ASN 331.A ND2 PRO 326.A O no hydrogen 3.153 N/A ASN 331.A ND2 LYS 666.A O no hydrogen 2.834 N/A ILE 332.A N ASN 328.A O no hydrogen 3.043 N/A CYS 335.A N ILE 332.A O no hydrogen 3.404 N/A CYS 335.A SG ILE 181.A O no hydrogen 3.748 N/A LEU 338.A N VAL 365.A O no hydrogen 2.792 N/A TYR 339.A N SER 337.A OG no hydrogen 2.950 N/A TYR 339.A OH MET 322.A O no hydrogen 2.963 N/A LYS 340.A NZ SER 323.A O no hydrogen 2.905 N/A PHE 341.A N LEU 338.A O no hydrogen 2.849 N/A ARG 345.A N LEU 659.A O no hydrogen 2.981 N/A GLY 347.A N PHE 344.A O no hydrogen 2.676 N/A LEU 348.A N PRO 343.A O no hydrogen 2.738 N/A ASN 349.A ND2 GLU 353.A OE2 no hydrogen 3.203 N/A VAL 352.A N LEU 348.A O no hydrogen 2.988 N/A GLU 353.A N ASN 349.A O no hydrogen 2.746 N/A TRP 354.A N ARG 350.A O no hydrogen 2.778 N/A ILE 355.A N ILE 351.A O no hydrogen 2.742 N/A LEU 356.A N VAL 352.A O no hydrogen 3.020 N/A ALA 357.A N GLU 353.A O no hydrogen 3.124 N/A GLU 359.A N GLU 359.A OE2 no hydrogen 3.028 N/A LYS 362.A N VAL 373.A O no hydrogen 3.040 N/A LYS 362.A NZ TRP 354.A O no hydrogen 2.688 N/A LYS 362.A NZ ILE 355.A O no hydrogen 3.283 N/A LYS 362.A NZ ALA 357.A O no hydrogen 2.846 N/A LYS 362.A NZ GLU 359.A O no hydrogen 2.994 N/A LEU 364.A N TYR 371.A O no hydrogen 2.563 N/A VAL 365.A N PRO 336.A O no hydrogen 2.678 N/A TYR 366.A N ASN 369.A O no hydrogen 3.109 N/A ASP 368.A N ASP 368.A OD1 no hydrogen 2.577 N/A ASN 369.A N TYR 366.A O no hydrogen 2.773 N/A ILE 370.A N ILE 381.A O no hydrogen 2.735 N/A TYR 371.A N LEU 364.A O no hydrogen 2.796 N/A TYR 371.A OH ASP 535.A O no hydrogen 2.903 N/A ILE 372.A N TYR 379.A O no hydrogen 2.928 N/A VAL 373.A N LYS 362.A O no hydrogen 2.945 N/A HIS 374.A N THR 377.A O no hydrogen 3.186 N/A SER 375.A OG HIS 374.A ND1 no hydrogen 2.799 N/A ASN 376.A N GLU 360.A OE1 no hydrogen 3.155 N/A THR 377.A N HIS 374.A O no hydrogen 2.904 N/A THR 377.A OG1 SER 375.A O no hydrogen 3.371 N/A TRP 378.A N ILE 500.A O no hydrogen 2.877 N/A TRP 378.A NE1 LEU 534.A O no hydrogen 3.003 N/A TYR 379.A N ILE 372.A O no hydrogen 2.664 N/A SER 380.A N ARG 498.A O no hydrogen 2.818 N/A ILE 381.A N ILE 370.A O no hydrogen 2.805 N/A ASP 382.A N LYS 495.A O no hydrogen 3.298 N/A LEU 383.A N ASP 368.A O no hydrogen 3.145 N/A GLU 384.A N ASN 493.A O no hydrogen 2.908 N/A ALA 388.A N LYS 385.A O no hydrogen 2.930 N/A CYS 390.A SG THR 391.A O no hydrogen 3.337 N/A GLN 393.A N GLN 393.A OE1 no hydrogen 3.034 N/A HIS 394.A N THR 391.A OG1 no hydrogen 3.157 N/A GLN 396.A N ARG 392.A O no hydrogen 3.390 N/A ALA 397.A N GLN 393.A O no hydrogen 2.865 N/A ALA 398.A N HIS 394.A O no hydrogen 3.182 N/A MET 399.A N MET 395.A O no hydrogen 2.522 N/A TYR 400.A N GLN 396.A O no hydrogen 2.913 N/A TYR 400.A OH GLU 173.A OE1 no hydrogen 2.529 N/A TYR 401.A N ALA 397.A O no hydrogen 3.027 N/A TYR 401.A OH LEU 183.A O no hydrogen 2.473 N/A ILE 402.A N ALA 398.A O no hydrogen 2.998 N/A LEU 403.A N MET 399.A O no hydrogen 3.232 N/A THR 404.A N TYR 400.A O no hydrogen 2.809 N/A THR 404.A OG1 TYR 400.A O no hydrogen 2.816 N/A THR 404.A OG1 TYR 401.A O no hydrogen 2.976 N/A ARG 405.A N TYR 401.A O no hydrogen 3.036 N/A ARG 405.A NE THR 404.A OG1 no hydrogen 3.423 N/A ARG 405.A NH1 GLU 173.A OE2 no hydrogen 3.341 N/A ARG 405.A NH1 ASP 180.A OD2 no hydrogen 3.338 N/A ARG 405.A NH2 GLU 173.A OE2 no hydrogen 2.728 N/A TRP 407.A N LEU 403.A O no hydrogen 2.966 N/A TRP 407.A NE1 ILE 317.A O no hydrogen 2.688 N/A SER 408.A OG LEU 403.A O no hydrogen 3.072 N/A SER 408.A OG SER 698.A OG no hydrogen 3.281 N/A ASP 412.A N ASP 409.A O no hydrogen 3.048 N/A MET 414.A N TRP 407.A O no hydrogen 2.777 N/A ASN 416.A N LEU 198.A O no hydrogen 2.847 N/A ALA 420.A N ASN 416.A O no hydrogen 3.323 N/A THR 421.A N GLN 417.A O no hydrogen 2.921 N/A THR 421.A OG1 GLN 417.A O no hydrogen 2.628 N/A PHE 422.A N THR 418.A O no hydrogen 2.854 N/A ALA 423.A N TRP 419.A O no hydrogen 2.907 N/A MET 424.A N ALA 420.A O no hydrogen 3.075 N/A ASN 425.A N THR 421.A O no hydrogen 2.787 N/A ASN 425.A ND2 THR 705.A O no hydrogen 2.918 N/A ILE 426.A N THR 421.A O no hydrogen 3.049 N/A ILE 426.A N PHE 422.A O no hydrogen 3.083 N/A ALA 427.A N PHE 422.A O no hydrogen 2.426 N/A ALA 429.A N ILE 426.A O no hydrogen 2.940 N/A LEU 430.A N ILE 426.A O no hydrogen 3.114 N/A VAL 432.A N PRO 428.A O no hydrogen 3.006 N/A ASP 433.A N GLY 447.A O no hydrogen 2.764 N/A SER 434.A OG SER 280.A O no hydrogen 3.340 N/A SER 434.A OG LEU 430.A O no hydrogen 2.836 N/A SER 435.A OG SER 280.A O no hydrogen 3.398 N/A CYS 436.A N ILE 443.A O no hydrogen 2.847 N/A CYS 436.A SG ILE 443.A O no hydrogen 3.559 N/A CYS 436.A SG LYS 444.A O no hydrogen 4.003 N/A CYS 436.A SG THR 445.A OG1 no hydrogen 3.424 N/A LEU 437.A N GLY 282.A O no hydrogen 3.005 N/A ILE 438.A N LEU 441.A O no hydrogen 3.069 N/A LEU 441.A N ILE 438.A O no hydrogen 2.991 N/A GLN 442.A NE2 ARG 39.A O no hydrogen 3.560 N/A ILE 443.A N CYS 436.A O no hydrogen 3.024 N/A LYS 444.A N LYS 34.A O no hydrogen 3.011 N/A THR 445.A N SER 434.A O no hydrogen 3.082 N/A GLY 447.A N ASP 433.A OD1 no hydrogen 2.774 N/A GLN 448.A NE2 ASN 459.A OD1 no hydrogen 3.647 N/A SER 450.A OG GLU 387.A OE1 no hydrogen 2.519 N/A ASN 452.A N GLY 449.A O no hydrogen 3.090 N/A ASN 452.A ND2 GLN 448.A OE1 no hydrogen 3.293 N/A ASN 452.A ND2 GLY 449.A O no hydrogen 2.594 N/A THR 455.A OG1 ASN 452.A O no hydrogen 2.632 N/A ASN 458.A ND2 GLN 448.A OE1 no hydrogen 2.899 N/A ASN 459.A N THR 455.A O no hydrogen 3.303 N/A ASN 459.A ND2 GLU 387.A OE2 no hydrogen 3.122 N/A HIS 460.A N PHE 456.A O no hydrogen 2.899 N/A LEU 461.A N ILE 457.A O no hydrogen 2.926 N/A LEU 462.A N ASN 458.A O no hydrogen 3.111 N/A SER 463.A N ASN 459.A O no hydrogen 3.022 N/A SER 463.A OG ALA 367.A O no hydrogen 2.757 N/A SER 463.A OG ASN 459.A O no hydrogen 3.539 N/A THR 464.A N HIS 460.A O no hydrogen 2.956 N/A THR 464.A OG1 THR 182.A OG1 no hydrogen 2.877 N/A THR 464.A OG1 HIS 460.A O no hydrogen 2.645 N/A LEU 465.A N LEU 461.A O no hydrogen 2.979 N/A VAL 466.A N LEU 462.A O no hydrogen 3.263 N/A LEU 467.A N SER 463.A O no hydrogen 2.831 N/A ASP 468.A N THR 464.A O no hydrogen 3.013 N/A GLN 469.A N LEU 465.A O no hydrogen 2.939 N/A TRP 470.A N VAL 466.A O no hydrogen 2.858 N/A TRP 470.A NE1 PRO 476.A O no hydrogen 2.720 N/A ASN 471.A N LEU 467.A O no hydrogen 2.829 N/A ASN 471.A ND2 SER 683.A OG no hydrogen 3.083 N/A LEU 472.A N ASP 468.A O no hydrogen 3.070 N/A MET 473.A N GLN 469.A O no hydrogen 3.241 N/A ARG 474.A N ASN 471.A O no hydrogen 3.284 N/A GLN 475.A N TRP 470.A O no hydrogen 2.892 N/A GLN 475.A NE2 PRO 361.A O no hydrogen 3.366 N/A GLN 475.A NE2 ASN 471.A OD1 no hydrogen 3.334 N/A ARG 477.A NE TYR 379.A OH no hydrogen 3.054 N/A SER 480.A N ARG 477.A O no hydrogen 2.865 N/A SER 480.A OG ARG 477.A O no hydrogen 2.717 N/A PHE 483.A N SER 480.A OG no hydrogen 3.321 N/A LYS 484.A N SER 480.A O no hydrogen 3.331 N/A LYS 484.A NZ GLU 487.A OE2 no hydrogen 3.390 N/A LYS 484.A NZ PHE 494.A O no hydrogen 3.492 N/A SER 485.A N GLU 481.A O no hydrogen 3.214 N/A SER 485.A OG GLU 482.A O no hydrogen 2.950 N/A GLU 487.A N LYS 484.A O no hydrogen 3.061 N/A LEU 490.A N ILE 486.A O no hydrogen 3.138 N/A GLY 491.A N GLU 487.A O no hydrogen 2.940 N/A ASN 493.A N ASN 389.A OD1 no hydrogen 3.219 N/A PHE 494.A N GLU 487.A OE1 no hydrogen 3.439 N/A LYS 495.A N ASP 382.A O no hydrogen 3.004 N/A GLU 497.A N SER 380.A O no hydrogen 2.767 N/A ARG 498.A NE GLU 497.A OE1 no hydrogen 3.177 N/A ARG 498.A NH1 GLU 533.A O no hydrogen 3.165 N/A ARG 498.A NH1 ASP 555.A OD1 no hydrogen 2.782 N/A ARG 498.A NH2 ASP 555.A OD1 no hydrogen 3.520 N/A ILE 500.A N TRP 378.A O no hydrogen 3.027 N/A ILE 503.A N ASN 376.A O no hydrogen 3.070 N/A ARG 504.A N ASN 376.A OD1 no hydrogen 3.368 N/A ARG 504.A NE ILE 355.A O no hydrogen 3.179 N/A ARG 504.A NE ALA 357.A O no hydrogen 3.237 N/A ARG 504.A NH1 GLU 360.A OE1 no hydrogen 2.708 N/A ARG 504.A NH1 ASN 376.A OD1 no hydrogen 2.934 N/A ARG 504.A NH2 ALA 357.A O no hydrogen 3.350 N/A ARG 504.A NH2 GLU 360.A OE1 no hydrogen 2.933 N/A LYS 506.A N ASP 502.A O no hydrogen 3.051 N/A LYS 506.A NZ ASP 501.A O no hydrogen 2.891 N/A LEU 507.A N ILE 503.A O no hydrogen 3.050 N/A ARG 508.A N ARG 504.A O no hydrogen 3.021 N/A GLN 509.A N GLY 505.A O no hydrogen 2.998 N/A LEU 510.A N LEU 507.A O no hydrogen 3.350 N/A VAL 511.A N ARG 508.A O no hydrogen 3.144 N/A LEU 513.A N GLN 509.A O no hydrogen 3.119 N/A GLY 517.A N SER 520.A O no hydrogen 3.167 N/A GLY 521.A N ASP 546.A OD1 no hydrogen 2.998 N/A GLY 521.A N ASP 546.A OD2 no hydrogen 3.242 N/A VAL 523.A N GLY 517.A O no hydrogen 3.011 N/A SER 528.A OG ASN 599.A O no hydrogen 3.492 N/A THR 531.A OG1 GLU 533.A OE2 no hydrogen 2.823 N/A VAL 532.A N ALA 541.A O no hydrogen 2.909 N/A LEU 534.A N VAL 532.A O no hydrogen 3.017 N/A LEU 536.A N TRP 539.A O no hydrogen 2.773 N/A LEU 537.A N TYR 371.A OH no hydrogen 2.817 N/A GLY 538.A N ASP 535.A O no hydrogen 3.245 N/A TRP 539.A N LEU 536.A O no hydrogen 2.800 N/A SER 540.A N VAL 553.A O no hydrogen 2.929 N/A ALA 541.A N VAL 532.A O no hydrogen 2.814 N/A THR 542.A N VAL 551.A O no hydrogen 3.142 N/A THR 542.A OG1 PRO 530.A O no hydrogen 2.801 N/A SER 544.A N ILE 549.A O no hydrogen 2.755 N/A SER 544.A OG LEU 519.A O no hydrogen 2.645 N/A LYS 545.A N SER 520.A OG no hydrogen 3.002 N/A ASP 546.A N LEU 519.A O no hydrogen 2.856 N/A LEU 547.A N SER 544.A OG no hydrogen 2.969 N/A GLY 548.A N SER 544.A O no hydrogen 2.767 N/A TYR 550.A N ASN 349.A OD1 no hydrogen 3.333 N/A TYR 550.A OH LEU 507.A O no hydrogen 2.620 N/A VAL 551.A N THR 542.A O no hydrogen 2.609 N/A VAL 553.A N SER 540.A O no hydrogen 3.075 N/A LEU 554.A N VAL 595.A O no hydrogen 3.159 N/A ASP 555.A N GLY 538.A O no hydrogen 3.430 N/A LYS 556.A N GLU 533.A OE1 no hydrogen 2.829 N/A GLU 557.A N ASP 555.A OD2 no hydrogen 2.808 N/A ARG 558.A N ASP 555.A OD2 no hydrogen 3.426 N/A LEU 559.A N ASP 555.A O no hydrogen 2.904 N/A PHE 560.A N LYS 556.A O no hydrogen 3.182 N/A CYS 561.A N GLU 557.A O no hydrogen 3.189 N/A SER 562.A N ARG 558.A O no hydrogen 2.984 N/A SER 562.A OG GLU 637.A OE1 no hydrogen 3.068 N/A SER 562.A OG GLU 637.A OE2 no hydrogen 2.919 N/A ALA 563.A N LEU 559.A O no hydrogen 2.822 N/A ALA 564.A N PHE 560.A O no hydrogen 2.779 N/A TYR 565.A OH ILE 132.A O no hydrogen 2.565 N/A TYR 565.A OH LYS 135.A O no hydrogen 2.635 N/A ALA 583.A N GLY 579.A O no hydrogen 2.754 N/A TYR 584.A N ILE 580.A O no hydrogen 3.068 N/A LYS 585.A N GLU 581.A O no hydrogen 2.844 N/A LYS 585.A NZ GLN 582.A OE1 no hydrogen 3.463 N/A VAL 586.A N GLN 582.A O no hydrogen 3.294 N/A VAL 587.A N ALA 583.A O no hydrogen 3.245 N/A ARG 588.A N TYR 584.A O no hydrogen 2.756 N/A ARG 588.A NE ASP 100.A OD2 no hydrogen 3.262 N/A ARG 588.A NH2 TYR 589.A OH no hydrogen 3.545 N/A TYR 589.A N LYS 585.A O no hydrogen 2.849 N/A TYR 589.A OH ASP 100.A OD1 no hydrogen 2.976 N/A TYR 589.A OH ASP 100.A OD2 no hydrogen 2.962 N/A GLU 590.A N VAL 586.A O no hydrogen 2.889 N/A ALA 591.A N VAL 587.A O no hydrogen 2.967 N/A LEU 592.A N ARG 588.A O no hydrogen 3.205 N/A ARG 593.A N TYR 589.A O no hydrogen 3.240 N/A ARG 593.A NH1 TYR 518.A OH no hydrogen 3.086 N/A ARG 593.A NH1 ASN 604.A OD1 no hydrogen 2.795 N/A LEU 594.A N GLU 590.A O no hydrogen 2.891 N/A VAL 595.A N ALA 591.A O no hydrogen 2.981 N/A GLY 597.A N LEU 592.A O no hydrogen 2.956 N/A TRP 598.A N ARG 593.A O no hydrogen 3.030 N/A ASN 599.A N GLY 596.A O no hydrogen 2.973 N/A ASN 599.A ND2 SER 529.A O no hydrogen 2.990 N/A TYR 600.A N GLY 597.A O no hydrogen 2.736 N/A LEU 602.A N GLU 124.A OE2 no hydrogen 3.020 N/A LEU 603.A N GLU 124.A OE1 no hydrogen 2.744 N/A ASN 604.A N TYR 600.A O no hydrogen 2.696 N/A ASN 604.A ND2 TYR 518.A OH no hydrogen 3.308 N/A LYS 605.A N PRO 601.A O no hydrogen 3.100 N/A LYS 605.A NZ GLU 524.A OE1 no hydrogen 3.225 N/A ALA 606.A N LEU 602.A O no hydrogen 2.703 N/A CYS 607.A N LEU 603.A O no hydrogen 2.932 N/A CYS 607.A SG LEU 603.A O no hydrogen 3.222 N/A LYS 608.A N ASN 604.A O no hydrogen 2.777 N/A LYS 608.A NZ GLU 524.A OE2 no hydrogen 3.536 N/A ASN 609.A N LYS 605.A O no hydrogen 2.800 N/A ASN 610.A N ALA 606.A O no hydrogen 3.137 N/A ASN 610.A ND2 TYR 589.A OH no hydrogen 3.474 N/A ALA 611.A N CYS 607.A O no hydrogen 2.946 N/A GLY 612.A N LYS 608.A O no hydrogen 2.803 N/A ALA 613.A N ASN 609.A O no hydrogen 2.839 N/A ALA 614.A N ASN 610.A O no hydrogen 3.172 N/A ARG 615.A N ALA 611.A O no hydrogen 2.810 N/A ARG 615.A NH2 GLU 590.A OE2 no hydrogen 2.826 N/A ARG 616.A N GLY 612.A O no hydrogen 2.725 N/A HIS 617.A N ALA 613.A O no hydrogen 2.956 N/A LEU 618.A N ALA 614.A O no hydrogen 2.959 N/A GLU 619.A N ARG 615.A O no hydrogen 3.032 N/A LYS 621.A N HIS 617.A O no hydrogen 3.168 N/A GLY 622.A N LEU 618.A O no hydrogen 3.151 N/A LEU 625.A N PHE 623.A O no hydrogen 3.046 N/A GLU 627.A N PRO 624.A O no hydrogen 3.174 N/A PHE 628.A N LEU 625.A O no hydrogen 2.884 N/A LEU 629.A N LEU 625.A O no hydrogen 3.093 N/A TRP 632.A NE1 ILE 647.A O no hydrogen 2.785 N/A SER 633.A OG GLY 639.A O no hydrogen 3.091 N/A SER 633.A OG GLU 643.A OE2 no hydrogen 3.378 N/A LEU 635.A N TRP 632.A O no hydrogen 2.741 N/A SER 636.A N TRP 632.A O no hydrogen 3.218 N/A PHE 638.A N SER 636.A OG no hydrogen 2.993 N/A GLY 639.A N SER 636.A O no hydrogen 3.309 N/A ALA 641.A N PHE 638.A O no hydrogen 3.126 N/A PHE 642.A N GLY 639.A O no hydrogen 2.774 N/A GLU 643.A N GLU 640.A O no hydrogen 3.505 N/A THR 650.A N LYS 648.A O no hydrogen 3.057 N/A THR 650.A OG1 LYS 648.A O no hydrogen 3.418 N/A THR 652.A N SER 655.A OG no hydrogen 2.976 N/A SER 653.A OG TYR 518.A O no hydrogen 2.949 N/A SER 655.A N THR 652.A OG1 no hydrogen 3.251 N/A SER 655.A OG THR 652.A O no hydrogen 3.538 N/A GLU 658.A N GLU 654.A O no hydrogen 2.754 N/A LEU 659.A N SER 655.A O no hydrogen 2.940 N/A ASN 660.A N LEU 656.A O no hydrogen 3.185 N/A ASN 660.A ND2 LEU 656.A O no hydrogen 3.020 N/A VAL 663.A N ARG 345.A O no hydrogen 2.739 N/A ASN 669.A N ASN 327.A OD1 no hydrogen 2.728 N/A ASN 669.A ND2 ASN 324.A O no hydrogen 2.807 N/A ASN 671.A N VAL 185.A O no hydrogen 3.017 N/A ASN 671.A ND2 SER 408.A O no hydrogen 3.118 N/A ARG 672.A NH1 GLU 694.A O no hydrogen 3.277 N/A ARG 672.A NH1 GLU 694.A OE1 no hydrogen 3.485 N/A ARG 672.A NH2 GLU 694.A O no hydrogen 3.456 N/A GLY 677.A N ASN 675.A OD1 no hydrogen 2.763 N/A SER 683.A N LEU 679.A O no hydrogen 3.044 N/A SER 683.A OG ASP 468.A OD2 no hydrogen 2.937 N/A SER 683.A OG LEU 679.A O no hydrogen 2.974 N/A ASN 684.A N LYS 680.A O no hydrogen 3.444 N/A ALA 685.A N ALA 681.A O no hydrogen 2.994 N/A LEU 686.A N VAL 682.A O no hydrogen 3.235 N/A LYS 687.A N ASN 684.A O no hydrogen 2.937 N/A THR 688.A OG1 ALA 685.A O no hydrogen 3.293 N/A ARG 690.A N THR 688.A OG1 no hydrogen 3.392 N/A TYR 691.A OH THR 171.A OG1 no hydrogen 2.969 N/A ASN 693.A ND2 GLY 696.A O no hydrogen 2.738 N/A GLY 696.A N ASN 693.A O no hydrogen 3.262 N/A SER 698.A N GLY 411.A O no hydrogen 2.920 N/A SER 698.A OG SER 408.A OG no hydrogen 3.281 N/A SER 698.A OG GLY 411.A O no hydrogen 3.089 N/A SER 698.A OG ALA 695.A O no hydrogen 2.610 N/A VAL 701.A N LEU 697.A O no hydrogen 3.008 N/A LEU 702.A N SER 698.A O no hydrogen 3.069 N/A LEU 703.A N GLY 699.A O no hydrogen 2.930 N/A ALA 704.A N LEU 700.A O no hydrogen 3.004 N/A THR 705.A N VAL 701.A O no hydrogen 3.254 N/A THR 705.A OG1 GLN 417.A OE1 no hydrogen 2.969 N/A THR 705.A OG1 VAL 701.A O no hydrogen 2.647 N/A ALA 706.A N LEU 702.A O no hydrogen 2.987 N/A ARG 707.A N LEU 703.A O no hydrogen 3.289 N/A SER 708.A OG ALA 704.A O no hydrogen 2.655 N/A ARG 709.A N ILE 747.A O no hydrogen 3.015 N/A ARG 709.A NH1 ASP 746.A O no hydrogen 2.985 N/A ALA 716.A N ASP 712.A O no hydrogen 2.890 N/A ALA 716.A N ALA 713.A O no hydrogen 3.222 N/A LYS 717.A N ALA 713.A O no hydrogen 3.299 N/A ALA 718.A N VAL 714.A O no hydrogen 3.137 N/A GLU 719.A N LYS 715.A O no hydrogen 2.994 N/A ALA 720.A N ALA 716.A O no hydrogen 3.230 N/A GLU 721.A N LYS 717.A O no hydrogen 2.902 N/A LYS 722.A N ALA 718.A O no hydrogen 3.138 N/A LEU 723.A N GLU 719.A O no hydrogen 2.917 N/A HIS 724.A N ALA 720.A O no hydrogen 2.917 N/A LYS 725.A N GLU 721.A O no hydrogen 3.430 N/A SER 726.A N LYS 722.A O no hydrogen 3.380 N/A GLU 733.A N ASP 730.A OD1 no hydrogen 2.773 N/A ARG 734.A NH1 SER 726.A O no hydrogen 3.418 N/A ARG 734.A NH2 HIS 724.A O no hydrogen 3.317 N/A SER 735.A N TRP 731.A O no hydrogen 2.696 N/A SER 735.A OG PHE 732.A O no hydrogen 2.933 N/A THR 737.A N GLU 733.A O no hydrogen 2.915 N/A THR 737.A OG1 GLU 733.A O no hydrogen 2.332 N/A LEU 738.A N ARG 734.A O no hydrogen 2.911 N/A SER 739.A N SER 735.A O no hydrogen 2.909 N/A ASP 740.A N GLU 736.A O no hydrogen 2.915 N/A LEU 741.A N THR 737.A O no hydrogen 3.432 N/A LEU 742.A N LEU 738.A O no hydrogen 3.015 N/A LEU 742.A N SER 739.A O no hydrogen 2.784 N/A GLU 743.A N SER 739.A O no hydrogen 3.022 N/A LYS 744.A N ASP 740.A O no hydrogen 2.668 N/A ALA 745.A N LEU 741.A O no hydrogen 3.348 N/A ASP 746.A N GLU 743.A O no hydrogen 3.095 N/A ILE 747.A N LEU 742.A O no hydrogen 2.974 N/A ALA 748.A N LEU 742.A O no hydrogen 3.292 N/A SER 749.A N ARG 707.A O no hydrogen 3.368 N/A SER 749.A OG ARG 707.A O no hydrogen 3.341 N/A HIS 753.A N LYS 750.A O no hydrogen 3.263 N/A GLU 758.A N SER 754.A O no hydrogen 2.882 N/A THR 759.A N ALA 755.A O no hydrogen 2.938 N/A SER 760.A N LEU 756.A O no hydrogen 3.224 N/A ASP 761.A N VAL 757.A O no hydrogen 3.326 N/A ALA 762.A N GLU 758.A O no hydrogen 3.226 N/A LEU 763.A N SER 760.A O no hydrogen 3.239 N/A GLU 764.A N ASP 761.A O no hydrogen 3.164 N/A