Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 8ca3_G.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ASN 2.A N SER 1.A OG no hydrogen 2.495 N/A ILE 4.A N VAL 15.A O no hydrogen 2.560 N/A VAL 6.A N VAL 13.A O no hydrogen 3.200 N/A PHE 7.A N TRP 72.A O no hydrogen 2.701 N/A VAL 8.A N GLN 11.A O no hydrogen 3.042 N/A ASP 9.A N ILE 74.A O no hydrogen 2.663 N/A GLN 11.A N VAL 8.A O no hydrogen 3.016 N/A SER 12.A OG GLU 5.A OE1 no hydrogen 2.770 N/A SER 12.A OG GLU 5.A OE2 no hydrogen 2.406 N/A VAL 13.A N VAL 6.A O no hydrogen 2.917 N/A VAL 15.A N ILE 4.A O no hydrogen 2.887 N/A GLU 16.A N GLU 16.A OE1 no hydrogen 2.464 N/A THR 19.A N GLU 16.A O no hydrogen 3.375 N/A THR 19.A OG1 THR 20.A O no hydrogen 3.294 N/A VAL 21.A N MET 66.A O no hydrogen 3.094 N/A LEU 22.A N ALA 63.A O no hydrogen 3.038 N/A GLN 23.A N THR 20.A OG1 no hydrogen 3.428 N/A ALA 24.A N THR 20.A O no hydrogen 2.923 N/A CYS 25.A N VAL 21.A O no hydrogen 2.887 N/A CYS 25.A SG VAL 21.A O no hydrogen 3.275 N/A GLU 26.A N LEU 22.A O no hydrogen 2.898 N/A LYS 27.A N GLN 23.A O no hydrogen 2.953 N/A VAL 28.A N ALA 24.A O no hydrogen 3.385 N/A GLY 29.A N CYS 25.A O no hydrogen 2.910 N/A ARG 34.A NE ILE 32.A O no hydrogen 3.175 N/A ARG 34.A NH1 GLU 26.A OE2 no hydrogen 3.168 N/A ARG 34.A NH2 ILE 32.A O no hydrogen 3.050 N/A ARG 40.A N HIS 38.A ND1 no hydrogen 3.182 N/A ARG 40.A NH2 GLU 251.A OE1 no hydrogen 3.023 N/A LEU 41.A N HIS 38.A O no hydrogen 3.241 N/A ARG 48.A NH1 GLY 45.A O no hydrogen 3.004 N/A VAL 52.A N VAL 61.A O no hydrogen 2.905 N/A GLU 55.A N ASN 73.A O no hydrogen 2.888 N/A VAL 61.A N VAL 52.A O no hydrogen 3.139 N/A ALA 63.A N CYS 50.A O no hydrogen 3.035 N/A ALA 65.A N ALA 62.A O no hydrogen 3.027 N/A MET 66.A N ALA 62.A O no hydrogen 2.998 N/A VAL 68.A N THR 19.A O no hydrogen 2.911 N/A GLY 71.A N GLU 5.A O no hydrogen 2.765 N/A ASN 73.A ND2 GLU 55.A OE1 no hydrogen 2.800 N/A ILE 74.A N PHE 7.A O no hydrogen 2.819 N/A LEU 75.A N GLU 53.A O no hydrogen 2.904 N/A THR 76.A N ASP 9.A OD1 no hydrogen 3.212 N/A THR 76.A OG1 ASP 9.A OD1 no hydrogen 3.427 N/A THR 76.A OG1 ASP 9.A OD2 no hydrogen 2.728 N/A SER 78.A OG GLU 53.A OE1 no hydrogen 2.633 N/A SER 78.A OG LEU 75.A O no hydrogen 2.814 N/A SER 81.A OG THR 76.A O no hydrogen 2.912 N/A SER 81.A OG SER 78.A O no hydrogen 3.060 N/A LYS 82.A N SER 78.A O no hydrogen 2.940 N/A LYS 83.A N GLU 79.A O no hydrogen 2.865 N/A ALA 84.A N LYS 80.A O no hydrogen 2.940 N/A ARG 85.A N SER 81.A O no hydrogen 2.902 N/A ARG 85.A NH2 THR 76.A O no hydrogen 2.768 N/A GLU 86.A N LYS 82.A O no hydrogen 2.943 N/A GLY 87.A N LYS 83.A O no hydrogen 2.909 N/A VAL 88.A N ALA 84.A O no hydrogen 2.930 N/A MET 89.A N ARG 85.A O no hydrogen 2.914 N/A GLU 90.A N GLU 86.A O no hydrogen 2.901 N/A PHE 91.A N GLY 87.A O no hydrogen 2.953 N/A LEU 92.A N VAL 88.A O no hydrogen 2.904 N/A LEU 93.A N MET 89.A O no hydrogen 2.916 N/A ALA 94.A N PHE 91.A O no hydrogen 3.318 N/A CYS 100.A SG GLN 112.A OE1 no hydrogen 3.214 N/A CYS 103.A N CYS 100.A O no hydrogen 3.210 N/A GLU 108.A N GLN 105.A O no hydrogen 2.993 N/A GLN 112.A NE2 GLY 106.A O no hydrogen 2.204 N/A ASP 113.A N CYS 109.A O no hydrogen 2.947 N/A GLN 114.A N ASP 110.A O no hydrogen 2.869 N/A GLN 114.A NE2 ARG 34.A O no hydrogen 2.620 N/A SER 115.A N LEU 111.A O no hydrogen 2.873 N/A MET 116.A N GLN 112.A O no hydrogen 2.929 N/A MET 117.A N ASP 113.A O no hydrogen 2.950 N/A PHE 118.A N GLN 114.A O no hydrogen 2.860 N/A GLY 119.A N GLN 114.A O no hydrogen 3.153 N/A GLY 119.A N SER 115.A O no hydrogen 3.046 N/A ARG 122.A N SER 120.A OG no hydrogen 3.273 N/A ARG 124.A NE GLU 90.A OE2 no hydrogen 2.649 N/A LYS 129.A NZ LEU 93.A O no hydrogen 3.517 N/A LYS 129.A NZ ALA 94.A O no hydrogen 2.677 N/A LYS 129.A NZ HIS 96.A O no hydrogen 3.330 N/A ARG 130.A N ASN 95.A OD1 no hydrogen 3.197 N/A ARG 130.A NE ASN 174.A OD1 no hydrogen 3.405 N/A LYS 135.A NZ GLN 177.A OE1 no hydrogen 3.430 N/A LYS 142.A N THR 204.A O no hydrogen 2.863 N/A THR 143.A OG1 LYS 135.A O no hydrogen 2.609 N/A MET 145.A N ASP 134.A OD2 no hydrogen 3.142 N/A THR 146.A OG1 VAL 132.A O no hydrogen 2.826 N/A ARG 147.A N ILE 144.A O no hydrogen 3.449 N/A ARG 147.A NH1 GLY 201.A O no hydrogen 3.202 N/A ARG 147.A NH2 ASP 99.A OD2 no hydrogen 2.890 N/A CYS 148.A N MET 145.A O no hydrogen 3.384 N/A GLN 150.A NE2 MET 176.A O no hydrogen 3.616 N/A THR 152.A OG1 ASN 46.A OD1 no hydrogen 3.322 N/A THR 152.A OG1 CYS 151.A O no hydrogen 2.534 N/A ARG 153.A NE ILE 197.A O no hydrogen 2.863 N/A ARG 156.A N THR 152.A O no hydrogen 2.926 N/A ARG 156.A NE THR 152.A O no hydrogen 3.449 N/A ARG 156.A NE THR 152.A OG1 no hydrogen 3.314 N/A ARG 156.A NH1 CYS 36.A O no hydrogen 2.710 N/A ARG 156.A NH1 SER 42.A O no hydrogen 2.625 N/A ARG 156.A NH2 CYS 36.A O no hydrogen 2.439 N/A ARG 156.A NH2 CYS 151.A O no hydrogen 2.858 N/A PHE 157.A N ARG 153.A O no hydrogen 2.909 N/A ALA 158.A N CYS 154.A O no hydrogen 2.897 N/A SER 159.A N ILE 155.A O no hydrogen 2.930 N/A SER 159.A OG ILE 155.A O no hydrogen 3.182 N/A GLU 160.A N ARG 156.A O no hydrogen 2.877 N/A ILE 161.A N PHE 157.A O no hydrogen 2.962 N/A ALA 162.A N PHE 157.A O no hydrogen 2.910 N/A VAL 164.A N ALA 158.A O no hydrogen 2.910 N/A THR 170.A N GLN 177.A O no hydrogen 2.940 N/A MET 176.A N GLY 173.A O no hydrogen 3.151 N/A GLY 179.A N GLY 168.A O no hydrogen 2.852 N/A THR 180.A OG1 ILE 182.A O no hydrogen 2.901 N/A GLU 183.A N GLU 183.A OE1 no hydrogen 2.422 N/A MET 187.A N MET 185.A O no hydrogen 2.819 N/A SER 188.A OG MET 187.A O no hydrogen 2.509 N/A GLU 189.A N GLU 189.A OE1 no hydrogen 2.599 N/A SER 191.A N SER 188.A O no hydrogen 3.334 N/A SER 191.A OG ASP 260.A OD1 no hydrogen 3.234 N/A SER 191.A OG ASP 260.A OD2 no hydrogen 2.565 N/A GLY 192.A N ASP 260.A OD1 no hydrogen 2.804 N/A ASN 193.A N LEU 190.A O no hydrogen 3.324 N/A ASN 193.A ND2 LEU 190.A O no hydrogen 2.488 N/A ASN 193.A ND2 ILE 258.A O no hydrogen 3.189 N/A VAL 194.A N SER 191.A O no hydrogen 3.389 N/A ILE 195.A N GLY 192.A O no hydrogen 2.869 N/A ILE 197.A N ASN 193.A O no hydrogen 2.972 N/A CYS 198.A N VAL 194.A O no hydrogen 2.942 N/A CYS 198.A SG VAL 200.A O no hydrogen 2.890 N/A THR 204.A N LYS 142.A O no hydrogen 2.900 N/A LYS 206.A N LEU 140.A O no hydrogen 2.906 N/A LYS 206.A NZ ASN 136.A OD1 no hydrogen 3.557 N/A LYS 206.A NZ GLY 138.A O no hydrogen 3.514 N/A ALA 209.A N LYS 206.A O no hydrogen 3.279 N/A PHE 210.A N ASP 104.A OD1 no hydrogen 3.194 N/A THR 211.A N TYR 208.A O no hydrogen 3.294 N/A THR 211.A OG1 TYR 208.A O no hydrogen 2.958 N/A ARG 213.A N GLU 216.A OE1 no hydrogen 3.285 N/A ARG 213.A NH1 CYS 103.A O no hydrogen 2.591 N/A ARG 213.A NH2 CYS 100.A O no hydrogen 3.432 N/A THR 217.A N ARG 213.A O no hydrogen 2.972 N/A THR 217.A OG1 ARG 213.A O no hydrogen 3.427 N/A THR 217.A OG1 PRO 214.A O no hydrogen 3.074 N/A ARG 218.A N THR 237.A O no hydrogen 2.811 N/A ARG 218.A NH2 ALA 581.A O no hydrogen 3.095 N/A LYS 219.A NZ THR 217.A O no hydrogen 3.078 N/A THR 220.A N VAL 235.A O no hydrogen 2.931 N/A SER 222.A N ILE 233.A O no hydrogen 2.903 N/A ASP 224.A N SER 231.A O no hydrogen 2.731 N/A MET 226.A N ASP 224.A OD1 no hydrogen 2.573 N/A ILE 233.A N SER 222.A O no hydrogen 2.895 N/A VAL 234.A N LEU 246.A O no hydrogen 2.699 N/A VAL 235.A N THR 220.A O no hydrogen 2.871 N/A SER 236.A N ARG 244.A O no hydrogen 3.185 N/A THR 237.A N ARG 218.A O no hydrogen 2.862 N/A THR 237.A OG1 GLU 241.A O no hydrogen 2.349 N/A ARG 238.A N GLU 241.A O no hydrogen 2.917 N/A ARG 238.A NH1 GLU 216.A OE1 no hydrogen 3.092 N/A ARG 238.A NH2 THR 211.A O no hydrogen 3.230 N/A GLU 241.A N THR 237.A OG1 no hydrogen 3.186 N/A MET 243.A N SER 236.A O no hydrogen 2.814 N/A ARG 244.A N SER 236.A O no hydrogen 3.504 N/A ARG 244.A NH1 GLU 108.A OE2 no hydrogen 3.231 N/A ARG 244.A NH2 GLU 108.A OE1 no hydrogen 2.537 N/A LEU 246.A N VAL 234.A O no hydrogen 2.960 N/A ARG 248.A N ASN 232.A O no hydrogen 3.475 N/A ARG 248.A NE ILE 233.A O no hydrogen 3.190 N/A ARG 248.A NH2 SER 222.A O no hydrogen 2.539 N/A ARG 248.A NH2 ILE 233.A O no hydrogen 3.521 N/A ILE 253.A N HIS 250.A O no hydrogen 3.275 N/A ASN 254.A ND2 ASN 232.A O no hydrogen 2.582 N/A ASN 254.A ND2 ARG 248.A O no hydrogen 3.256 N/A GLU 255.A N HIS 250.A O no hydrogen 2.701 N/A ILE 258.A N ASN 193.A OD1 no hydrogen 2.796 N/A SER 259.A OG THR 262.A OG1 no hydrogen 2.714 N/A ASP 260.A N GLU 189.A O no hydrogen 3.016 N/A LYS 261.A NZ ASP 227.A OD1 no hydrogen 3.369 N/A LYS 261.A NZ THR 669.A OG1 no hydrogen 3.085 N/A THR 262.A OG1 ASP 224.A OD2 no hydrogen 3.495 N/A THR 262.A OG1 SER 259.A OG no hydrogen 2.714 N/A ARG 263.A N SER 259.A O no hydrogen 2.946 N/A ARG 263.A N ASP 260.A O no hydrogen 3.237 N/A ARG 263.A NH2 ASP 196.A OD2 no hydrogen 3.031 N/A PHE 264.A N ASP 260.A O no hydrogen 2.882 N/A TYR 266.A OH MET 243.A O no hydrogen 2.882 N/A GLY 268.A N ALA 265.A O no hydrogen 2.946 N/A LEU 269.A N TYR 266.A O no hydrogen 3.067 N/A LYS 270.A N ASP 267.A O no hydrogen 3.373 N/A ARG 271.A N GLY 268.A O no hydrogen 3.174 N/A ARG 271.A NE ALA 675.A O no hydrogen 3.013 N/A ARG 273.A NH1 LEU 269.A O no hydrogen 2.930 N/A ARG 273.A NH1 GLU 563.A OE2 no hydrogen 3.350 N/A ARG 273.A NH2 GLU 563.A OE1 no hydrogen 3.560 N/A ARG 273.A NH2 GLU 563.A OE2 no hydrogen 2.836 N/A THR 275.A OG1 PRO 585.A O no hydrogen 2.753 N/A MET 278.A N ILE 555.A O no hydrogen 2.883 N/A VAL 279.A N THR 287.A O no hydrogen 3.045 N/A ARG 280.A NE LEU 285.A O no hydrogen 3.458 N/A ASN 281.A N ASP 553.A O no hydrogen 3.133 N/A GLU 282.A N ASP 553.A OD1 no hydrogen 3.057 N/A THR 287.A N VAL 279.A O no hydrogen 3.027 N/A THR 287.A OG1 LEU 285.A O no hydrogen 3.145 N/A THR 289.A N PRO 277.A O no hydrogen 2.964 N/A THR 289.A OG1 SER 290.A O no hydrogen 3.511 N/A THR 289.A OG1 ASP 293.A OD2 no hydrogen 2.914 N/A TRP 291.A NE1 LEU 587.A O no hydrogen 3.149 N/A GLU 292.A N GLU 292.A OE1 no hydrogen 2.476 N/A ASP 293.A N SER 290.A OG no hydrogen 3.301 N/A ALA 294.A N SER 290.A O no hydrogen 2.892 N/A LEU 295.A N TRP 291.A O no hydrogen 2.927 N/A SER 296.A N GLU 292.A O no hydrogen 2.898 N/A SER 296.A OG GLU 292.A O no hydrogen 2.668 N/A ALA 299.A N LEU 295.A O no hydrogen 2.914 N/A GLY 300.A N SER 296.A O no hydrogen 2.885 N/A MET 301.A N ARG 297.A O no hydrogen 2.937 N/A LEU 302.A N VAL 298.A O no hydrogen 2.884 N/A GLN 303.A N ALA 299.A O no hydrogen 2.901 N/A GLN 303.A NE2 ALA 299.A O no hydrogen 3.341 N/A ASN 304.A N GLY 300.A O no hydrogen 2.904 N/A PHE 305.A N MET 301.A O no hydrogen 2.921 N/A ALA 309.A N GLU 306.A O no hydrogen 3.337 N/A ALA 311.A N MET 516.A O no hydrogen 2.994 N/A ILE 313.A N PHE 518.A O no hydrogen 2.913 N/A ALA 314.A N CYS 339.A O no hydrogen 2.956 N/A ALA 320.A N THR 567.A O no hydrogen 2.856 N/A GLU 321.A N GLU 321.A OE1 no hydrogen 2.497 N/A LEU 323.A N ASP 319.A O no hydrogen 2.955 N/A VAL 324.A N ALA 320.A O no hydrogen 2.887 N/A ALA 325.A N GLU 321.A O no hydrogen 2.918 N/A LEU 326.A N ALA 322.A O no hydrogen 2.940 N/A LYS 327.A N LEU 323.A O no hydrogen 2.894 N/A LYS 327.A NZ LEU 500.A O no hydrogen 2.683 N/A ASP 328.A N VAL 324.A O no hydrogen 2.894 N/A LEU 329.A N ALA 325.A O no hydrogen 2.938 N/A LEU 330.A N LEU 326.A O no hydrogen 2.938 N/A ASN 331.A N LYS 327.A O no hydrogen 2.865 N/A ASN 331.A ND2 LYS 327.A O no hydrogen 2.471 N/A LYS 332.A N ASP 328.A O no hydrogen 2.903 N/A VAL 333.A N LEU 329.A O no hydrogen 2.959 N/A ASP 334.A N ASN 331.A O no hydrogen 2.619 N/A SER 335.A N LEU 330.A O no hydrogen 2.926 N/A SER 335.A OG VAL 310.A O no hydrogen 2.197 N/A CYS 339.A N ALA 312.A O no hydrogen 2.910 N/A CYS 339.A SG ALA 312.A O no hydrogen 3.230 N/A CYS 339.A SG ASN 337.A O no hydrogen 3.417 N/A THR 340.A N LYS 503.A O no hydrogen 3.441 N/A THR 340.A OG1 ALA 314.A O no hydrogen 3.499 N/A THR 340.A OG1 GLN 494.A OE1 no hydrogen 3.216 N/A GLU 341.A N ALA 314.A O no hydrogen 2.894 N/A ILE 343.A N GLN 454.A OE1 no hydrogen 2.492 N/A ASP 352.A N ALA 349.A O no hydrogen 2.906 N/A SER 355.A OG ASN 635.A O no hydrogen 2.428 N/A ASN 356.A N LEU 353.A O no hydrogen 2.882 N/A ASN 356.A ND2 GLY 350.A O no hydrogen 3.352 N/A TYR 357.A OH ASP 499.A OD1 no hydrogen 2.949 N/A LEU 359.A N THR 571.A O no hydrogen 2.848 N/A ASN 360.A ND2 SER 355.A O no hydrogen 3.577 N/A ASN 360.A ND2 MET 485.A O no hydrogen 2.344 N/A THR 361.A OG1 LYS 483.A O no hydrogen 2.993 N/A THR 362.A N LEU 359.A O no hydrogen 2.790 N/A THR 362.A OG1 THR 361.A O no hydrogen 2.122 N/A ILE 363.A N GLU 572.A OE1 no hydrogen 3.304 N/A GLY 365.A N THR 362.A OG1 no hydrogen 3.170 N/A GLU 367.A N ALA 364.A O no hydrogen 2.938 N/A ALA 369.A N GLY 365.A O no hydrogen 2.947 N/A ASP 370.A N LYS 443.A O no hydrogen 2.952 N/A VAL 372.A N LYS 400.A O no hydrogen 2.894 N/A LEU 373.A N MET 445.A O no hydrogen 2.878 N/A LEU 374.A N ALA 402.A O no hydrogen 2.895 N/A VAL 375.A N VAL 447.A O no hydrogen 2.933 N/A GLY 376.A N ILE 404.A O no hydrogen 3.445 N/A THR 377.A OG1 GLU 382.A OE2 no hydrogen 2.788 N/A ARG 380.A NE ASP 409.A O no hydrogen 3.235 N/A ARG 380.A NH1 GLU 189.A OE2 no hydrogen 3.481 N/A GLU 382.A N PRO 379.A O no hydrogen 3.254 N/A PHE 386.A N ALA 383.A O no hydrogen 3.060 N/A ASN 387.A N ALA 383.A O no hydrogen 3.458 N/A ALA 388.A N PRO 384.A O no hydrogen 2.907 N/A ARG 389.A N LEU 385.A O no hydrogen 2.879 N/A ARG 389.A NH1 GLU 251.A O no hydrogen 3.000 N/A ARG 389.A NH1 GLU 367.A OE2 no hydrogen 3.558 N/A ARG 389.A NH2 GLU 251.A O no hydrogen 3.258 N/A ARG 389.A NH2 ILE 253.A O no hydrogen 3.085 N/A ILE 390.A N PHE 386.A O no hydrogen 2.933 N/A ARG 391.A N ASN 387.A O no hydrogen 2.909 N/A ARG 391.A NE GLU 160.A O no hydrogen 2.839 N/A ARG 391.A NH2 SER 159.A O no hydrogen 2.974 N/A LYS 392.A N ALA 388.A O no hydrogen 2.888 N/A LYS 392.A NZ GLU 255.A OE2 no hydrogen 2.128 N/A LYS 392.A NZ GLU 367.A OE2 no hydrogen 3.291 N/A SER 393.A N ARG 389.A O no hydrogen 2.932 N/A SER 393.A OG ARG 389.A O no hydrogen 2.975 N/A TRP 394.A N ILE 390.A O no hydrogen 2.901 N/A LEU 395.A N ARG 391.A O no hydrogen 2.874 N/A HIS 396.A N LYS 392.A O no hydrogen 2.922 N/A LYS 400.A N ASP 370.A O no hydrogen 2.952 N/A ALA 402.A N VAL 372.A O no hydrogen 2.888 N/A LEU 403.A N ASP 415.A O no hydrogen 2.891 N/A ILE 404.A N LEU 374.A O no hydrogen 2.904 N/A THR 411.A OG1 LEU 410.A O no hydrogen 2.111 N/A TYR 412.A N LEU 410.A O no hydrogen 2.575 N/A TYR 412.A OH ASN 387.A OD1 no hydrogen 3.233 N/A ASP 415.A N VAL 401.A O no hydrogen 2.878 N/A LEU 417.A N LEU 403.A O no hydrogen 2.910 N/A ILE 427.A N ILE 423.A O no hydrogen 2.918 N/A ALA 428.A N LEU 424.A O no hydrogen 2.913 N/A SER 429.A N GLN 425.A O no hydrogen 2.871 N/A GLY 430.A N ILE 427.A O no hydrogen 3.055 N/A ARG 431.A N ASP 426.A O no hydrogen 3.113 N/A CYS 435.A N HIS 432.A O no hydrogen 3.216 N/A CYS 435.A SG HIS 432.A O no hydrogen 2.999 N/A GLU 436.A N SER 433.A O no hydrogen 3.211 N/A LEU 438.A N PHE 434.A O no hydrogen 2.969 N/A LYS 439.A N CYS 435.A O no hydrogen 2.871 N/A LYS 439.A NZ CYS 435.A O no hydrogen 3.056 N/A ASP 440.A N GLU 436.A O no hydrogen 2.944 N/A ALA 441.A N VAL 437.A O no hydrogen 2.860 N/A ALA 441.A N LEU 438.A O no hydrogen 3.132 N/A LYS 442.A N ASP 370.A OD2 no hydrogen 3.193 N/A MET 445.A N VAL 371.A O no hydrogen 2.914 N/A VAL 446.A N VAL 484.A O no hydrogen 2.827 N/A VAL 447.A N LEU 373.A O no hydrogen 2.903 N/A LEU 448.A N ASN 486.A O no hydrogen 3.289 N/A GLY 449.A N VAL 375.A O no hydrogen 3.325 N/A SER 450.A N LEU 488.A O no hydrogen 3.234 N/A SER 451.A OG PRO 658.A O no hydrogen 2.178 N/A LEU 453.A N GLY 449.A O no hydrogen 2.942 N/A GLN 454.A N SER 450.A O no hydrogen 2.902 N/A GLN 454.A N SER 451.A O no hydrogen 3.231 N/A ARG 455.A N ALA 452.A O no hydrogen 2.963 N/A ARG 455.A NH1 ASP 457.A OD2 no hydrogen 3.132 N/A ARG 455.A NH2 ASP 457.A OD2 no hydrogen 3.261 N/A ILE 461.A N ASP 457.A O no hydrogen 2.902 N/A LEU 462.A N GLY 458.A O no hydrogen 2.918 N/A VAL 463.A N ALA 459.A O no hydrogen 2.900 N/A ALA 464.A N ALA 460.A O no hydrogen 2.905 N/A VAL 465.A N ILE 461.A O no hydrogen 2.927 N/A SER 466.A N LEU 462.A O no hydrogen 2.886 N/A SER 466.A OG LEU 462.A O no hydrogen 3.394 N/A SER 466.A OG VAL 463.A O no hydrogen 2.699 N/A ASN 467.A N VAL 463.A O no hydrogen 2.889 N/A MET 468.A N ALA 464.A O no hydrogen 2.928 N/A VAL 469.A N VAL 465.A O no hydrogen 2.911 N/A GLN 470.A N SER 466.A O no hydrogen 2.897 N/A LYS 471.A N ASN 467.A O no hydrogen 2.910 N/A ILE 472.A N MET 468.A O no hydrogen 2.858 N/A ARG 473.A N VAL 469.A O no hydrogen 2.946 N/A VAL 474.A N LYS 471.A O no hydrogen 3.235 N/A THR 475.A N LYS 471.A O no hydrogen 2.881 N/A THR 475.A OG1 LYS 471.A O no hydrogen 3.323 N/A THR 475.A OG1 ILE 472.A O no hydrogen 2.882 N/A THR 476.A N ILE 472.A O no hydrogen 2.946 N/A THR 476.A OG1 LEU 438.A O no hydrogen 3.165 N/A THR 476.A OG1 LYS 439.A O no hydrogen 3.434 N/A THR 476.A OG1 ALA 441.A O no hydrogen 2.719 N/A TRP 482.A NE1 PRO 444.A O no hydrogen 3.189 N/A LYS 483.A NZ GLU 481.A O no hydrogen 3.345 N/A ASN 486.A N VAL 446.A O no hydrogen 3.296 N/A ILE 487.A N LEU 358.A O no hydrogen 3.275 N/A LEU 488.A N LEU 448.A O no hydrogen 3.001 N/A HIS 489.A N THR 571.A OG1 no hydrogen 2.906 N/A SER 493.A OG GLY 316.A O no hydrogen 3.153 N/A GLN 494.A NE2 GLU 342.A O no hydrogen 3.475 N/A ALA 497.A N SER 493.A O no hydrogen 2.915 N/A LEU 498.A N GLN 494.A O no hydrogen 2.926 N/A ASP 499.A N VAL 495.A O no hydrogen 2.893 N/A LEU 500.A N ALA 496.A O no hydrogen 2.930 N/A GLY 501.A N ALA 497.A O no hydrogen 2.918 N/A TYR 502.A N ALA 497.A O no hydrogen 2.863 N/A TYR 502.A OH LEU 323.A O no hydrogen 2.290 N/A LYS 503.A N LEU 338.A O no hydrogen 3.052 N/A GLY 505.A N GLU 342.A O no hydrogen 3.229 N/A ARG 510.A N VAL 506.A O no hydrogen 2.935 N/A ARG 510.A NE VAL 506.A O no hydrogen 3.559 N/A LYS 511.A N GLU 507.A O no hydrogen 2.866 N/A ASN 512.A N ALA 508.A O no hydrogen 2.944 N/A MET 516.A N ALA 309.A O no hydrogen 2.913 N/A PHE 518.A N ALA 311.A O no hydrogen 2.831 N/A LEU 519.A N VAL 539.A O no hydrogen 2.907 N/A LEU 520.A N ILE 313.A O no hydrogen 2.912 N/A GLY 525.A N ALA 522.A O no hydrogen 3.134 N/A CYS 526.A SG GLU 341.A OE2 no hydrogen 2.886 N/A CYS 536.A SG PRO 514.A O no hydrogen 2.944 N/A CYS 536.A SG LYS 515.A O no hydrogen 2.903 N/A VAL 539.A N LEU 517.A O no hydrogen 3.069 N/A TYR 540.A N VAL 554.A O no hydrogen 2.875 N/A GLN 541.A N LEU 519.A O no hydrogen 2.860 N/A GLN 541.A NE2 ASP 591.A O no hydrogen 3.398 N/A HIS 544.A ND1 HIS 543.A ND1 no hydrogen 2.918 N/A HIS 544.A NE2 GLY 268.A O no hydrogen 2.607 N/A VAL 547.A N ASP 523.A OD1 no hydrogen 3.113 N/A GLY 548.A N ASP 523.A OD1 no hydrogen 3.410 N/A MET 551.A N GLY 548.A O no hydrogen 3.228 N/A ALA 552.A N ALA 549.A O no hydrogen 3.176 N/A VAL 554.A N ILE 538.A O no hydrogen 3.104 N/A ILE 555.A N MET 278.A O no hydrogen 2.877 N/A LEU 556.A N TYR 540.A O no hydrogen 2.854 N/A GLY 558.A N GLY 542.A O no hydrogen 2.510 N/A GLU 563.A N ALA 560.A O no hydrogen 3.158 N/A LYS 564.A NZ ALA 559.A O no hydrogen 3.461 N/A SER 565.A OG THR 578.A O no hydrogen 3.547 N/A THR 567.A N GLU 321.A OE1 no hydrogen 3.217 N/A THR 567.A OG1 GLU 321.A OE1 no hydrogen 3.123 N/A THR 567.A OG1 GLU 321.A OE2 no hydrogen 2.318 N/A THR 567.A OG1 TYR 628.A OH no hydrogen 2.865 N/A TYR 568.A N GLN 576.A O no hydrogen 2.866 N/A ASN 570.A N ARG 574.A O no hydrogen 2.921 N/A ASN 570.A ND2 VAL 229.A O no hydrogen 3.486 N/A ASN 570.A ND2 GLU 572.A OE2 no hydrogen 2.929 N/A THR 571.A N ALA 228.A O no hydrogen 2.925 N/A THR 571.A OG1 ILE 487.A O no hydrogen 3.360 N/A GLY 573.A N ASN 570.A O no hydrogen 2.697 N/A ARG 574.A NE GLU 572.A OE2 no hydrogen 2.943 N/A GLN 576.A N TYR 568.A O no hydrogen 2.884 N/A GLN 576.A NE2 ALA 575.A O no hydrogen 2.446 N/A THR 578.A N ALA 566.A O no hydrogen 2.914 N/A THR 578.A OG1 LYS 564.A O no hydrogen 2.819 N/A THR 578.A OG1 ALA 566.A O no hydrogen 3.412 N/A ALA 581.A N THR 562.A O no hydrogen 2.912 N/A ILE 594.A N GLU 590.A O no hydrogen 2.898 N/A ILE 595.A N ASP 591.A O no hydrogen 2.925 N/A ARG 596.A N TRP 592.A O no hydrogen 2.906 N/A ALA 597.A N LYS 593.A O no hydrogen 3.219 N/A LEU 598.A N ILE 594.A O no hydrogen 2.905 N/A SER 599.A N ILE 595.A O no hydrogen 2.902 N/A SER 599.A OG ARG 596.A O no hydrogen 2.694 N/A SER 599.A OG ILE 604.A O no hydrogen 3.146 N/A GLU 600.A N ARG 596.A O no hydrogen 2.884 N/A ILE 601.A N ALA 597.A O no hydrogen 2.942 N/A ALA 602.A N LEU 598.A O no hydrogen 2.900 N/A TYR 608.A OH ASP 328.A OD2 no hydrogen 3.172 N/A THR 610.A OG1 GLN 613.A OE1 no hydrogen 3.320 N/A GLN 613.A N THR 610.A OG1 no hydrogen 3.414 N/A VAL 614.A N THR 610.A O no hydrogen 2.941 N/A ARG 615.A N LEU 611.A O no hydrogen 2.897 N/A ARG 615.A NE THR 567.A OG1 no hydrogen 3.373 N/A ARG 615.A NH2 SER 565.A OG no hydrogen 3.413 N/A ASN 616.A N ASP 612.A O no hydrogen 2.893 N/A ARG 617.A N GLN 613.A O no hydrogen 2.910 N/A ARG 617.A NE ASP 328.A OD1 no hydrogen 3.066 N/A ARG 617.A NH2 ASP 328.A OD1 no hydrogen 2.505 N/A LEU 618.A N VAL 614.A O no hydrogen 2.918 N/A GLU 619.A N ARG 615.A O no hydrogen 2.863 N/A GLU 620.A N ASN 616.A O no hydrogen 2.910 N/A VAL 621.A N ARG 617.A O no hydrogen 2.930 N/A SER 622.A N LEU 618.A O no hydrogen 2.876 N/A SER 622.A OG ASP 499.A O no hydrogen 3.081 N/A ASN 624.A ND2 ASP 499.A OD2 no hydrogen 3.011 N/A LEU 625.A N SER 622.A O no hydrogen 3.390 N/A ARG 627.A N ASN 624.A O no hydrogen 2.988 N/A ARG 627.A NH1 GLU 632.A OE2 no hydrogen 3.468 N/A TYR 628.A OH THR 567.A OG1 no hydrogen 2.865 N/A ASP 629.A N ALA 575.A O no hydrogen 3.039 N/A GLN 638.A NE2 GLN 470.A OE1 no hydrogen 3.381 N/A GLN 639.A N GLN 639.A OE1 no hydrogen 2.540 N/A ALA 640.A N TYR 636.A O no hydrogen 3.000 N/A SER 641.A N PHE 637.A O no hydrogen 2.805 N/A SER 641.A OG PHE 637.A O no hydrogen 2.261 N/A GLU 642.A N GLN 638.A O no hydrogen 2.921 N/A LEU 643.A N GLN 639.A O no hydrogen 2.978 N/A ALA 644.A N ALA 640.A O no hydrogen 2.882 N/A LYS 645.A N SER 641.A O no hydrogen 2.839 N/A LEU 646.A N GLU 642.A O no hydrogen 2.969 N/A VAL 647.A N LEU 643.A O no hydrogen 2.909 N/A LEU 652.A N ASP 457.A OD2 no hydrogen 3.147 N/A LEU 656.A N ASP 419.A O no hydrogen 3.336 N/A LYS 664.A NZ ASP 665.A OD1 no hydrogen 2.825 N/A ASP 665.A N THR 662.A O no hydrogen 3.067 N/A PHE 666.A N ILE 663.A O no hydrogen 2.858 N/A ILE 672.A N ASP 670.A OD2 no hydrogen 2.946 N/A ARG 674.A N ASP 670.A O no hydrogen 2.879 N/A ARG 674.A NE ASP 546.A OD2 no hydrogen 2.563 N/A ALA 675.A N SER 671.A O no hydrogen 2.929 N/A SER 676.A N ILE 672.A O no hydrogen 2.922 N/A SER 676.A OG SER 673.A O no hydrogen 2.941 N/A GLN 677.A N ASP 267.A OD2 no hydrogen 2.433 N/A THR 678.A N ASP 267.A OD2 no hydrogen 3.318 N/A THR 678.A OG1 PHE 264.A O no hydrogen 2.898 N/A LYS 681.A N GLN 677.A O no hydrogen 3.207 N/A CYS 682.A N THR 678.A O no hydrogen 2.928 N/A CYS 682.A SG THR 678.A O no hydrogen 2.951 N/A VAL 683.A N MET 679.A O no hydrogen 2.878 N/A LYS 684.A N ALA 680.A O no hydrogen 2.923 N/A ALA 685.A N LYS 681.A O no hydrogen 2.954 N/A VAL 686.A N CYS 682.A O no hydrogen 2.887 N/A THR 687.A N VAL 683.A O no hydrogen 2.871 N/A THR 687.A OG1 VAL 683.A O no hydrogen 3.540 N/A THR 687.A OG1 LYS 684.A O no hydrogen 2.250 N/A GLU 688.A N LYS 684.A O no hydrogen 2.979 N/A