Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 6t0s_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): MET 1.A N ASN 33.A OD1 no hydrogen 3.498 N/A ARG 6.A N GLU 2.A O no hydrogen 3.162 N/A THR 7.A N PHE 4.A O no hydrogen 3.326 N/A THR 7.A OG1 ASN 3.A O no hydrogen 2.814 N/A ASN 8.A N PHE 4.A O no hydrogen 3.048 N/A LEU 14.A N ASN 10.A O no hydrogen 3.105 N/A GLU 15.A N PRO 11.A O no hydrogen 2.908 N/A ARG 16.A N MET 12.A O no hydrogen 2.929 N/A ALA 17.A N ILE 13.A O no hydrogen 2.929 N/A GLU 18.A N LEU 14.A O no hydrogen 2.881 N/A LYS 19.A N GLU 15.A O no hydrogen 2.939 N/A THR 20.A N ARG 16.A O no hydrogen 2.950 N/A THR 20.A OG1 ARG 16.A O no hydrogen 2.940 N/A THR 20.A OG1 ALA 17.A O no hydrogen 2.927 N/A MET 21.A N ALA 17.A O no hydrogen 2.906 N/A LYS 22.A N GLU 18.A O no hydrogen 2.911 N/A TYR 24.A N MET 21.A O no hydrogen 3.192 N/A GLU 26.A N MET 21.A O no hydrogen 3.258 N/A LYS 34.A NZ GLU 26.A OE1 no hydrogen 3.124 N/A LYS 34.A NZ GLU 26.A OE2 no hydrogen 2.966 N/A ALA 36.A N GLY 32.A O no hydrogen 2.911 N/A ALA 37.A N ASN 33.A O no hydrogen 2.899 N/A ILE 38.A N LYS 34.A O no hydrogen 2.925 N/A SER 39.A N PHE 35.A O no hydrogen 2.925 N/A SER 39.A OG PHE 35.A O no hydrogen 2.639 N/A THR 40.A N ALA 36.A O no hydrogen 2.895 N/A THR 40.A OG1 ALA 36.A O no hydrogen 2.481 N/A HIS 41.A N ALA 37.A O no hydrogen 2.927 N/A MET 42.A N ILE 38.A O no hydrogen 2.917 N/A GLU 43.A N SER 39.A O no hydrogen 2.900 N/A VAL 44.A N THR 40.A O no hydrogen 2.913 N/A CYS 45.A N HIS 41.A O no hydrogen 2.971 N/A CYS 45.A SG HIS 41.A O no hydrogen 3.347 N/A PHE 46.A N MET 42.A O no hydrogen 2.901 N/A MET 47.A N GLU 43.A O no hydrogen 2.887 N/A TYR 48.A N VAL 44.A O no hydrogen 2.885 N/A TYR 48.A OH HIS 143.A ND1 no hydrogen 3.009 N/A SER 49.A N CYS 45.A O no hydrogen 2.945 N/A ASP 50.A N PHE 46.A O no hydrogen 2.904 N/A PHE 51.A N ASP 50.A OD1 no hydrogen 2.589 N/A HIS 52.A ND1 ASP 50.A O no hydrogen 2.723 N/A HIS 52.A NE2 ASP 161.A OD1 no hydrogen 2.944 N/A PHE 53.A N ILE 61.A O no hydrogen 2.898 N/A ILE 54.A N LYS 70.A O no hydrogen 3.004 N/A GLY 58.A N ASP 55.A OD1 no hydrogen 2.702 N/A ILE 61.A N PHE 53.A O no hydrogen 2.782 N/A ARG 72.A N HIS 52.A O no hydrogen 2.828 N/A ARG 72.A NE ASP 108.A OD1 no hydrogen 2.691 N/A ARG 72.A NH2 ILE 159.A O no hydrogen 3.303 N/A GLU 74.A N TYR 107.A O no hydrogen 2.882 N/A ILE 76.A N ASP 105.A O no hydrogen 2.845 N/A GLU 77.A N ASP 105.A O no hydrogen 2.986 N/A ARG 81.A N GLU 23.A OE2 no hydrogen 2.627 N/A ASN 82.A N GLU 80.A OE1 no hydrogen 2.750 N/A ASN 82.A ND2 GLU 80.A OE1 no hydrogen 2.708 N/A ALA 84.A N GLU 80.A O no hydrogen 2.896 N/A TRP 85.A N ARG 81.A O no hydrogen 2.908 N/A THR 86.A N ASN 82.A O no hydrogen 2.903 N/A THR 86.A OG1 ASN 82.A O no hydrogen 2.642 N/A ILE 87.A N ILE 83.A O no hydrogen 2.963 N/A VAL 88.A N ALA 84.A O no hydrogen 2.914 N/A ASN 89.A N TRP 85.A O no hydrogen 2.868 N/A SER 90.A N THR 86.A O no hydrogen 2.906 N/A SER 90.A OG THR 86.A O no hydrogen 2.824 N/A ILE 91.A N ILE 87.A O no hydrogen 2.956 N/A CYS 92.A N VAL 88.A O no hydrogen 2.878 N/A CYS 92.A SG VAL 88.A O no hydrogen 3.280 N/A CYS 92.A SG SER 98.A O no hydrogen 3.899 N/A ASN 93.A N ASN 89.A O no hydrogen 3.131 N/A MET 94.A N ILE 91.A O no hydrogen 3.085 N/A THR 95.A N ILE 91.A O no hydrogen 3.264 N/A THR 95.A OG1 ASN 97.A OD1 no hydrogen 2.564 N/A ASN 97.A N THR 95.A OG1 no hydrogen 3.220 N/A LYS 99.A NZ ASN 89.A OD1 no hydrogen 3.440 N/A ARG 101.A N GLU 138.A OE1 no hydrogen 2.575 N/A ASP 105.A N ILE 115.A O no hydrogen 3.004 N/A LEU 106.A N ILE 115.A O no hydrogen 2.915 N/A TYR 107.A N GLU 74.A O no hydrogen 2.920 N/A ASP 108.A N LYS 113.A O no hydrogen 2.869 N/A TYR 109.A N ARG 72.A O no hydrogen 3.252 N/A LYS 110.A NZ GLY 58.A O no hydrogen 2.459 N/A THR 111.A N ASP 108.A OD2 no hydrogen 2.496 N/A THR 111.A OG1 ASP 108.A OD2 no hydrogen 2.508 N/A ASN 112.A ND2 TYR 107.A OH no hydrogen 3.300 N/A LYS 113.A N ASP 108.A O no hydrogen 2.985 N/A LYS 113.A NZ THR 111.A OG1 no hydrogen 3.425 N/A ILE 115.A N LEU 106.A O no hydrogen 2.863 N/A GLU 116.A N TYR 141.A O no hydrogen 2.776 N/A ILE 117.A N ASP 105.A OD2 no hydrogen 2.618 N/A THR 120.A N PHE 145.A O no hydrogen 2.941 N/A ARG 121.A NE PHE 188.A O no hydrogen 2.978 N/A ARG 121.A NH2 PHE 188.A O no hydrogen 2.443 N/A ARG 122.A N THR 120.A OG1 no hydrogen 3.092 N/A TYR 127.A N LYS 123.A O no hydrogen 3.455 N/A TYR 128.A N VAL 124.A O no hydrogen 2.913 N/A TYR 129.A N GLU 125.A O no hydrogen 2.922 N/A GLU 130.A N ASP 126.A O no hydrogen 2.922 N/A ALA 131.A N TYR 127.A O no hydrogen 2.888 N/A ALA 132.A N TYR 128.A O no hydrogen 2.897 N/A SER 133.A N TYR 129.A O no hydrogen 2.893 N/A SER 133.A OG TYR 129.A O no hydrogen 2.778 N/A LYS 134.A N GLU 130.A O no hydrogen 2.933 N/A LEU 135.A N ALA 131.A O no hydrogen 2.809 N/A ASN 139.A N ASN 139.A OD1 no hydrogen 2.444 N/A TYR 141.A N PHE 114.A O no hydrogen 3.043 N/A ILE 142.A N THR 154.A OG1 no hydrogen 2.917 N/A HIS 143.A N GLU 116.A O no hydrogen 3.006 N/A HIS 143.A ND1 TYR 48.A OH no hydrogen 3.009 N/A HIS 143.A NE2 GLU 151.A OE1 no hydrogen 2.409 N/A ILE 144.A N MET 152.A O no hydrogen 2.888 N/A PHE 145.A N GLY 118.A O no hydrogen 2.996 N/A SER 146.A OG GLU 150.A O no hydrogen 3.334 N/A ASP 148.A N SER 146.A OG no hydrogen 3.143 N/A MET 152.A N ILE 144.A O no hydrogen 2.929 N/A THR 154.A OG1 ILE 142.A O no hydrogen 3.181 N/A GLU 157.A N THR 154.A O no hydrogen 3.500 N/A SER 164.A OG ASP 161.A OD1 no hydrogen 3.219 N/A SER 164.A OG ASP 161.A OD2 no hydrogen 3.441 N/A ARG 165.A NE LEU 160.A O no hydrogen 3.450 N/A ARG 165.A NH1 GLU 151.A OE2 no hydrogen 2.840 N/A ALA 166.A N GLU 162.A O no hydrogen 2.914 N/A ARG 167.A N GLU 163.A O no hydrogen 2.910 N/A ILE 168.A N SER 164.A O no hydrogen 2.902 N/A LYS 169.A N ARG 165.A O no hydrogen 2.931 N/A LYS 169.A NZ GLU 151.A OE2 no hydrogen 3.027 N/A THR 170.A N ALA 166.A O no hydrogen 2.896 N/A THR 170.A OG1 ALA 166.A O no hydrogen 2.530 N/A ARG 171.A N ARG 167.A O no hydrogen 2.897 N/A ARG 171.A NH2 ASN 8.A O no hydrogen 2.919 N/A LEU 172.A N ILE 168.A O no hydrogen 2.918 N/A PHE 173.A N LYS 169.A O no hydrogen 2.917 N/A VAL 174.A N THR 170.A O no hydrogen 2.903 N/A LEU 175.A N ARG 171.A O no hydrogen 2.913 N/A ARG 176.A N LEU 172.A O no hydrogen 2.878 N/A GLN 177.A N PHE 173.A O no hydrogen 2.925 N/A GLU 178.A N VAL 174.A O no hydrogen 2.899 N/A LEU 179.A N LEU 175.A O no hydrogen 2.891 N/A ALA 180.A N ARG 176.A O no hydrogen 2.899 N/A THR 181.A N GLN 177.A O no hydrogen 2.910 N/A THR 181.A OG1 GLN 177.A O no hydrogen 2.926 N/A THR 181.A OG1 GLU 178.A O no hydrogen 3.157 N/A ALA 182.A N GLU 178.A O no hydrogen 3.146 N/A GLY 183.A N ALA 180.A O no hydrogen 3.191 N/A LEU 184.A N LEU 179.A O no hydrogen 2.909 N/A SER 187.A OG LEU 184.A O no hydrogen 2.832 N/A PHE 188.A N LEU 184.A O no hydrogen 3.133 N/A ARG 189.A N TRP 185.A O no hydrogen 2.542 N/A GLN 190.A N ASP 186.A O no hydrogen 3.046 N/A SER 191.A N PHE 188.A O no hydrogen 3.304 N/A SER 191.A OG PHE 188.A O no hydrogen 2.573 N/A GLN 206.A N PRO 202.A O no hydrogen 2.800 N/A GLN 206.A NE2 GLN 206.A O no hydrogen 3.478 N/A GLN 206.A NE2 ASN 210.A OD1 no hydrogen 3.512 N/A ARG 207.A N PRO 203.A O no hydrogen 2.924 N/A LEU 208.A N THR 204.A O no hydrogen 2.951 N/A ALA 209.A N PHE 205.A O no hydrogen 2.827 N/A ASN 210.A N GLN 206.A O no hydrogen 2.946 N/A GLN 211.A N LEU 208.A O no hydrogen 3.269 N/A SER 212.A OG LEU 208.A O no hydrogen 2.915 N/A PHE 217.A N PRO 214.A O no hydrogen 3.195 N/A LYS 218.A N GLN 222.A OE1 no hydrogen 3.300 N/A LYS 218.A NZ GLN 222.A OE1 no hydrogen 3.522 N/A TYR 220.A N ASN 210.A OD1 no hydrogen 3.117 N/A PHE 223.A N ASP 219.A O no hydrogen 3.248 N/A LYS 224.A N TYR 220.A O no hydrogen 2.904 N/A ALA 225.A N HIS 221.A O no hydrogen 2.888 N/A TYR 226.A N GLN 222.A O no hydrogen 2.929 N/A VAL 227.A N PHE 223.A O no hydrogen 2.949 N/A SER 228.A N LYS 224.A O no hydrogen 2.939 N/A SER 228.A OG LYS 224.A O no hydrogen 2.894 N/A SER 229.A N TYR 226.A O no hydrogen 3.312 N/A SER 229.A OG ALA 225.A O no hydrogen 2.991 N/A ASN 233.A N ASN 235.A OD1 no hydrogen 3.354 N/A ALA 238.A N GLY 234.A O no hydrogen 3.302 N/A LYS 239.A N ASN 235.A O no hydrogen 2.943 N/A LEU 240.A N ILE 236.A O no hydrogen 2.852 N/A GLY 241.A N GLU 237.A O no hydrogen 2.942 N/A MET 243.A N LYS 239.A O no hydrogen 3.208 N/A LYS 246.A N SER 244.A OG no hydrogen 3.413 N/A GLU 252.A N THR 669.A O no hydrogen 2.960 N/A PHE 254.A N PRO 667.A O no hydrogen 2.949 N/A ARG 257.A N ASP 255.A OD1 no hydrogen 3.474 N/A ARG 257.A NE ASP 255.A OD1 no hydrogen 3.100 N/A ARG 257.A NH2 ASP 255.A OD2 no hydrogen 3.149 N/A THR 258.A N ASP 255.A O no hydrogen 2.881 N/A THR 258.A OG1 ASP 255.A O no hydrogen 3.478 N/A ILE 259.A N ASP 255.A O no hydrogen 3.230 N/A ARG 260.A NH2 GLU 261.A O no hydrogen 3.435 N/A ARG 260.A NH2 GLU 680.A OE2 no hydrogen 2.723 N/A LEU 262.A N ASN 697.A OD1 no hydrogen 2.896 N/A GLU 263.A N GLU 680.A OE2 no hydrogen 2.993 N/A CYS 270.A SG LYS 391.A O no hydrogen 3.620 N/A THR 271.A OG1 GLU 527.A OE1 no hydrogen 3.000 N/A GLN 272.A N LYS 525.A O no hydrogen 3.218 N/A GLN 272.A NE2 GLU 399.A OE2 no hydrogen 3.373 N/A ARG 273.A NH2 ASP 686.A OD1 no hydrogen 3.376 N/A SER 274.A OG PHE 276.A O no hydrogen 2.544 N/A MET 282.A N PHE 514.A O no hydrogen 3.279 N/A LEU 284.A N LEU 489.A O no hydrogen 2.902 N/A SER 285.A OG ASN 488.A OD1 no hydrogen 2.581 N/A VAL 286.A N THR 487.A O no hydrogen 2.921 N/A ASN 288.A N ARG 485.A O.A no hydrogen 3.044 N/A ASN 288.A N ARG 485.A O.B no hydrogen 3.057 N/A HIS 291.A NE2 ASP 300.A OD1 no hydrogen 2.989 N/A GLY 295.A N ASP 300.A OD1 no hydrogen 3.437 N/A ILE 296.A N GLY 293.A O no hydrogen 3.293 N/A ASP 300.A N ILE 296.A O no hydrogen 3.162 N/A ALA 301.A N PRO 297.A O no hydrogen 2.904 N/A LYS 302.A N MET 298.A O no hydrogen 2.940 N/A LYS 302.A NZ ILE 339.A O no hydrogen 2.897 N/A ALA 303.A N LYS 299.A O no hydrogen 2.939 N/A CYS 304.A N ASP 300.A O no hydrogen 2.908 N/A CYS 304.A SG LEU 284.A O no hydrogen 3.328 N/A CYS 304.A SG ASP 300.A O no hydrogen 3.250 N/A CYS 304.A SG THR 487.A O no hydrogen 3.388 N/A LEU 305.A N ALA 301.A O no hydrogen 2.893 N/A ASP 306.A N LYS 302.A O no hydrogen 2.957 N/A THR 307.A N CYS 304.A O no hydrogen 3.165 N/A THR 307.A OG1 CYS 304.A O no hydrogen 2.346 N/A PHE 308.A N LEU 305.A O no hydrogen 3.452 N/A LYS 312.A NZ GLU 533.A OE2 no hydrogen 2.557 N/A LYS 312.A NZ ASP 536.A OD1 no hydrogen 2.989 N/A LYS 312.A NZ ASP 536.A OD2 no hydrogen 3.326 N/A ILE 317.A N VAL 531.A O no hydrogen 2.909 N/A LYS 318.A N VAL 531.A O no hydrogen 2.934 N/A LYS 318.A NZ LYS 319.A O no hydrogen 3.110 N/A LYS 318.A NZ TRP 526.A O no hydrogen 2.469 N/A LYS 318.A NZ TYR 529.A O no hydrogen 3.426 N/A HIS 320.A N ASN 325.A OD1 no hydrogen 2.459 N/A ASN 325.A ND2 HIS 320.A O no hydrogen 3.066 N/A TYR 328.A OH HIS 320.A ND1 no hydrogen 3.303 N/A LEU 329.A N ASN 325.A O no hydrogen 2.980 N/A MET 330.A N THR 326.A O no hydrogen 2.902 N/A ILE 331.A N ASN 327.A O no hydrogen 2.861 N/A TRP 332.A N TYR 328.A O no hydrogen 2.987 N/A GLU 333.A N LEU 329.A O no hydrogen 2.974 N/A GLN 334.A N MET 330.A O no hydrogen 2.886 N/A GLN 334.A NE2 LYS 350.A O no hydrogen 2.920 N/A LEU 335.A N ILE 331.A O no hydrogen 2.902 N/A LEU 336.A N TRP 332.A O no hydrogen 2.943 N/A GLU 337.A N GLU 333.A O no hydrogen 2.941 N/A SER 338.A N GLN 334.A O no hydrogen 2.898 N/A SER 338.A OG GLN 334.A O no hydrogen 2.883 N/A ILE 339.A N LEU 335.A O no hydrogen 2.918 N/A LYS 340.A N LEU 336.A O no hydrogen 2.980 N/A LEU 349.A N TYR 469.A O no hydrogen 2.942 N/A LYS 351.A NZ GLU 467.A O no hydrogen 3.169 N/A THR 352.A N LYS 350.A O no hydrogen 2.818 N/A THR 352.A OG1 GLN 334.A OE1 no hydrogen 2.869 N/A HIS 354.A NE2 GLN 334.A OE1 no hydrogen 2.746 N/A LYS 356.A N THR 352.A O no hydrogen 2.754 N/A TRP 357.A N ASN 353.A O no hydrogen 2.918 N/A GLY 358.A N HIS 354.A O no hydrogen 2.896 N/A LEU 359.A N LEU 355.A O no hydrogen 2.926 N/A GLY 360.A N TRP 357.A O no hydrogen 3.290 N/A GLU 361.A N LYS 356.A O no hydrogen 2.935 N/A GLU 371.A N GLU 371.A OE1 no hydrogen 2.848 N/A ASP 372.A N ASP 369.A O no hydrogen 3.240 N/A CYS 373.A N PHE 370.A O no hydrogen 3.104 N/A CYS 373.A SG ASP 369.A O no hydrogen 3.311 N/A ARG 390.A N ILE 684.A O no hydrogen 2.947 N/A ARG 390.A NE GLU 388.A OE2 no hydrogen 2.655 N/A ARG 390.A NH1 GLU 388.A OE2 no hydrogen 3.113 N/A ARG 390.A NH1 GLU 527.A OE1 no hydrogen 2.756 N/A ARG 390.A NH1 GLU 527.A OE2 no hydrogen 3.552 N/A ARG 390.A NH2 PHE 269.A O no hydrogen 2.470 N/A ARG 390.A NH2 THR 271.A OG1 no hydrogen 2.811 N/A ARG 390.A NH2 GLU 527.A OE1 no hydrogen 3.558 N/A LYS 391.A N LYS 268.A O no hydrogen 2.465 N/A LYS 391.A NZ GLU 266.A OE2 no hydrogen 3.313 N/A TRP 395.A NE1 CYS 270.A O no hydrogen 2.689 N/A GLN 397.A NE2 GLN 397.A O no hydrogen 3.193 N/A GLN 397.A NE2 ASN 401.A OD1 no hydrogen 2.554 N/A SER 398.A N SER 394.A O no hydrogen 2.985 N/A SER 398.A OG SER 394.A O no hydrogen 2.805 N/A GLU 399.A N TRP 395.A O no hydrogen 2.831 N/A PHE 400.A N ILE 396.A O no hydrogen 2.965 N/A ASN 401.A N GLN 397.A O no hydrogen 2.925 N/A LYS 402.A N SER 398.A O no hydrogen 2.939 N/A LYS 402.A NZ GLU 405.A OE2 no hydrogen 3.533 N/A ALA 403.A N GLU 399.A O no hydrogen 2.879 N/A SER 404.A OG PHE 400.A O no hydrogen 3.102 N/A THR 407.A N GLN 441.A O no hydrogen 2.618 N/A THR 407.A OG1 GLN 441.A O no hydrogen 2.423 N/A ASN 410.A N ARG 479.A O no hydrogen 2.516 N/A TRP 411.A N SER 440.A O no hydrogen 3.022 N/A GLU 416.A N GLU 416.A OE1 no hydrogen 2.788 N/A VAL 421.A N GLU 425.A OE1 no hydrogen 2.735 N/A ALA 422.A N GLU 425.A OE1 no hydrogen 2.891 N/A GLU 425.A N ALA 422.A O no hydrogen 3.132 N/A HIS 426.A N ALA 422.A O no hydrogen 3.327 N/A ILE 427.A N PRO 423.A O no hydrogen 2.979 N/A ALA 428.A N ILE 424.A O no hydrogen 2.872 N/A SER 429.A N GLU 425.A O no hydrogen 2.866 N/A SER 429.A OG ASP 420.A OD2 no hydrogen 2.489 N/A SER 429.A OG GLU 425.A O no hydrogen 2.868 N/A ARG 430.A N HIS 426.A O no hydrogen 2.969 N/A ARG 431.A N ILE 427.A O no hydrogen 2.989 N/A ARG 431.A NE THR 597.A OG1 no hydrogen 2.709 N/A ARG 431.A NH1 GLU 582.A OE2 no hydrogen 3.034 N/A ARG 431.A NH2 ASP 595.A OD1 no hydrogen 2.989 N/A ARG 431.A NH2 THR 597.A OG1 no hydrogen 3.140 N/A ARG 432.A N ALA 428.A O no hydrogen 2.822 N/A ARG 432.A NH2 SER 429.A OG no hydrogen 3.136 N/A ASN 433.A N SER 429.A O no hydrogen 2.888 N/A PHE 434.A N ARG 430.A O no hydrogen 2.998 N/A PHE 435.A N ARG 431.A O no hydrogen 2.918 N/A THR 436.A N ARG 432.A O no hydrogen 2.860 N/A THR 436.A OG1 ARG 432.A O no hydrogen 2.602 N/A ALA 437.A N ASN 433.A O no hydrogen 2.913 N/A GLU 438.A N PHE 434.A O no hydrogen 2.993 N/A SER 440.A N THR 436.A O no hydrogen 3.207 N/A SER 440.A OG ILE 412.A O no hydrogen 2.998 N/A GLN 441.A NE2 ASN 410.A OD1 no hydrogen 3.255 N/A CYS 442.A SG ALA 403.A O no hydrogen 3.267 N/A CYS 442.A SG GLU 405.A O no hydrogen 3.823 N/A ARG 443.A N GLU 405.A O no hydrogen 3.107 N/A SER 445.A OG VAL 439.A O no hydrogen 2.756 N/A TYR 447.A N ARG 443.A O no hydrogen 2.961 N/A ILE 448.A N ALA 444.A O no hydrogen 2.874 N/A MET 449.A N SER 445.A O no hydrogen 2.974 N/A LYS 450.A N GLU 446.A O no hydrogen 2.890 N/A LYS 450.A NZ LEU 277.A O no hydrogen 2.840 N/A ALA 451.A N TYR 447.A O no hydrogen 2.927 N/A VAL 452.A N ILE 448.A O no hydrogen 2.900 N/A TYR 453.A N MET 449.A O no hydrogen 2.939 N/A ILE 454.A N LYS 450.A O no hydrogen 2.956 N/A ASN 455.A N ALA 451.A O no hydrogen 2.901 N/A ASN 455.A ND2 ALA 451.A O no hydrogen 2.400 N/A THR 456.A N VAL 452.A O no hydrogen 2.924 N/A THR 456.A OG1 VAL 452.A O no hydrogen 2.705 N/A ALA 457.A N TYR 453.A O no hydrogen 2.987 N/A LEU 458.A N ILE 454.A O no hydrogen 2.867 N/A LEU 459.A N ASN 455.A O no hydrogen 2.907 N/A ASN 460.A N THR 456.A O no hydrogen 2.968 N/A SER 461.A N ALA 457.A O no hydrogen 2.933 N/A SER 461.A OG ALA 457.A O no hydrogen 2.944 N/A SER 462.A N LEU 458.A O no hydrogen 2.876 N/A SER 462.A OG LEU 458.A O no hydrogen 2.340 N/A CYS 463.A N LEU 459.A O no hydrogen 2.949 N/A CYS 463.A SG LEU 459.A O no hydrogen 3.272 N/A THR 464.A N ASN 460.A O no hydrogen 2.966 N/A THR 464.A OG1 ASN 460.A O no hydrogen 2.734 N/A ALA 465.A N SER 461.A O no hydrogen 3.099 N/A VAL 471.A N LEU 347.A O no hydrogen 2.995 N/A ILE 472.A N ILE 493.A O no hydrogen 2.855 N/A ILE 474.A N GLY 491.A O no hydrogen 2.810 N/A THR 476.A N ASN 488.A O no hydrogen 2.937 N/A THR 476.A OG1 TYR 490.A OH no hydrogen 3.368 N/A CYS 478.A N ARG 486.A O no hydrogen 2.904 N/A CYS 478.A SG ARG 486.A O no hydrogen 3.978 N/A ARG 479.A N ASN 410.A O no hydrogen 3.229 N/A ASP 480.A N GLN 484.A O no hydrogen 3.191 N/A SER 482.A OG ASP 480.A OD2 no hydrogen 2.947 N/A SER 482.A OG GLN 484.A OE1 no hydrogen 3.467 N/A GLY 483.A N ASP 480.A O no hydrogen 3.227 N/A ARG 486.A N CYS 478.A O no hydrogen 2.896 N/A ARG 486.A NE ASP 480.A OD1 no hydrogen 3.380 N/A ARG 486.A NH2 ASP 480.A OD2 no hydrogen 3.569 N/A THR 487.A N VAL 286.A O no hydrogen 2.952 N/A ASN 488.A N THR 476.A O no hydrogen 2.886 N/A LEU 489.A N LEU 284.A O no hydrogen 2.878 N/A TYR 490.A N ILE 474.A O no hydrogen 2.911 N/A TYR 490.A OH GLU 446.A OE2 no hydrogen 2.635 N/A TYR 490.A OH THR 476.A OG1 no hydrogen 3.368 N/A PHE 492.A N LEU 512.A O no hydrogen 2.882 N/A ILE 493.A N ILE 472.A O no hydrogen 2.858 N/A ILE 494.A N ILE 510.A O no hydrogen 2.882 N/A LYS 495.A N GLN 470.A O no hydrogen 2.810 N/A LYS 495.A NZ SER 461.A O no hydrogen 3.542 N/A LYS 495.A NZ ALA 465.A O no hydrogen 2.493 N/A LYS 495.A NZ GLU 468.A O no hydrogen 3.379 N/A LYS 495.A NZ GLY 496.A O no hydrogen 3.113 N/A LYS 495.A NZ SER 498.A OG no hydrogen 2.792 N/A GLY 496.A N ASN 508.A O no hydrogen 2.889 N/A SER 498.A OG SER 462.A O no hydrogen 3.215 N/A HIS 499.A NE2 GLU 467.A OE2 no hydrogen 2.554 N/A ARG 501.A N ASP 505.A OD2 no hydrogen 3.309 N/A ASN 502.A N ASP 505.A OD2 no hydrogen 3.196 N/A VAL 507.A N THR 559.A O no hydrogen 2.841 N/A ASN 508.A ND2 LEU 359.A O no hydrogen 3.400 N/A PHE 509.A N ASN 557.A O no hydrogen 2.892 N/A ILE 510.A N ILE 494.A O no hydrogen 2.924 N/A SER 511.A N ARG 555.A O no hydrogen 2.906 N/A SER 511.A OG GLU 513.A OE1 no hydrogen 3.256 N/A LEU 512.A N PHE 492.A O no hydrogen 2.913 N/A GLU 513.A N TYR 553.A O no hydrogen 2.922 N/A PHE 514.A N TYR 490.A O no hydrogen 3.008 N/A SER 515.A N TYR 551.A O no hydrogen 2.913 N/A SER 515.A OG ASP 280.A O no hydrogen 2.474 N/A THR 517.A N SER 515.A OG no hydrogen 3.202 N/A THR 517.A OG1 ASP 280.A OD1 no hydrogen 3.099 N/A ARG 520.A NE ASP 518.A OD1 no hydrogen 3.130 N/A ARG 520.A NE ASP 518.A OD2 no hydrogen 3.457 N/A ARG 520.A NH2 ASP 518.A OD1 no hydrogen 3.435 N/A LYS 525.A N GLU 522.A O no hydrogen 2.960 N/A LYS 525.A NZ ASP 280.A OD2 no hydrogen 3.147 N/A LYS 525.A NZ GLU 399.A OE2 no hydrogen 2.816 N/A TRP 526.A N ILE 523.A O no hydrogen 2.950 N/A CYS 530.A N VAL 554.A O no hydrogen 2.678 N/A CYS 530.A SG LYS 318.A O no hydrogen 3.883 N/A CYS 530.A SG ASN 325.A OD1 no hydrogen 3.420 N/A VAL 531.A N LYS 318.A O no hydrogen 2.886 N/A LEU 532.A N LEU 552.A O no hydrogen 2.939 N/A GLU 533.A N THR 315.A O no hydrogen 3.037 N/A ILE 534.A N VAL 550.A O no hydrogen 2.942 N/A GLY 535.A N VAL 550.A O no hydrogen 3.007 N/A ASP 536.A N GLY 310.A O no hydrogen 3.354 N/A MET 537.A N LYS 548.A O no hydrogen 2.903 N/A ILE 539.A N MET 537.A O no hydrogen 3.015 N/A ILE 539.A N ILE 546.A O no hydrogen 2.893 N/A THR 541.A N SER 544.A O no hydrogen 3.008 N/A THR 541.A OG1 SER 544.A O no hydrogen 3.244 N/A ILE 543.A N THR 541.A OG1 no hydrogen 3.298 N/A SER 544.A N THR 541.A OG1 no hydrogen 3.267 N/A ILE 546.A N ILE 539.A O no hydrogen 2.903 N/A LYS 548.A N MET 537.A O no hydrogen 2.916 N/A VAL 550.A N GLY 535.A O no hydrogen 2.841 N/A TYR 551.A N SER 515.A O no hydrogen 2.910 N/A LEU 552.A N LEU 532.A O no hydrogen 3.002 N/A TYR 553.A N GLU 513.A O no hydrogen 2.879 N/A TYR 553.A OH THR 517.A O no hydrogen 2.707 N/A VAL 554.A N CYS 530.A O no hydrogen 2.740 N/A ARG 555.A N SER 511.A O no hydrogen 2.938 N/A ARG 555.A NE THR 556.A O no hydrogen 3.141 N/A ARG 555.A NH2 THR 556.A O no hydrogen 3.261 N/A THR 556.A OG1 GLY 358.A O no hydrogen 2.925 N/A ASN 557.A N PHE 509.A O no hydrogen 2.890 N/A ASN 557.A ND2 SER 274.A O no hydrogen 3.435 N/A GLY 558.A N ASN 557.A OD1 no hydrogen 2.822 N/A THR 559.A N VAL 507.A O no hydrogen 2.968 N/A THR 559.A OG1 SER 560.A O no hydrogen 3.410 N/A MET 564.A N SER 560.A O no hydrogen 3.019 N/A LYS 565.A N LYS 561.A O no hydrogen 2.912 N/A LYS 565.A NZ GLU 569.A OE1 no hydrogen 3.014 N/A LYS 565.A NZ GLU 569.A OE2 no hydrogen 3.465 N/A TRP 566.A N ILE 562.A O no hydrogen 2.945 N/A GLY 567.A N LYS 563.A O no hydrogen 2.887 N/A MET 568.A N MET 564.A O no hydrogen 2.958 N/A CYS 573.A N MET 570.A O no hydrogen 2.956 N/A CYS 573.A SG SER 633.A O no hydrogen 3.339 N/A LEU 574.A N ARG 571.A O no hydrogen 2.952 N/A LEU 575.A N ARG 572.A O no hydrogen 2.951 N/A GLN 576.A N ARG 572.A O no hydrogen 3.236 N/A SER 577.A N CYS 573.A O no hydrogen 3.150 N/A SER 577.A OG CYS 626.A O no hydrogen 2.819 N/A LEU 578.A N LEU 574.A O no hydrogen 3.389 N/A GLN 579.A N LEU 575.A O no hydrogen 2.762 N/A VAL 581.A N SER 577.A O no hydrogen 3.003 N/A GLU 582.A N LEU 578.A O no hydrogen 2.705 N/A SER 583.A N GLN 579.A O no hydrogen 3.275 N/A SER 583.A OG GLN 579.A O no hydrogen 3.457 N/A SER 583.A OG GLN 580.A O no hydrogen 2.310 N/A MET 584.A N GLN 580.A O no hydrogen 3.127 N/A ILE 585.A N VAL 581.A O no hydrogen 2.920 N/A GLU 586.A N GLU 582.A O no hydrogen 2.483 N/A ALA 587.A N SER 583.A O no hydrogen 2.697 N/A ALA 587.A N MET 584.A O no hydrogen 3.017 N/A GLU 588.A N MET 584.A O no hydrogen 3.260 N/A SER 589.A N ILE 585.A O no hydrogen 3.356 N/A SER 589.A OG ILE 585.A O no hydrogen 2.690 N/A SER 589.A OG LYS 594.A O no hydrogen 3.330 N/A ALA 590.A N GLU 586.A O no hydrogen 2.955 N/A ALA 590.A N ALA 587.A O no hydrogen 2.986 N/A VAL 591.A N GLU 588.A O no hydrogen 2.943 N/A LYS 592.A N GLU 588.A O no hydrogen 2.763 N/A LYS 592.A NZ GLU 588.A OE1 no hydrogen 3.518 N/A MET 596.A N SER 589.A OG no hydrogen 3.172 N/A THR 597.A OG1 ASP 595.A OD1 no hydrogen 3.173 N/A PHE 601.A N THR 597.A O no hydrogen 2.957 N/A ARG 602.A N GLU 598.A O no hydrogen 2.944 N/A ASN 606.A ND2 LYS 619.A O no hydrogen 3.031 N/A TRP 608.A N GLY 620.A O no hydrogen 2.974 N/A ILE 610.A N GLU 618.A O no hydrogen 2.940 N/A GLY 611.A N GLU 618.A O no hydrogen 3.158 N/A SER 613.A N GLY 616.A O no hydrogen 2.564 N/A SER 613.A OG GLY 616.A O no hydrogen 2.786 N/A SER 613.A OG GLU 618.A OE2 no hydrogen 2.990 N/A GLY 616.A N SER 613.A OG no hydrogen 2.737 N/A GLU 618.A N GLY 611.A O no hydrogen 2.719 N/A GLY 620.A N TRP 608.A O no hydrogen 2.843 N/A LYS 624.A NZ SER 404.A O no hydrogen 3.335 N/A VAL 625.A N THR 621.A O no hydrogen 2.994 N/A CYS 626.A N ILE 622.A O no hydrogen 2.932 N/A CYS 626.A SG GLY 623.A O no hydrogen 3.237 N/A ARG 627.A N GLY 623.A O no hydrogen 2.971 N/A ARG 627.A NE SER 404.A O no hydrogen 3.149 N/A VAL 628.A N LYS 624.A O no hydrogen 2.888 N/A LEU 629.A N VAL 625.A O no hydrogen 2.934 N/A LEU 630.A N CYS 626.A O no hydrogen 2.932 N/A ALA 631.A N ARG 627.A O no hydrogen 2.929 N/A LYS 632.A N VAL 628.A O no hydrogen 2.895 N/A SER 633.A N LEU 629.A O no hydrogen 2.980 N/A SER 633.A OG GLN 576.A OE1 no hydrogen 2.671 N/A SER 633.A OG LEU 629.A O no hydrogen 3.246 N/A VAL 634.A N LEU 630.A O no hydrogen 2.901 N/A PHE 635.A N ALA 631.A O no hydrogen 2.921 N/A ASN 636.A N LYS 632.A O no hydrogen 2.914 N/A SER 637.A N SER 633.A O no hydrogen 2.968 N/A SER 637.A N VAL 634.A O no hydrogen 3.150 N/A ILE 638.A N VAL 634.A O no hydrogen 2.863 N/A TYR 639.A N PHE 635.A O no hydrogen 3.029 N/A TYR 639.A OH GLN 272.A OE1 no hydrogen 2.320 N/A SER 641.A OG ASP 686.A OD2 no hydrogen 2.663 N/A GLN 643.A NE2 ASN 685.A OD1 no hydrogen 2.638 N/A LEU 644.A N SER 641.A O no hydrogen 3.239 N/A GLU 645.A N SER 641.A O no hydrogen 3.333 N/A GLY 646.A N ALA 642.A O no hydrogen 2.969 N/A PHE 647.A N GLN 643.A O no hydrogen 2.896 N/A SER 648.A N LEU 644.A O no hydrogen 2.918 N/A SER 648.A OG LEU 644.A O no hydrogen 2.848 N/A ALA 649.A N GLU 645.A O no hydrogen 2.987 N/A GLU 650.A N GLY 646.A O no hydrogen 2.961 N/A SER 651.A N PHE 647.A O no hydrogen 2.871 N/A SER 651.A OG PHE 647.A O no hydrogen 2.652 N/A SER 651.A OG SER 648.A O no hydrogen 3.477 N/A ARG 652.A N SER 648.A O no hydrogen 2.979 N/A LEU 655.A N SER 651.A O no hydrogen 2.956 N/A LEU 656.A N ARG 652.A O no hydrogen 2.915 N/A LEU 657.A N LYS 653.A O no hydrogen 2.897 N/A ILE 658.A N LEU 654.A O no hydrogen 2.964 N/A GLN 659.A N LEU 655.A O no hydrogen 2.937 N/A GLN 659.A NE2 ASP 663.A OD2 no hydrogen 3.166 N/A ALA 660.A N LEU 656.A O no hydrogen 2.877 N/A PHE 661.A N LEU 657.A O no hydrogen 2.935 N/A ARG 662.A N ILE 658.A O no hydrogen 2.945 N/A ASP 663.A N GLN 659.A O no hydrogen 3.096 N/A ASN 664.A N PHE 661.A O no hydrogen 3.114 N/A LEU 665.A N ALA 660.A O no hydrogen 3.097 N/A THR 669.A N GLU 252.A O no hydrogen 2.930 N/A LEU 672.A N GLU 252.A OE2 no hydrogen 2.911 N/A GLY 674.A N ASP 671.A OD1 no hydrogen 3.245 N/A LEU 675.A N ASP 671.A O no hydrogen 3.292 N/A TYR 676.A N LEU 672.A O no hydrogen 2.920 N/A TYR 676.A OH ARG 260.A O no hydrogen 2.489 N/A GLU 677.A N LYS 673.A O no hydrogen 2.905 N/A ALA 678.A N GLY 674.A O no hydrogen 2.908 N/A ILE 679.A N LEU 675.A O no hydrogen 2.927 N/A GLU 680.A N TYR 676.A O no hydrogen 2.903 N/A CYS 682.A N ILE 679.A O no hydrogen 3.246 N/A CYS 682.A SG ALA 678.A O no hydrogen 3.571 N/A ASN 685.A N GLN 643.A OE1 no hydrogen 3.241 N/A ASP 686.A N GLN 643.A OE1 no hydrogen 3.139 N/A TRP 688.A NE1 ASN 636.A OD1 no hydrogen 2.430 N/A LEU 690.A N ASP 686.A O no hydrogen 3.083 N/A LEU 691.A N PRO 687.A O no hydrogen 2.919 N/A ASN 692.A N TRP 688.A O no hydrogen 2.920 N/A ASN 692.A ND2 TRP 688.A O no hydrogen 2.444 N/A ALA 693.A N VAL 689.A O no hydrogen 2.898 N/A SER 694.A N LEU 690.A O no hydrogen 2.967 N/A TRP 695.A N LEU 691.A O no hydrogen 2.877 N/A TRP 695.A NE1 GLN 397.A OE1 no hydrogen 3.030 N/A PHE 696.A N ASN 692.A O no hydrogen 2.881 N/A ASN 697.A N ALA 693.A O no hydrogen 2.971 N/A ASN 697.A ND2 LEU 262.A O no hydrogen 3.323 N/A SER 698.A N SER 694.A O no hydrogen 2.925 N/A SER 698.A OG SER 694.A O no hydrogen 2.813 N/A PHE 699.A N TRP 695.A O no hydrogen 2.888 N/A LEU 700.A N PHE 696.A O no hydrogen 2.886 N/A LYS 701.A N ASN 697.A O no hydrogen 2.957 N/A ALA 702.A N SER 698.A O no hydrogen 2.918 N/A VAL 703.A N PHE 699.A O no hydrogen 2.908 N/A GLN 704.A N LEU 700.A O no hydrogen 2.922 N/A GLN 704.A NE2 PRO 256.A O no hydrogen 2.480 N/A LEU 705.A N LYS 701.A O no hydrogen 2.912 N/A SER 706.A N ALA 702.A O no hydrogen 2.914 N/A SER 706.A OG VAL 703.A O no hydrogen 2.546 N/A MET 707.A N VAL 703.A O no hydrogen 3.268 N/A