Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1tll_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ARG 3.A NH2 HIS 30.A O no hydrogen 3.563 N/A ALA 6.A N ASP 33.A O no hydrogen 2.915 N/A THR 7.A N LEU 52.A O no hydrogen 2.944 N/A THR 7.A OG1 GLU 50.A OE2 no hydrogen 2.252 N/A ILE 8.A N LYS 35.A O no hydrogen 2.722 N/A LEU 9.A N LEU 54.A O no hydrogen 2.767 N/A TYR 10.A N MET 37.A O no hydrogen 3.085 N/A ALA 11.A N VAL 56.A O no hydrogen 3.273 N/A THR 12.A N ASN 68.A OD1 no hydrogen 3.325 N/A GLY 15.A N THR 12.A OG1 no hydrogen 2.776 N/A LYS 16.A NZ GLN 147.A OE1 no hydrogen 3.468 N/A GLN 18.A NE2 TYR 10.A OH no hydrogen 3.198 N/A ALA 19.A N GLY 15.A O no hydrogen 3.051 N/A TYR 20.A N LYS 16.A O no hydrogen 3.019 N/A ALA 21.A N SER 17.A O no hydrogen 2.815 N/A LYS 22.A N GLN 18.A O no hydrogen 3.052 N/A THR 23.A N ALA 19.A O no hydrogen 2.977 N/A THR 23.A OG1 ALA 19.A O no hydrogen 3.081 N/A LEU 24.A N TYR 20.A O no hydrogen 2.800 N/A CYS 25.A N ALA 21.A O no hydrogen 2.906 N/A GLU 26.A N LYS 22.A O no hydrogen 2.915 N/A ILE 27.A N THR 23.A O no hydrogen 3.196 N/A PHE 28.A N LEU 24.A O no hydrogen 3.053 N/A LYS 29.A N GLU 26.A O no hydrogen 3.275 N/A HIS 30.A N ILE 27.A O no hydrogen 3.067 N/A PHE 32.A N PHE 28.A O no hydrogen 2.826 N/A ASP 33.A N VAL 4.A O no hydrogen 2.839 N/A LYS 35.A N ALA 6.A O no hydrogen 3.031 N/A MET 37.A N ILE 8.A O no hydrogen 2.805 N/A MET 39.A N TYR 10.A O no hydrogen 2.740 N/A GLU 40.A N SER 38.A OG no hydrogen 3.061 N/A GLU 41.A N SER 38.A O no hydrogen 2.989 N/A TYR 42.A N SER 38.A O no hydrogen 3.114 N/A TYR 42.A OH GLU 50.A OE1 no hydrogen 2.715 N/A VAL 45.A N ASP 43.A OD1 no hydrogen 3.034 N/A HIS 46.A N ASP 43.A O no hydrogen 2.989 N/A HIS 49.A N HIS 46.A O no hydrogen 2.735 N/A GLU 50.A N LEU 47.A O no hydrogen 2.932 N/A VAL 53.A N ARG 102.A O no hydrogen 2.718 N/A LEU 54.A N THR 7.A O no hydrogen 2.835 N/A VAL 55.A N SER 104.A O no hydrogen 3.077 N/A VAL 56.A N LEU 9.A O no hydrogen 2.959 N/A THR 57.A N PHE 106.A O no hydrogen 3.090 N/A THR 57.A OG1 SER 58.A O no hydrogen 2.796 N/A PHE 60.A N ASP 64.A O no hydrogen 2.735 N/A ASN 62.A N ASP 64.A OD1 no hydrogen 3.295 N/A ASN 62.A ND2 GLU 609.A OE1 no hydrogen 2.658 N/A ASP 64.A N PHE 60.A O no hydrogen 2.702 N/A GLU 67.A N GLU 13.A OE2 no hydrogen 2.592 N/A GLY 69.A N PRO 66.A O no hydrogen 2.833 N/A GLU 70.A N GLU 67.A O no hydrogen 3.400 N/A GLY 73.A N GLY 69.A O no hydrogen 2.995 N/A CYS 74.A N GLU 70.A O no hydrogen 2.930 N/A CYS 74.A SG GLU 70.A O no hydrogen 3.094 N/A ALA 75.A N LYS 71.A O no hydrogen 2.995 N/A LEU 76.A N PHE 72.A O no hydrogen 3.200 N/A MET 77.A N GLY 73.A O no hydrogen 2.968 N/A GLU 78.A N CYS 74.A O no hydrogen 2.648 N/A GLU 78.A N ALA 75.A O no hydrogen 3.105 N/A MET 79.A N ALA 75.A O no hydrogen 2.942 N/A ARG 80.A N LEU 76.A O no hydrogen 3.040 N/A HIS 81.A N GLU 78.A O no hydrogen 2.734 N/A HIS 81.A NE2 ARG 84.A O no hydrogen 2.342 N/A SER 86.A OG ASP 603.A OD1 no hydrogen 3.448 N/A TYR 87.A OH GLY 63.A O no hydrogen 2.720 N/A VAL 89.A N SER 86.A O no hydrogen 3.102 N/A VAL 89.A N SER 86.A OG no hydrogen 2.972 N/A ARG 90.A N SER 86.A O no hydrogen 3.078 N/A ARG 90.A NH1 GLU 129.A OE2 no hydrogen 3.491 N/A ARG 90.A NH2 GLU 129.A OE2 no hydrogen 2.746 N/A PHE 91.A N TYR 87.A O no hydrogen 3.095 N/A ASN 92.A ND2 GLY 63.A O no hydrogen 2.495 N/A SER 93.A OG VAL 89.A O no hydrogen 2.593 N/A SER 95.A N SER 93.A O no hydrogen 2.958 N/A LEU 98.A N LEU 130.A O no hydrogen 2.598 N/A ALA 99.A N GLY 96.A O no hydrogen 3.326 N/A ASN 100.A ND2 ASN 100.A O no hydrogen 2.270 N/A VAL 101.A N LEU 98.A O no hydrogen 3.011 N/A ARG 102.A N ALA 51.A O no hydrogen 2.890 N/A ARG 102.A NE GLU 133.A OE2 no hydrogen 2.612 N/A PHE 103.A N GLU 133.A O no hydrogen 3.188 N/A SER 104.A N VAL 53.A O no hydrogen 3.293 N/A SER 104.A OG LEU 136.A O no hydrogen 3.229 N/A PHE 106.A N VAL 55.A O no hydrogen 2.776 N/A GLY 107.A N ARG 139.A O no hydrogen 3.116 N/A LEU 108.A N THR 57.A O no hydrogen 2.932 N/A GLY 109.A N GLY 141.A O no hydrogen 3.021 N/A ARG 111.A N ASP 142.A OD1 no hydrogen 3.443 N/A ALA 112.A N SER 110.A OG no hydrogen 3.106 N/A TYR 113.A N SER 110.A O no hydrogen 3.050 N/A CYS 117.A SG GLY 107.A O no hydrogen 3.569 N/A ALA 118.A N HIS 115.A O no hydrogen 3.326 N/A PHE 119.A N THR 59.A OG1 no hydrogen 3.137 N/A HIS 121.A N CYS 117.A O no hydrogen 3.161 N/A HIS 121.A NE2 GLU 140.A OE2 no hydrogen 2.580 N/A ALA 122.A N ALA 118.A O no hydrogen 2.942 N/A VAL 123.A N PHE 119.A O no hydrogen 3.068 N/A ASP 124.A N GLY 120.A O no hydrogen 2.799 N/A THR 125.A N HIS 121.A O no hydrogen 2.715 N/A THR 125.A OG1 HIS 121.A O no hydrogen 2.708 N/A LEU 126.A N ALA 122.A O no hydrogen 2.616 N/A LEU 127.A N VAL 123.A O no hydrogen 2.801 N/A GLU 129.A N THR 125.A O no hydrogen 3.297 N/A LEU 130.A N LEU 126.A O no hydrogen 3.110 N/A GLY 131.A N GLU 128.A O no hydrogen 3.194 N/A GLY 132.A N LEU 127.A O no hydrogen 2.830 N/A GLU 133.A N VAL 101.A O no hydrogen 2.806 N/A ARG 134.A NE ASP 124.A OD1 no hydrogen 3.064 N/A ARG 134.A NE ASP 124.A OD2 no hydrogen 3.374 N/A ARG 134.A NH1 GLU 128.A OE2 no hydrogen 2.415 N/A ARG 134.A NH2 ASP 124.A O no hydrogen 3.376 N/A ARG 134.A NH2 ASP 124.A OD2 no hydrogen 3.102 N/A ARG 134.A NH2 GLU 128.A OE2 no hydrogen 2.497 N/A ILE 135.A N PHE 103.A O no hydrogen 2.775 N/A LEU 136.A N SER 104.A OG no hydrogen 3.310 N/A ARG 139.A N VAL 105.A O no hydrogen 3.287 N/A GLY 141.A N GLY 107.A O no hydrogen 2.745 N/A GLU 143.A N GLY 109.A O no hydrogen 2.960 N/A LEU 144.A N ASP 142.A OD1 no hydrogen 2.781 N/A CYS 145.A N ASP 142.A O no hydrogen 2.928 N/A GLY 146.A N GLU 353.A OE2 no hydrogen 2.854 N/A GLN 147.A NE2 GLY 141.A O no hydrogen 3.082 N/A ALA 150.A N GLY 146.A O no hydrogen 2.854 N/A PHE 151.A N GLN 147.A O no hydrogen 3.213 N/A PHE 151.A N GLU 148.A O no hydrogen 3.210 N/A ARG 152.A N GLU 148.A O no hydrogen 3.456 N/A ARG 152.A NH1 SER 346.A O no hydrogen 3.414 N/A ARG 152.A NH2 SER 346.A O no hydrogen 3.376 N/A THR 153.A N GLU 149.A O no hydrogen 3.497 N/A TRP 154.A N ALA 150.A O no hydrogen 3.292 N/A ALA 155.A N PHE 151.A O no hydrogen 2.625 N/A LYS 156.A N ARG 152.A O no hydrogen 2.710 N/A LYS 157.A N THR 153.A O no hydrogen 3.022 N/A VAL 158.A N TRP 154.A O no hydrogen 2.849 N/A PHE 159.A N ALA 155.A O no hydrogen 3.331 N/A LYS 160.A N LYS 156.A O no hydrogen 3.032 N/A LYS 160.A NZ ASP 164.A OD2 no hydrogen 2.776 N/A ALA 161.A N LYS 157.A O no hydrogen 2.602 N/A ALA 162.A N VAL 158.A O no hydrogen 2.841 N/A CYS 163.A N PHE 159.A O no hydrogen 2.885 N/A CYS 163.A SG PHE 159.A O no hydrogen 3.531 N/A ASP 164.A N LYS 160.A O no hydrogen 3.028 N/A VAL 165.A N ALA 161.A O no hydrogen 3.051 N/A PHE 166.A N ALA 162.A O no hydrogen 2.867 N/A CYS 167.A N ASP 164.A O no hydrogen 2.965 N/A CYS 167.A SG ASP 164.A O no hydrogen 3.678 N/A CYS 167.A SG VAL 165.A O no hydrogen 3.749 N/A VAL 168.A N CYS 163.A O no hydrogen 3.149 N/A ASP 170.A N ASP 171.A OD1 no hydrogen 3.355 N/A SER 180.A OG ASP 178.A O no hydrogen 2.976 N/A TRP 181.A NE1 THR 378.A OG1 no hydrogen 3.125 N/A LYS 185.A N LYS 182.A O no hydrogen 2.994 N/A ARG 187.A N GLU 281.A O no hydrogen 2.791 N/A THR 189.A N LYS 279.A O no hydrogen 2.849 N/A THR 189.A OG1 GLU 281.A OE1 no hydrogen 3.064 N/A VAL 191.A N VAL 277.A O no hydrogen 2.826 N/A THR 198.A OG1 ASP 196.A OD1 no hydrogen 3.299 N/A GLY 200.A N ASP 196.A O no hydrogen 2.764 N/A LEU 201.A N LEU 197.A O no hydrogen 2.925 N/A SER 202.A N THR 198.A O no hydrogen 3.214 N/A SER 202.A N GLN 199.A O no hydrogen 3.193 N/A SER 202.A OG THR 198.A O no hydrogen 2.774 N/A ASN 203.A N GLN 199.A O no hydrogen 3.225 N/A VAL 204.A N GLY 200.A O no hydrogen 3.069 N/A HIS 205.A N LEU 201.A O no hydrogen 3.037 N/A LYS 206.A N ASN 203.A O no hydrogen 3.067 N/A LYS 207.A N SER 202.A O no hydrogen 3.073 N/A VAL 209.A N SER 202.A OG no hydrogen 3.064 N/A SER 210.A N CYS 443.A O no hydrogen 2.880 N/A ALA 212.A N VAL 441.A O no hydrogen 2.944 N/A ARG 213.A N HIS 235.A O no hydrogen 2.941 N/A LEU 215.A N ARG 233.A O no hydrogen 2.664 N/A SER 216.A N ARG 233.A O no hydrogen 3.444 N/A ARG 217.A NE LEU 432.A O no hydrogen 3.178 N/A ARG 217.A NH2 LEU 432.A O no hydrogen 3.372 N/A ARG 217.A NH2 ILE 435.A O no hydrogen 2.384 N/A GLN 218.A N PHE 231.A O no hydrogen 2.798 N/A LEU 220.A N THR 229.A O no hydrogen 2.772 N/A SER 222.A N ILE 505.A O no hydrogen 3.030 N/A LYS 224.A N SER 222.A OG no hydrogen 2.724 N/A SER 225.A N SER 222.A O no hydrogen 3.083 N/A SER 225.A OG ARG 227.A O no hydrogen 3.226 N/A ARG 227.A N SER 225.A OG no hydrogen 3.195 N/A THR 229.A OG1 GLN 221.A OE1 no hydrogen 2.599 N/A ILE 230.A N VAL 409.A O no hydrogen 2.872 N/A PHE 231.A N GLN 218.A O no hydrogen 2.685 N/A VAL 232.A N LEU 407.A O no hydrogen 2.863 N/A ARG 233.A N SER 216.A O no hydrogen 2.910 N/A ARG 233.A NE GLU 404.A OE2 no hydrogen 2.484 N/A ARG 233.A NH2 GLU 404.A OE1 no hydrogen 2.975 N/A ARG 233.A NH2 GLU 404.A OE2 no hydrogen 2.602 N/A LEU 234.A N VAL 405.A O no hydrogen 2.839 N/A HIS 235.A N ARG 213.A O no hydrogen 2.548 N/A THR 236.A N ASP 403.A O no hydrogen 3.096 N/A ASN 237.A N HIS 235.A ND1 no hydrogen 2.712 N/A LEU 242.A N ASN 239.A O no hydrogen 3.002 N/A TYR 244.A OH SER 396.A OG no hydrogen 2.640 N/A TYR 244.A OH GLU 404.A O no hydrogen 2.761 N/A GLN 245.A N ASP 248.A OD1 no hydrogen 2.949 N/A ASP 248.A N GLN 245.A O no hydrogen 3.138 N/A HIS 249.A N ARG 446.A O no hydrogen 3.027 N/A HIS 249.A NE2 ASP 610.A OD1 no hydrogen 2.818 N/A HIS 249.A NE2 ASP 610.A OD2 no hydrogen 2.913 N/A LEU 250.A N TYR 392.A O no hydrogen 2.727 N/A GLY 251.A N PHE 444.A O no hydrogen 2.789 N/A VAL 252.A N ARG 390.A O no hydrogen 2.668 N/A PHE 253.A N PRO 442.A O no hydrogen 2.905 N/A ASN 256.A N LYS 312.A O no hydrogen 2.914 N/A ASN 256.A ND2 PHE 311.A O no hydrogen 2.797 N/A ASN 256.A ND2 LYS 312.A O no hydrogen 3.679 N/A ASN 256.A ND2 LEU 315.A O no hydrogen 3.125 N/A ASP 259.A N HIS 257.A ND1 no hydrogen 2.912 N/A VAL 261.A N HIS 257.A O no hydrogen 3.015 N/A ASN 262.A N GLU 258.A O no hydrogen 2.711 N/A ALA 263.A N ASP 259.A O no hydrogen 2.796 N/A LEU 264.A N LEU 260.A O no hydrogen 3.011 N/A ILE 265.A N VAL 261.A O no hydrogen 2.982 N/A GLU 266.A N ASN 262.A O no hydrogen 2.855 N/A ARG 267.A N LEU 264.A O no hydrogen 2.900 N/A ARG 267.A NH1 LEU 367.A O no hydrogen 2.525 N/A ARG 267.A NH2 LEU 367.A O no hydrogen 3.176 N/A ARG 267.A NH2 PHE 370.A O no hydrogen 3.397 N/A ARG 267.A NH2 ILE 373.A O no hydrogen 3.055 N/A LEU 268.A N ILE 265.A O no hydrogen 3.115 N/A GLU 269.A N MET 375.A O no hydrogen 2.916 N/A ASN 275.A N PRO 273.A O no hydrogen 2.384 N/A VAL 278.A N CYS 305.A O no hydrogen 3.006 N/A LYS 279.A N THR 189.A O no hydrogen 2.798 N/A GLU 281.A N ARG 187.A O no hydrogen 2.630 N/A MET 282.A N LYS 297.A O no hydrogen 2.832 N/A LEU 283.A N LYS 185.A O no hydrogen 2.627 N/A GLU 284.A N ASN 295.A O no hydrogen 2.707 N/A THR 288.A N GLY 291.A O no hydrogen 3.259 N/A GLY 291.A N THR 288.A O no hydrogen 3.177 N/A SER 294.A OG GLU 285.A OE2 no hydrogen 2.781 N/A ASN 295.A N GLU 284.A O no hydrogen 3.113 N/A ASN 295.A ND2 GLU 284.A O no hydrogen 3.078 N/A LYS 297.A N MET 282.A O no hydrogen 2.935 N/A GLU 299.A N VAL 280.A O no hydrogen 2.788 N/A SER 300.A OG SER 300.A O no hydrogen 2.539 N/A ARG 301.A NH1 LEU 384.A O no hydrogen 2.906 N/A ARG 301.A NH2 LEU 381.A O no hydrogen 2.918 N/A ARG 301.A NH2 LEU 384.A O no hydrogen 3.125 N/A CYS 305.A SG PRO 303.A O no hydrogen 3.411 N/A CYS 305.A SG THR 306.A O no hydrogen 3.684 N/A THR 306.A N GLN 309.A OE1 no hydrogen 3.176 N/A THR 306.A OG1 GLN 309.A OE1 no hydrogen 3.537 N/A GLN 309.A N THR 306.A OG1 no hydrogen 3.049 N/A ALA 310.A N THR 306.A O no hydrogen 2.916 N/A PHE 311.A N ILE 307.A O no hydrogen 2.943 N/A LYS 312.A N PHE 308.A O no hydrogen 2.814 N/A LYS 312.A NZ TYR 313.A OH no hydrogen 2.764 N/A TYR 313.A N GLN 309.A O no hydrogen 2.727 N/A TYR 314.A N ALA 310.A O no hydrogen 2.913 N/A ASP 316.A N SER 385.A O no hydrogen 2.581 N/A THR 318.A N ASP 316.A OD1 no hydrogen 3.245 N/A THR 319.A N ASP 316.A OD1 no hydrogen 2.798 N/A THR 319.A OG1 ASP 316.A OD1 no hydrogen 2.606 N/A THR 319.A OG1 ASP 316.A OD2 no hydrogen 2.518 N/A THR 322.A N GLN 325.A OE1 no hydrogen 3.461 N/A GLN 325.A N THR 322.A OG1 no hydrogen 3.341 N/A GLN 325.A NE2 GLN 383.A O no hydrogen 2.905 N/A LEU 326.A N THR 322.A O no hydrogen 3.045 N/A GLN 327.A N PRO 323.A O no hydrogen 3.038 N/A GLN 327.A NE2 SER 346.A OG no hydrogen 2.858 N/A GLN 328.A N LEU 324.A O no hydrogen 3.299 N/A GLN 328.A NE2 GLN 383.A OE1 no hydrogen 3.293 N/A PHE 329.A N GLN 325.A O no hydrogen 3.151 N/A ALA 330.A N LEU 326.A O no hydrogen 2.750 N/A SER 331.A OG GLN 328.A O no hydrogen 3.166 N/A LEU 332.A N PHE 329.A O no hydrogen 2.882 N/A ALA 333.A N ALA 330.A O no hydrogen 2.809 N/A THR 334.A N SER 372.A O no hydrogen 3.150 N/A THR 334.A OG1 SER 372.A O no hydrogen 3.265 N/A GLU 338.A N ASN 335.A OD1 no hydrogen 2.816 N/A LYS 339.A N ASN 335.A O no hydrogen 2.651 N/A LYS 339.A N GLU 336.A O no hydrogen 3.249 N/A LYS 339.A NZ ALA 330.A O no hydrogen 3.311 N/A GLN 340.A N GLU 336.A O no hydrogen 3.216 N/A GLN 340.A N LYS 337.A O no hydrogen 3.274 N/A GLN 340.A NE2 GLU 336.A O no hydrogen 3.033 N/A ARG 341.A N LYS 337.A O no hydrogen 3.334 N/A LEU 343.A N LYS 339.A O no hydrogen 3.178 N/A VAL 344.A N GLN 340.A O no hydrogen 2.746 N/A LEU 345.A N ARG 341.A O no hydrogen 2.903 N/A SER 346.A N LEU 342.A O no hydrogen 3.039 N/A SER 346.A OG LEU 342.A O no hydrogen 2.914 N/A LYS 347.A N VAL 344.A O no hydrogen 3.449 N/A GLY 348.A N LEU 345.A O no hydrogen 3.290 N/A TYR 352.A OH PRO 321.A O no hydrogen 2.516 N/A GLU 353.A N LEU 349.A O no hydrogen 3.062 N/A GLU 354.A N GLN 350.A O no hydrogen 2.812 N/A TRP 355.A N GLU 351.A O no hydrogen 2.871 N/A TRP 355.A NE1 GLU 369.A OE2 no hydrogen 3.170 N/A LYS 356.A N TYR 352.A O no hydrogen 2.804 N/A TRP 357.A N GLU 353.A O no hydrogen 2.825 N/A TRP 357.A NE1 LEU 144.A O no hydrogen 3.208 N/A GLY 358.A N GLU 354.A O no hydrogen 2.815 N/A LYS 359.A N TRP 355.A O no hydrogen 2.786 N/A LYS 359.A NZ GLU 369.A OE1 no hydrogen 3.003 N/A ASN 360.A N LYS 356.A O no hydrogen 2.616 N/A THR 362.A N GLU 365.A OE1 no hydrogen 2.986 N/A THR 362.A OG1 GLU 365.A OE1 no hydrogen 3.524 N/A MET 363.A N ILE 317.A O no hydrogen 3.105 N/A GLU 365.A N THR 362.A OG1 no hydrogen 3.141 N/A VAL 366.A N THR 362.A O no hydrogen 3.051 N/A VAL 366.A N MET 363.A O no hydrogen 3.276 N/A LEU 367.A N MET 363.A O no hydrogen 3.120 N/A GLU 368.A N VAL 364.A O no hydrogen 2.939 N/A GLU 369.A N GLU 365.A O no hydrogen 3.016 N/A GLU 369.A N VAL 366.A O no hydrogen 3.011 N/A PHE 370.A N VAL 366.A O no hydrogen 3.045 N/A SER 372.A N GLU 338.A OE2 no hydrogen 2.659 N/A SER 372.A OG GLU 338.A OE2 no hydrogen 2.504 N/A ILE 373.A N PHE 370.A O no hydrogen 3.339 N/A GLN 374.A N LEU 332.A O no hydrogen 3.154 N/A LEU 379.A N PRO 376.A O no hydrogen 2.655 N/A LEU 381.A N ALA 377.A O no hydrogen 3.301 N/A THR 382.A OG1 GLU 299.A OE1 no hydrogen 3.282 N/A GLN 383.A N LEU 379.A O no hydrogen 2.793 N/A LEU 384.A N LEU 380.A O no hydrogen 2.871 N/A LEU 387.A N TYR 314.A O no hydrogen 2.887 N/A GLN 388.A NE2 LEU 386.A O no hydrogen 3.351 N/A ARG 390.A N VAL 252.A O no hydrogen 2.730 N/A ARG 390.A NH1 GLN 388.A O no hydrogen 2.785 N/A TYR 392.A N LEU 250.A O no hydrogen 2.892 N/A SER 393.A OG ASP 610.A OD2 no hydrogen 3.450 N/A ILE 394.A N ASP 248.A O no hydrogen 3.135 N/A SER 395.A N HIS 406.A O no hydrogen 2.807 N/A SER 395.A OG SER 393.A O no hydrogen 3.504 N/A SER 395.A OG THR 408.A OG1 no hydrogen 2.826 N/A SER 395.A OG ALA 471.A O no hydrogen 2.891 N/A SER 396.A OG TYR 244.A OH no hydrogen 2.640 N/A SER 397.A N GLN 478.A OE1 no hydrogen 2.971 N/A ASP 399.A N SER 397.A OG no hydrogen 3.224 N/A TYR 401.A N SER 397.A O no hydrogen 2.877 N/A GLU 404.A N TYR 401.A O no hydrogen 3.295 N/A VAL 405.A N LEU 234.A O no hydrogen 2.879 N/A HIS 406.A N SER 396.A OG no hydrogen 3.380 N/A HIS 406.A NE2 GLU 404.A OE2 no hydrogen 2.962 N/A LEU 407.A N VAL 232.A O no hydrogen 2.904 N/A THR 408.A OG1 SER 395.A OG no hydrogen 2.826 N/A THR 408.A OG1 TYR 509.A OH no hydrogen 2.667 N/A VAL 409.A N ILE 230.A O no hydrogen 2.875 N/A ILE 411.A N SER 228.A O no hydrogen 2.869 N/A VAL 412.A N SER 429.A OG no hydrogen 3.150 N/A TYR 414.A N HIS 424.A O no hydrogen 3.043 N/A THR 416.A N PRO 422.A O no hydrogen 2.930 N/A THR 416.A OG1 PRO 422.A O no hydrogen 3.382 N/A ARG 417.A N GLY 358.A O no hydrogen 3.011 N/A GLU 420.A N ARG 417.A O no hydrogen 3.255 N/A GLY 421.A N THR 416.A O no hydrogen 2.933 N/A HIS 424.A N TYR 414.A O no hydrogen 2.815 N/A HIS 424.A NE2 GLU 365.A OE2 no hydrogen 3.035 N/A GLY 426.A N VAL 412.A O no hydrogen 2.705 N/A SER 430.A N GLY 426.A O no hydrogen 3.097 N/A SER 430.A OG GLY 426.A O no hydrogen 2.634 N/A SER 430.A OG VAL 427.A O no hydrogen 3.242 N/A TRP 431.A N VAL 427.A O no hydrogen 3.080 N/A LEU 432.A N CYS 428.A O no hydrogen 2.750 N/A ASN 433.A N SER 429.A O no hydrogen 3.049 N/A ARG 434.A N TRP 431.A O no hydrogen 2.846 N/A ARG 434.A NH1 SER 430.A OG no hydrogen 3.067 N/A ILE 435.A N TRP 431.A O no hydrogen 3.047 N/A GLN 436.A N ASP 439.A OD2 no hydrogen 2.391 N/A ASP 439.A N GLN 436.A O no hydrogen 2.801 N/A CYS 443.A N SER 210.A O no hydrogen 3.038 N/A CYS 443.A SG VAL 441.A O no hydrogen 3.615 N/A PHE 444.A N GLY 251.A O no hydrogen 2.993 N/A ARG 446.A N HIS 249.A O no hydrogen 2.931 N/A ARG 446.A NH1 GLU 13.A OE1 no hydrogen 3.508 N/A ALA 448.A N ASP 248.A OD2 no hydrogen 2.678 N/A PHE 451.A N ALA 448.A O no hydrogen 2.972 N/A HIS 452.A NE2 ASP 248.A OD2 no hydrogen 2.496 N/A GLN 458.A NE2 ASN 490.A O no hydrogen 2.760 N/A ILE 462.A N HIS 562.A O no hydrogen 2.752 N/A LEU 463.A N VAL 495.A O no hydrogen 2.800 N/A VAL 464.A N TYR 564.A O no hydrogen 2.615 N/A GLY 465.A N VAL 497.A O no hydrogen 3.045 N/A GLY 467.A N GLY 499.A O no hydrogen 2.857 N/A GLY 469.A N PRO 466.A O no hydrogen 3.015 N/A ILE 470.A N GLY 467.A O no hydrogen 3.146 N/A ALA 471.A N THR 468.A O no hydrogen 2.941 N/A PHE 473.A N ILE 470.A O no hydrogen 2.773 N/A ARG 474.A N ALA 471.A O no hydrogen 3.418 N/A ARG 474.A NH1 SER 395.A O no hydrogen 2.689 N/A ARG 474.A NH1 HIS 406.A ND1 no hydrogen 3.404 N/A ARG 474.A NH2 GLU 512.A OE2 no hydrogen 3.239 N/A SER 475.A N PRO 472.A O no hydrogen 3.061 N/A SER 475.A OG PRO 472.A O no hydrogen 2.766 N/A PHE 476.A N PRO 472.A O no hydrogen 3.269 N/A TRP 477.A N PHE 473.A O no hydrogen 2.967 N/A GLN 478.A N ARG 474.A O no hydrogen 3.348 N/A GLN 479.A N SER 475.A O no hydrogen 3.005 N/A ARG 480.A N PHE 476.A O no hydrogen 2.855 N/A GLN 481.A N TRP 477.A O no hydrogen 2.798 N/A PHE 482.A N GLN 478.A O no hydrogen 2.927 N/A ASP 483.A N GLN 479.A O no hydrogen 3.000 N/A ILE 484.A N ARG 480.A O no hydrogen 3.114 N/A GLN 485.A N GLN 481.A O no hydrogen 3.038 N/A HIS 486.A N PHE 482.A O no hydrogen 2.844 N/A LYS 487.A N ASP 483.A O no hydrogen 2.771 N/A LYS 487.A NZ ASP 399.A OD1 no hydrogen 3.545 N/A MET 489.A N ASP 483.A O no hydrogen 3.445 N/A CYS 492.A N PRO 457.A O no hydrogen 2.938 N/A CYS 492.A SG PRO 493.A O no hydrogen 3.789 N/A MET 494.A N VAL 521.A O no hydrogen 2.778 N/A VAL 495.A N CYS 461.A O no hydrogen 3.127 N/A LEU 496.A N GLU 524.A O no hydrogen 3.379 N/A VAL 497.A N LEU 463.A O no hydrogen 2.811 N/A PHE 498.A N TYR 526.A O no hydrogen 2.968 N/A CYS 500.A N ALA 528.A O no hydrogen 2.797 N/A ARG 501.A N ASP 506.A OD1 no hydrogen 3.349 N/A SER 503.A N GLU 532.A OE1 no hydrogen 3.330 N/A ILE 505.A N GLN 502.A O no hydrogen 2.805 N/A ASP 506.A N GLN 502.A O no hydrogen 2.960 N/A HIS 507.A ND1 TYR 529.A OH no hydrogen 3.187 N/A TYR 509.A OH THR 408.A OG1 no hydrogen 2.667 N/A ARG 510.A NH1 SER 503.A OG no hydrogen 3.227 N/A THR 513.A N TYR 509.A O no hydrogen 2.866 N/A THR 513.A N ARG 510.A O no hydrogen 3.256 N/A THR 513.A OG1 TYR 509.A O no hydrogen 3.253 N/A THR 513.A OG1 ARG 510.A O no hydrogen 2.651 N/A LEU 514.A N ARG 510.A O no hydrogen 3.052 N/A GLN 515.A N GLU 511.A O no hydrogen 2.864 N/A ALA 516.A N GLU 512.A O no hydrogen 3.330 N/A LYS 517.A N THR 513.A O no hydrogen 2.989 N/A LYS 517.A N LEU 514.A O no hydrogen 2.898 N/A LYS 517.A NZ GLU 524.A OE1 no hydrogen 2.884 N/A ASN 518.A N LEU 514.A O no hydrogen 3.069 N/A LYS 519.A N ALA 516.A O no hydrogen 3.338 N/A GLY 520.A N LYS 517.A O no hydrogen 3.000 N/A VAL 521.A N ALA 516.A O no hydrogen 3.146 N/A ARG 523.A N MET 494.A O no hydrogen 2.673 N/A ARG 523.A NH2 SER 551.A OG no hydrogen 2.960 N/A TYR 526.A N LEU 496.A O no hydrogen 2.886 N/A ALA 528.A N PHE 498.A O no hydrogen 3.085 N/A TYR 529.A OH HIS 507.A ND1 no hydrogen 3.187 N/A SER 530.A N CYS 500.A O no hydrogen 2.834 N/A SER 530.A OG CYS 500.A O no hydrogen 3.063 N/A ARG 531.A N ARG 501.A O no hydrogen 2.933 N/A ARG 535.A N GLU 532.A O no hydrogen 3.467 N/A LYS 538.A N TYR 529.A O no hydrogen 2.963 N/A LYS 538.A NZ GLU 546.A OE1 no hydrogen 2.530 N/A LYS 538.A NZ GLU 546.A OE2 no hydrogen 2.666 N/A TYR 539.A N ASP 542.A OD2 no hydrogen 2.708 N/A ASP 542.A N TYR 539.A O no hydrogen 2.566 N/A VAL 543.A N TYR 539.A O no hydrogen 3.217 N/A LEU 544.A N VAL 540.A O no hydrogen 3.069 N/A GLN 545.A N GLN 541.A O no hydrogen 3.312 N/A GLN 545.A N ASP 542.A O no hydrogen 2.902 N/A GLU 546.A N ASP 542.A O no hydrogen 2.739 N/A GLN 547.A N VAL 543.A O no hydrogen 2.956 N/A VAL 552.A N LEU 548.A O no hydrogen 2.715 N/A TYR 553.A N ALA 549.A O no hydrogen 3.054 N/A ARG 554.A N GLU 550.A O no hydrogen 2.686 N/A ALA 555.A N SER 551.A O no hydrogen 2.590 N/A LEU 556.A N VAL 552.A O no hydrogen 2.867 N/A LYS 557.A N TYR 553.A O no hydrogen 2.838 N/A GLU 558.A N ARG 554.A O no hydrogen 3.188 N/A GLN 559.A N ARG 554.A O no hydrogen 3.069 N/A GLY 561.A N ALA 555.A O no hydrogen 2.716 N/A HIS 562.A N PRO 460.A O no hydrogen 2.696 N/A HIS 562.A ND1 HIS 608.A NE2 no hydrogen 3.058 N/A ILE 563.A N ARG 606.A O no hydrogen 3.144 N/A TYR 564.A N ILE 462.A O no hydrogen 2.699 N/A TYR 564.A OH HIS 452.A O no hydrogen 2.815 N/A VAL 565.A N HIS 608.A O no hydrogen 2.827 N/A CYS 566.A N VAL 464.A O no hydrogen 2.893 N/A CYS 566.A SG GLY 469.A O no hydrogen 3.223 N/A CYS 566.A SG ASP 610.A O no hydrogen 3.882 N/A GLY 567.A N ASP 610.A O no hydrogen 3.058 N/A VAL 569.A N GLY 613.A O no hydrogen 2.903 N/A MET 571.A N ASP 568.A OD1 no hydrogen 2.922 N/A ALA 572.A N ASP 568.A O no hydrogen 3.109 N/A ALA 573.A N VAL 569.A O no hydrogen 3.066 N/A ASP 574.A N THR 570.A O no hydrogen 3.055 N/A VAL 575.A N MET 571.A O no hydrogen 2.784 N/A LEU 576.A N ALA 572.A O no hydrogen 3.192 N/A LEU 576.A N ALA 573.A O no hydrogen 3.279 N/A LYS 577.A N ASP 574.A O no hydrogen 3.016 N/A ALA 578.A N ASP 574.A O no hydrogen 2.936 N/A ILE 579.A N VAL 575.A O no hydrogen 3.149 N/A GLN 580.A N LEU 576.A O no hydrogen 3.300 N/A ARG 581.A N LYS 577.A O no hydrogen 2.856 N/A ARG 581.A NH1 GLN 545.A OE1 no hydrogen 3.147 N/A ILE 582.A N ALA 578.A O no hydrogen 3.137 N/A MET 583.A N ILE 579.A O no hydrogen 2.935 N/A THR 584.A N GLN 580.A O no hydrogen 3.072 N/A THR 584.A OG1 GLN 580.A O no hydrogen 3.137 N/A THR 584.A OG1 LEU 589.A O no hydrogen 3.123 N/A GLN 585.A N ARG 581.A O no hydrogen 2.740 N/A GLY 587.A N THR 584.A O no hydrogen 3.178 N/A ALA 594.A N SER 590.A O no hydrogen 3.115 N/A VAL 596.A N GLU 592.A O no hydrogen 2.752 N/A PHE 597.A N ASP 593.A O no hydrogen 2.856 N/A ILE 598.A N ALA 594.A O no hydrogen 3.171 N/A SER 599.A N GLY 595.A O no hydrogen 2.872 N/A ARG 600.A N VAL 596.A O no hydrogen 3.041 N/A ARG 600.A N PHE 597.A O no hydrogen 3.163 N/A LEU 601.A N PHE 597.A O no hydrogen 2.978 N/A ARG 602.A N ILE 598.A O no hydrogen 3.034 N/A ARG 602.A NH1 GLU 609.A OE1 no hydrogen 3.377 N/A ASP 603.A N SER 599.A O no hydrogen 3.341 N/A ASP 604.A N ARG 600.A O no hydrogen 2.903 N/A ASN 605.A N ARG 602.A O no hydrogen 2.714 N/A ARG 606.A N LEU 601.A O no hydrogen 2.904 N/A ARG 606.A NE GLY 561.A O no hydrogen 2.993 N/A ARG 606.A NH2 LEU 556.A O no hydrogen 2.898 N/A ARG 606.A NH2 GLY 561.A O no hydrogen 3.046 N/A HIS 608.A N ILE 563.A O no hydrogen 3.031 N/A HIS 608.A ND1 SER 450.A O no hydrogen 2.743 N/A HIS 608.A NE2 HIS 562.A ND1 no hydrogen 3.058 N/A ASP 610.A N VAL 565.A O no hydrogen 2.927 N/A PHE 612.A N GLY 567.A O no hydrogen 3.068 N/A THR 615.A N ASP 568.A OD2 no hydrogen 2.854 N/A LEU 616.A N ASP 568.A OD2 no hydrogen 2.875 N/A ARG 617.A NH1 GLU 620.A OE1 no hydrogen 2.931 N/A THR 618.A OG1 THR 615.A O no hydrogen 3.568 N/A VAL 621.A N ARG 617.A O no hydrogen 2.805 N/A THR 622.A N THR 618.A O no hydrogen 2.823 N/A ASN 623.A N TYR 619.A O no hydrogen 2.842 N/A ARG 624.A N GLU 620.A O no hydrogen 3.046 N/A LEU 625.A N VAL 621.A O no hydrogen 3.120 N/A ARG 626.A N THR 622.A O no hydrogen 2.788 N/A SER 627.A N ASN 623.A O no hydrogen 3.155 N/A SER 627.A OG ASN 623.A O no hydrogen 2.978 N/A GLU 628.A N ARG 624.A O no hydrogen 3.048 N/A SER 629.A N LEU 625.A O no hydrogen 3.048 N/A SER 629.A OG LEU 625.A O no hydrogen 3.286 N/A SER 629.A OG ARG 626.A O no hydrogen 3.489 N/A ILE 630.A N SER 627.A O no hydrogen 2.771 N/A