Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 6ldd_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): TYR 5.A OH ASP 91.A OD2 no hydrogen 2.663 N/A GLN 7.A NE2 ARG 302.A O no hydrogen 2.956 N/A ASN 9.A N ARG 12.A O no hydrogen 2.714 N/A ASN 9.A ND2 ALA 300.A O no hydrogen 2.823 N/A SER 11.A N ASN 9.A OD1 no hydrogen 2.744 N/A SER 11.A OG ILE 298.A O no hydrogen 3.570 N/A ARG 12.A NE ASP 299.A OD1 no hydrogen 2.860 N/A ARG 12.A NH2 ILE 203.A O no hydrogen 2.738 N/A ARG 12.A NH2 ASP 299.A OD2 no hydrogen 2.736 N/A VAL 14.A N SER 8.A OG no hydrogen 2.979 N/A PHE 15.A N LEU 194.A O no hydrogen 2.776 N/A LEU 17.A N VAL 192.A O no hydrogen 2.723 N/A GLY 19.A N VAL 48.A O no hydrogen 2.805 N/A TRP 21.A N MET 46.A O no hydrogen 2.864 N/A TRP 21.A NE1 LEU 17.A O no hydrogen 2.836 N/A ASP 22.A N GLN 71.A O no hydrogen 2.847 N/A ARG 24.A N VAL 69.A O no hydrogen 2.921 N/A ARG 24.A NH1 PRO 41.A O no hydrogen 2.752 N/A ALA 26.A N TRP 67.A O no hydrogen 2.931 N/A GLY 27.A N SER 30.A O no hydrogen 2.902 N/A TYR 31.A OH ASP 98.A OD2 no hydrogen 2.623 N/A TYR 31.A OH TYR 100.A OH no hydrogen 2.494 N/A GLU 34.A N GLU 34.A OE1 no hydrogen 2.717 N/A TRP 35.A N PRO 32.A O no hydrogen 3.080 N/A ALA 36.A N ALA 33.A O no hydrogen 2.970 N/A ASP 37.A N GLU 34.A O no hydrogen 3.107 N/A LEU 40.A N GLN 71.A OE1 no hydrogen 2.811 N/A LEU 44.A N PHE 23.A O no hydrogen 2.834 N/A MET 46.A N TRP 21.A O no hydrogen 2.920 N/A ALA 47.A N GLN 55.A OE1 no hydrogen 2.871 N/A VAL 48.A N GLY 19.A O no hydrogen 2.775 N/A GLY 50.A N LEU 188.A O no hydrogen 2.867 N/A SER 51.A N HIS 338.A O no hydrogen 2.972 N/A SER 51.A OG ASN 189.A OD1 no hydrogen 2.481 N/A SER 51.A OG HIS 338.A O no hydrogen 3.183 N/A TYR 52.A N ALA 186.A O no hydrogen 3.075 N/A ASN 53.A ND2 LEU 61.A O no hydrogen 2.984 N/A GLN 55.A N TYR 52.A O no hydrogen 3.144 N/A GLN 55.A NE2 ALA 47.A O no hydrogen 3.138 N/A GLN 55.A NE2 SER 51.A O no hydrogen 3.012 N/A GLU 58.A N ASN 56.A OD1 no hydrogen 2.930 N/A LEU 59.A N ASN 56.A O no hydrogen 3.308 N/A LEU 59.A N ASN 56.A OD1 no hydrogen 3.204 N/A ARG 62.A NE ASP 54.A OD1 no hydrogen 2.832 N/A ARG 62.A NH2 ASP 54.A OD1 no hydrogen 3.533 N/A ARG 62.A NH2 ASP 54.A OD2 no hydrogen 2.866 N/A ALA 63.A N ASN 60.A O no hydrogen 2.969 N/A HIS 64.A N LEU 61.A O no hydrogen 3.113 N/A HIS 64.A NE2 TRP 67.A O no hydrogen 2.744 N/A GLY 66.A N ASN 137.A OD1 no hydrogen 2.875 N/A TRP 67.A N GLY 27.A O no hydrogen 2.957 N/A VAL 68.A N VAL 135.A O no hydrogen 2.922 N/A VAL 69.A N ARG 24.A O no hydrogen 2.833 N/A TYR 70.A N VAL 133.A O no hydrogen 2.852 N/A GLN 71.A N ASP 22.A O no hydrogen 2.900 N/A GLN 71.A NE2 ALA 38.A O no hydrogen 3.025 N/A GLN 71.A NE2 THR 132.A OG1 no hydrogen 3.000 N/A ARG 72.A N LEU 131.A O no hydrogen 2.930 N/A ARG 72.A NE SER 73.A O no hydrogen 2.873 N/A ARG 72.A NH1 LEU 17.A O no hydrogen 2.823 N/A ARG 72.A NH2 SER 73.A O no hydrogen 2.944 N/A PHE 74.A N ASN 129.A O no hydrogen 3.131 N/A LEU 80.A N PRO 77.A O no hydrogen 3.011 N/A ALA 82.A N SER 78.A O no hydrogen 3.080 N/A GLN 84.A N VAL 81.A O no hydrogen 2.983 N/A GLN 84.A NE2 ALA 82.A O no hydrogen 3.169 N/A ARG 85.A N THR 197.A O no hydrogen 2.858 N/A ARG 85.A NH1 THR 197.A OG1 no hydrogen 2.780 N/A MET 86.A N THR 121.A OG1 no hydrogen 2.952 N/A ILE 87.A N TYR 195.A O no hydrogen 2.921 N/A LEU 88.A N PHE 118.A O no hydrogen 2.847 N/A ARG 89.A N GLU 193.A O no hydrogen 2.856 N/A ARG 89.A NE ASP 91.A OD1 no hydrogen 3.028 N/A ARG 89.A NH1 MET 3.A O no hydrogen 3.282 N/A ARG 89.A NH2 ASP 91.A OD1 no hydrogen 3.416 N/A ARG 89.A NH2 GLU 371.A OE1 no hydrogen 2.975 N/A PHE 90.A N PHE 116.A O no hydrogen 2.839 N/A ASP 91.A N HIS 191.A O no hydrogen 2.925 N/A THR 94.A N GLY 187.A O no hydrogen 2.946 N/A THR 94.A OG1 GLY 112.A O no hydrogen 2.670 N/A HIS 95.A N ASP 136.A O no hydrogen 2.818 N/A HIS 95.A NE2 ASN 184.A OD1 no hydrogen 2.675 N/A ALA 96.A N ASP 136.A O no hydrogen 3.249 N/A ALA 97.A N HIS 109.A O no hydrogen 2.921 N/A ASP 98.A N ALA 134.A O no hydrogen 2.922 N/A VAL 99.A N GLY 107.A O no hydrogen 2.918 N/A TYR 100.A N THR 132.A O no hydrogen 2.836 N/A TYR 100.A OH TYR 31.A OH no hydrogen 2.494 N/A LEU 101.A N GLN 104.A O no hydrogen 2.925 N/A ASN 102.A N LEU 130.A O no hydrogen 2.830 N/A ASN 102.A ND2 ALA 123.A O no hydrogen 3.000 N/A ASN 102.A ND2 ASN 129.A OD1 no hydrogen 2.913 N/A GLN 104.A N LEU 101.A O no hydrogen 3.056 N/A GLN 104.A NE2 ASN 102.A O no hydrogen 3.346 N/A LEU 106.A N VAL 99.A O no hydrogen 2.784 N/A SER 108.A OG ASP 98.A OD1 no hydrogen 2.631 N/A HIS 109.A N ALA 97.A O no hydrogen 2.941 N/A GLY 111.A N HIS 95.A O no hydrogen 2.919 N/A PHE 116.A N PHE 90.A O no hydrogen 2.984 N/A PHE 118.A N LEU 88.A O no hydrogen 2.891 N/A VAL 120.A N MET 86.A O no hydrogen 2.832 N/A THR 121.A N ASP 119.A OD1 no hydrogen 3.005 N/A THR 121.A OG1 ASP 119.A OD1 no hydrogen 2.563 N/A ALA 123.A N VAL 120.A O no hydrogen 3.189 N/A LEU 124.A N VAL 120.A O no hydrogen 2.970 N/A HIS 125.A N ASN 129.A OD1 no hydrogen 2.989 N/A HIS 125.A ND1 ALA 126.A O no hydrogen 3.045 N/A ASN 129.A N PHE 74.A O no hydrogen 2.722 N/A ASN 129.A ND2 PHE 74.A O no hydrogen 3.545 N/A ASN 129.A ND2 HIS 125.A O no hydrogen 2.953 N/A LEU 130.A N ASN 102.A OD1 no hydrogen 2.881 N/A LEU 131.A N ARG 72.A O no hydrogen 2.889 N/A THR 132.A N TYR 100.A O no hydrogen 2.911 N/A VAL 133.A N TYR 70.A O no hydrogen 2.864 N/A ALA 134.A N ASP 98.A O no hydrogen 2.906 N/A VAL 135.A N VAL 68.A O no hydrogen 2.861 N/A ASP 136.A N ALA 96.A O no hydrogen 2.771 N/A ASN 137.A N GLY 66.A O no hydrogen 3.038 N/A ASN 137.A ND2 TYR 52.A OH no hydrogen 2.989 N/A ASN 137.A ND2 HIS 64.A O no hydrogen 2.882 N/A ARG 138.A N ASP 136.A OD1 no hydrogen 3.063 N/A ARG 138.A NE ASP 136.A OD1 no hydrogen 3.002 N/A ARG 138.A NE ASP 136.A OD2 no hydrogen 3.353 N/A ARG 138.A NH2 ASP 136.A OD2 no hydrogen 3.064 N/A ILE 139.A N ASN 176.A OD1 no hydrogen 2.885 N/A GLY 140.A N THR 143.A OG1 no hydrogen 2.865 N/A SER 141.A N ASP 149.A OD1 no hydrogen 3.226 N/A SER 141.A OG ASP 149.A OD2 no hydrogen 2.792 N/A THR 143.A N GLY 140.A O no hydrogen 3.296 N/A THR 143.A OG1 GLY 140.A O no hydrogen 3.051 N/A THR 143.A OG1 PRO 145.A O no hydrogen 2.840 N/A VAL 146.A N VAL 391.A O no hydrogen 3.067 N/A GLY 147.A N GLY 140.A O no hydrogen 2.867 N/A ASN 148.A N LEU 177.A O no hydrogen 2.533 N/A ASN 148.A ND2 THR 152.A O no hydrogen 3.337 N/A ASN 148.A ND2 ASN 179.A OD1 no hydrogen 3.250 N/A THR 152.A OG1 ALA 153.A O no hydrogen 3.343 N/A PHE 154.A N PRO 178.A O no hydrogen 2.872 N/A GLY 156.A N ALA 153.A O no hydrogen 3.081 N/A VAL 162.A N ASN 159.A O no hydrogen 3.052 N/A VAL 165.A N VAL 162.A O no hydrogen 2.897 N/A ALA 166.A N VAL 162.A O no hydrogen 3.172 N/A GLU 167.A N PRO 163.A O no hydrogen 2.929 N/A ALA 168.A N ALA 164.A O no hydrogen 2.906 N/A LYS 169.A N VAL 165.A O no hydrogen 2.922 N/A LYS 169.A NZ ASP 158.A OD1 no hydrogen 3.326 N/A LYS 169.A NZ ASP 158.A OD2 no hydrogen 2.665 N/A LYS 170.A N GLU 167.A O no hydrogen 3.257 N/A HIS 171.A N ALA 168.A O no hydrogen 3.136 N/A HIS 171.A NE2 GLU 167.A OE2 no hydrogen 2.878 N/A ALA 172.A N LYS 169.A O no hydrogen 3.360 N/A GLN 175.A NE2 ALA 63.A O no hydrogen 2.669 N/A GLN 175.A NE2 ARG 174.A O no hydrogen 2.828 N/A ASN 176.A ND2 ASN 137.A OD1 no hydrogen 2.979 N/A ASN 179.A N VAL 146.A O no hydrogen 2.968 N/A ASN 179.A ND2 GLY 392.A O no hydrogen 2.725 N/A PHE 183.A N ALA 578.A O no hydrogen 2.924 N/A ASN 184.A ND2 ASN 137.A O no hydrogen 2.881 N/A PHE 185.A N PHE 183.A O no hydrogen 2.836 N/A ALA 186.A N ASN 53.A OD1 no hydrogen 2.950 N/A GLY 187.A N THR 94.A O no hydrogen 3.038 N/A LEU 188.A N TYR 70.A OH no hydrogen 3.281 N/A ASN 189.A N GLY 187.A O no hydrogen 2.933 N/A ASN 189.A ND2 THR 94.A OG1 no hydrogen 2.946 N/A ASN 189.A ND2 PHE 185.A O no hydrogen 3.649 N/A ARG 190.A NH1 PHE 113.A O no hydrogen 2.872 N/A ARG 190.A NH1 PRO 368.A O no hydrogen 3.502 N/A ARG 190.A NH2 GLU 333.A OE1 no hydrogen 2.841 N/A ARG 190.A NH2 PRO 368.A O no hydrogen 2.671 N/A HIS 191.A ND1 ASP 18.A OD2 no hydrogen 2.552 N/A VAL 192.A N ASP 18.A OD1 no hydrogen 2.983 N/A GLU 193.A N ARG 89.A O no hydrogen 2.959 N/A LEU 194.A N PHE 15.A O no hydrogen 2.889 N/A TYR 195.A N ILE 87.A O no hydrogen 2.834 N/A TYR 195.A OH GLU 117.A OE1 no hydrogen 2.803 N/A TYR 195.A OH GLU 117.A OE2 no hydrogen 3.248 N/A THR 196.A N ILE 13.A O no hydrogen 2.930 N/A THR 197.A N ARG 85.A O no hydrogen 2.987 N/A THR 197.A OG1 PRO 198.A O no hydrogen 2.972 N/A TYR 202.A N GLY 235.A O no hydrogen 2.948 N/A ILE 203.A N ASP 299.A OD2 no hydrogen 2.744 N/A ALA 204.A N THR 233.A O no hydrogen 2.875 N/A ASP 205.A N THR 233.A O no hydrogen 3.241 N/A ALA 207.A N ASP 231.A O no hydrogen 2.869 N/A ILE 208.A N ASN 420.A OD1 no hydrogen 2.885 N/A THR 209.A N ALA 229.A O no hydrogen 3.041 N/A THR 210.A N GLN 462.A OE1 no hydrogen 2.874 N/A THR 210.A OG1 ARG 308.A O no hydrogen 3.398 N/A GLU 211.A N LEU 227.A O no hydrogen 2.682 N/A ARG 212.A N LEU 227.A O no hydrogen 3.001 N/A ARG 212.A NE ASP 214.A OD1 no hydrogen 2.686 N/A ARG 212.A NH2 ASP 214.A OD1 no hydrogen 3.412 N/A ARG 212.A NH2 ASP 214.A OD2 no hydrogen 2.795 N/A ASP 214.A N ASN 225.A O no hydrogen 2.867 N/A ALA 217.A N THR 222.A O no hydrogen 2.789 N/A ALA 220.A N ALA 217.A O no hydrogen 3.023 N/A CYS 221.A N ASP 219.A OD1 no hydrogen 3.062 N/A ALA 223.A N ALA 275.A O no hydrogen 2.985 N/A ALA 224.A N HIS 215.A O no hydrogen 3.160 N/A ASN 225.A N ASP 214.A O no hydrogen 3.381 N/A ASN 225.A ND2 ASP 214.A OD2 no hydrogen 3.175 N/A ALA 226.A N ILE 272.A O no hydrogen 2.901 N/A LEU 227.A N ARG 212.A O no hydrogen 2.851 N/A ILE 228.A N ILE 270.A O no hydrogen 2.966 N/A ALA 229.A N THR 209.A O no hydrogen 2.900 N/A TYR 230.A N GLY 268.A O no hydrogen 2.891 N/A ASP 231.A N ALA 207.A O no hydrogen 3.021 N/A VAL 232.A N ALA 266.A O no hydrogen 2.845 N/A THR 233.A N ASP 205.A O no hydrogen 2.798 N/A PHE 234.A N ALA 264.A O no hydrogen 2.847 N/A GLY 235.A N TYR 202.A O no hydrogen 2.872 N/A ASP 237.A N ASP 200.A O no hydrogen 2.760 N/A ARG 239.A NH2 LEU 293.A O no hydrogen 3.082 N/A GLN 240.A NE2 ASP 259.A OD1 no hydrogen 3.523 N/A VAL 241.A N ALA 258.A O no hydrogen 2.934 N/A ARG 242.A N GLU 291.A O no hydrogen 2.886 N/A ARG 242.A NE GLU 291.A OE1 no hydrogen 3.251 N/A ARG 242.A NH2 GLU 291.A OE1 no hydrogen 3.232 N/A ILE 243.A N VAL 256.A O no hydrogen 2.754 N/A SER 244.A N VAL 289.A O no hydrogen 2.933 N/A ILE 245.A N ALA 254.A O no hydrogen 2.678 N/A LEU 246.A N THR 287.A O no hydrogen 2.863 N/A ASP 247.A N THR 251.A O no hydrogen 2.932 N/A GLY 248.A N TYR 284.A OH no hydrogen 2.870 N/A GLU 249.A N ASP 247.A OD1 no hydrogen 2.941 N/A GLY 250.A N ASP 247.A O no hydrogen 2.961 N/A THR 251.A N ASP 247.A OD1 no hydrogen 2.858 N/A VAL 253.A N ILE 245.A O no hydrogen 2.880 N/A VAL 256.A N ILE 243.A O no hydrogen 2.897 N/A ALA 258.A N VAL 241.A O no hydrogen 2.824 N/A ILE 260.A N ARG 239.A O no hydrogen 2.854 N/A GLU 261.A N LYS 265.A O no hydrogen 2.740 N/A LYS 265.A N GLU 261.A O no hydrogen 2.888 N/A ALA 266.A N VAL 232.A O no hydrogen 2.897 N/A GLY 268.A N TYR 230.A O no hydrogen 2.980 N/A ILE 270.A N ILE 228.A O no hydrogen 2.876 N/A ILE 272.A N ALA 226.A O no hydrogen 2.876 N/A ASP 274.A N ALA 224.A O no hydrogen 2.842 N/A LYS 276.A N TYR 286.A OH no hydrogen 2.944 N/A LEU 277.A N CYS 221.A O no hydrogen 2.963 N/A TRP 278.A N ILE 307.A O no hydrogen 2.887 N/A TRP 278.A NE1 ASP 378.A O no hydrogen 2.739 N/A ASN 279.A N ALA 282.A O no hydrogen 3.113 N/A ASN 279.A ND2 ALA 220.A O no hydrogen 2.784 N/A GLY 281.A N GLY 381.A O no hydrogen 2.962 N/A ALA 282.A N ASN 279.A O no hydrogen 3.025 N/A TYR 286.A N PHE 305.A O no hydrogen 2.863 N/A THR 287.A N LEU 246.A O no hydrogen 2.887 N/A ALA 288.A N GLN 303.A O no hydrogen 2.819 N/A VAL 289.A N SER 244.A O no hydrogen 2.866 N/A ALA 290.A N TYR 301.A O no hydrogen 2.905 N/A GLU 291.A N ARG 242.A O no hydrogen 2.894 N/A LEU 292.A N ASP 299.A O no hydrogen 2.870 N/A LEU 293.A N GLN 240.A O no hydrogen 3.060 N/A ILE 298.A N LEU 292.A O no hydrogen 2.916 N/A TYR 301.A N ALA 290.A O no hydrogen 2.934 N/A TYR 301.A OH TYR 5.A O no hydrogen 2.650 N/A ARG 302.A N GLN 7.A OE1 no hydrogen 2.698 N/A GLN 303.A N ALA 288.A O no hydrogen 2.881 N/A GLN 303.A NE2 THR 304.A O no hydrogen 2.923 N/A PHE 305.A N TYR 286.A O no hydrogen 2.929 N/A ARG 308.A N THR 210.A OG1 no hydrogen 3.178 N/A ARG 308.A NE PRO 422.A O no hydrogen 2.882 N/A ARG 308.A NH1 ARG 308.A O no hydrogen 2.754 N/A ARG 308.A NH2 PRO 422.A O no hydrogen 3.331 N/A ARG 308.A NH2 ILE 424.A O no hydrogen 3.218 N/A THR 309.A N ASN 320.A OD1 no hydrogen 2.975 N/A GLU 311.A N LEU 318.A O no hydrogen 2.898 N/A SER 313.A N THR 316.A O no hydrogen 2.966 N/A THR 316.A N SER 313.A O no hydrogen 2.847 N/A THR 316.A OG1 SER 313.A O no hydrogen 2.566 N/A LEU 318.A N GLU 311.A O no hydrogen 2.865 N/A ILE 319.A N LYS 322.A O no hydrogen 2.887 N/A ASN 320.A N THR 309.A O no hydrogen 2.997 N/A ASN 320.A ND2 TRP 278.A O no hydrogen 2.976 N/A ASN 320.A ND2 ASN 279.A OD1 no hydrogen 2.730 N/A LYS 322.A N ILE 319.A O no hydrogen 2.898 N/A LYS 322.A NZ ALA 217.A O no hydrogen 3.264 N/A LYS 322.A NZ GLY 218.A O no hydrogen 3.443 N/A PHE 324.A N PHE 317.A O no hydrogen 2.712 N/A TYR 325.A N ASP 616.A O no hydrogen 3.014 N/A TYR 325.A OH GLU 569.A OE1 no hydrogen 2.508 N/A PHE 326.A N ILE 567.A O no hydrogen 3.014 N/A LYS 327.A N ASN 360.A OD1 no hydrogen 2.824 N/A LYS 327.A NZ HIS 358.A O no hydrogen 2.852 N/A LYS 327.A NZ TRP 611.A O no hydrogen 3.065 N/A LYS 327.A NZ ILE 614.A O no hydrogen 2.688 N/A GLY 328.A N GLU 569.A O no hydrogen 2.957 N/A GLY 330.A N LEU 571.A O no hydrogen 2.890 N/A LYS 331.A N ARG 363.A O no hydrogen 3.473 N/A LYS 331.A NZ ASP 350.A OD2 no hydrogen 2.831 N/A HIS 332.A ND1 TYR 367.A OH no hydrogen 2.788 N/A GLU 333.A N TYR 367.A OH no hydrogen 2.875 N/A SER 335.A N GLY 339.A O no hydrogen 3.127 N/A GLY 339.A N SER 335.A O no hydrogen 3.005 N/A ARG 340.A N SER 51.A OG no hydrogen 2.806 N/A ARG 340.A NE GLU 333.A O no hydrogen 2.870 N/A ARG 340.A NH1 PHE 183.A O no hydrogen 2.912 N/A ARG 340.A NH2 GLU 333.A O no hydrogen 3.173 N/A GLY 341.A N HIS 338.A O no hydrogen 2.828 N/A THR 342.A N ASN 189.A O no hydrogen 2.971 N/A LEU 346.A N ASP 343.A OD1 no hydrogen 3.218 N/A ASN 347.A N ASP 343.A O no hydrogen 2.903 N/A ASN 347.A ND2 ASP 344.A OD1 no hydrogen 3.080 N/A VAL 348.A N ASP 344.A O no hydrogen 2.920 N/A LYS 349.A N VAL 345.A O no hydrogen 2.976 N/A ASP 350.A N LEU 346.A O no hydrogen 2.850 N/A VAL 351.A N ASN 347.A O no hydrogen 2.915 N/A SER 352.A N VAL 348.A O no hydrogen 3.017 N/A SER 352.A OG LYS 349.A O no hydrogen 2.537 N/A LEU 353.A N LYS 349.A O no hydrogen 2.890 N/A ILE 354.A N ASP 350.A O no hydrogen 2.843 N/A HIS 355.A N VAL 351.A O no hydrogen 2.994 N/A HIS 355.A NE2 GLU 380.A OE1 no hydrogen 3.037 N/A TRP 356.A N SER 352.A O no hydrogen 2.879 N/A LEU 357.A N LEU 353.A O no hydrogen 2.893 N/A HIS 358.A N HIS 355.A O no hydrogen 2.952 N/A ALA 359.A N ILE 354.A O no hydrogen 3.017 N/A ASN 360.A N LYS 327.A O no hydrogen 2.831 N/A ASN 360.A ND2 TYR 325.A O no hydrogen 2.900 N/A ASN 360.A ND2 ASP 616.A OD1 no hydrogen 2.846 N/A SER 361.A OG LYS 327.A O no hydrogen 3.084 N/A SER 361.A OG ASN 360.A OD1 no hydrogen 3.116 N/A PHE 362.A N VAL 383.A O no hydrogen 3.045 N/A ARG 363.A N PHE 329.A O no hydrogen 3.286 N/A ARG 363.A NH1 GLU 387.A OE1 no hydrogen 2.740 N/A ARG 363.A NH1 ASN 431.A OD1 no hydrogen 2.895 N/A ARG 363.A NH2 THR 526.A O no hydrogen 3.385 N/A ARG 363.A NH2 GLU 527.A OE2 no hydrogen 3.114 N/A THR 364.A N ILE 385.A O no hydrogen 2.888 N/A THR 364.A OG1 TYR 367.A O no hydrogen 3.237 N/A THR 364.A OG1 ASP 386.A OD1 no hydrogen 3.371 N/A THR 364.A OG1 GLU 387.A O no hydrogen 3.466 N/A SER 365.A OG LYS 331.A O no hydrogen 2.814 N/A SER 365.A OG ARG 363.A O no hydrogen 3.527 N/A HIS 366.A ND1 GLU 387.A OE2 no hydrogen 2.965 N/A TYR 367.A N THR 364.A O no hydrogen 2.863 N/A TYR 367.A OH HIS 332.A ND1 no hydrogen 2.788 N/A TYR 367.A OH GLU 333.A O no hydrogen 3.336 N/A TYR 369.A N TYR 374.A OH no hydrogen 2.889 N/A TYR 369.A OH SER 365.A O no hydrogen 2.747 N/A ALA 370.A N GLU 333.A OE2 no hydrogen 2.869 N/A SER 372.A OG ASP 344.A OD1 no hydrogen 2.636 N/A MET 373.A N ALA 370.A O no hydrogen 3.060 N/A TYR 374.A OH ASP 386.A OD1 no hydrogen 2.629 N/A ASP 375.A N GLU 371.A O no hydrogen 3.055 N/A LEU 376.A N SER 372.A O no hydrogen 2.908 N/A CYS 377.A N MET 373.A O no hydrogen 2.926 N/A CYS 377.A SG MET 373.A O no hydrogen 3.421 N/A ASP 378.A N TYR 374.A O no hydrogen 2.870 N/A ARG 379.A N ASP 375.A O no hydrogen 3.007 N/A ILE 382.A N CYS 377.A O no hydrogen 3.133 N/A VAL 383.A N ASN 360.A O no hydrogen 2.837 N/A ILE 384.A N CYS 423.A O no hydrogen 2.726 N/A ILE 385.A N PHE 362.A O no hydrogen 2.988 N/A ASP 386.A N MET 426.A O no hydrogen 2.960 N/A GLU 387.A N THR 364.A OG1 no hydrogen 2.789 N/A VAL 388.A N SER 428.A O no hydrogen 3.294 N/A VAL 391.A N PRO 389.A O no hydrogen 2.869 N/A SER 394.A N GLN 397.A OE1 no hydrogen 2.888 N/A SER 394.A OG GLN 397.A OE1 no hydrogen 3.504 N/A TRP 395.A NE1 ARG 441.A O no hydrogen 2.743 N/A GLN 397.A N SER 394.A O no hydrogen 2.948 N/A GLN 397.A NE2 SER 141.A O no hydrogen 2.884 N/A TYR 398.A OH GLY 434.A O no hydrogen 2.682 N/A ASN 400.A N GLN 397.A O no hydrogen 2.904 N/A LEU 402.A N ASN 400.A OD1 no hydrogen 3.092 N/A ALA 404.A N ASN 400.A O no hydrogen 3.064 N/A GLU 405.A N PRO 401.A O no hydrogen 2.955 N/A ARG 406.A N LEU 402.A O no hydrogen 2.923 N/A ARG 406.A NH1 SER 142.A O no hydrogen 2.788 N/A HIS 407.A N VAL 403.A O no hydrogen 2.851 N/A HIS 407.A ND1 TYR 448.A OH no hydrogen 2.695 N/A HIS 407.A NE2 ILE 429.A O no hydrogen 2.683 N/A ARG 408.A N ALA 404.A O no hydrogen 2.969 N/A ARG 408.A NE GLU 405.A OE1 no hydrogen 3.320 N/A ARG 408.A NH2 GLU 405.A OE1 no hydrogen 2.857 N/A GLU 409.A N GLU 405.A O no hydrogen 2.892 N/A ALA 410.A N ARG 406.A O no hydrogen 2.897 N/A ILE 411.A N HIS 407.A O no hydrogen 2.970 N/A ARG 412.A N ARG 408.A O no hydrogen 2.939 N/A ARG 412.A NH2 GLU 405.A OE2 no hydrogen 3.276 N/A GLY 413.A N GLU 409.A O no hydrogen 2.858 N/A MET 414.A N ALA 410.A O no hydrogen 2.894 N/A ILE 415.A N ILE 411.A O no hydrogen 2.987 N/A ALA 416.A N ARG 412.A O no hydrogen 2.878 N/A ARG 417.A N GLY 413.A O no hydrogen 2.946 N/A ARG 417.A NE ASP 418.A OD1 no hydrogen 2.607 N/A ARG 417.A NE ASP 418.A OD2 no hydrogen 3.396 N/A ARG 417.A NH1 TYR 369.A O no hydrogen 2.895 N/A ARG 417.A NH2 TYR 369.A O no hydrogen 2.882 N/A ARG 417.A NH2 ASP 418.A OD2 no hydrogen 2.815 N/A ASP 418.A N MET 414.A O no hydrogen 2.900 N/A ASP 418.A N ILE 415.A O no hydrogen 3.304 N/A LYS 419.A NZ ASP 205.A OD1 no hydrogen 3.069 N/A LYS 419.A NZ ILE 206.A O no hydrogen 3.405 N/A LYS 419.A NZ ALA 416.A O no hydrogen 2.792 N/A ASN 420.A ND2 ILE 206.A O no hydrogen 2.873 N/A HIS 421.A N ASP 418.A O no hydrogen 3.233 N/A HIS 421.A ND1 ASP 378.A OD2 no hydrogen 2.593 N/A CYS 423.A N ASP 378.A OD1 no hydrogen 3.066 N/A CYS 423.A SG TYR 374.A O no hydrogen 3.711 N/A CYS 423.A SG ASP 378.A OD1 no hydrogen 3.155 N/A VAL 425.A N ILE 384.A O no hydrogen 2.976 N/A TRP 427.A N PRO 465.A O no hydrogen 3.157 N/A TRP 427.A NE1 ASP 460.A OD2 no hydrogen 3.013 N/A SER 428.A N ASP 386.A O no hydrogen 2.783 N/A SER 428.A OG GLU 387.A OE1 no hydrogen 2.851 N/A ILE 429.A N THR 467.A O no hydrogen 3.062 N/A ASN 431.A N ALA 390.A O no hydrogen 3.054 N/A GLU 432.A N VAL 469.A O no hydrogen 2.720 N/A GLY 434.A N MET 393.A O no hydrogen 3.046 N/A GLY 437.A N THR 477.A OG1 no hydrogen 3.092 N/A ARG 441.A N ASP 438.A O no hydrogen 3.453 N/A GLN 444.A N GLU 440.A O no hydrogen 2.802 N/A ALA 445.A N ARG 441.A O no hydrogen 2.933 N/A TYR 446.A N PRO 442.A O no hydrogen 2.939 N/A ASP 447.A N ARG 443.A O no hydrogen 2.875 N/A TYR 448.A N GLN 444.A O no hydrogen 2.957 N/A TYR 448.A OH HIS 407.A ND1 no hydrogen 2.695 N/A PHE 449.A N ALA 445.A O no hydrogen 2.946 N/A ARG 450.A N TYR 446.A O no hydrogen 2.906 N/A TYR 453.A N PHE 449.A O no hydrogen 2.874 N/A TYR 453.A OH ASP 485.A OD1 no hydrogen 2.544 N/A GLU 454.A N ARG 450.A O no hydrogen 2.887 N/A LEU 455.A N PRO 451.A O no hydrogen 2.839 N/A ALA 456.A N LEU 452.A O no hydrogen 2.980 N/A HIS 457.A N TYR 453.A O no hydrogen 3.243 N/A HIS 457.A ND1 ASN 463.A OD1 no hydrogen 2.705 N/A HIS 457.A NE2 ASP 485.A OD2 no hydrogen 2.641 N/A ALA 458.A N GLU 454.A O no hydrogen 2.936 N/A SER 459.A N LEU 455.A O no hydrogen 2.890 N/A SER 459.A OG LEU 455.A O no hydrogen 2.571 N/A GLN 462.A N ASP 460.A OD1 no hydrogen 3.049 N/A GLN 462.A NE2 THR 210.A O no hydrogen 3.018 N/A ASN 463.A N ASP 460.A O no hydrogen 2.794 N/A ARG 464.A N ASP 460.A OD2 no hydrogen 2.723 N/A ARG 464.A NE ILE 424.A O no hydrogen 3.007 N/A ARG 464.A NH1 LYS 419.A O no hydrogen 2.928 N/A ARG 464.A NH1 ASP 460.A OD1 no hydrogen 2.904 N/A ARG 464.A NH2 LYS 419.A O no hydrogen 3.131 N/A ARG 464.A NH2 ILE 424.A O no hydrogen 3.317 N/A VAL 466.A N ASP 485.A OD2 no hydrogen 2.617 N/A THR 467.A N TRP 427.A O no hydrogen 2.730 N/A THR 467.A OG1 VAL 486.A O no hydrogen 2.612 N/A VAL 469.A N ALA 430.A O no hydrogen 3.003 N/A CYS 470.A N CYS 488.A O no hydrogen 2.991 N/A CYS 470.A SG CYS 471.A O no hydrogen 3.333 N/A CYS 470.A SG ASP 478.A OD2 no hydrogen 3.339 N/A CYS 471.A SG GLN 472.A O no hydrogen 3.861 N/A ASN 473.A ND2 ASP 478.A OD2 no hydrogen 3.131 N/A ASP 474.A N ASP 436.A OD2 no hydrogen 2.884 N/A THR 476.A N ASP 474.A OD1 no hydrogen 3.117 N/A THR 476.A OG1 ASP 474.A OD1 no hydrogen 2.511 N/A THR 476.A OG1 ASP 474.A OD2 no hydrogen 3.448 N/A THR 477.A N ASP 474.A O no hydrogen 3.145 N/A THR 477.A OG1 ASP 474.A O no hydrogen 3.265 N/A ASP 478.A N ASP 474.A O no hydrogen 3.151 N/A THR 480.A N ASP 478.A OD1 no hydrogen 2.789 N/A GLU 481.A N ASP 478.A OD1 no hydrogen 3.077 N/A THR 483.A N THR 480.A O no hydrogen 2.960 N/A THR 483.A OG1 THR 480.A O no hydrogen 2.675 N/A MET 484.A N GLU 481.A O no hydrogen 3.034 N/A ASP 485.A N VAL 466.A O no hydrogen 2.994 N/A VAL 487.A N PRO 522.A O no hydrogen 2.930 N/A CYS 488.A N GLU 481.A OE2 no hydrogen 2.970 N/A CYS 488.A SG THR 467.A OG1 no hydrogen 3.321 N/A ILE 489.A N MET 524.A O no hydrogen 2.986 N/A ASN 490.A N CYS 470.A O no hydrogen 2.836 N/A ASN 490.A ND2 ASN 431.A OD1 no hydrogen 3.476 N/A ASN 490.A ND2 GLU 432.A OE2 no hydrogen 3.146 N/A ARG 491.A N GLU 527.A O no hydrogen 3.005 N/A ARG 491.A NE GLU 512.A OE1 no hydrogen 3.002 N/A ARG 491.A NE GLU 512.A OE2 no hydrogen 2.659 N/A ARG 491.A NH1 CYS 470.A O no hydrogen 3.364 N/A ARG 491.A NH1 ASN 490.A O no hydrogen 2.808 N/A ARG 491.A NH2 GLU 512.A OE2 no hydrogen 2.649 N/A TYR 492.A N GLN 472.A OE1 no hydrogen 2.845 N/A TYR 492.A OH GLU 527.A OE1 no hydrogen 2.643 N/A TYR 493.A OH GLU 512.A OE1 no hydrogen 2.437 N/A GLY 494.A N ASN 497.A O no hydrogen 2.747 N/A TRP 495.A N TYR 492.A O no hydrogen 3.017 N/A TYR 496.A N TYR 492.A O no hydrogen 3.183 N/A ASN 497.A ND2 GLN 472.A OE1 no hydrogen 3.372 N/A SER 499.A OG TRP 495.A O no hydrogen 2.863 N/A GLY 500.A N GLY 494.A O no hydrogen 2.914 N/A ASP 501.A N LEU 498.A O no hydrogen 3.049 N/A ALA 504.A N ASP 501.A OD1 no hydrogen 3.216 N/A ALA 505.A N ASP 501.A O no hydrogen 2.954 N/A CYS 506.A N LEU 502.A O no hydrogen 2.920 N/A CYS 506.A SG LEU 502.A O no hydrogen 3.238 N/A HIS 507.A N ASP 503.A O no hydrogen 2.964 N/A ALA 508.A N ALA 504.A O no hydrogen 2.907 N/A LEU 509.A N ALA 505.A O no hydrogen 2.909 N/A ASN 510.A N CYS 506.A O no hydrogen 2.898 N/A ASN 510.A ND2 GLU 559.A OE1 no hydrogen 2.845 N/A ILE 511.A N HIS 507.A O no hydrogen 2.981 N/A GLU 512.A N ALA 508.A O no hydrogen 3.027 N/A LEU 513.A N LEU 509.A O no hydrogen 2.826 N/A ASP 514.A N ASN 510.A O no hydrogen 2.885 N/A PHE 515.A N ILE 511.A O no hydrogen 3.072 N/A TRP 516.A N GLU 512.A O no hydrogen 2.939 N/A TRP 516.A NE1 GLU 512.A OE2 no hydrogen 2.921 N/A GLU 517.A N LEU 513.A O no hydrogen 2.879 N/A ILE 519.A N TRP 516.A O no hydrogen 3.186 N/A VAL 523.A N TRP 565.A O no hydrogen 3.166 N/A MET 524.A N VAL 487.A O no hydrogen 2.889 N/A PHE 525.A N GLY 568.A O no hydrogen 3.159 N/A THR 526.A N ILE 489.A O no hydrogen 2.936 N/A THR 526.A OG1 ASN 490.A OD1 no hydrogen 2.590 N/A TYR 528.A OH ASN 557.A OD1 no hydrogen 2.590 N/A THR 532.A N ARG 590.A O no hydrogen 2.726 N/A THR 532.A OG1 ALA 530.A O no hydrogen 2.802 N/A ILE 533.A N PHE 544.A O no hydrogen 3.021 N/A GLU 534.A N GLU 534.A OE1 no hydrogen 2.685 N/A GLY 535.A N GLU 546.A OE2 no hydrogen 2.810 N/A ILE 536.A N ILE 533.A O no hydrogen 3.080 N/A HIS 537.A ND1 GLU 547.A OE2 no hydrogen 2.527 N/A GLY 538.A N GLU 547.A OE1 no hydrogen 3.077 N/A SER 545.A N GLU 542.A O no hydrogen 2.920 N/A SER 545.A OG GLU 542.A O no hydrogen 2.622 N/A GLU 546.A N ILE 536.A O no hydrogen 3.009 N/A GLU 547.A N GLU 547.A OE1 no hydrogen 2.733 N/A PHE 548.A N SER 545.A OG no hydrogen 3.104 N/A GLN 549.A N SER 545.A O no hydrogen 3.418 N/A GLN 549.A NE2 GLY 592.A O no hydrogen 3.170 N/A ARG 550.A N GLU 546.A O no hydrogen 3.032 N/A ASP 551.A N GLU 547.A O no hydrogen 2.852 N/A TYR 552.A N PHE 548.A O no hydrogen 2.836 N/A TYR 552.A OH TYR 493.A O no hydrogen 2.734 N/A TYR 553.A N GLN 549.A O no hydrogen 3.082 N/A TYR 553.A OH TYR 528.A O no hydrogen 2.709 N/A ALA 554.A N ARG 550.A O no hydrogen 2.971 N/A ARG 555.A N ASP 551.A O no hydrogen 2.936 N/A ARG 555.A NH1 ASP 503.A OD1 no hydrogen 2.919 N/A ARG 555.A NH2 ASP 503.A OD1 no hydrogen 3.008 N/A ILE 556.A N TYR 552.A O no hydrogen 3.025 N/A ASN 557.A N TYR 553.A O no hydrogen 2.941 N/A ALA 558.A N ALA 554.A O no hydrogen 3.015 N/A GLU 559.A N ARG 555.A O no hydrogen 3.054 N/A ILE 560.A N ILE 556.A O no hydrogen 3.001 N/A ASP 561.A N ASN 557.A O no hydrogen 2.996 N/A LYS 562.A N GLU 559.A O no hydrogen 3.242 N/A LYS 562.A NZ GLU 559.A OE1 no hydrogen 3.364 N/A ARG 563.A N ILE 560.A O no hydrogen 3.094 N/A ARG 563.A NH1 ASP 514.A OD1 no hydrogen 2.919 N/A ARG 563.A NH1 GLU 517.A OE2 no hydrogen 3.139 N/A ARG 563.A NH2 ASN 510.A OD1 no hydrogen 2.931 N/A ARG 563.A NH2 ASP 514.A OD1 no hydrogen 2.963 N/A TRP 565.A NE1 GLU 517.A OE2 no hydrogen 3.029 N/A PHE 566.A N ARG 563.A O no hydrogen 3.081 N/A ILE 567.A N VAL 523.A O no hydrogen 2.861 N/A GLU 569.A N PHE 326.A O no hydrogen 2.793 N/A GLN 570.A N PHE 525.A O no hydrogen 2.929 N/A GLN 570.A NE2 SER 361.A OG no hydrogen 3.076 N/A LEU 571.A N GLY 328.A O no hydrogen 2.907 N/A TRP 572.A N TYR 528.A O no hydrogen 3.014 N/A ASN 573.A N LYS 591.A O no hydrogen 2.789 N/A PHE 574.A N GLY 330.A O no hydrogen 3.048 N/A ALA 575.A N ASN 573.A OD1 no hydrogen 2.882 N/A ASP 576.A N LEU 594.A O no hydrogen 3.025 N/A PHE 577.A N ASN 589.A O no hydrogen 3.159 N/A ALA 578.A N ASP 334.A OD2 no hydrogen 2.967 N/A THR 579.A OG1 PHE 580.A O no hydrogen 2.828 N/A ARG 585.A N GLY 582.A O no hydrogen 3.186 N/A ARG 585.A NE ASP 181.A OD1 no hydrogen 2.899 N/A ARG 585.A NE ASP 181.A OD2 no hydrogen 3.324 N/A ARG 585.A NH1 ILE 584.A O no hydrogen 2.940 N/A ARG 585.A NH2 ASP 181.A OD2 no hydrogen 2.993 N/A ARG 585.A NH2 TYR 496.A OH no hydrogen 3.083 N/A ASN 589.A N PHE 577.A O no hydrogen 2.906 N/A ASN 589.A ND2 ASP 181.A OD2 no hydrogen 2.760 N/A ARG 590.A N ASP 531.A OD2 no hydrogen 2.945 N/A ARG 590.A NE ASP 576.A OD2 no hydrogen 2.866 N/A ARG 590.A NH1 VAL 586.A O no hydrogen 2.926 N/A ARG 590.A NH2 GLU 534.A OE1 no hydrogen 2.854 N/A LYS 591.A N ASN 589.A OD1 no hydrogen 2.937 N/A LYS 591.A NZ TYR 496.A OH no hydrogen 2.790 N/A LYS 591.A NZ ASP 531.A OD1 no hydrogen 2.701 N/A ILE 593.A N ASN 573.A O no hydrogen 2.998 N/A LEU 594.A N PHE 574.A O no hydrogen 3.153 N/A THR 595.A N GLN 599.A O no hydrogen 2.699 N/A THR 595.A OG1 GLN 599.A OE1 no hydrogen 3.004 N/A ARG 596.A NE ASP 334.A OD1 no hydrogen 2.742 N/A ARG 596.A NH2 ASP 334.A OD1 no hydrogen 3.283 N/A ARG 596.A NH2 ASP 334.A OD2 no hydrogen 3.024 N/A ASP 597.A N THR 595.A OG1 no hydrogen 3.297 N/A ARG 598.A N THR 595.A O no hydrogen 2.805 N/A ARG 598.A NE ASP 350.A OD1 no hydrogen 2.820 N/A ARG 598.A NH1 ARG 596.A O no hydrogen 3.193 N/A ARG 598.A NH2 ASP 350.A OD2 no hydrogen 2.861 N/A GLN 599.A N THR 595.A OG1 no hydrogen 2.968 N/A LYS 601.A N ILE 593.A O no hydrogen 2.980 N/A LYS 601.A NZ THR 532.A O no hydrogen 2.784 N/A LYS 601.A NZ ASP 576.A OD1 no hydrogen 2.854 N/A LYS 601.A NZ ASP 576.A OD2 no hydrogen 3.001 N/A LYS 601.A NZ GLY 592.A O no hydrogen 2.755 N/A MET 602.A N GLU 546.A OE1 no hydrogen 3.002 N/A ALA 604.A N LYS 601.A O no hydrogen 2.789 N/A HIS 605.A N LYS 601.A O no hydrogen 3.436 N/A TRP 606.A N MET 602.A O no hydrogen 3.028 N/A LEU 607.A N ALA 603.A O no hydrogen 2.848 N/A ARG 608.A N ALA 604.A O no hydrogen 2.876 N/A ARG 608.A NE TRP 356.A O no hydrogen 2.750 N/A GLU 609.A N HIS 605.A O no hydrogen 2.984 N/A ARG 610.A N TRP 606.A O no hydrogen 2.921 N/A ARG 610.A NE GLU 569.A OE2 no hydrogen 2.880 N/A ARG 610.A NH1 ASP 561.A OD2 no hydrogen 2.856 N/A ARG 610.A NH2 ASP 561.A OD1 no hydrogen 2.932 N/A ARG 610.A NH2 ASP 561.A OD2 no hydrogen 3.489 N/A ARG 610.A NH2 GLU 569.A OE1 no hydrogen 2.686 N/A ARG 610.A NH2 GLU 569.A OE2 no hydrogen 3.531 N/A TRP 611.A N LEU 607.A O no hydrogen 2.846 N/A TRP 611.A NE1 GLU 569.A OE2 no hydrogen 2.790 N/A ALA 612.A N ARG 608.A O no hydrogen 2.953 N/A GLY 613.A N ARG 610.A O no hydrogen 3.106 N/A ILE 614.A N TRP 611.A O no hydrogen 3.208 N/A TYR 617.A OH ASN 279.A OD1 no hydrogen 2.898 N/A GLY 618.A N PRO 323.A O no hydrogen 3.051 N/A TYR 619.A OH ASP 561.A OD1 no hydrogen 2.637 N/A LYS 620.A NZ ILE 560.A O no hydrogen 2.953 N/A LYS 620.A NZ ARG 563.A O no hydrogen 2.801 N/A LYS 620.A NZ PHE 566.A O no hydrogen 2.758 N/A