Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 5urd_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LYS 4.A NZ GLU 54.A O no hydrogen 2.939 N/A LYS 4.A NZ TYR 56.A O no hydrogen 2.800 N/A LYS 4.A NZ ASP 90.A OD2 no hydrogen 2.853 N/A GLU 5.A N GLU 55.A O no hydrogen 2.712 N/A GLU 10.A N SER 7.A OG no hydrogen 3.150 N/A LYS 11.A N SER 7.A O no hydrogen 3.115 N/A LYS 11.A NZ SER 6.A O no hydrogen 3.489 N/A MET 12.A N PHE 8.A O no hydrogen 2.861 N/A LYS 13.A N VAL 9.A O no hydrogen 2.915 N/A LYS 13.A NZ GLU 10.A OE2 no hydrogen 3.256 N/A LYS 13.A NZ GLU 66.A OE2 no hydrogen 2.571 N/A LYS 14.A N GLU 10.A O no hydrogen 3.021 N/A THR 15.A N LYS 11.A O no hydrogen 3.074 N/A THR 15.A N MET 12.A O no hydrogen 3.229 N/A THR 15.A OG1 LYS 11.A O no hydrogen 2.841 N/A THR 15.A OG1 MET 12.A O no hydrogen 3.459 N/A GLY 16.A N LYS 13.A O no hydrogen 3.486 N/A ARG 17.A N MET 12.A O no hydrogen 2.870 N/A ARG 17.A NH1 ASP 288.A OD2 no hydrogen 3.449 N/A ARG 17.A NH2 ASP 288.A OD2 no hydrogen 3.017 N/A ASN 18.A N ARG 47.A O no hydrogen 2.948 N/A ASN 18.A ND2 LYS 69.A O no hydrogen 3.171 N/A ILE 19.A N ARG 47.A O no hydrogen 3.209 N/A ILE 20.A N LEU 71.A O no hydrogen 3.131 N/A VAL 21.A N MET 49.A O no hydrogen 2.900 N/A PHE 22.A N VAL 73.A O no hydrogen 2.904 N/A TYR 23.A N ALA 51.A O no hydrogen 3.211 N/A GLY 24.A N CYS 75.A O no hydrogen 2.823 N/A SER 25.A N ASN 87.A OD1 no hydrogen 3.091 N/A GLN 26.A NE2 ASP 86.A OD2 no hydrogen 2.894 N/A THR 27.A OG1 TYR 79.A OH no hydrogen 3.286 N/A GLU 32.A N GLY 28.A O no hydrogen 3.024 N/A PHE 33.A N THR 29.A O no hydrogen 3.107 N/A ALA 34.A N ALA 30.A O no hydrogen 2.921 N/A ASN 35.A N GLU 31.A O no hydrogen 3.018 N/A ARG 36.A N GLU 32.A O no hydrogen 2.949 N/A ARG 36.A NH1 GLU 152.A OE1 no hydrogen 3.065 N/A ARG 36.A NH1 GLU 152.A OE2 no hydrogen 3.298 N/A ARG 36.A NH2 GLU 152.A OE2 no hydrogen 3.033 N/A LEU 37.A N PHE 33.A O no hydrogen 2.914 N/A SER 38.A N ALA 34.A O no hydrogen 2.864 N/A LYS 39.A N ASN 35.A O no hydrogen 2.988 N/A ASP 40.A N ARG 36.A O no hydrogen 2.932 N/A ALA 41.A N LEU 37.A O no hydrogen 3.303 N/A ARG 43.A N ASP 40.A O no hydrogen 2.890 N/A TYR 44.A N ALA 41.A O no hydrogen 2.958 N/A GLY 45.A N HIS 42.A O no hydrogen 3.244 N/A MET 46.A N ALA 41.A O no hydrogen 3.063 N/A ARG 47.A N ASN 18.A OD1 no hydrogen 2.948 N/A MET 49.A N ILE 19.A O no hydrogen 3.071 N/A SER 50.A OG ASN 35.A OD1 no hydrogen 2.848 N/A ALA 51.A N VAL 21.A O no hydrogen 2.827 N/A GLU 54.A N ASP 52.A OD1 no hydrogen 2.804 N/A GLU 55.A N ASP 52.A O no hydrogen 3.045 N/A TYR 56.A N PRO 53.A O no hydrogen 3.125 N/A ALA 59.A N ASP 57.A OD1 no hydrogen 3.064 N/A ASP 60.A N ASP 57.A O no hydrogen 3.168 N/A LEU 61.A N LEU 58.A O no hydrogen 3.000 N/A SER 62.A N ALA 59.A O no hydrogen 3.329 N/A SER 62.A OG ALA 59.A O no hydrogen 3.102 N/A SER 63.A N ASP 60.A O no hydrogen 2.861 N/A LEU 64.A N LEU 61.A O no hydrogen 2.998 N/A GLU 66.A N SER 63.A O no hydrogen 2.942 N/A ILE 67.A N LEU 64.A O no hydrogen 3.002 N/A LYS 69.A NZ PHE 170.A O no hydrogen 3.263 N/A SER 70.A OG LEU 64.A O no hydrogen 2.904 N/A SER 70.A OG ILE 67.A O no hydrogen 2.994 N/A LEU 71.A N ASN 18.A O no hydrogen 2.938 N/A VAL 72.A N LYS 106.A O no hydrogen 3.046 N/A VAL 73.A N ILE 20.A O no hydrogen 2.914 N/A PHE 74.A N ALA 108.A O no hydrogen 3.009 N/A CYS 75.A N PHE 22.A O no hydrogen 2.883 N/A MET 76.A N PHE 110.A O no hydrogen 3.035 N/A ALA 77.A N GLY 24.A O no hydrogen 2.942 N/A THR 78.A N LEU 112.A O no hydrogen 3.072 N/A TYR 79.A N ASP 83.A O no hydrogen 2.758 N/A ASP 83.A N TYR 79.A O no hydrogen 2.880 N/A THR 85.A OG1 ASN 87.A OD1 no hydrogen 2.586 N/A ASN 87.A ND2 TYR 23.A O no hydrogen 2.845 N/A ASN 87.A ND2 ASP 52.A OD1 no hydrogen 3.076 N/A ALA 88.A N THR 85.A O no hydrogen 2.891 N/A GLN 89.A N ASP 86.A O no hydrogen 3.422 N/A TYR 92.A N ALA 88.A O no hydrogen 2.904 N/A ASP 93.A N GLN 89.A O no hydrogen 2.913 N/A TRP 94.A N ASP 90.A O no hydrogen 3.002 N/A LEU 95.A N PHE 91.A O no hydrogen 2.827 N/A GLN 96.A N TYR 92.A O no hydrogen 3.157 N/A GLU 97.A N ASP 93.A O no hydrogen 3.167 N/A THR 98.A N TRP 94.A O no hydrogen 2.727 N/A VAL 100.A N THR 98.A OG1 no hydrogen 3.021 N/A LEU 102.A N LEU 134.A O no hydrogen 2.886 N/A THR 103.A N ASP 101.A OD1 no hydrogen 2.932 N/A THR 103.A OG1 ASP 101.A OD1 no hydrogen 2.516 N/A THR 103.A OG1 ASP 101.A OD2 no hydrogen 3.337 N/A VAL 105.A N LEU 102.A O no hydrogen 2.936 N/A PHE 107.A N GLN 137.A O no hydrogen 3.173 N/A ALA 108.A N VAL 72.A O no hydrogen 3.185 N/A PHE 110.A N PHE 74.A O no hydrogen 2.843 N/A GLY 111.A N GLY 143.A O no hydrogen 2.671 N/A LEU 112.A N MET 76.A O no hydrogen 2.854 N/A GLY 113.A N GLY 145.A O no hydrogen 2.996 N/A LYS 115.A N ASP 146.A OD1 no hydrogen 3.004 N/A THR 116.A N ASN 114.A OD1 no hydrogen 2.795 N/A THR 116.A OG1 ASN 114.A OD1 no hydrogen 2.727 N/A TYR 117.A N ASN 114.A O no hydrogen 3.018 N/A ALA 122.A N HIS 119.A O no hydrogen 3.416 N/A MET 123.A N THR 78.A OG1 no hydrogen 3.004 N/A LYS 125.A N ASN 121.A O no hydrogen 2.990 N/A LYS 125.A NZ PHE 120.A O no hydrogen 3.317 N/A TYR 126.A N ALA 122.A O no hydrogen 2.952 N/A VAL 127.A N MET 123.A O no hydrogen 2.964 N/A ASP 128.A N GLY 124.A O no hydrogen 2.985 N/A GLN 129.A N LYS 125.A O no hydrogen 2.983 N/A ARG 130.A N TYR 126.A O no hydrogen 2.776 N/A ARG 130.A NE LEU 95.A O no hydrogen 2.796 N/A ARG 130.A NH1 GLN 133.A OE1 no hydrogen 2.993 N/A ARG 130.A NH2 LEU 95.A O no hydrogen 3.270 N/A LEU 131.A N VAL 127.A O no hydrogen 3.038 N/A GLN 133.A N GLN 129.A O no hydrogen 3.062 N/A LEU 134.A N ARG 130.A O no hydrogen 2.931 N/A GLY 135.A N GLU 132.A O no hydrogen 2.986 N/A ALA 136.A N LEU 131.A O no hydrogen 2.953 N/A GLN 137.A N VAL 105.A O no hydrogen 2.867 N/A ARG 138.A NE ASP 128.A OD1 no hydrogen 2.712 N/A ARG 138.A NH1 GLU 132.A OE1 no hydrogen 2.972 N/A ARG 138.A NH1 GLU 132.A OE2 no hydrogen 3.484 N/A ARG 138.A NH2 ASP 128.A O no hydrogen 3.310 N/A ARG 138.A NH2 ASP 128.A OD1 no hydrogen 3.545 N/A ARG 138.A NH2 ASP 128.A OD2 no hydrogen 3.028 N/A ARG 138.A NH2 GLU 132.A OE2 no hydrogen 2.993 N/A ILE 139.A N PHE 107.A O no hydrogen 2.783 N/A GLY 143.A N VAL 109.A O no hydrogen 2.808 N/A GLY 145.A N GLY 111.A O no hydrogen 2.711 N/A ASP 146.A N ASP 154.A OD2 no hydrogen 2.912 N/A ASP 147.A N GLY 113.A O no hydrogen 2.810 N/A ASP 148.A N ASP 146.A OD1 no hydrogen 2.820 N/A GLY 149.A N ASP 146.A O no hydrogen 3.163 N/A GLU 153.A N ASN 150.A OD1 no hydrogen 2.932 N/A ASP 154.A N ASN 150.A O no hydrogen 3.168 N/A PHE 155.A N LEU 151.A O no hydrogen 2.849 N/A ILE 156.A N GLU 152.A O no hydrogen 2.930 N/A THR 157.A N GLU 153.A O no hydrogen 2.918 N/A THR 157.A OG1 GLU 153.A O no hydrogen 2.831 N/A TRP 158.A N ASP 154.A O no hydrogen 3.041 N/A TRP 158.A NE1 GLU 141.A O no hydrogen 2.920 N/A ARG 159.A N PHE 155.A O no hydrogen 2.816 N/A ARG 159.A NE ASP 40.A OD2 no hydrogen 2.520 N/A ARG 159.A NH2 ASP 40.A OD1 no hydrogen 2.905 N/A GLU 160.A N ILE 156.A O no hydrogen 2.931 N/A GLN 161.A N TRP 158.A O no hydrogen 3.067 N/A PHE 162.A N TRP 158.A O no hydrogen 2.791 N/A TRP 163.A N ARG 159.A O no hydrogen 3.339 N/A TRP 163.A NE1 ASP 40.A OD2 no hydrogen 2.995 N/A ALA 165.A N GLN 161.A O no hydrogen 3.211 N/A VAL 166.A N PHE 162.A O no hydrogen 2.877 N/A CYS 167.A N TRP 163.A O no hydrogen 2.806 N/A CYS 167.A SG TRP 163.A O no hydrogen 3.207 N/A GLU 168.A N PRO 164.A O no hydrogen 2.837 N/A PHE 169.A N ALA 165.A O no hydrogen 3.005 N/A PHE 170.A N VAL 166.A O no hydrogen 2.968 N/A VAL 172.A N CYS 167.A O no hydrogen 2.930 N/A SER 177.A OG GLU 324.A OE2 no hydrogen 2.814 N/A ARG 179.A NE GLU 382.A OE2 no hydrogen 2.988 N/A ARG 179.A NH1 ASP 378.A OD2 no hydrogen 2.481 N/A ARG 179.A NH2 ASP 378.A OD2 no hydrogen 2.978 N/A ARG 179.A NH2 GLU 382.A OE2 no hydrogen 3.186 N/A GLN 180.A N GLU 382.A OE1 no hydrogen 2.846 N/A GLN 180.A NE2 GLN 180.A O no hydrogen 3.679 N/A GLN 180.A NE2 ASN 286.A OD1 no hydrogen 2.853 N/A TYR 181.A N GLU 382.A OE2 no hydrogen 3.355 N/A GLU 182.A N ASN 285.A O no hydrogen 2.877 N/A VAL 184.A N SER 283.A O no hydrogen 2.959 N/A HIS 186.A N ILE 281.A O no hydrogen 2.906 N/A LYS 193.A N ASP 190.A O no hydrogen 2.935 N/A VAL 194.A N VAL 191.A O no hydrogen 3.073 N/A TYR 195.A N PRO 300.A O no hydrogen 2.904 N/A TYR 195.A OH GLY 200.A O no hydrogen 3.031 N/A THR 196.A N GLU 198.A OE1 no hydrogen 2.647 N/A THR 196.A OG1 GLU 198.A OE1 no hydrogen 3.560 N/A GLU 198.A N GLU 198.A OE1 no hydrogen 2.676 N/A LYS 203.A N GLU 198.A OE2 no hydrogen 2.694 N/A LYS 203.A NZ ALA 192.A O no hydrogen 3.316 N/A SER 204.A N ARG 201.A O no hydrogen 2.918 N/A SER 204.A OG ARG 201.A O no hydrogen 2.593 N/A ASN 207.A N LYS 203.A O no hydrogen 2.824 N/A GLN 208.A NE2 SER 204.A O no hydrogen 3.031 N/A GLN 208.A NE2 PRO 217.A O no hydrogen 3.145 N/A ASP 213.A N ASN 216.A O no hydrogen 2.896 N/A LYS 215.A N ASP 213.A OD1 no hydrogen 3.054 N/A ASN 216.A N ASP 213.A O no hydrogen 2.949 N/A ASN 216.A N ASP 213.A OD1 no hydrogen 2.997 N/A ASN 216.A ND2 LYS 209.A O no hydrogen 2.775 N/A ASN 216.A ND2 PRO 211.A O no hydrogen 3.022 N/A PHE 218.A N MET 442.A O no hydrogen 2.839 N/A LEU 219.A N GLN 208.A OE1 no hydrogen 2.779 N/A ALA 220.A N VAL 440.A O no hydrogen 2.941 N/A VAL 222.A N ALA 438.A O no hydrogen 2.833 N/A THR 223.A N GLU 240.A O no hydrogen 2.864 N/A THR 223.A OG1 GLU 240.A O no hydrogen 3.156 N/A ASN 225.A ND2 ARG 431.A O no hydrogen 3.276 N/A ASN 225.A ND2 LYS 433.A O no hydrogen 2.807 N/A ARG 226.A N HIS 238.A O no hydrogen 2.959 N/A ARG 226.A NH2 GLU 509.A OE2 no hydrogen 2.872 N/A LYS 227.A NZ ASN 229.A OD1 no hydrogen 3.055 N/A LYS 227.A NZ GLY 231.A O no hydrogen 3.137 N/A LEU 228.A N LEU 236.A O no hydrogen 2.698 N/A ASN 229.A ND2 ARG 234.A O no hydrogen 2.738 N/A GLN 230.A NE2 TYR 504.A O no hydrogen 3.110 N/A GLY 231.A N GLU 502.A O no hydrogen 2.800 N/A GLU 233.A N GLU 502.A OE1 no hydrogen 3.037 N/A ARG 234.A NH1 ASP 503.A OD2 no hydrogen 3.288 N/A LEU 236.A N ASN 229.A OD1 no hydrogen 2.948 N/A MET 237.A N ALA 409.A O no hydrogen 2.826 N/A HIS 238.A N ARG 226.A O no hydrogen 2.874 N/A HIS 238.A ND1 TYR 506.A OH no hydrogen 2.593 N/A HIS 238.A NE2 GLU 240.A OE1 no hydrogen 2.921 N/A LEU 239.A N ILE 407.A O no hydrogen 2.813 N/A GLU 240.A N ALA 224.A O no hydrogen 2.874 N/A LEU 241.A N VAL 405.A O no hydrogen 2.841 N/A ASP 242.A N ALA 221.A O no hydrogen 2.839 N/A ILE 243.A N ASN 403.A O no hydrogen 3.020 N/A SER 244.A N ASP 242.A OD1 no hydrogen 2.839 N/A SER 244.A OG ASP 242.A OD1 no hydrogen 2.760 N/A SER 246.A OG ILE 243.A O no hydrogen 2.656 N/A ILE 248.A N SER 246.A OG no hydrogen 3.020 N/A TYR 250.A OH SER 396.A OG no hydrogen 2.875 N/A TYR 250.A OH HIS 401.A O no hydrogen 2.708 N/A TYR 250.A OH SER 404.A O no hydrogen 2.793 N/A GLU 251.A N ASP 254.A OD2 no hydrogen 2.739 N/A SER 252.A OG SER 396.A O no hydrogen 3.345 N/A SER 252.A OG GLU 477.A OE1 no hydrogen 3.370 N/A ASP 254.A N GLU 251.A O no hydrogen 3.065 N/A HIS 255.A N ARG 445.A O no hydrogen 3.095 N/A HIS 255.A NE2 ASP 606.A OD1 no hydrogen 2.849 N/A VAL 256.A N TYR 392.A O no hydrogen 2.832 N/A ALA 257.A N PHE 443.A O no hydrogen 2.792 N/A VAL 258.A N ARG 390.A O no hydrogen 2.930 N/A TYR 259.A N PRO 441.A O no hydrogen 3.120 N/A TYR 259.A OH ALA 214.A O no hydrogen 2.748 N/A ASN 262.A N THR 308.A O no hydrogen 2.821 N/A ASN 262.A ND2 LEU 307.A O no hydrogen 2.830 N/A ASN 262.A ND2 LEU 311.A O no hydrogen 2.802 N/A LEU 266.A N ASP 263.A OD1 no hydrogen 3.079 N/A VAL 267.A N ASP 263.A O no hydrogen 3.176 N/A ASN 268.A N SER 264.A O no hydrogen 2.870 N/A GLN 269.A N ALA 265.A O no hydrogen 2.976 N/A ILE 270.A N LEU 266.A O no hydrogen 3.039 N/A GLY 271.A N VAL 267.A O no hydrogen 3.214 N/A GLU 272.A N ASN 268.A O no hydrogen 2.846 N/A ILE 273.A N GLN 269.A O no hydrogen 2.825 N/A LEU 274.A N ILE 270.A O no hydrogen 3.155 N/A GLY 275.A N GLU 272.A O no hydrogen 3.102 N/A ALA 276.A N GLY 271.A O no hydrogen 2.985 N/A ASP 279.A N ASP 277.A OD1 no hydrogen 2.951 N/A VAL 280.A N ASP 277.A O no hydrogen 3.402 N/A MET 282.A N THR 301.A O no hydrogen 2.847 N/A SER 283.A N VAL 184.A O no hydrogen 2.981 N/A ASN 285.A N GLU 182.A O no hydrogen 3.004 N/A ASN 286.A N LYS 294.A O no hydrogen 2.975 N/A ASN 286.A ND2 LYS 293.A O no hydrogen 2.794 N/A LEU 287.A N GLN 180.A O no hydrogen 2.812 N/A ASP 288.A N ASN 286.A OD1 no hydrogen 2.851 N/A GLU 290.A N ASP 288.A OD1 no hydrogen 2.924 N/A SER 291.A N ASP 288.A O no hydrogen 3.201 N/A LYS 293.A N SER 291.A OG no hydrogen 3.068 N/A LYS 294.A NZ GLU 289.A O no hydrogen 2.816 N/A HIS 295.A ND1 LEU 284.A O no hydrogen 2.840 N/A CYS 299.A SG PHE 297.A O no hydrogen 3.402 N/A THR 301.A N MET 282.A O no hydrogen 2.899 N/A THR 301.A OG1 TYR 195.A O no hydrogen 2.951 N/A THR 302.A OG1 THR 305.A OG1 no hydrogen 2.991 N/A ARG 304.A N LEU 278.A O no hydrogen 2.870 N/A ARG 304.A NE ASP 279.A OD1 no hydrogen 2.855 N/A ARG 304.A NH2 ASP 279.A OD1 no hydrogen 3.492 N/A ARG 304.A NH2 ASP 279.A OD2 no hydrogen 2.848 N/A THR 305.A N THR 302.A OG1 no hydrogen 3.069 N/A THR 305.A OG1 THR 302.A OG1 no hydrogen 2.991 N/A ALA 306.A N THR 302.A O no hydrogen 3.072 N/A LEU 307.A N TYR 303.A O no hydrogen 2.911 N/A THR 308.A N ARG 304.A O no hydrogen 3.009 N/A THR 308.A N THR 305.A O no hydrogen 3.246 N/A THR 308.A OG1 ARG 304.A O no hydrogen 2.617 N/A TYR 309.A N THR 305.A O no hydrogen 2.837 N/A TYR 310.A N ALA 306.A O no hydrogen 2.894 N/A TYR 310.A OH GLU 198.A O no hydrogen 2.601 N/A LEU 311.A N ALA 306.A O no hydrogen 2.840 N/A ASP 312.A N PRO 385.A O no hydrogen 2.836 N/A THR 314.A N ASP 312.A OD1 no hydrogen 3.153 N/A ASN 315.A N ASP 312.A OD1 no hydrogen 3.084 N/A ASN 315.A ND2 ASP 312.A OD2 no hydrogen 2.815 N/A ARG 318.A NH1 GLU 152.A OE1 no hydrogen 3.490 N/A THR 319.A N GLU 152.A OE2 no hydrogen 2.822 N/A THR 319.A OG1 GLU 152.A OE2 no hydrogen 2.583 N/A VAL 321.A N ARG 318.A O no hydrogen 3.111 N/A LEU 322.A N ARG 318.A O no hydrogen 3.298 N/A TYR 323.A N THR 319.A O no hydrogen 2.843 N/A GLU 324.A N ASN 320.A O no hydrogen 2.964 N/A LEU 325.A N VAL 321.A O no hydrogen 3.035 N/A ALA 326.A N LEU 322.A O no hydrogen 3.076 N/A ALA 326.A N TYR 323.A O no hydrogen 3.305 N/A GLN 327.A NE2 SER 177.A OG no hydrogen 2.977 N/A GLN 327.A NE2 GLU 324.A O no hydrogen 2.806 N/A TYR 328.A N LEU 325.A O no hydrogen 2.890 N/A TYR 328.A OH HIS 379.A ND1 no hydrogen 2.682 N/A ALA 329.A N ALA 326.A O no hydrogen 3.026 N/A SER 330.A N SER 372.A O no hydrogen 3.275 N/A GLU 331.A N SER 372.A OG no hydrogen 3.109 N/A SER 333.A N GLU 331.A OE2 no hydrogen 3.339 N/A SER 333.A OG GLU 331.A OE2 no hydrogen 3.290 N/A GLN 335.A N GLU 331.A O no hydrogen 2.925 N/A GLU 336.A N PRO 332.A O no hydrogen 2.816 N/A HIS 337.A N SER 333.A O no hydrogen 3.002 N/A LEU 338.A N GLU 334.A O no hydrogen 3.147 N/A HIS 339.A N GLN 335.A O no hydrogen 3.035 N/A LYS 340.A N GLU 336.A O no hydrogen 2.991 N/A MET 341.A N LEU 338.A O no hydrogen 3.416 N/A ALA 342.A N HIS 339.A O no hydrogen 3.443 N/A SER 343.A N LYS 340.A O no hydrogen 2.996 N/A SER 343.A OG LYS 340.A O no hydrogen 2.655 N/A SER 344.A OG GLU 160.A OE1 no hydrogen 2.503 N/A SER 344.A OG GLU 160.A OE2 no hydrogen 3.151 N/A LYS 349.A NZ SER 344.A O no hydrogen 3.259 N/A GLU 350.A N GLY 346.A O no hydrogen 3.156 N/A LEU 351.A N GLU 347.A O no hydrogen 2.871 N/A TYR 352.A N GLY 348.A O no hydrogen 3.067 N/A TYR 352.A OH PRO 317.A O no hydrogen 2.921 N/A LEU 353.A N LYS 349.A O no hydrogen 2.990 N/A SER 354.A N GLU 350.A O no hydrogen 2.976 N/A SER 354.A OG GLU 350.A O no hydrogen 2.921 N/A TRP 355.A N LEU 351.A O no hydrogen 2.750 N/A VAL 356.A N TYR 352.A O no hydrogen 3.018 N/A VAL 357.A N TYR 352.A O no hydrogen 3.004 N/A GLU 358.A N LEU 353.A O no hydrogen 2.810 N/A ALA 359.A N SER 354.A O no hydrogen 3.158 N/A ARG 360.A N VAL 357.A O no hydrogen 2.966 N/A ARG 360.A NE TYR 414.A OH no hydrogen 3.239 N/A ARG 360.A NH1 ASN 315.A OD1 no hydrogen 3.075 N/A ARG 361.A N VAL 356.A O no hydrogen 2.958 N/A ARG 361.A NE ASP 369.A OD2 no hydrogen 2.715 N/A ARG 361.A NH1 TRP 355.A O no hydrogen 2.762 N/A ARG 361.A NH2 ASP 369.A OD2 no hydrogen 3.183 N/A ALA 365.A N HIS 362.A ND1 no hydrogen 3.122 N/A ILE 366.A N HIS 362.A O no hydrogen 3.102 N/A LEU 367.A N ILE 363.A O no hydrogen 2.944 N/A GLN 368.A N LEU 364.A O no hydrogen 2.877 N/A ASP 369.A N ALA 365.A O no hydrogen 2.880 N/A TYR 370.A N ILE 366.A O no hydrogen 2.902 N/A SER 372.A N GLU 334.A OE2 no hydrogen 2.896 N/A SER 372.A OG GLU 334.A OE2 no hydrogen 2.430 N/A LEU 373.A N TYR 370.A O no hydrogen 2.870 N/A ARG 374.A N TYR 328.A O no hydrogen 3.123 N/A ARG 374.A NH1 LEU 367.A O no hydrogen 2.950 N/A ARG 374.A NH1 LEU 373.A O no hydrogen 2.727 N/A HIS 379.A ND1 TYR 328.A OH no hydrogen 2.682 N/A LEU 380.A N PRO 376.A O no hydrogen 3.270 N/A CYS 381.A N ILE 377.A O no hydrogen 3.046 N/A CYS 381.A SG ILE 377.A O no hydrogen 3.486 N/A GLU 382.A N ASP 378.A O no hydrogen 3.280 N/A GLU 382.A N HIS 379.A O no hydrogen 3.086 N/A LEU 383.A N HIS 379.A O no hydrogen 3.092 N/A LEU 383.A N LEU 380.A O no hydrogen 2.945 N/A LEU 384.A N LEU 380.A O no hydrogen 2.969 N/A ARG 386.A NE TYR 310.A O no hydrogen 2.808 N/A LEU 387.A N TYR 310.A O no hydrogen 2.925 N/A GLN 388.A NE2 ARG 386.A O no hydrogen 3.299 N/A ARG 390.A N VAL 258.A O no hydrogen 2.923 N/A ARG 390.A NH2 GLN 388.A O no hydrogen 2.795 N/A TYR 392.A N VAL 256.A O no hydrogen 2.909 N/A SER 393.A OG ASP 606.A OD2 no hydrogen 2.772 N/A ILE 394.A N ASP 254.A O no hydrogen 3.083 N/A ALA 395.A N HIS 406.A O no hydrogen 2.780 N/A SER 396.A OG TYR 250.A OH no hydrogen 2.875 N/A SER 396.A OG SER 404.A O no hydrogen 3.454 N/A SER 397.A N GLN 476.A OE1 no hydrogen 2.944 N/A SER 397.A OG GLU 477.A OE1 no hydrogen 2.532 N/A SER 398.A OG TYR 250.A O no hydrogen 2.667 N/A SER 398.A OG GLU 251.A OE2 no hydrogen 3.473 N/A LYS 399.A N SER 397.A OG no hydrogen 3.202 N/A VAL 400.A N SER 397.A O no hydrogen 3.059 N/A HIS 401.A N SER 397.A O no hydrogen 2.646 N/A SER 404.A N HIS 401.A O no hydrogen 3.333 N/A SER 404.A OG LEU 241.A O no hydrogen 3.405 N/A VAL 405.A N LEU 241.A O no hydrogen 2.923 N/A HIS 406.A N SER 396.A OG no hydrogen 3.251 N/A ILE 407.A N LEU 239.A O no hydrogen 2.835 N/A ALA 409.A N MET 237.A O no hydrogen 2.984 N/A ALA 411.A N HIS 235.A O no hydrogen 2.878 N/A VAL 412.A N THR 427.A OG1 no hydrogen 2.997 N/A TYR 414.A N ASN 422.A O no hydrogen 3.050 N/A ALA 416.A N ARG 420.A O no hydrogen 2.994 N/A GLY 419.A N ALA 416.A O no hydrogen 2.994 N/A ARG 420.A NH1 GLN 368.A OE1 no hydrogen 2.728 N/A ARG 420.A NH1 ASP 369.A OD1 no hydrogen 3.320 N/A ARG 420.A NH2 ASP 369.A OD2 no hydrogen 2.856 N/A ARG 420.A NH2 SER 418.A O no hydrogen 2.947 N/A ASN 422.A N TYR 414.A O no hydrogen 2.858 N/A GLY 424.A N VAL 412.A O no hydrogen 2.794 N/A SER 428.A N GLY 424.A O no hydrogen 3.106 N/A SER 428.A OG GLY 424.A O no hydrogen 2.739 N/A TRP 429.A N VAL 425.A O no hydrogen 3.219 N/A LEU 430.A N ALA 426.A O no hydrogen 2.820 N/A ARG 431.A N THR 427.A O no hydrogen 2.872 N/A ALA 432.A N SER 428.A O no hydrogen 3.291 N/A LYS 433.A N LEU 430.A O no hydrogen 3.017 N/A LYS 433.A NZ LEU 439.A O no hydrogen 2.956 N/A VAL 440.A N ALA 220.A O no hydrogen 2.725 N/A MET 442.A N PHE 218.A O no hydrogen 2.829 N/A PHE 443.A N ALA 257.A O no hydrogen 3.102 N/A ARG 445.A N HIS 255.A O no hydrogen 2.887 N/A ARG 445.A NE ASP 86.A OD2 no hydrogen 3.382 N/A SER 447.A N ASP 254.A OD1 no hydrogen 2.919 N/A SER 447.A OG GLY 253.A O no hydrogen 2.514 N/A PHE 449.A N SER 447.A OG no hydrogen 3.182 N/A ARG 450.A NH1 ASP 254.A OD1 no hydrogen 2.869 N/A ARG 450.A NH1 PHE 449.A O no hydrogen 3.167 N/A ARG 450.A NH2 ASP 254.A OD1 no hydrogen 2.622 N/A SER 455.A OG GLU 487.A O no hydrogen 2.682 N/A THR 457.A N LYS 454.A O no hydrogen 3.155 N/A THR 457.A OG1 LYS 454.A O no hydrogen 3.403 N/A VAL 459.A N GLU 490.A O no hydrogen 2.916 N/A ILE 460.A N HIS 557.A O no hydrogen 2.963 N/A MET 461.A N LEU 492.A O no hydrogen 2.879 N/A VAL 462.A N TYR 559.A O no hydrogen 2.783 N/A GLY 463.A N TYR 494.A O no hydrogen 3.025 N/A GLY 465.A N GLY 496.A O no hydrogen 2.776 N/A GLY 467.A N PRO 464.A O no hydrogen 2.920 N/A ILE 468.A N GLY 465.A O no hydrogen 3.106 N/A ALA 469.A N THR 466.A O no hydrogen 3.153 N/A MET 472.A N ILE 468.A O no hydrogen 3.248 N/A MET 472.A N ALA 469.A O no hydrogen 3.219 N/A GLY 473.A N PRO 470.A O no hydrogen 2.996 N/A PHE 474.A N PRO 470.A O no hydrogen 3.046 N/A ILE 475.A N PHE 471.A O no hydrogen 2.825 N/A GLN 476.A N MET 472.A O no hydrogen 3.040 N/A GLU 477.A N GLY 473.A O no hydrogen 2.973 N/A ARG 478.A N PHE 474.A O no hydrogen 2.871 N/A ARG 478.A NE THR 491.A OG1 no hydrogen 3.056 N/A ARG 478.A NH1 THR 457.A O no hydrogen 3.206 N/A ARG 478.A NH2 THR 457.A O no hydrogen 2.837 N/A ARG 478.A NH2 GLU 490.A O no hydrogen 3.284 N/A ARG 478.A NH2 THR 491.A OG1 no hydrogen 3.260 N/A ALA 479.A N ILE 475.A O no hydrogen 2.901 N/A TRP 480.A N GLN 476.A O no hydrogen 2.923 N/A LEU 481.A N GLU 477.A O no hydrogen 2.771 N/A ARG 482.A N ARG 478.A O no hydrogen 3.071 N/A ARG 482.A NH1 ASP 516.A O no hydrogen 3.087 N/A ARG 482.A NH2 ASP 516.A O no hydrogen 3.531 N/A GLU 483.A N ALA 479.A O no hydrogen 2.951 N/A GLN 484.A N LEU 481.A O no hydrogen 3.108 N/A GLY 485.A N ARG 482.A O no hydrogen 2.881 N/A LYS 486.A N LEU 481.A O no hydrogen 3.187 N/A GLY 489.A N SER 455.A O no hydrogen 2.997 N/A THR 491.A N THR 520.A OG1 no hydrogen 2.720 N/A THR 491.A OG1 GLY 489.A O no hydrogen 3.458 N/A LEU 492.A N VAL 459.A O no hydrogen 2.944 N/A LEU 493.A N GLN 521.A O no hydrogen 3.054 N/A TYR 494.A N MET 461.A O no hydrogen 2.738 N/A TYR 494.A OH ASP 543.A OD2 no hydrogen 2.586 N/A TYR 495.A N ASN 523.A O no hydrogen 2.853 N/A TYR 495.A OH ASP 503.A O no hydrogen 3.189 N/A CYS 497.A N ALA 525.A O no hydrogen 3.074 N/A CYS 497.A SG ARG 499.A O no hydrogen 3.908 N/A ARG 498.A N ASP 503.A OD1 no hydrogen 3.048 N/A ARG 498.A NH2 GLU 233.A OE1 no hydrogen 3.019 N/A ARG 499.A N ASP 503.A OD1 no hydrogen 3.416 N/A SER 500.A N GLU 529.A OE1 no hydrogen 2.756 N/A SER 500.A OG GLU 529.A OE1 no hydrogen 2.834 N/A GLU 502.A N ARG 499.A O no hydrogen 2.939 N/A ASP 503.A N ARG 499.A O no hydrogen 3.283 N/A TYR 504.A N GLN 230.A OE1 no hydrogen 3.109 N/A LEU 505.A N TYR 495.A OH no hydrogen 2.855 N/A TYR 506.A OH HIS 238.A ND1 no hydrogen 2.593 N/A ARG 507.A NE GLU 508.A OE2 no hydrogen 3.032 N/A ARG 507.A NH2 GLU 508.A OE2 no hydrogen 3.480 N/A GLU 509.A N GLU 509.A OE1 no hydrogen 2.583 N/A LEU 510.A N TYR 506.A O no hydrogen 2.868 N/A ALA 511.A N ARG 507.A O no hydrogen 3.041 N/A ARG 512.A N GLU 508.A O no hydrogen 3.008 N/A ARG 512.A NE ARG 512.A O no hydrogen 3.304 N/A PHE 513.A N GLU 509.A O no hydrogen 2.968 N/A HIS 514.A N LEU 510.A O no hydrogen 2.947 N/A LYS 515.A N ALA 511.A O no hydrogen 2.931 N/A ASP 516.A N ARG 512.A O no hydrogen 2.929 N/A GLY 517.A N HIS 514.A O no hydrogen 3.048 N/A ALA 518.A N PHE 513.A O no hydrogen 2.819 N/A LEU 519.A N PHE 513.A O no hydrogen 3.163 N/A THR 520.A N THR 491.A O no hydrogen 2.735 N/A THR 520.A OG1 THR 491.A O no hydrogen 3.364 N/A GLN 521.A N THR 491.A O no hydrogen 3.421 N/A ASN 523.A N LEU 493.A O no hydrogen 2.885 N/A ASN 523.A ND2 GLN 521.A OE1 no hydrogen 3.071 N/A ALA 525.A N TYR 495.A O no hydrogen 2.851 N/A SER 527.A N CYS 497.A O no hydrogen 2.941 N/A SER 527.A OG CYS 497.A O no hydrogen 3.521 N/A ARG 528.A N ARG 498.A O no hydrogen 2.909 N/A GLN 530.A NE2 PHE 526.A O no hydrogen 2.756 N/A GLN 530.A NE2 HIS 532.A O no hydrogen 3.026 N/A TYR 535.A N HIS 538.A ND1 no hydrogen 2.773 N/A GLN 537.A N GLN 537.A OE1 no hydrogen 2.801 N/A HIS 538.A N TYR 535.A O no hydrogen 2.917 N/A LEU 539.A N TYR 535.A O no hydrogen 3.428 N/A LEU 540.A N VAL 536.A O no hydrogen 2.985 N/A LYS 541.A N GLN 537.A O no hydrogen 2.987 N/A ARG 542.A N HIS 538.A O no hydrogen 2.977 N/A ARG 542.A NE ASP 543.A OD1 no hydrogen 2.830 N/A ARG 542.A NH2 ASN 523.A OD1 no hydrogen 2.785 N/A ARG 542.A NH2 ASP 543.A OD1 no hydrogen 3.490 N/A ARG 542.A NH2 ASP 543.A OD2 no hydrogen 3.003 N/A ASP 543.A N LEU 539.A O no hydrogen 2.947 N/A ARG 544.A N LYS 541.A O no hydrogen 3.079 N/A ARG 544.A NH1 LYS 541.A O no hydrogen 2.829 N/A HIS 546.A NE2 GLU 490.A OE1 no hydrogen 2.833 N/A LEU 547.A N ASP 543.A O no hydrogen 2.938 N/A TRP 548.A N ARG 544.A O no hydrogen 2.887 N/A LYS 549.A N GLU 545.A O no hydrogen 3.232 N/A LEU 550.A N HIS 546.A O no hydrogen 3.003 N/A ILE 551.A N LEU 547.A O no hydrogen 2.846 N/A HIS 552.A N TRP 548.A O no hydrogen 2.794 N/A HIS 552.A ND1 TYR 593.A OH no hydrogen 2.877 N/A GLU 553.A N LYS 549.A O no hydrogen 2.910 N/A GLY 554.A N LYS 549.A O no hydrogen 3.084 N/A ALA 556.A N LEU 550.A O no hydrogen 2.897 N/A HIS 557.A N PRO 458.A O no hydrogen 2.975 N/A ILE 558.A N ARG 602.A O no hydrogen 2.801 N/A TYR 559.A N ILE 460.A O no hydrogen 2.870 N/A TYR 559.A OH ARG 450.A O no hydrogen 2.477 N/A VAL 560.A N SER 604.A O no hydrogen 2.942 N/A CYS 561.A N VAL 462.A O no hydrogen 2.886 N/A CYS 561.A SG GLY 467.A O no hydrogen 3.168 N/A CYS 561.A SG ASP 606.A O no hydrogen 3.236 N/A CYS 561.A SG ASP 606.A OD2 no hydrogen 3.555 N/A GLY 562.A N ASP 606.A O no hydrogen 3.138 N/A ALA 564.A N TRP 608.A O no hydrogen 3.058 N/A ARG 565.A N ASP 563.A OD1 no hydrogen 3.186 N/A ASN 566.A N ASP 563.A OD2 no hydrogen 2.735 N/A MET 567.A N ASP 563.A OD2 no hydrogen 3.025 N/A ALA 568.A N ASP 563.A O no hydrogen 3.053 N/A LYS 569.A NZ THR 116.A O no hydrogen 3.209 N/A ASP 570.A N ASN 566.A O no hydrogen 2.968 N/A VAL 571.A N MET 567.A O no hydrogen 2.884 N/A GLN 572.A N ALA 568.A O no hydrogen 2.987 N/A GLN 572.A NE2 GLU 118.A OE1 no hydrogen 3.044 N/A GLN 572.A NE2 TYR 576.A OH no hydrogen 2.777 N/A ASN 573.A N LYS 569.A O no hydrogen 2.916 N/A THR 574.A N ASP 570.A O no hydrogen 3.110 N/A THR 574.A OG1 ASP 570.A O no hydrogen 3.165 N/A PHE 575.A N VAL 571.A O no hydrogen 3.005 N/A TYR 576.A N GLN 572.A O no hydrogen 2.972 N/A ASP 577.A N ASN 573.A O no hydrogen 3.027 N/A ILE 578.A N THR 574.A O no hydrogen 2.905 N/A VAL 579.A N PHE 575.A O no hydrogen 3.034 N/A ALA 580.A N TYR 576.A O no hydrogen 2.858 N/A GLU 581.A N ASP 577.A O no hydrogen 3.073 N/A GLU 581.A N ILE 578.A O no hydrogen 3.129 N/A PHE 582.A N ILE 578.A O no hydrogen 3.081 N/A GLY 583.A N VAL 579.A O no hydrogen 2.826 N/A MET 585.A N ALA 580.A O no hydrogen 3.233 N/A ALA 590.A N GLU 586.A O no hydrogen 2.930 N/A VAL 591.A N HIS 587.A O no hydrogen 2.771 N/A ASP 592.A N THR 588.A O no hydrogen 3.142 N/A TYR 593.A N GLN 589.A O no hydrogen 2.877 N/A TYR 593.A OH HIS 552.A ND1 no hydrogen 2.877 N/A VAL 594.A N ALA 590.A O no hydrogen 2.964 N/A LYS 595.A N VAL 591.A O no hydrogen 2.908 N/A LYS 595.A NZ GLU 118.A OE2 no hydrogen 3.056 N/A LYS 596.A N ASP 592.A O no hydrogen 2.957 N/A LEU 597.A N TYR 593.A O no hydrogen 3.147 N/A MET 598.A N VAL 594.A O no hydrogen 3.294 N/A THR 599.A N LYS 595.A O no hydrogen 3.219 N/A THR 599.A OG1 LYS 596.A O no hydrogen 2.672 N/A LYS 600.A N LYS 596.A O no hydrogen 2.803 N/A GLY 601.A N MET 598.A O no hydrogen 3.292 N/A ARG 602.A N LEU 597.A O no hydrogen 2.748 N/A ARG 602.A NE ALA 556.A O no hydrogen 3.037 N/A ARG 602.A NH2 ILE 551.A O no hydrogen 2.716 N/A ARG 602.A NH2 ALA 556.A O no hydrogen 2.824 N/A SER 604.A N ILE 558.A O no hydrogen 2.842 N/A ASP 606.A N VAL 560.A O no hydrogen 2.926 N/A TRP 608.A N GLY 562.A O no hydrogen 2.957 N/A