Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 2dji_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ILE 4.A N ILE 170.A O no hydrogen 2.805 N/A ASN 5.A ND2 ALA 166.A O no hydrogen 2.840 N/A ILE 6.A N VAL 168.A O no hydrogen 2.889 N/A GLY 7.A N ALA 166.A O no hydrogen 3.189 N/A LEU 8.A N ASN 5.A OD1 no hydrogen 3.096 N/A ALA 9.A N ASN 5.A O no hydrogen 3.076 N/A VAL 10.A N ILE 6.A O no hydrogen 2.973 N/A MET 11.A N GLY 7.A O no hydrogen 3.037 N/A LYS 12.A N LEU 8.A O no hydrogen 2.853 N/A ILE 13.A N ALA 9.A O no hydrogen 2.898 N/A LEU 14.A N VAL 10.A O no hydrogen 2.933 N/A GLU 15.A N MET 11.A O no hydrogen 2.949 N/A SER 16.A N LYS 12.A O no hydrogen 3.030 N/A SER 16.A OG ILE 13.A O no hydrogen 2.537 N/A SER 16.A OG SER 177.A OG no hydrogen 2.631 N/A TRP 17.A N ILE 13.A O no hydrogen 3.129 N/A TRP 17.A N LEU 14.A O no hydrogen 3.086 N/A TRP 17.A NE1 ASP 144.A OD1 no hydrogen 2.851 N/A GLY 18.A N GLU 15.A O no hydrogen 2.920 N/A ALA 19.A N LEU 14.A O no hydrogen 2.873 N/A ASP 20.A N GLY 18.A O no hydrogen 2.983 N/A THR 21.A OG1 ASP 20.A OD1 no hydrogen 2.874 N/A THR 21.A OG1 ASN 427.A OD1 no hydrogen 3.049 N/A ILE 22.A N LYS 45.A O no hydrogen 2.843 N/A TYR 23.A N VAL 71.A O no hydrogen 2.832 N/A GLY 24.A N LEU 47.A O no hydrogen 3.243 N/A LEU 30.A N SER 27.A O no hydrogen 2.992 N/A SER 31.A OG GLY 28.A O no hydrogen 3.028 N/A SER 32.A OG GLY 163.A O no hydrogen 3.110 N/A MET 34.A N LEU 30.A O no hydrogen 3.113 N/A ASP 35.A N SER 31.A O no hydrogen 2.799 N/A ALA 36.A N LEU 33.A O no hydrogen 3.058 N/A MET 37.A N MET 34.A O no hydrogen 2.986 N/A ASN 42.A N GLU 39.A O no hydrogen 2.928 N/A ASN 43.A N GLU 15.A OE2 no hydrogen 3.145 N/A LYS 45.A N ASP 20.A O no hydrogen 2.807 N/A LYS 45.A NZ ASN 43.A OD1 no hydrogen 2.693 N/A LEU 47.A N ILE 22.A O no hydrogen 2.811 N/A GLN 48.A N TYR 456.A OH no hydrogen 2.903 N/A VAL 49.A N GLY 24.A O no hydrogen 2.992 N/A LYS 50.A N ASP 449.A OD1 no hydrogen 2.787 N/A GLU 52.A N GLU 52.A OE1 no hydrogen 2.735 N/A GLU 53.A N HIS 51.A ND1 no hydrogen 3.094 N/A VAL 54.A N HIS 51.A O no hydrogen 2.880 N/A ALA 56.A N GLU 52.A O no hydrogen 2.994 N/A MET 57.A N GLU 53.A O no hydrogen 2.923 N/A ALA 58.A N VAL 54.A O no hydrogen 2.861 N/A ALA 59.A N GLY 55.A O no hydrogen 3.011 N/A VAL 60.A N ALA 56.A O no hydrogen 3.082 N/A MET 61.A N MET 57.A O no hydrogen 2.789 N/A GLN 62.A N ALA 58.A O no hydrogen 2.931 N/A SER 63.A N VAL 60.A O no hydrogen 3.039 N/A SER 63.A OG ASN 68.A O no hydrogen 3.349 N/A LYS 64.A N VAL 60.A O no hydrogen 3.191 N/A LYS 64.A NZ ASP 89.A OD1 no hydrogen 3.438 N/A LYS 64.A NZ ASP 89.A OD2 no hydrogen 2.755 N/A LYS 64.A NZ ASP 93.A OD2 no hydrogen 2.782 N/A LYS 64.A NZ THR 408.A O no hydrogen 2.900 N/A PHE 65.A N MET 61.A O no hydrogen 2.915 N/A GLY 66.A N SER 63.A O no hydrogen 2.847 N/A GLY 67.A N GLN 62.A O no hydrogen 2.747 N/A THR 72.A N VAL 98.A O no hydrogen 2.911 N/A VAL 73.A N TYR 23.A O no hydrogen 2.885 N/A GLY 74.A N ILE 100.A O no hydrogen 3.047 N/A GLY 76.A N THR 29.A OG1 no hydrogen 3.023 N/A GLY 77.A N GLN 119.A OE1 no hydrogen 2.910 N/A ALA 80.A N SER 75.A O no hydrogen 2.812 N/A SER 81.A N GLY 77.A O no hydrogen 2.950 N/A SER 81.A OG GLY 77.A O no hydrogen 3.221 N/A SER 81.A OG PRO 78.A O no hydrogen 3.246 N/A HIS 82.A N PRO 78.A O no hydrogen 3.062 N/A HIS 82.A ND1 GLU 52.A OE1 no hydrogen 2.784 N/A LEU 83.A N ALA 80.A O no hydrogen 3.206 N/A ILE 84.A N SER 81.A O no hydrogen 3.233 N/A ASN 85.A ND2 THR 414.A OG1 no hydrogen 2.834 N/A GLY 86.A N LEU 83.A O no hydrogen 3.014 N/A LEU 87.A N LEU 83.A O no hydrogen 3.054 N/A TYR 88.A N ILE 84.A O no hydrogen 2.858 N/A ASP 89.A N ASN 85.A O no hydrogen 3.215 N/A ALA 90.A N GLY 86.A O no hydrogen 3.116 N/A ALA 91.A N LEU 87.A O no hydrogen 2.887 N/A MET 92.A N TYR 88.A O no hydrogen 2.998 N/A ASP 93.A N ASP 89.A O no hydrogen 2.989 N/A ASN 94.A N ALA 91.A O no hydrogen 3.259 N/A ILE 95.A N ALA 90.A O no hydrogen 2.891 N/A VAL 97.A N GLY 155.A O no hydrogen 3.167 N/A VAL 98.A N GLY 70.A O no hydrogen 3.039 N/A ALA 99.A N ALA 157.A O no hydrogen 2.834 N/A ILE 100.A N THR 72.A O no hydrogen 2.897 N/A LEU 101.A N LEU 159.A O no hydrogen 2.745 N/A GLY 102.A N GLY 74.A O no hydrogen 2.803 N/A SER 103.A OG ARG 104.A O no hydrogen 2.997 N/A ARG 104.A NE GLU 108.A OE1 no hydrogen 2.726 N/A ARG 104.A NH2 GLU 108.A OE1 no hydrogen 3.436 N/A ARG 104.A NH2 GLU 108.A OE2 no hydrogen 2.861 N/A GLN 106.A N ASP 164.A OD1 no hydrogen 2.960 N/A GLN 106.A NE2 ALA 134.A O no hydrogen 3.333 N/A GLU 108.A N PRO 105.A O no hydrogen 2.885 N/A LEU 109.A N GLN 106.A O no hydrogen 3.075 N/A ASN 110.A N GLU 116.A OE2 no hydrogen 2.844 N/A MET 111.A N GLU 108.A O no hydrogen 3.117 N/A ALA 113.A N GLU 116.A OE1 no hydrogen 3.006 N/A GLU 116.A N ALA 113.A O no hydrogen 3.382 N/A GLN 119.A NE2 GLY 102.A O no hydrogen 2.980 N/A GLN 119.A NE2 GLU 160.A OE2 no hydrogen 2.867 N/A ASN 120.A N ASN 118.A OD1 no hydrogen 3.051 N/A ASN 120.A ND2 ASN 130.A O no hydrogen 3.311 N/A TYR 123.A OH ALA 80.A O no hydrogen 2.656 N/A ASP 124.A N PRO 121.A O no hydrogen 3.394 N/A ILE 126.A N TYR 123.A O no hydrogen 3.206 N/A ALA 127.A N TYR 123.A O no hydrogen 3.036 N/A VAL 128.A N VAL 156.A O no hydrogen 2.840 N/A TYR 129.A OH GLU 145.A OE1 no hydrogen 2.672 N/A ASN 130.A ND2 ASN 120.A O no hydrogen 2.801 N/A ASN 130.A ND2 ASP 124.A OD1 no hydrogen 3.095 N/A ARG 131.A N VAL 158.A O no hydrogen 2.980 N/A ARG 132.A NE GLU 160.A OE1 no hydrogen 2.899 N/A ARG 132.A NH2 GLU 160.A OE1 no hydrogen 3.437 N/A ARG 132.A NH2 GLU 160.A OE2 no hydrogen 2.822 N/A VAL 133.A N GLU 160.A O no hydrogen 2.995 N/A GLN 138.A N TYR 135.A O no hydrogen 3.333 N/A LEU 139.A N ALA 136.A O no hydrogen 2.961 N/A LEU 142.A N GLN 138.A O no hydrogen 3.078 N/A VAL 143.A N LEU 139.A O no hydrogen 2.949 N/A ASP 144.A N PRO 140.A O no hydrogen 2.956 N/A GLU 145.A N LYS 141.A O no hydrogen 2.922 N/A ALA 146.A N LEU 142.A O no hydrogen 2.816 N/A ALA 147.A N VAL 143.A O no hydrogen 3.067 N/A ARG 148.A N ASP 144.A O no hydrogen 3.050 N/A ARG 148.A NE SER 178.A OG no hydrogen 2.889 N/A ARG 148.A NH1 GLU 145.A OE2 no hydrogen 3.010 N/A ARG 148.A NH2 ASP 144.A OD2 no hydrogen 3.306 N/A MET 149.A N GLU 145.A O no hydrogen 2.711 N/A ALA 150.A N ALA 146.A O no hydrogen 2.793 N/A ILE 151.A N ALA 147.A O no hydrogen 3.178 N/A ALA 152.A N ARG 148.A O no hydrogen 2.930 N/A LYS 153.A N MET 149.A O no hydrogen 2.814 N/A ARG 154.A N ILE 151.A O no hydrogen 3.340 N/A GLY 155.A N ALA 150.A O no hydrogen 2.993 N/A ALA 157.A N VAL 97.A O no hydrogen 2.978 N/A VAL 158.A N TYR 129.A O no hydrogen 2.720 N/A LEU 159.A N ALA 99.A O no hydrogen 3.007 N/A GLU 160.A N ARG 131.A O no hydrogen 2.885 N/A VAL 161.A N LEU 101.A O no hydrogen 2.763 N/A GLY 163.A N SER 103.A O no hydrogen 2.795 N/A ASP 164.A N ASP 164.A OD1 no hydrogen 2.659 N/A PHE 165.A N PRO 162.A O no hydrogen 3.246 N/A VAL 168.A N PHE 165.A O no hydrogen 3.109 N/A ILE 170.A N ILE 4.A O no hydrogen 2.955 N/A ASN 172.A N ASN 2.A O no hydrogen 2.828 N/A ASN 172.A ND2 ASP 1.A OD2 no hydrogen 2.865 N/A GLN 174.A N ASP 171.A O no hydrogen 2.854 N/A TRP 175.A NE1 ASN 172.A OD1 no hydrogen 3.065 N/A SER 177.A OG SER 16.A OG no hydrogen 2.631 N/A SER 178.A N ASP 144.A OD1 no hydrogen 2.808 N/A SER 178.A OG ASP 144.A OD1 no hydrogen 3.310 N/A SER 178.A OG ASP 144.A OD2 no hydrogen 2.774 N/A ALA 179.A N SER 177.A OG no hydrogen 3.041 N/A SER 181.A N SER 178.A O no hydrogen 2.957 N/A LEU 182.A N ALA 179.A O no hydrogen 3.008 N/A ARG 183.A NH1 ASN 180.A O no hydrogen 3.025 N/A ARG 183.A NH1 LEU 182.A O no hydrogen 2.821 N/A ASP 194.A N ALA 191.A O no hydrogen 2.926 N/A ILE 195.A N ALA 191.A O no hydrogen 3.061 N/A ASP 196.A N ALA 192.A O no hydrogen 2.824 N/A ALA 197.A N GLN 193.A O no hydrogen 3.208 N/A ALA 198.A N ASP 194.A O no hydrogen 3.091 N/A VAL 199.A N ILE 195.A O no hydrogen 2.861 N/A GLU 200.A N ASP 196.A O no hydrogen 3.024 N/A LEU 201.A N ALA 197.A O no hydrogen 3.258 N/A LEU 202.A N ALA 198.A O no hydrogen 2.949 N/A ASN 203.A N VAL 199.A O no hydrogen 2.846 N/A ASN 204.A N GLU 200.A O no hydrogen 3.116 N/A SER 205.A N LEU 202.A O no hydrogen 3.311 N/A SER 205.A OG THR 272.A OG1 no hydrogen 2.954 N/A ARG 207.A N SER 205.A OG no hydrogen 3.276 N/A ARG 207.A NH1 GLU 269.A O no hydrogen 3.018 N/A ARG 207.A NH1 GLU 269.A OE2 no hydrogen 3.026 N/A ARG 207.A NH2 GLU 585.A O no hydrogen 2.695 N/A VAL 209.A N THR 272.A O no hydrogen 2.899 N/A ILE 210.A N PRO 233.A O no hydrogen 2.976 N/A TYR 211.A N LEU 274.A O no hydrogen 2.846 N/A TYR 211.A OH THR 255.A OG1 no hydrogen 2.830 N/A ALA 212.A N ILE 235.A O no hydrogen 2.811 N/A GLY 213.A N ALA 276.A O no hydrogen 2.856 N/A GLY 215.A N GLY 277.A O no hydrogen 2.926 N/A THR 216.A N GLY 213.A O no hydrogen 2.907 N/A THR 216.A OG1 GLY 213.A O no hydrogen 2.710 N/A MET 217.A N ILE 214.A O no hydrogen 2.958 N/A HIS 219.A N THR 216.A O no hydrogen 2.885 N/A VAL 223.A N HIS 219.A O no hydrogen 3.050 N/A GLN 224.A N GLY 220.A O no hydrogen 2.811 N/A GLU 225.A N PRO 221.A O no hydrogen 2.891 N/A LEU 226.A N ALA 222.A O no hydrogen 2.945 N/A ALA 227.A N VAL 223.A O no hydrogen 2.909 N/A ARG 228.A N GLN 224.A O no hydrogen 3.017 N/A ARG 228.A NH2 GLU 249.A OE1 no hydrogen 3.078 N/A LYS 229.A N GLU 225.A O no hydrogen 2.879 N/A LYS 229.A NZ LEU 327.A O no hydrogen 2.804 N/A LYS 229.A NZ VAL 330.A O no hydrogen 3.197 N/A ILE 230.A N LEU 226.A O no hydrogen 3.076 N/A LYS 231.A NZ ARG 228.A O no hydrogen 2.957 N/A LYS 231.A NZ VAL 333.A O no hydrogen 2.777 N/A ALA 232.A N ALA 227.A O no hydrogen 2.863 N/A VAL 234.A N ALA 250.A O no hydrogen 2.874 N/A ILE 235.A N ILE 210.A O no hydrogen 2.712 N/A THR 236.A N GLY 253.A O no hydrogen 2.821 N/A THR 236.A OG1 ALA 212.A O no hydrogen 3.443 N/A THR 236.A OG1 THR 237.A O no hydrogen 3.512 N/A ASN 240.A N THR 237.A O no hydrogen 2.965 N/A ASN 240.A ND2 ALA 212.A O no hydrogen 3.309 N/A ASN 240.A ND2 THR 216.A OG1 no hydrogen 3.122 N/A THR 243.A N ASN 240.A O no hydrogen 3.343 N/A THR 243.A OG1 ASN 240.A OD1 no hydrogen 2.618 N/A PHE 244.A N PHE 241.A O no hydrogen 3.176 N/A GLU 245.A N GLN 224.A OE1 no hydrogen 3.018 N/A TRP 246.A N MET 400.A O no hydrogen 2.950 N/A PHE 248.A N GLU 245.A O no hydrogen 2.893 N/A LEU 251.A N PHE 248.A O no hydrogen 3.247 N/A THR 252.A N VAL 234.A O no hydrogen 2.832 N/A THR 252.A OG1 VAL 234.A O no hydrogen 2.800 N/A SER 254.A OG VAL 258.A O no hydrogen 2.777 N/A THR 255.A OG1 TYR 211.A OH no hydrogen 2.830 N/A TYR 256.A N ASN 264.A OD1 no hydrogen 2.762 N/A TRP 260.A N SER 254.A O no hydrogen 2.992 N/A TRP 260.A NE1 ILE 395.A O no hydrogen 3.137 N/A LYS 261.A NZ GLU 265.A OE1 no hydrogen 2.591 N/A LYS 261.A NZ GLU 265.A OE2 no hydrogen 3.340 N/A LYS 261.A NZ VAL 573.A O no hydrogen 2.767 N/A ALA 263.A N THR 252.A O no hydrogen 2.967 N/A ASN 264.A ND2 TYR 256.A O no hydrogen 3.117 N/A ASN 264.A ND2 TRP 260.A O no hydrogen 2.915 N/A GLU 265.A N LYS 261.A O no hydrogen 3.100 N/A GLU 265.A N PRO 262.A O no hydrogen 3.055 N/A THR 266.A N PRO 262.A O no hydrogen 2.763 N/A THR 266.A OG1 PRO 262.A O no hydrogen 2.933 N/A THR 266.A OG1 ASN 342.A OD1 no hydrogen 2.755 N/A ILE 267.A N ALA 263.A O no hydrogen 3.099 N/A GLU 269.A N THR 266.A O no hydrogen 2.977 N/A ASP 271.A N ARG 207.A O no hydrogen 2.996 N/A THR 272.A N ARG 207.A O no hydrogen 3.393 N/A THR 272.A OG1 SER 205.A OG no hydrogen 2.954 N/A VAL 273.A N ASN 294.A O no hydrogen 3.013 N/A LEU 274.A N VAL 209.A O no hydrogen 2.887 N/A PHE 275.A N ILE 296.A O no hydrogen 2.659 N/A ALA 276.A N TYR 211.A O no hydrogen 2.891 N/A GLY 277.A N ILE 298.A O no hydrogen 2.929 N/A PHE 280.A N SER 278.A OG no hydrogen 3.108 N/A SER 283.A N PHE 280.A O no hydrogen 3.467 N/A SER 283.A OG PHE 280.A O no hydrogen 2.730 N/A GLU 284.A N GLU 284.A OE1 no hydrogen 2.852 N/A GLU 286.A N PHE 282.A O no hydrogen 2.938 N/A GLY 287.A N GLU 284.A O no hydrogen 3.124 N/A THR 288.A N SER 283.A O no hydrogen 3.069 N/A THR 288.A OG1 SER 283.A O no hydrogen 3.545 N/A ARG 290.A N GLY 287.A O no hydrogen 3.103 N/A ARG 290.A NH1 GLY 287.A O no hydrogen 2.869 N/A ASN 291.A ND2 LEU 268.A O no hydrogen 2.973 N/A VAL 292.A N PHE 289.A O no hydrogen 3.211 N/A ASP 293.A N ASP 271.A O no hydrogen 2.709 N/A ASN 294.A N ASP 271.A O no hydrogen 2.954 N/A PHE 295.A N ASP 312.A OD2 no hydrogen 2.742 N/A ILE 296.A N VAL 273.A O no hydrogen 2.803 N/A GLN 297.A N VAL 313.A O no hydrogen 2.963 N/A GLN 297.A NE2 MET 304.A O no hydrogen 3.067 N/A ILE 298.A N PHE 275.A O no hydrogen 2.970 N/A ASP 299.A N ILE 315.A O no hydrogen 3.042 N/A ASP 301.A N ASP 299.A OD1 no hydrogen 2.800 N/A ALA 303.A N ASP 301.A OD1 no hydrogen 3.036 N/A MET 304.A N ASP 301.A O no hydrogen 2.878 N/A LEU 305.A N PRO 302.A O no hydrogen 3.176 N/A GLY 306.A N GLN 297.A OE1 no hydrogen 2.881 N/A LYS 307.A N MET 304.A O no hydrogen 3.071 N/A ARG 308.A NE ASN 279.A OD1 no hydrogen 2.905 N/A ARG 308.A NH1 GLU 284.A OE1 no hydrogen 3.031 N/A HIS 309.A ND1 HIS 310.A O no hydrogen 2.698 N/A ASP 312.A N PHE 295.A O no hydrogen 2.781 N/A VAL 313.A N PHE 295.A O no hydrogen 3.434 N/A ILE 315.A N GLN 297.A O no hydrogen 2.809 N/A GLY 317.A N ASP 299.A O no hydrogen 2.997 N/A ASP 318.A N ILE 188.A O no hydrogen 3.094 N/A LEU 321.A N ASP 318.A OD2 no hydrogen 3.112 N/A ALA 322.A N ASP 318.A O no hydrogen 2.968 N/A ILE 323.A N ALA 319.A O no hydrogen 2.787 N/A ASP 324.A N ALA 320.A O no hydrogen 2.916 N/A GLU 325.A N LEU 321.A O no hydrogen 2.875 N/A ILE 326.A N ALA 322.A O no hydrogen 2.894 N/A LEU 327.A N ILE 323.A O no hydrogen 2.808 N/A ASN 328.A N ASP 324.A O no hydrogen 3.070 N/A LYS 329.A N GLU 325.A O no hydrogen 3.104 N/A LYS 329.A NZ ASP 196.A OD2 no hydrogen 2.779 N/A VAL 330.A N ILE 326.A O no hydrogen 2.900 N/A VAL 333.A N LYS 229.A O no hydrogen 2.751 N/A TRP 338.A NE1 PRO 208.A O no hydrogen 2.922 N/A TRP 339.A N SER 336.A OG no hydrogen 3.061 N/A THR 340.A N SER 336.A O no hydrogen 2.921 N/A THR 340.A OG1 SER 336.A O no hydrogen 3.073 N/A ALA 341.A N ALA 337.A O no hydrogen 2.876 N/A ASN 342.A N TRP 338.A O no hydrogen 3.125 N/A ASN 342.A ND2 TRP 338.A O no hydrogen 2.729 N/A LEU 343.A N TRP 339.A O no hydrogen 2.902 N/A LYS 344.A N THR 340.A O no hydrogen 3.154 N/A ASN 345.A N ALA 341.A O no hydrogen 3.029 N/A ASN 345.A ND2 GLU 265.A OE1 no hydrogen 2.960 N/A ILE 346.A N ASN 342.A O no hydrogen 2.878 N/A ALA 347.A N LEU 343.A O no hydrogen 3.000 N/A ASN 348.A N LYS 344.A O no hydrogen 2.942 N/A ASN 348.A ND2 ASN 571.A O no hydrogen 2.939 N/A TRP 349.A N ASN 345.A O no hydrogen 3.191 N/A ARG 350.A N ILE 346.A O no hydrogen 2.899 N/A ARG 350.A NH1 PHE 248.A O no hydrogen 2.854 N/A ARG 350.A NH2 PHE 248.A O no hydrogen 3.057 N/A GLU 351.A N ALA 347.A O no hydrogen 2.951 N/A TYR 352.A N ASN 348.A O no hydrogen 3.306 N/A TYR 352.A OH TYR 567.A O no hydrogen 2.682 N/A ILE 353.A N TRP 349.A O no hydrogen 3.016 N/A ASN 354.A N ARG 350.A O no hydrogen 2.888 N/A MET 355.A N GLU 351.A O no hydrogen 2.975 N/A LEU 356.A N TYR 352.A O no hydrogen 3.181 N/A GLU 357.A N ILE 353.A O no hydrogen 2.980 N/A THR 358.A N ASN 354.A O no hydrogen 2.969 N/A THR 358.A OG1 ASN 354.A O no hydrogen 2.784 N/A LYS 359.A NZ GLN 365.A OE1 no hydrogen 2.786 N/A LYS 359.A NZ GLU 568.A OE1 no hydrogen 2.608 N/A LYS 359.A NZ GLU 568.A OE2 no hydrogen 3.512 N/A GLY 362.A N GLU 512.A OE2 no hydrogen 3.065 N/A LEU 364.A N SER 509.A O no hydrogen 3.007 N/A GLN 365.A N GLN 368.A OE1 no hydrogen 2.727 N/A GLN 365.A NE2 ASP 540.A OD2 no hydrogen 2.955 N/A GLN 365.A NE2 GLU 568.A OE2 no hydrogen 3.215 N/A GLN 368.A N GLN 365.A O no hydrogen 3.254 N/A GLN 368.A NE2 LEU 356.A O no hydrogen 2.887 N/A GLN 368.A NE2 GLN 365.A OE1 no hydrogen 2.958 N/A VAL 369.A N PHE 366.A O no hydrogen 3.078 N/A TYR 370.A N PHE 366.A O no hydrogen 3.087 N/A TYR 370.A OH SER 390.A O no hydrogen 2.622 N/A ASN 371.A N TYR 367.A O no hydrogen 3.089 N/A ALA 372.A N GLN 368.A O no hydrogen 3.073 N/A ILE 373.A N VAL 369.A O no hydrogen 3.053 N/A ASN 374.A N TYR 370.A O no hydrogen 2.979 N/A ASN 374.A ND2 HIS 397.A O no hydrogen 2.918 N/A ASN 375.A N ASN 371.A O no hydrogen 3.099 N/A HIS 376.A N ILE 373.A O no hydrogen 3.133 N/A HIS 376.A NE2 ASP 515.A OD2 no hydrogen 2.846 N/A ALA 377.A N ILE 373.A O no hydrogen 2.819 N/A ASP 378.A N GLN 433.A OE1 no hydrogen 2.821 N/A ALA 381.A N ASP 378.A O no hydrogen 3.209 N/A ILE 382.A N GLN 433.A O no hydrogen 2.911 N/A TYR 383.A N MET 405.A O no hydrogen 2.768 N/A SER 384.A N TRP 435.A O no hydrogen 2.705 N/A SER 384.A OG ALA 418.A O no hydrogen 2.701 N/A ILE 385.A N ARG 407.A O no hydrogen 2.922 N/A ASP 386.A N ILE 437.A O no hydrogen 3.000 N/A VAL 387.A N ASP 386.A OD1 no hydrogen 2.887 N/A THR 391.A OG1 ASP 386.A O no hydrogen 2.753 N/A THR 391.A OG1 GLY 388.A O no hydrogen 2.986 N/A GLN 392.A N GLY 388.A O no hydrogen 2.982 N/A GLN 392.A NE2 ASP 386.A O no hydrogen 3.046 N/A THR 393.A N ASN 389.A O no hydrogen 3.187 N/A SER 394.A N THR 391.A O no hydrogen 3.040 N/A SER 394.A OG THR 391.A O no hydrogen 2.796 N/A ILE 395.A N GLN 392.A O no hydrogen 3.395 N/A ARG 396.A N THR 393.A O no hydrogen 2.910 N/A ARG 396.A NE GLY 259.A O no hydrogen 2.778 N/A ARG 396.A NH1 ILE 543.A O no hydrogen 2.922 N/A ARG 396.A NH2 ARG 257.A O no hydrogen 3.182 N/A ARG 396.A NH2 GLY 259.A O no hydrogen 3.251 N/A ARG 396.A NH2 ILE 543.A O no hydrogen 2.954 N/A HIS 397.A N SER 394.A O no hydrogen 3.012 N/A HIS 397.A ND1 GLU 357.A OE2 no hydrogen 2.901 N/A LEU 398.A N SER 394.A O no hydrogen 2.903 N/A HIS 399.A N ASN 374.A OD1 no hydrogen 2.953 N/A THR 401.A N ASN 404.A OD1 no hydrogen 2.944 N/A LYS 403.A N THR 401.A OG1 no hydrogen 3.203 N/A LYS 403.A NZ GLU 379.A OE1 no hydrogen 3.537 N/A LYS 403.A NZ GLU 379.A OE2 no hydrogen 3.120 N/A ASN 404.A N THR 401.A O no hydrogen 2.849 N/A ASN 404.A ND2 ALA 381.A O no hydrogen 2.954 N/A TRP 406.A N GLU 242.A OE1 no hydrogen 2.745 N/A TRP 406.A NE1 SER 394.A OG no hydrogen 3.125 N/A ARG 407.A N TYR 383.A O no hydrogen 3.046 N/A ARG 407.A NE LYS 64.A O no hydrogen 2.748 N/A ARG 407.A NH1 GLU 242.A OE1 no hydrogen 2.860 N/A ARG 407.A NH1 GLU 242.A OE2 no hydrogen 3.134 N/A ARG 407.A NH1 TRP 406.A O no hydrogen 3.028 N/A ARG 407.A NH2 LYS 64.A O no hydrogen 3.483 N/A THR 408.A OG1 ILE 385.A O no hydrogen 2.628 N/A SER 409.A N THR 408.A OG1 no hydrogen 2.669 N/A SER 409.A OG ASP 89.A OD1 no hydrogen 2.673 N/A THR 414.A N SER 409.A OG no hydrogen 2.876 N/A THR 414.A OG1 MET 415.A O no hydrogen 3.334 N/A GLY 416.A N ASP 386.A OD1 no hydrogen 2.861 N/A ALA 418.A N ASP 386.A OD2 no hydrogen 3.100 N/A GLY 421.A N ILE 417.A O no hydrogen 2.938 N/A GLY 422.A N ALA 418.A O no hydrogen 2.884 N/A LEU 423.A N ILE 419.A O no hydrogen 3.065 N/A GLY 424.A N PRO 420.A O no hydrogen 2.945 N/A ALA 425.A N GLY 421.A O no hydrogen 2.872 N/A LYS 426.A N GLY 422.A O no hydrogen 2.852 N/A LYS 426.A NZ PRO 430.A O no hydrogen 3.068 N/A LYS 426.A NZ ARG 432.A O no hydrogen 2.745 N/A ASN 427.A N LEU 423.A O no hydrogen 2.939 N/A THR 428.A N GLY 424.A O no hydrogen 3.237 N/A THR 428.A OG1 GLY 424.A O no hydrogen 2.925 N/A TYR 429.A N ALA 425.A O no hydrogen 2.834 N/A TYR 429.A OH PHE 65.A O no hydrogen 2.722 N/A ARG 432.A N TYR 429.A O no hydrogen 3.139 N/A ARG 432.A NE ASP 380.A O no hydrogen 2.657 N/A ARG 432.A NH2 ASP 380.A O no hydrogen 3.049 N/A TRP 435.A N ILE 382.A O no hydrogen 2.811 N/A TRP 435.A NE1 GLN 433.A OE1 no hydrogen 2.920 N/A ASN 436.A N ILE 461.A O no hydrogen 2.819 N/A ASN 436.A ND2 ASN 462.A OD1 no hydrogen 3.026 N/A ILE 437.A N SER 384.A O no hydrogen 2.942 N/A ILE 438.A N VAL 463.A O no hydrogen 2.824 N/A ASP 440.A N PHE 465.A O no hydrogen 2.895 N/A PHE 443.A N GLY 439.A O no hydrogen 2.843 N/A SER 444.A N ASP 440.A O no hydrogen 2.894 N/A SER 444.A OG ASP 440.A O no hydrogen 2.823 N/A MET 445.A N ALA 442.A O no hydrogen 3.112 N/A THR 446.A N PHE 443.A O no hydrogen 2.973 N/A THR 446.A OG1 ALA 442.A O no hydrogen 3.198 N/A TYR 447.A N PHE 443.A O no hydrogen 2.663 N/A ASP 449.A N THR 446.A O no hydrogen 2.985 N/A VAL 450.A N TYR 447.A O no hydrogen 2.998 N/A THR 452.A N ASP 449.A O no hydrogen 2.944 N/A THR 452.A OG1 ASP 449.A OD1 no hydrogen 2.612 N/A ASN 453.A N VAL 450.A O no hydrogen 3.091 N/A ASN 453.A ND2 MET 458.A O no hydrogen 2.907 N/A VAL 454.A N VAL 450.A O no hydrogen 3.317 N/A ARG 455.A N VAL 451.A O no hydrogen 2.773 N/A TYR 456.A N THR 452.A O no hydrogen 3.131 N/A ASN 457.A N VAL 454.A O no hydrogen 3.129 N/A MET 458.A N ASN 453.A O no hydrogen 2.996 N/A ILE 461.A N VAL 434.A O no hydrogen 2.961 N/A ASN 462.A N VAL 531.A O no hydrogen 2.836 N/A ASN 462.A ND2 VAL 531.A O no hydrogen 2.963 N/A VAL 463.A N ASN 436.A O no hydrogen 2.768 N/A VAL 464.A N ILE 533.A O no hydrogen 2.890 N/A PHE 465.A N ILE 438.A O no hydrogen 2.841 N/A SER 466.A N CYS 535.A O no hydrogen 2.908 N/A SER 466.A OG ASP 534.A OD1 no hydrogen 2.842 N/A ASN 467.A N ASP 440.A OD2 no hydrogen 2.815 N/A THR 468.A OG1 ASN 467.A O no hydrogen 2.450 N/A TYR 470.A N VAL 487.A O no hydrogen 3.233 N/A ILE 473.A N TYR 470.A O no hydrogen 2.725 N/A LYS 474.A NZ ASP 488.A OD1 no hydrogen 3.337 N/A LYS 474.A NZ ASP 488.A OD2 no hydrogen 3.267 N/A LYS 474.A NZ GLN 539.A OE1 no hydrogen 3.286 N/A ASN 475.A N ALA 471.A O no hydrogen 2.450 N/A LYS 476.A N PHE 472.A O no hydrogen 2.984 N/A LYS 476.A N ILE 473.A O no hydrogen 2.999 N/A TYR 477.A N ILE 473.A O no hydrogen 3.159 N/A ASP 479.A N LYS 476.A O no hydrogen 2.747 N/A THR 480.A N LYS 476.A O no hydrogen 3.011 N/A THR 480.A OG1 LYS 476.A O no hydrogen 3.382 N/A THR 480.A OG1 ASN 481.A OD1 no hydrogen 2.757 N/A ASN 481.A N TYR 477.A O no hydrogen 2.724 N/A TYR 494.A N ASP 534.A OD2 no hydrogen 3.377 N/A TYR 494.A OH SER 444.A OG no hydrogen 3.322 N/A LYS 496.A N ASP 493.A OD1 no hydrogen 2.997 N/A ILE 497.A N ASP 493.A O no hydrogen 3.168 N/A ALA 498.A N TYR 494.A O no hydrogen 2.968 N/A GLU 499.A N ALA 495.A O no hydrogen 3.087 N/A ALA 500.A N LYS 496.A O no hydrogen 2.999 N/A GLN 501.A N ILE 497.A O no hydrogen 3.071 N/A GLN 501.A N ALA 498.A O no hydrogen 2.989 N/A GLN 501.A NE2 TYR 447.A O no hydrogen 2.882 N/A GLY 502.A N GLU 499.A O no hydrogen 3.074 N/A ALA 503.A N ALA 498.A O no hydrogen 2.860 N/A LYS 504.A N THR 530.A O no hydrogen 2.935 N/A GLY 505.A N GLU 499.A OE1 no hydrogen 2.936 N/A PHE 506.A N VAL 532.A O no hydrogen 2.874 N/A VAL 508.A N ASP 534.A O no hydrogen 3.071 N/A ARG 510.A NE GLU 512.A OE1 no hydrogen 2.609 N/A ARG 510.A NH2 GLU 512.A OE1 no hydrogen 2.755 N/A ILE 511.A N GLY 362.A O no hydrogen 2.861 N/A GLU 512.A N GLU 512.A OE2 no hydrogen 2.663 N/A ASP 513.A N ARG 510.A O no hydrogen 3.066 N/A MET 514.A N ILE 511.A O no hydrogen 3.196 N/A ARG 516.A NE GLU 520.A OE2 no hydrogen 3.219 N/A VAL 517.A N ASP 513.A O no hydrogen 3.128 N/A MET 518.A N MET 514.A O no hydrogen 2.929 N/A ALA 519.A N ASP 515.A O no hydrogen 2.924 N/A GLU 520.A N ARG 516.A O no hydrogen 2.917 N/A ALA 521.A N VAL 517.A O no hydrogen 2.867 N/A VAL 522.A N MET 518.A O no hydrogen 2.932 N/A ALA 523.A N ALA 519.A O no hydrogen 3.031 N/A ALA 524.A N GLU 520.A O no hydrogen 2.917 N/A ASN 525.A N ALA 521.A O no hydrogen 2.966 N/A ASN 525.A ND2 HIS 529.A O no hydrogen 3.150 N/A LYS 526.A N VAL 522.A O no hydrogen 2.925 N/A ALA 527.A N ALA 524.A O no hydrogen 3.008 N/A GLY 528.A N ASN 525.A O no hydrogen 3.059 N/A HIS 529.A N ALA 524.A O no hydrogen 3.148 N/A VAL 531.A N VAL 460.A O no hydrogen 2.971 N/A VAL 532.A N LYS 504.A O no hydrogen 2.906 N/A ILE 533.A N ASN 462.A O no hydrogen 2.798 N/A ASP 534.A N PHE 506.A O no hydrogen 2.766 N/A CYS 535.A N VAL 464.A O no hydrogen 2.771 N/A CYS 535.A SG ILE 533.A O no hydrogen 3.809 N/A LYS 536.A N VAL 508.A O no hydrogen 2.847 N/A LYS 536.A NZ ASP 491.A OD1 no hydrogen 2.780 N/A LYS 536.A NZ ASP 491.A OD2 no hydrogen 3.099 N/A LYS 536.A NZ VAL 492.A O no hydrogen 3.151 N/A LYS 536.A NZ ASP 534.A OD1 no hydrogen 3.418 N/A LYS 536.A NZ ASP 534.A OD2 no hydrogen 2.833 N/A ILE 537.A N SER 466.A O no hydrogen 3.055 N/A THR 538.A N LEU 364.A O no hydrogen 3.047 N/A THR 538.A OG1 ASP 540.A OD2 no hydrogen 2.556 N/A ASP 540.A N THR 538.A OG1 no hydrogen 3.288 N/A ARG 541.A NH1 ASP 479.A OD2 no hydrogen 3.293 N/A ARG 541.A NH2 ASP 479.A OD2 no hydrogen 3.067 N/A GLU 546.A N GLU 546.A OE1 no hydrogen 2.567 N/A THR 547.A N PRO 544.A O no hydrogen 3.332 N/A THR 547.A OG1 THR 547.A O no hydrogen 2.563 N/A LYS 553.A N ASP 551.A OD1 no hydrogen 2.758 N/A LEU 554.A N ASP 551.A O no hydrogen 2.943 N/A TYR 555.A N ASP 551.A O no hydrogen 3.041 N/A SER 556.A N GLU 559.A OE1 no hydrogen 2.884 N/A SER 556.A OG GLU 559.A OE1 no hydrogen 3.308 N/A GLU 559.A N SER 556.A OG no hydrogen 3.104 N/A ILE 560.A N SER 556.A O no hydrogen 2.986 N/A LYS 561.A N GLU 557.A O no hydrogen 2.902 N/A ALA 562.A N ASP 558.A O no hydrogen 2.976 N/A TYR 563.A N GLU 559.A O no hydrogen 2.832 N/A TYR 563.A OH PRO 544.A O no hydrogen 2.797 N/A TYR 563.A OH THR 547.A O no hydrogen 3.380 N/A LYS 564.A N ILE 560.A O no hydrogen 2.843 N/A LYS 564.A NZ ALA 570.A O no hydrogen 3.297 N/A GLU 565.A N LYS 561.A O no hydrogen 2.963 N/A ARG 566.A N ALA 562.A O no hydrogen 2.923 N/A ARG 566.A NH2 GLU 478.A OE1 no hydrogen 2.629 N/A ARG 566.A NH2 GLU 478.A OE2 no hydrogen 3.186 N/A TYR 567.A N TYR 563.A O no hydrogen 3.134 N/A ALA 569.A N LYS 564.A O no hydrogen 2.890 N/A LEU 572.A N ALA 569.A O no hydrogen 3.042 N/A VAL 573.A N ASN 348.A OD1 no hydrogen 2.817 N/A PHE 575.A N GLU 265.A OE2 no hydrogen 2.918 N/A ARG 576.A NE ASP 551.A OD1 no hydrogen 3.329 N/A ARG 576.A NE ASP 551.A OD2 no hydrogen 2.843 N/A ARG 576.A NH1 GLU 580.A OE1 no hydrogen 2.818 N/A ARG 576.A NH2 ASP 551.A OD1 no hydrogen 2.885 N/A GLU 577.A N PRO 574.A O no hydrogen 2.960 N/A LEU 579.A N PHE 575.A O no hydrogen 2.973 N/A GLU 580.A N ARG 576.A O no hydrogen 2.921 N/A ALA 581.A N GLU 577.A O no hydrogen 3.040 N/A GLU 582.A N LEU 579.A O no hydrogen 3.017 N/A GLY 583.A N GLU 580.A O no hydrogen 3.046 N/A LEU 584.A N LEU 579.A O no hydrogen 2.925 N/A SER 586.A OG GLU 269.A OE1 no hydrogen 2.545 N/A LYS 587.A N GLU 269.A OE2 no hydrogen 2.937 N/A LYS 587.A NZ ALA 270.A O no hydrogen 2.929 N/A LYS 587.A NZ ASP 271.A OD1 no hydrogen 2.723 N/A LYS 587.A NZ ASN 291.A O no hydrogen 2.862 N/A LYS 587.A NZ ASP 293.A OD1 no hydrogen 3.522 N/A LYS 587.A NZ ASP 293.A OD2 no hydrogen 3.204 N/A TYR 588.A N SER 586.A OG no hydrogen 3.345 N/A ILE 589.A N SER 586.A OG no hydrogen 2.900 N/A