Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1khe_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ASN 1.A N SER 3.A OG no hydrogen 3.106 N/A LYS 5.A N LEU 2.A O no hydrogen 2.711 N/A LYS 5.A NZ PRO 31.A O no hydrogen 2.901 N/A VAL 6.A N SER 3.A O no hydrogen 3.051 N/A VAL 7.A N ILE 34.A O no hydrogen 2.826 N/A GLN 8.A NE2 ILE 36.A O no hydrogen 3.608 N/A ASP 12.A N SER 10.A OG no hydrogen 3.146 N/A SER 13.A N SER 10.A O no hydrogen 2.791 N/A SER 13.A OG SER 10.A O no hydrogen 2.888 N/A LEU 14.A N LEU 11.A O no hydrogen 2.879 N/A GLN 16.A NE2 GLU 20.A OE2 no hydrogen 2.810 N/A VAL 18.A N PRO 15.A O no hydrogen 2.856 N/A ARG 19.A N PRO 15.A O no hydrogen 2.943 N/A ARG 19.A NE GLU 23.A OE2 no hydrogen 2.726 N/A ARG 19.A NH1 ASP 12.A OD1 no hydrogen 3.517 N/A GLU 20.A N GLN 16.A O no hydrogen 2.879 N/A PHE 21.A N ALA 17.A O no hydrogen 3.283 N/A LEU 22.A N VAL 18.A O no hydrogen 3.067 N/A GLU 23.A N ARG 19.A O no hydrogen 2.809 N/A ASN 24.A N GLU 20.A O no hydrogen 2.887 N/A ASN 25.A N PHE 21.A O no hydrogen 3.227 N/A ASN 25.A ND2 PHE 21.A O no hydrogen 2.664 N/A ALA 26.A N LEU 22.A O no hydrogen 2.722 N/A GLU 27.A N GLU 23.A O no hydrogen 2.946 N/A LEU 28.A N ASN 24.A O no hydrogen 3.006 N/A CYS 29.A N ASN 25.A O no hydrogen 2.722 N/A CYS 29.A SG ASN 25.A O no hydrogen 3.502 N/A CYS 29.A SG PHE 119.A O no hydrogen 4.003 N/A GLN 30.A N ALA 26.A O no hydrogen 2.626 N/A GLN 30.A NE2 GLU 27.A O no hydrogen 2.758 N/A HIS 33.A N ARG 125.A O no hydrogen 3.258 N/A ILE 34.A N LYS 5.A O no hydrogen 2.884 N/A HIS 35.A NE2 GLU 43.A OE2 no hydrogen 2.840 N/A ILE 36.A N GLN 8.A O no hydrogen 3.039 N/A CYS 37.A N VAL 128.A O no hydrogen 3.021 N/A CYS 37.A SG VAL 128.A O no hydrogen 3.317 N/A ASP 38.A N GLU 43.A OE2 no hydrogen 2.792 N/A GLY 39.A N GLU 43.A OE1 no hydrogen 2.868 N/A SER 40.A N ASP 38.A OD1 no hydrogen 3.149 N/A SER 40.A OG ASP 38.A OD1 no hydrogen 3.391 N/A SER 40.A OG GLU 42.A OE1 no hydrogen 3.084 N/A GLU 42.A N GLU 42.A OE1 no hydrogen 2.412 N/A GLU 43.A N SER 40.A OG no hydrogen 3.072 N/A ASN 44.A N SER 40.A O no hydrogen 3.129 N/A GLY 45.A N GLU 41.A O no hydrogen 2.734 N/A ARG 46.A N GLU 42.A O no hydrogen 2.851 N/A ARG 46.A NH2 GLN 8.A OE1 no hydrogen 2.970 N/A LEU 47.A N GLU 43.A O no hydrogen 2.640 N/A LEU 48.A N ASN 44.A O no hydrogen 2.761 N/A GLY 49.A N GLY 45.A O no hydrogen 2.973 N/A GLN 50.A N ARG 46.A O no hydrogen 3.000 N/A GLU 52.A N GLY 49.A O no hydrogen 2.815 N/A GLU 53.A N GLN 50.A O no hydrogen 2.891 N/A GLY 54.A N GLU 51.A O no hydrogen 2.921 N/A ARG 57.A N LEU 67.A O no hydrogen 2.887 N/A LEU 59.A N CYS 65.A O no hydrogen 2.881 N/A LYS 61.A N GLY 344.A O no hydrogen 2.979 N/A TYR 62.A N LEU 59.A O no hydrogen 2.943 N/A ASN 64.A ND2 ASN 332.A OD1 no hydrogen 3.061 N/A CYS 65.A SG ASP 63.A O no hydrogen 3.747 N/A CYS 65.A SG ILE 329.A O no hydrogen 3.869 N/A CYS 65.A SG GLN 330.A O no hydrogen 3.926 N/A TRP 66.A N THR 333.A O no hydrogen 3.042 N/A TRP 66.A NE1 ASN 64.A OD1 no hydrogen 2.733 N/A LEU 67.A N ARG 57.A O no hydrogen 2.805 N/A ALA 68.A N PHE 335.A O no hydrogen 2.966 N/A THR 70.A N ASN 337.A OD1 no hydrogen 2.937 N/A THR 70.A OG1 ASP 71.A O no hydrogen 2.990 N/A THR 70.A OG1 ASN 337.A OD1 no hydrogen 3.389 N/A ARG 73.A N ASP 71.A OD1 no hydrogen 2.863 N/A ARG 73.A NE ASP 71.A OD1 no hydrogen 3.339 N/A ARG 73.A NH2 ASP 71.A OD2 no hydrogen 2.876 N/A ASP 74.A N ASP 71.A O no hydrogen 2.792 N/A ARG 77.A NH1 GLU 79.A OE2 no hydrogen 2.647 N/A LYS 81.A NZ PRO 197.A O no hydrogen 2.453 N/A THR 82.A N GLU 79.A O no hydrogen 2.667 N/A THR 82.A N SER 80.A O no hydrogen 2.963 N/A THR 82.A OG1 ILE 78.A O no hydrogen 2.638 N/A VAL 83.A N ILE 202.A O no hydrogen 2.844 N/A ILE 84.A N ARG 105.A O no hydrogen 3.006 N/A VAL 85.A N HIS 204.A O no hydrogen 2.649 N/A THR 86.A OG1 GLU 88.A O no hydrogen 2.669 N/A THR 86.A OG1 THR 92.A OG1 no hydrogen 2.792 N/A ASP 91.A N GLU 88.A O no hydrogen 2.977 N/A THR 92.A N GLN 89.A O no hydrogen 2.679 N/A THR 92.A OG1 THR 86.A OG1 no hydrogen 2.792 N/A VAL 93.A N GLN 89.A O no hydrogen 3.132 N/A LYS 97.A N ASP 559.A O no hydrogen 2.906 N/A LYS 97.A NZ ASN 562.A OD1 no hydrogen 2.452 N/A GLN 102.A N GLN 560.A OE1 no hydrogen 2.870 N/A LEU 103.A N SER 101.A OG no hydrogen 2.978 N/A ARG 105.A NH1 SER 80.A O no hydrogen 2.017 N/A TRP 106.A NE1 THR 86.A O no hydrogen 2.840 N/A TRP 106.A NE1 THR 86.A OG1 no hydrogen 2.905 N/A ASP 110.A N SER 107.A OG no hydrogen 3.033 N/A PHE 111.A N SER 107.A O no hydrogen 2.934 N/A GLU 112.A N GLU 108.A O no hydrogen 2.905 N/A LYS 113.A N GLU 109.A O no hydrogen 3.168 N/A ALA 114.A N ASP 110.A O no hydrogen 2.987 N/A PHE 115.A N PHE 111.A O no hydrogen 2.808 N/A PHE 115.A N GLU 112.A O no hydrogen 3.113 N/A ASN 116.A N GLU 112.A O no hydrogen 3.087 N/A ALA 117.A N LYS 113.A O no hydrogen 2.923 N/A ARG 118.A N PHE 115.A O no hydrogen 2.861 N/A ARG 118.A NE LEU 199.A O no hydrogen 2.964 N/A ARG 118.A NH1 ALA 114.A O no hydrogen 3.093 N/A PHE 119.A N PHE 115.A O no hydrogen 2.928 N/A GLY 121.A N LEU 28.A O no hydrogen 2.944 N/A CYS 122.A N PHE 119.A O no hydrogen 2.957 N/A CYS 122.A SG PHE 119.A O no hydrogen 3.255 N/A CYS 122.A SG SER 178.A OG no hydrogen 3.410 N/A GLY 124.A N ASP 32.A OD1 no hydrogen 3.259 N/A ARG 125.A NE CYS 181.A O no hydrogen 2.792 N/A ARG 125.A NH2 CYS 181.A O no hydrogen 2.595 N/A VAL 128.A N HIS 35.A O no hydrogen 2.846 N/A ILE 129.A N GLU 145.A O no hydrogen 2.947 N/A PHE 131.A N GLY 143.A O no hydrogen 2.889 N/A SER 132.A N ARG 159.A O no hydrogen 2.983 N/A SER 132.A OG GLY 133.A O no hydrogen 2.882 N/A GLY 133.A N PRO 306.A O no hydrogen 2.938 N/A SER 137.A OG PRO 401.A O no hydrogen 3.189 N/A LEU 139.A N SER 137.A OG no hydrogen 2.924 N/A SER 140.A N SER 137.A O no hydrogen 2.992 N/A SER 140.A OG PRO 134.A O no hydrogen 2.686 N/A LYS 141.A NZ GLU 240.A OE1 no hydrogen 3.069 N/A GLY 143.A N PHE 131.A O no hydrogen 2.889 N/A ILE 144.A N VAL 173.A O no hydrogen 3.216 N/A GLU 145.A N ILE 129.A O no hydrogen 2.796 N/A LEU 146.A N CYS 175.A O no hydrogen 2.492 N/A THR 147.A N TYR 127.A O no hydrogen 3.136 N/A THR 147.A OG1 HIS 177.A ND1 no hydrogen 2.710 N/A SER 149.A N THR 147.A OG1 no hydrogen 2.953 N/A TYR 151.A OH THR 336.A OG1 no hydrogen 2.487 N/A VAL 152.A N SER 149.A OG no hydrogen 2.928 N/A VAL 153.A N SER 149.A O no hydrogen 3.253 N/A ALA 154.A N PRO 150.A O no hydrogen 3.021 N/A SER 155.A N TYR 151.A O no hydrogen 2.963 N/A SER 155.A OG TYR 151.A O no hydrogen 2.816 N/A ARG 156.A NE GLY 39.A O no hydrogen 2.823 N/A ARG 156.A NH2 GLY 39.A O no hydrogen 3.098 N/A ILE 157.A N SER 155.A O no hydrogen 3.116 N/A THR 158.A OG1 ARG 159.A O no hydrogen 3.476 N/A ARG 159.A N SER 132.A O no hydrogen 3.356 N/A ARG 159.A NH1 GLU 307.A O no hydrogen 3.137 N/A ARG 159.A NH2 GLU 399.A OE2 no hydrogen 2.929 N/A GLY 160.A N PRO 130.A O no hydrogen 2.926 N/A THR 161.A N ASP 38.A O no hydrogen 2.931 N/A VAL 163.A N GLY 160.A O no hydrogen 2.940 N/A GLU 165.A N THR 161.A O no hydrogen 2.908 N/A ALA 166.A N PRO 162.A O no hydrogen 3.041 N/A LEU 167.A N VAL 163.A O no hydrogen 2.810 N/A GLY 168.A N LEU 164.A O no hydrogen 3.042 N/A GLY 170.A N LEU 167.A O no hydrogen 2.686 N/A VAL 173.A N ILE 142.A O no hydrogen 2.775 N/A LYS 174.A N ARG 209.A O no hydrogen 2.924 N/A CYS 175.A N ILE 144.A O no hydrogen 3.034 N/A CYS 175.A SG VAL 173.A O no hydrogen 3.551 N/A LEU 176.A N ILE 211.A O no hydrogen 2.930 N/A HIS 177.A N LEU 146.A O no hydrogen 2.892 N/A HIS 177.A ND1 THR 147.A OG1 no hydrogen 2.710 N/A HIS 177.A NE2 SER 216.A O no hydrogen 2.951 N/A SER 178.A N SER 213.A O no hydrogen 3.175 N/A SER 178.A OG ASP 148.A OD2 no hydrogen 2.653 N/A VAL 179.A N ASP 148.A OD1 no hydrogen 2.716 N/A GLY 180.A N SER 178.A OG no hydrogen 2.889 N/A CYS 181.A SG VAL 179.A O no hydrogen 3.880 N/A CYS 181.A SG CYS 195.A O no hydrogen 3.222 N/A LEU 183.A N LYS 123.A O no hydrogen 2.838 N/A ASN 191.A ND2 THR 70.A O no hydrogen 3.208 N/A TRP 193.A N VAL 190.A O no hydrogen 2.443 N/A TRP 193.A NE1 ASP 74.A OD2 no hydrogen 2.862 N/A ASN 196.A N GLY 215.A O no hydrogen 2.719 N/A ASN 196.A ND2 GLY 180.A O no hydrogen 3.109 N/A LEU 199.A N ASN 196.A O no hydrogen 3.162 N/A THR 200.A N PRO 197.A O no hydrogen 3.451 N/A THR 200.A OG1 ASN 196.A O no hydrogen 2.592 N/A LEU 201.A N PHE 214.A O no hydrogen 2.930 N/A ILE 202.A N LYS 81.A O no hydrogen 3.018 N/A ALA 203.A N ILE 212.A O no hydrogen 2.481 N/A HIS 204.A N VAL 83.A O no hydrogen 3.038 N/A HIS 204.A ND1 VAL 83.A O no hydrogen 2.744 N/A LEU 205.A N GLU 210.A O no hydrogen 2.801 N/A ARG 209.A N PRO 206.A O no hydrogen 2.822 N/A ARG 209.A NH1 GLU 239.A OE1 no hydrogen 2.642 N/A ARG 209.A NH2 PRO 206.A O no hydrogen 3.240 N/A ARG 209.A NH2 GLU 239.A OE2 no hydrogen 3.138 N/A GLU 210.A N LEU 205.A O no hydrogen 3.126 N/A ILE 211.A N LYS 174.A O no hydrogen 2.819 N/A ILE 212.A N ALA 203.A O no hydrogen 2.742 N/A SER 213.A N LEU 176.A O no hydrogen 2.913 N/A SER 213.A OG ASN 221.A O no hydrogen 2.631 N/A PHE 214.A N LEU 201.A O no hydrogen 2.655 N/A GLY 215.A N SER 178.A O no hydrogen 2.744 N/A SER 216.A OG ASP 74.A OD1 no hydrogen 2.613 N/A SER 216.A OG ASP 74.A OD2 no hydrogen 3.315 N/A GLY 217.A N ASP 74.A OD2 no hydrogen 2.510 N/A TYR 218.A N SER 216.A OG no hydrogen 3.042 N/A TYR 218.A OH ASN 381.A O no hydrogen 3.050 N/A ASN 221.A N TYR 218.A O no hydrogen 2.605 N/A ASN 221.A ND2 SER 216.A OG no hydrogen 3.065 N/A SER 222.A N GLY 219.A O no hydrogen 3.148 N/A SER 222.A OG GLY 217.A O no hydrogen 2.607 N/A SER 222.A OG GLY 219.A O no hydrogen 3.442 N/A LEU 223.A N GLY 219.A O no hydrogen 2.830 N/A LEU 224.A N GLU 145.A OE1 no hydrogen 2.951 N/A LYS 226.A N LEU 223.A O no hydrogen 2.961 N/A LYS 226.A NZ LYS 226.A O no hydrogen 2.828 N/A LYS 226.A NZ ASP 290.A OD2 no hydrogen 2.604 N/A LYS 226.A NZ GLU 307.A OE2 no hydrogen 2.406 N/A LYS 227.A NZ ASP 290.A OD1 no hydrogen 3.465 N/A LYS 227.A NZ ASP 290.A OD2 no hydrogen 2.818 N/A CYS 228.A SG HIS 204.A NE2 no hydrogen 3.390 N/A CYS 228.A SG GLY 220.A O no hydrogen 3.509 N/A PHE 229.A N LEU 224.A O no hydrogen 3.071 N/A ALA 230.A N GLY 225.A O no hydrogen 3.233 N/A LEU 231.A N LYS 227.A O no hydrogen 3.157 N/A ARG 232.A N LYS 227.A O no hydrogen 2.967 N/A ARG 232.A NE PRO 451.A O no hydrogen 3.113 N/A ARG 232.A NH1 HIS 204.A NE2 no hydrogen 3.003 N/A ARG 232.A NH2 PRO 451.A O no hydrogen 2.848 N/A SER 234.A N LEU 231.A O no hydrogen 2.959 N/A SER 234.A OG LEU 231.A O no hydrogen 2.718 N/A SER 234.A OG ARG 232.A O no hydrogen 2.869 N/A ARG 235.A NE GLU 239.A OE2 no hydrogen 2.891 N/A ARG 235.A NH2 ASP 207.A OD1 no hydrogen 2.674 N/A ARG 235.A NH2 GLU 239.A OE2 no hydrogen 3.141 N/A ALA 237.A N ALA 233.A O no hydrogen 2.702 N/A LYS 238.A N SER 234.A O no hydrogen 2.984 N/A GLU 239.A N ARG 235.A O no hydrogen 3.028 N/A GLU 240.A N LEU 236.A O no hydrogen 2.736 N/A TRP 242.A N ALA 237.A O no hydrogen 3.056 N/A TRP 242.A NE1 GLU 240.A OE1 no hydrogen 3.041 N/A GLU 245.A N ALA 292.A O no hydrogen 2.996 N/A HIS 246.A ND1 ALA 449.A O no hydrogen 2.747 N/A LEU 247.A N ALA 263.A O no hydrogen 2.872 N/A VAL 248.A N GLY 288.A O no hydrogen 2.783 N/A LEU 249.A N LEU 261.A O no hydrogen 2.849 N/A GLY 250.A N GLU 285.A O no hydrogen 2.826 N/A ILE 251.A N LYS 259.A O no hydrogen 2.712 N/A THR 252.A N LYS 283.A O no hydrogen 2.678 N/A ASN 253.A N GLU 257.A O no hydrogen 2.965 N/A GLU 255.A N ASN 253.A OD1 no hydrogen 2.910 N/A GLY 256.A N ASN 253.A O no hydrogen 2.947 N/A GLU 257.A N ASN 253.A OD1 no hydrogen 3.101 N/A LYS 258.A NZ GLU 285.A OE2 no hydrogen 2.682 N/A LYS 258.A NZ ASP 395.A OD2 no hydrogen 2.579 N/A LYS 259.A N ILE 251.A O no hydrogen 2.904 N/A LYS 259.A NZ GLU 257.A OE2 no hydrogen 2.913 N/A LYS 259.A NZ GLU 407.A OE1 no hydrogen 2.728 N/A LYS 259.A NZ ASP 510.A OD1 no hydrogen 2.960 N/A TYR 260.A OH ASP 395.A OD1 no hydrogen 2.572 N/A TYR 260.A OH ASP 395.A OD2 no hydrogen 2.759 N/A LEU 261.A N LEU 249.A O no hydrogen 2.758 N/A ALA 262.A N GLY 408.A O no hydrogen 2.739 N/A ALA 263.A N LEU 247.A O no hydrogen 3.066 N/A ALA 264.A N ILE 410.A O no hydrogen 2.844 N/A CYS 269.A N PRO 266.A O no hydrogen 2.992 N/A CYS 269.A SG SER 267.A O no hydrogen 3.380 N/A CYS 269.A SG SER 439.A OG no hydrogen 3.434 N/A LYS 271.A NZ HIS 246.A NE2 no hydrogen 3.341 N/A LYS 271.A NZ PHE 265.A O no hydrogen 3.124 N/A THR 272.A OG1 ASP 289.A OD2 no hydrogen 2.563 N/A LEU 274.A N GLY 270.A O no hydrogen 3.021 N/A ALA 275.A N LYS 271.A O no hydrogen 2.743 N/A SER 278.A N GLY 497.A O no hydrogen 3.144 N/A SER 278.A OG GLY 497.A O no hydrogen 3.274 N/A SER 278.A OG GLU 498.A OE1 no hydrogen 2.767 N/A TRP 282.A N LEU 279.A O no hydrogen 3.351 N/A LYS 283.A N THR 252.A O no hydrogen 2.805 N/A GLU 285.A N GLY 250.A O no hydrogen 2.542 N/A CYS 286.A N ILE 393.A O no hydrogen 2.911 N/A VAL 287.A N VAL 248.A O no hydrogen 2.833 N/A GLY 288.A N VAL 248.A O no hydrogen 3.079 N/A ALA 292.A N GLU 245.A O no hydrogen 2.916 N/A TRP 293.A N ILE 304.A O no hydrogen 3.104 N/A TRP 293.A NE1 ALA 230.A O no hydrogen 2.889 N/A ASP 296.A N HIS 300.A O no hydrogen 2.630 N/A GLN 298.A N ASP 296.A OD1 no hydrogen 2.933 N/A GLY 299.A N ASP 296.A O no hydrogen 2.695 N/A HIS 300.A N ASP 296.A OD1 no hydrogen 2.664 N/A ARG 302.A N LYS 294.A O no hydrogen 2.849 N/A ARG 302.A NE ASP 296.A OD2 no hydrogen 3.258 N/A ARG 302.A NH1 GLY 403.A O no hydrogen 2.649 N/A ARG 302.A NH2 ASP 296.A OD2 no hydrogen 3.474 N/A ALA 303.A N VAL 404.A O no hydrogen 2.805 N/A ILE 304.A N TRP 293.A O no hydrogen 2.934 N/A ASN 305.A ND2 VAL 287.A O no hydrogen 2.968 N/A GLU 307.A N ASN 305.A OD1 no hydrogen 2.904 N/A ASN 308.A ND2 ILE 157.A O no hydrogen 3.595 N/A ASN 308.A ND2 THR 158.A O no hydrogen 2.966 N/A PHE 310.A N THR 386.A O no hydrogen 3.067 N/A ALA 314.A N SER 382.A O no hydrogen 2.814 N/A GLY 316.A N GLU 349.A O no hydrogen 2.772 N/A THR 317.A N ALA 314.A O no hydrogen 2.845 N/A THR 317.A OG1 VAL 313.A O no hydrogen 3.305 N/A THR 317.A OG1 ALA 314.A O no hydrogen 2.800 N/A SER 318.A OG THR 321.A OG1 no hydrogen 2.841 N/A THR 321.A N SER 318.A OG no hydrogen 2.969 N/A THR 321.A OG1 GLY 316.A O no hydrogen 2.774 N/A THR 321.A OG1 SER 318.A O no hydrogen 3.474 N/A THR 321.A OG1 SER 318.A OG no hydrogen 2.841 N/A ASN 322.A N SER 318.A O no hydrogen 2.679 N/A ASN 322.A ND2 THR 272.A O no hydrogen 3.371 N/A ALA 325.A N ASN 322.A OD1 no hydrogen 2.921 N/A ILE 326.A N ASN 322.A O no hydrogen 2.988 N/A LYS 327.A N PRO 323.A O no hydrogen 2.970 N/A THR 328.A N ASN 324.A O no hydrogen 2.921 N/A THR 328.A OG1 ASN 324.A O no hydrogen 2.848 N/A ILE 329.A N ALA 325.A O no hydrogen 3.275 N/A GLN 330.A N LYS 327.A O no hydrogen 3.123 N/A GLN 330.A NE2 ILE 326.A O no hydrogen 2.920 N/A ASN 332.A N ASP 63.A O no hydrogen 3.046 N/A ASN 332.A ND2 GLN 390.A OE1 no hydrogen 2.912 N/A THR 333.A OG1 LYS 331.A O no hydrogen 2.600 N/A THR 333.A OG1 THR 386.A OG1 no hydrogen 2.632 N/A ILE 334.A N CYS 385.A O no hydrogen 3.119 N/A PHE 335.A N TRP 66.A O no hydrogen 2.826 N/A THR 336.A N ARG 383.A O no hydrogen 2.885 N/A THR 336.A OG1 TYR 151.A OH no hydrogen 2.487 N/A ASN 337.A N ALA 68.A O no hydrogen 2.880 N/A ASN 337.A ND2 THR 70.A OG1 no hydrogen 3.065 N/A ALA 339.A N TYR 347.A O no hydrogen 3.113 N/A GLU 340.A N THR 362.A O no hydrogen 2.819 N/A THR 341.A N GLY 345.A O no hydrogen 2.965 N/A THR 341.A OG1 ASP 343.A OD2 no hydrogen 2.305 N/A SER 342.A N THR 360.A O no hydrogen 2.759 N/A SER 342.A OG THR 360.A O no hydrogen 3.505 N/A GLY 344.A N THR 341.A O no hydrogen 2.884 N/A GLY 345.A N THR 341.A OG1 no hydrogen 2.879 N/A VAL 346.A N TYR 62.A OH no hydrogen 2.739 N/A TYR 347.A N ALA 339.A O no hydrogen 2.659 N/A TYR 347.A OH GLU 353.A O no hydrogen 2.733 N/A TRP 348.A NE1 THR 317.A O no hydrogen 2.905 N/A ILE 351.A N TRP 348.A O no hydrogen 3.021 N/A VAL 359.A N ALA 356.A O no hydrogen 3.053 N/A THR 360.A N SER 342.A OG no hydrogen 2.710 N/A THR 362.A N GLU 340.A O no hydrogen 2.667 N/A SER 363.A N LYS 367.A O no hydrogen 2.919 N/A SER 363.A OG LYS 367.A O no hydrogen 3.379 N/A TRP 364.A N CYS 377.A O no hydrogen 2.831 N/A LYS 365.A N SER 363.A OG no hydrogen 3.087 N/A ASN 366.A N SER 363.A O no hydrogen 2.850 N/A LYS 367.A N SER 363.A OG no hydrogen 3.354 N/A LYS 367.A NZ LYS 365.A O no hydrogen 3.325 N/A TRP 369.A N ILE 361.A O no hydrogen 3.175 N/A TRP 369.A NE1 GLU 375.A O no hydrogen 2.790 N/A GLU 372.A N SER 370.A OG no hydrogen 2.855 N/A ASP 373.A N SER 370.A O no hydrogen 3.496 N/A GLY 374.A N ASP 373.A OD1 no hydrogen 2.050 N/A CYS 377.A N GLU 349.A OE2 no hydrogen 2.718 N/A CYS 377.A SG GLU 349.A OE1 no hydrogen 3.735 N/A CYS 377.A SG GLU 349.A OE2 no hydrogen 3.467 N/A ALA 378.A N GLU 349.A OE1 no hydrogen 3.180 N/A HIS 379.A N ASN 337.A O no hydrogen 3.073 N/A ASN 381.A N HIS 379.A ND1 no hydrogen 3.050 N/A SER 382.A N HIS 379.A O no hydrogen 2.907 N/A SER 382.A OG HIS 379.A O no hydrogen 2.628 N/A ARG 383.A N THR 336.A O no hydrogen 3.147 N/A ARG 383.A NH1 PHE 311.A O no hydrogen 2.637 N/A ARG 383.A NH2 ASN 381.A OD1 no hydrogen 3.026 N/A PHE 384.A N GLY 312.A O no hydrogen 2.720 N/A CYS 385.A SG SER 155.A O no hydrogen 3.885 N/A THR 386.A N PHE 310.A O no hydrogen 3.104 N/A THR 386.A OG1 THR 328.A O no hydrogen 3.343 N/A THR 386.A OG1 THR 333.A OG1 no hydrogen 2.632 N/A ALA 388.A N ASN 308.A O no hydrogen 2.970 N/A GLN 390.A N PRO 387.A O no hydrogen 3.211 N/A GLN 390.A NE2 THR 328.A O no hydrogen 2.834 N/A GLN 390.A NE2 LYS 331.A O no hydrogen 2.934 N/A CYS 391.A N ALA 388.A O no hydrogen 3.086 N/A ILE 394.A N CYS 391.A O no hydrogen 3.109 N/A ASP 395.A N CYS 286.A O no hydrogen 2.849 N/A ALA 397.A N ASP 395.A OD1 no hydrogen 2.610 N/A TRP 398.A N ASP 395.A O no hydrogen 3.004 N/A SER 400.A N ALA 397.A O no hydrogen 2.951 N/A SER 400.A OG GLU 402.A OE2 no hydrogen 2.725 N/A GLY 403.A N SER 400.A O no hydrogen 2.794 N/A VAL 404.A N ALA 303.A O no hydrogen 2.793 N/A ILE 406.A N LEU 301.A O no hydrogen 2.761 N/A GLU 407.A N TYR 260.A O no hydrogen 2.900 N/A ILE 409.A N LYS 476.A O no hydrogen 2.862 N/A ILE 410.A N ALA 262.A O no hydrogen 2.730 N/A PHE 411.A N PHE 478.A O no hydrogen 2.715 N/A ARG 414.A N SER 439.A OG no hydrogen 2.755 N/A ARG 414.A NE ALA 268.A O no hydrogen 2.590 N/A ARG 414.A NH2 ALA 268.A O no hydrogen 2.824 N/A ARG 415.A N ASN 481.A OD1 no hydrogen 3.089 N/A ARG 415.A NH1 GLU 549.A OE2 no hydrogen 2.705 N/A ARG 415.A NH2 GLU 549.A OE1 no hydrogen 2.522 N/A ARG 415.A NH2 GLU 549.A OE2 no hydrogen 3.351 N/A TYR 423.A N HIS 479.A O no hydrogen 2.752 N/A GLU 424.A N TYR 520.A O no hydrogen 2.667 N/A ALA 425.A N ILE 477.A O no hydrogen 2.921 N/A LEU 426.A N HIS 430.A ND1 no hydrogen 2.920 N/A TRP 428.A NE1 TRP 464.A O no hydrogen 3.010 N/A HIS 430.A N SER 427.A OG no hydrogen 3.136 N/A GLY 431.A N SER 427.A O no hydrogen 2.859 N/A VAL 432.A N TRP 428.A O no hydrogen 2.709 N/A PHE 433.A N GLN 429.A O no hydrogen 3.207 N/A VAL 434.A N HIS 430.A O no hydrogen 2.698 N/A GLY 435.A N GLY 431.A O no hydrogen 2.998 N/A ALA 436.A N VAL 432.A O no hydrogen 2.814 N/A ALA 437.A N VAL 434.A O no hydrogen 3.125 N/A ARG 438.A NH1 GLU 549.A OE2 no hydrogen 3.092 N/A GLU 440.A N ARG 414.A O no hydrogen 3.095 N/A ALA 441.A N ILE 443.A O no hydrogen 2.655 N/A HIS 445.A NE2 ASP 552.A OD1 no hydrogen 2.889 N/A PHE 448.A N GLY 435.A O no hydrogen 2.724 N/A ALA 449.A N ASP 446.A O no hydrogen 2.754 N/A ARG 450.A NE GLN 102.A O no hydrogen 3.245 N/A ASN 456.A N ASP 91.A O no hydrogen 3.062 N/A ASN 456.A ND2 ARG 90.A O no hydrogen 2.893 N/A ASN 456.A ND2 ASP 564.A OD2 no hydrogen 3.081 N/A LYS 459.A N ASN 456.A OD1 no hydrogen 2.898 N/A TYR 460.A N ASN 456.A O no hydrogen 2.797 N/A TYR 460.A OH GLU 245.A OE1 no hydrogen 2.516 N/A TYR 460.A OH GLU 245.A OE2 no hydrogen 3.195 N/A LEU 461.A N PHE 457.A O no hydrogen 2.858 N/A ALA 462.A N GLY 458.A O no hydrogen 3.062 N/A HIS 463.A N LYS 459.A O no hydrogen 2.906 N/A HIS 463.A NE2 TRP 242.A O no hydrogen 2.948 N/A TRP 464.A N TYR 460.A O no hydrogen 3.069 N/A TRP 464.A NE1 GLU 245.A OE2 no hydrogen 2.942 N/A LEU 465.A N LEU 461.A O no hydrogen 2.847 N/A SER 466.A N ALA 462.A O no hydrogen 2.810 N/A SER 466.A OG HIS 463.A O no hydrogen 2.662 N/A GLN 468.A N SER 466.A O no hydrogen 2.731 N/A ALA 472.A N HIS 469.A O no hydrogen 3.008 N/A LYS 473.A N GLY 299.A O no hydrogen 2.809 N/A LYS 473.A NZ ALA 471.A O no hydrogen 3.138 N/A LYS 476.A N GLU 407.A O no hydrogen 3.078 N/A LYS 476.A NZ GLU 424.A OE2 no hydrogen 2.705 N/A PHE 478.A N ILE 409.A O no hydrogen 2.945 N/A HIS 479.A N TYR 423.A O no hydrogen 2.930 N/A VAL 480.A N PHE 411.A O no hydrogen 2.971 N/A ASN 481.A N LEU 421.A O no hydrogen 2.903 N/A ASN 481.A ND2 ARG 415.A O no hydrogen 2.820 N/A ASN 481.A ND2 VAL 419.A O no hydrogen 2.772 N/A PHE 483.A N ASN 481.A OD1 no hydrogen 2.911 N/A ARG 484.A NH1 LEU 538.A O no hydrogen 2.787 N/A ARG 484.A NH1 SER 540.A O no hydrogen 3.023 N/A ARG 484.A NH2 SER 540.A O no hydrogen 2.763 N/A LYS 485.A N PRO 416.A O no hydrogen 2.844 N/A ASP 486.A N LYS 490.A O no hydrogen 2.746 N/A LYS 487.A NZ GLU 488.A OE2 no hydrogen 2.921 N/A GLU 488.A N ASP 486.A OD1 no hydrogen 3.034 N/A GLY 489.A N ASP 486.A O no hydrogen 2.851 N/A LYS 490.A N ASP 486.A OD1 no hydrogen 2.858 N/A LEU 492.A N ARG 484.A O no hydrogen 2.772 N/A TRP 493.A NE1 ASN 499.A OD1 no hydrogen 2.732 N/A GLU 498.A N GLY 495.A O no hydrogen 2.868 N/A ASN 499.A N PHE 496.A O no hydrogen 2.681 N/A SER 500.A N GLY 497.A O no hydrogen 3.335 N/A SER 500.A OG GLY 497.A O no hydrogen 3.160 N/A ARG 501.A N GLU 498.A O no hydrogen 2.902 N/A ARG 501.A NE GLU 498.A OE1 no hydrogen 2.655 N/A ARG 501.A NH1 ASN 528.A O no hydrogen 2.872 N/A ARG 501.A NH1 LYS 530.A O no hydrogen 2.742 N/A ARG 501.A NH2 GLU 498.A OE1 no hydrogen 2.831 N/A ARG 501.A NH2 LYS 530.A O no hydrogen 3.142 N/A LEU 503.A N ASN 499.A O no hydrogen 3.015 N/A GLU 504.A N SER 500.A O no hydrogen 3.007 N/A GLU 504.A N ARG 501.A O no hydrogen 3.264 N/A TRP 505.A N ARG 501.A O no hydrogen 3.250 N/A ASN 507.A N GLU 504.A O no hydrogen 2.983 N/A ARG 508.A N TRP 505.A O no hydrogen 3.166 N/A ARG 508.A NE GLU 424.A OE1 no hydrogen 2.609 N/A ARG 508.A NH2 GLU 424.A OE1 no hydrogen 3.086 N/A ARG 508.A NH2 GLU 424.A OE2 no hydrogen 2.623 N/A ASP 510.A N PHE 506.A O no hydrogen 3.231 N/A GLY 511.A N ARG 508.A O no hydrogen 2.752 N/A LYS 514.A N ILE 521.A O no hydrogen 2.873 N/A THR 516.A N GLY 519.A O no hydrogen 2.948 N/A THR 516.A OG1 GLY 519.A O no hydrogen 2.777 N/A ILE 518.A N THR 516.A OG1 no hydrogen 3.067 N/A GLY 519.A N THR 516.A O no hydrogen 3.294 N/A GLY 519.A N THR 516.A OG1 no hydrogen 3.350 N/A TYR 520.A N GLU 424.A O no hydrogen 2.808 N/A ILE 521.A N LYS 514.A O no hydrogen 2.933 N/A LYS 523.A N SER 512.A O no hydrogen 3.454 N/A ALA 526.A N LYS 523.A O no hydrogen 2.979 N/A ASN 528.A ND2 GLU 504.A OE1 no hydrogen 3.238 N/A LYS 530.A N ASN 528.A OD1 no hydrogen 3.053 N/A LEU 532.A N LEU 529.A O no hydrogen 3.020 N/A LEU 538.A N ASN 536.A O no hydrogen 3.045 N/A SER 540.A N GLU 537.A O no hydrogen 3.314 N/A LYS 543.A NZ SER 581.A O no hydrogen 3.334 N/A PHE 545.A N SER 542.A OG no hydrogen 3.068 N/A TRP 546.A N SER 542.A O no hydrogen 2.925 N/A TRP 546.A NE1 GLY 418.A O no hydrogen 3.069 N/A ASP 547.A N LYS 543.A O no hydrogen 2.646 N/A LYS 548.A N GLU 544.A O no hydrogen 3.017 N/A GLU 549.A N PHE 545.A O no hydrogen 2.954 N/A VAL 550.A N TRP 546.A O no hydrogen 3.016 N/A GLU 551.A N ASP 547.A O no hydrogen 3.424 N/A ASP 552.A N LYS 548.A O no hydrogen 2.979 N/A ILE 553.A N GLU 549.A O no hydrogen 2.782 N/A GLU 554.A N VAL 550.A O no hydrogen 2.612 N/A LYS 555.A N GLU 551.A O no hydrogen 2.998 N/A LYS 555.A NZ ASP 559.A OD2 no hydrogen 2.798 N/A TYR 556.A N ASP 552.A O no hydrogen 3.077 N/A LEU 557.A N ILE 553.A O no hydrogen 2.912 N/A VAL 558.A N GLU 554.A O no hydrogen 2.990 N/A ASP 559.A N LYS 555.A O no hydrogen 2.956 N/A GLN 560.A N TYR 556.A O no hydrogen 2.910 N/A GLN 560.A NE2 LEU 100.A O no hydrogen 3.454 N/A VAL 561.A N LEU 557.A O no hydrogen 2.717 N/A ASN 562.A ND2 ILE 95.A O no hydrogen 2.944 N/A ASP 564.A N VAL 561.A O no hydrogen 2.768 N/A LEU 565.A N ASN 562.A O no hydrogen 3.269 N/A ILE 569.A N PRO 566.A O no hydrogen 2.878 N/A GLU 570.A N PRO 566.A O no hydrogen 3.229 N/A ARG 571.A N CYS 567.A O no hydrogen 2.742 N/A GLU 572.A N GLU 568.A O no hydrogen 2.750 N/A ILE 573.A N ILE 569.A O no hydrogen 2.790 N/A LEU 574.A N GLU 570.A O no hydrogen 2.896 N/A ALA 575.A N ARG 571.A O no hydrogen 2.836 N/A LEU 576.A N GLU 572.A O no hydrogen 3.106 N/A LYS 577.A N ILE 573.A O no hydrogen 3.196 N/A LYS 577.A NZ GLU 554.A OE1 no hydrogen 2.809 N/A LYS 577.A NZ GLU 554.A OE2 no hydrogen 3.214 N/A GLN 578.A N LEU 574.A O no hydrogen 2.775 N/A ARG 579.A N ALA 575.A O no hydrogen 2.703 N/A ARG 579.A NE PRO 517.A O no hydrogen 2.535 N/A ARG 579.A NH2 PRO 517.A O no hydrogen 3.167 N/A ILE 580.A N LEU 576.A O no hydrogen 2.842 N/A SER 581.A N LYS 577.A O no hydrogen 3.193 N/A SER 581.A OG GLN 578.A O no hydrogen 2.719 N/A GLN 582.A N ARG 579.A O no hydrogen 3.322 N/A