Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4hxg_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): TRP 3.A NE1 LYS 339.A O no hydrogen 2.851 N/A ASP 4.A N THR 7.A OG1 no hydrogen 3.183 N/A GLU 5.A N GLU 5.A OE2 no hydrogen 2.834 N/A LYS 6.A N ASP 4.A OD1 no hydrogen 2.713 N/A THR 7.A N ASP 4.A O no hydrogen 3.386 N/A THR 7.A OG1 GLU 2.A O no hydrogen 3.011 N/A THR 7.A OG1 ASP 4.A OD1 no hydrogen 3.101 N/A THR 9.A N LYS 6.A O no hydrogen 3.140 N/A THR 9.A OG1 LYS 6.A O no hydrogen 2.762 N/A LYS 10.A N THR 7.A O no hydrogen 3.029 N/A ALA 12.A N ASN 331.A OD1 no hydrogen 2.688 N/A TYR 13.A N THR 29.A O no hydrogen 3.055 N/A TYR 13.A OH PHE 8.A O no hydrogen 2.733 N/A SER 15.A N VAL 27.A O no hydrogen 2.927 N/A ARG 18.A N ALA 25.A O no hydrogen 2.886 N/A ARG 18.A NE ASP 16.A OD1 no hydrogen 3.187 N/A ARG 18.A NH2 ASP 16.A OD1 no hydrogen 3.438 N/A THR 19.A N ASP 299.A OD2 no hydrogen 2.888 N/A THR 19.A OG1 LEU 23.A O no hydrogen 2.785 N/A ARG 20.A N LEU 23.A O no hydrogen 3.238 N/A LYS 21.A N ASP 301.A OD2 no hydrogen 3.093 N/A LEU 23.A N ARG 20.A O no hydrogen 2.843 N/A VAL 24.A N GLU 45.A O no hydrogen 2.904 N/A ALA 25.A N ARG 18.A O no hydrogen 2.909 N/A TYR 26.A N VAL 43.A O no hydrogen 3.144 N/A TYR 26.A OH GLU 45.A OE2 no hydrogen 2.909 N/A TYR 26.A OH TYR 330.A OH no hydrogen 2.637 N/A VAL 27.A N SER 15.A O no hydrogen 2.815 N/A LEU 28.A N THR 41.A O no hydrogen 2.936 N/A THR 29.A N TYR 13.A O no hydrogen 2.821 N/A THR 29.A OG1 ASN 40.A OD1 no hydrogen 2.689 N/A LYS 30.A N GLU 39.A O no hydrogen 2.992 N/A ASN 32.A N LYS 37.A O no hydrogen 3.029 N/A ASN 32.A ND2 GLU 39.A OE2 no hydrogen 2.938 N/A SER 35.A N ASN 32.A OD1 no hydrogen 2.719 N/A ASN 36.A N LEU 33.A O no hydrogen 3.323 N/A LYS 37.A N ASN 32.A O no hydrogen 3.118 N/A LYS 37.A N SER 35.A OG no hydrogen 3.185 N/A TYR 38.A OH GLY 574.A O no hydrogen 2.727 N/A GLU 39.A N LYS 30.A O no hydrogen 2.929 N/A THR 41.A N LEU 28.A O no hydrogen 2.941 N/A THR 41.A OG1 GLU 55.A OE2 no hydrogen 2.506 N/A ILE 42.A N ILE 54.A O no hydrogen 2.890 N/A VAL 43.A N TYR 26.A O no hydrogen 3.042 N/A ILE 44.A N LYS 52.A O no hydrogen 3.156 N/A GLU 45.A N VAL 24.A O no hydrogen 2.587 N/A ASN 46.A N SER 50.A O no hydrogen 2.602 N/A LEU 47.A N ASN 22.A O no hydrogen 3.099 N/A ARG 51.A NE GLU 45.A OE2 no hydrogen 3.114 N/A LYS 52.A N ILE 44.A O no hydrogen 2.818 N/A LYS 52.A NZ LEU 84.A O no hydrogen 2.672 N/A ILE 54.A N ILE 42.A O no hydrogen 2.915 N/A ASP 56.A N GLU 55.A OE2 no hydrogen 2.872 N/A SER 58.A N MET 72.A O no hydrogen 3.110 N/A ARG 61.A N ALA 70.A O no hydrogen 2.765 N/A ARG 61.A NE ILE 101.A O no hydrogen 3.087 N/A ARG 61.A NH1 ASP 16.A OD2 no hydrogen 3.076 N/A ARG 61.A NH1 PRO 60.A O no hydrogen 2.494 N/A SER 63.A N LYS 68.A O no hydrogen 2.753 N/A SER 63.A OG ASP 65.A OD1 no hydrogen 3.130 N/A SER 63.A OG LYS 68.A O no hydrogen 2.615 N/A ASP 65.A N SER 107.A OG no hydrogen 3.052 N/A GLY 66.A N SER 63.A O no hydrogen 2.604 N/A LYS 67.A N ASP 65.A OD1 no hydrogen 2.738 N/A LYS 68.A N SER 63.A OG no hydrogen 2.924 N/A LYS 68.A NZ SER 107.A O no hydrogen 3.037 N/A ILE 69.A N ALA 82.A O no hydrogen 2.721 N/A ALA 70.A N ARG 61.A O no hydrogen 2.694 N/A PHE 71.A N TRP 80.A O no hydrogen 2.909 N/A MET 72.A N SER 58.A O no hydrogen 2.894 N/A ARG 73.A N GLN 78.A O no hydrogen 3.144 N/A ARG 73.A NE GLU 55.A O no hydrogen 3.286 N/A ARG 73.A NE ASP 56.A O no hydrogen 3.318 N/A ARG 73.A NH2 GLU 55.A O no hydrogen 3.321 N/A GLN 78.A N ARG 73.A O no hydrogen 2.902 N/A GLN 78.A NE2 GLU 94.A OE1 no hydrogen 2.736 N/A ILE 79.A N LEU 93.A O no hydrogen 2.646 N/A TRP 80.A N PHE 71.A O no hydrogen 2.843 N/A VAL 81.A N LYS 90.A O no hydrogen 3.130 N/A ALA 82.A N ILE 69.A O no hydrogen 2.721 N/A ASP 83.A N SER 88.A O no hydrogen 3.072 N/A LEU 84.A N LYS 67.A O no hydrogen 3.080 N/A LYS 85.A N ASP 83.A OD1 no hydrogen 3.044 N/A THR 86.A N ASP 83.A OD2 no hydrogen 3.279 N/A THR 86.A OG1 ASP 83.A OD2 no hydrogen 2.559 N/A THR 86.A OG1 SER 88.A OG no hydrogen 2.778 N/A LEU 87.A N ASP 83.A O no hydrogen 2.611 N/A SER 88.A N THR 86.A OG1 no hydrogen 2.853 N/A SER 88.A OG ASP 83.A OD2 no hydrogen 3.373 N/A SER 88.A OG THR 86.A OG1 no hydrogen 2.778 N/A LYS 90.A N VAL 81.A O no hydrogen 3.056 N/A LYS 90.A NZ THR 151.A O no hydrogen 3.113 N/A LYS 90.A NZ GLU 152.A O no hydrogen 3.342 N/A LYS 90.A NZ GLU 154.A OE2 no hydrogen 3.113 N/A VAL 92.A N ILE 79.A O no hydrogen 2.734 N/A LEU 93.A N ILE 79.A O no hydrogen 3.351 N/A ALA 95.A N ALA 77.A O no hydrogen 2.875 N/A ASN 97.A ND2 PHE 115.A O no hydrogen 3.672 N/A ARG 99.A N VAL 113.A O no hydrogen 2.858 N/A ARG 99.A NH1 GLU 142.A OE2 no hydrogen 2.808 N/A ARG 99.A NH2 GLU 142.A OE1 no hydrogen 3.521 N/A ARG 99.A NH2 GLU 142.A OE2 no hydrogen 3.319 N/A SER 100.A N VAL 113.A O no hydrogen 3.202 N/A GLU 102.A N LEU 111.A O no hydrogen 2.913 N/A TRP 103.A NE1 ARG 61.A O no hydrogen 2.890 N/A ASN 104.A N ARG 109.A O no hydrogen 3.059 N/A ASN 104.A ND2 GLY 172.A O no hydrogen 3.090 N/A ASP 106.A N ASN 104.A OD1 no hydrogen 2.923 N/A SER 107.A N ASN 104.A O no hydrogen 3.487 N/A ARG 108.A N ASP 106.A OD1 no hydrogen 2.713 N/A ARG 108.A NE ASP 150.A OD1 no hydrogen 2.701 N/A ARG 108.A NH2 ASP 150.A OD2 no hydrogen 3.359 N/A ARG 109.A N ASP 106.A OD1 no hydrogen 2.963 N/A ARG 109.A NE ASP 106.A OD2 no hydrogen 2.766 N/A ARG 109.A NH2 ASP 106.A OD2 no hydrogen 3.041 N/A ARG 109.A NH2 ASP 173.A OD1 no hydrogen 2.991 N/A LEU 110.A N ILE 149.A O no hydrogen 2.755 N/A LEU 111.A N GLU 102.A O no hydrogen 2.710 N/A ALA 112.A N TRP 147.A O no hydrogen 2.823 N/A VAL 113.A N SER 100.A O no hydrogen 3.014 N/A GLY 114.A N THR 145.A O no hydrogen 3.023 N/A PHE 115.A N ASN 97.A O no hydrogen 3.090 N/A LYS 116.A N LYS 143.A O no hydrogen 3.095 N/A ARG 117.A NE GLU 142.A OE1 no hydrogen 2.999 N/A ARG 117.A NH1 MET 136.A O no hydrogen 3.428 N/A ARG 117.A NH2 MET 136.A O no hydrogen 2.765 N/A ARG 117.A NH2 GLU 142.A OE1 no hydrogen 2.825 N/A ARG 118.A N ASP 140.A O no hydrogen 3.016 N/A ARG 118.A NH1 ASP 127.A OD1 no hydrogen 3.072 N/A ARG 118.A NH1 ASP 127.A OD2 no hydrogen 3.468 N/A GLU 119.A N ASP 140.A OD2 no hydrogen 2.870 N/A ASP 122.A N ASP 120.A OD2 no hydrogen 2.774 N/A PHE 123.A N ASP 120.A OD2 no hydrogen 2.935 N/A PHE 125.A N ASP 140.A OD1 no hydrogen 2.895 N/A ASP 128.A N GLU 126.A OE1 no hydrogen 2.770 N/A VAL 129.A N ASP 128.A OD1 no hydrogen 2.807 N/A TRP 132.A NE1 PHE 490.A O no hydrogen 3.097 N/A PHE 133.A N GLY 137.A O no hydrogen 3.203 N/A ASP 134.A N ASP 492.A OD2 no hydrogen 2.940 N/A MET 136.A N PHE 133.A O no hydrogen 3.108 N/A PHE 139.A N ALA 131.A O no hydrogen 3.015 N/A GLY 141.A N GLU 126.A OE2 no hydrogen 3.358 N/A LYS 143.A N LYS 116.A O no hydrogen 3.066 N/A LYS 143.A NZ GLU 161.A OE1 no hydrogen 3.306 N/A THR 144.A N LYS 162.A O no hydrogen 2.813 N/A THR 144.A OG1 PRO 163.A O no hydrogen 2.680 N/A THR 145.A N GLY 114.A O no hydrogen 3.032 N/A PHE 146.A N PHE 160.A O no hydrogen 2.791 N/A TRP 147.A N ALA 112.A O no hydrogen 2.760 N/A VAL 148.A N GLU 158.A O no hydrogen 2.910 N/A ILE 149.A N LEU 110.A O no hydrogen 2.946 N/A ASP 150.A N GLU 155.A O no hydrogen 2.902 N/A THR 151.A N ARG 108.A O no hydrogen 3.288 N/A THR 151.A OG1 ARG 108.A O no hydrogen 2.591 N/A GLU 152.A N ASP 150.A OD1 no hydrogen 2.931 N/A GLY 153.A N ASP 150.A OD2 no hydrogen 2.932 N/A GLU 155.A N ASP 150.A O no hydrogen 3.327 N/A ILE 157.A N VAL 148.A O no hydrogen 2.862 N/A PHE 160.A N PHE 146.A O no hydrogen 3.247 N/A LYS 162.A N THR 144.A O no hydrogen 2.708 N/A LYS 162.A NZ GLU 202.A OE1 no hydrogen 2.883 N/A LYS 162.A NZ GLU 202.A OE2 no hydrogen 2.993 N/A ARG 164.A NE GLU 142.A O no hydrogen 3.353 N/A ARG 164.A NH2 GLU 126.A OE1 no hydrogen 2.819 N/A SER 166.A N THR 144.A OG1 no hydrogen 3.062 N/A SER 166.A N PRO 163.A O no hydrogen 3.223 N/A SER 166.A OG PRO 163.A O no hydrogen 2.763 N/A SER 167.A N SER 178.A O no hydrogen 2.893 N/A ILE 169.A N VAL 176.A O no hydrogen 3.049 N/A TRP 170.A N GLU 102.A OE1 no hydrogen 3.229 N/A HIS 171.A N SER 174.A O no hydrogen 2.875 N/A HIS 171.A ND1 SER 216.A OG no hydrogen 2.826 N/A SER 174.A N HIS 171.A O no hydrogen 2.771 N/A ILE 175.A N TRP 197.A O no hydrogen 2.791 N/A VAL 176.A N ILE 169.A O no hydrogen 2.855 N/A VAL 177.A N TYR 195.A O no hydrogen 2.870 N/A SER 178.A N SER 167.A O no hydrogen 3.026 N/A VAL 179.A N ASP 193.A O no hydrogen 2.813 N/A HIS 181.A N TYR 191.A O no hydrogen 3.010 N/A HIS 181.A ND1 ASP 193.A OD1 no hydrogen 2.999 N/A HIS 181.A ND1 ASP 193.A OD2 no hydrogen 3.240 N/A ARG 182.A NH1 ASP 128.A OD1 no hydrogen 3.450 N/A ARG 182.A NH2 ASP 128.A OD2 no hydrogen 3.059 N/A ARG 187.A N HIS 181.A O no hydrogen 2.790 N/A ARG 187.A NH1 ASP 183.A OD2 no hydrogen 3.049 N/A TYR 188.A OH VAL 129.A O no hydrogen 3.154 N/A LYS 190.A NZ TYR 191.A OH no hydrogen 3.532 N/A TYR 191.A OH GLU 228.A OE2 no hydrogen 3.026 N/A TRP 192.A N VAL 209.A O no hydrogen 2.703 N/A ASP 193.A N VAL 179.A O no hydrogen 2.731 N/A ILE 194.A N PHE 206.A O no hydrogen 3.185 N/A TYR 195.A N VAL 177.A O no hydrogen 2.855 N/A LEU 196.A N GLU 203.A O no hydrogen 2.927 N/A TRP 197.A N ILE 175.A O no hydrogen 2.739 N/A LYS 198.A N GLU 201.A O no hydrogen 2.878 N/A GLU 201.A N LYS 198.A O no hydrogen 2.846 N/A GLU 203.A N LEU 196.A O no hydrogen 3.173 N/A LYS 204.A NZ GLU 207.A OE1 no hydrogen 2.780 N/A LEU 205.A N ILE 194.A O no hydrogen 2.745 N/A PHE 206.A N ILE 194.A O no hydrogen 3.266 N/A LYS 208.A N ASP 193.A OD1 no hydrogen 3.126 N/A LYS 208.A NZ ASP 183.A OD2 no hydrogen 3.478 N/A VAL 209.A N TRP 192.A O no hydrogen 3.093 N/A SER 210.A N PRO 227.A O no hydrogen 3.407 N/A SER 210.A OG LYS 190.A O no hydrogen 2.978 N/A TYR 212.A N TYR 224.A O no hydrogen 3.176 N/A ALA 213.A N SER 178.A OG no hydrogen 3.237 N/A ILE 214.A N LEU 222.A O no hydrogen 2.970 N/A SER 216.A N ASP 215.A OD1 no hydrogen 2.739 N/A SER 216.A OG HIS 171.A ND1 no hydrogen 2.826 N/A ASP 217.A N ARG 220.A O no hydrogen 3.192 N/A GLY 218.A N SER 216.A OG no hydrogen 2.675 N/A GLU 219.A N ASP 217.A OD1 no hydrogen 2.929 N/A ARG 220.A N ASP 217.A OD1 no hydrogen 2.644 N/A ARG 220.A NE ASP 217.A OD2 no hydrogen 2.864 N/A ILE 221.A N TYR 241.A O no hydrogen 3.063 N/A LEU 222.A N ASP 215.A O no hydrogen 2.962 N/A LEU 223.A N TYR 239.A O no hydrogen 2.714 N/A TYR 224.A N TYR 212.A O no hydrogen 2.827 N/A TYR 224.A OH VAL 256.A O no hydrogen 2.703 N/A GLY 225.A N LYS 237.A O no hydrogen 2.814 N/A LYS 226.A NZ GLU 234.A OE1 no hydrogen 2.867 N/A LYS 226.A NZ GLU 413.A OE2 no hydrogen 2.555 N/A LYS 229.A NZ VAL 232.A O no hydrogen 3.015 N/A LYS 229.A NZ ASP 236.A OD1 no hydrogen 2.954 N/A LYS 230.A N GLU 234.A OE2 no hydrogen 2.736 N/A TYR 231.A N GLU 234.A OE2 no hydrogen 2.891 N/A VAL 232.A N GLU 500.A OE2 no hydrogen 3.120 N/A SER 233.A N GLU 500.A OE1 no hydrogen 2.856 N/A SER 233.A OG GLU 500.A OE1 no hydrogen 2.782 N/A GLU 234.A N TYR 231.A O no hydrogen 3.126 N/A HIS 235.A N GLU 413.A OE2 no hydrogen 3.028 N/A HIS 235.A NE2 TYR 411.A O no hydrogen 2.604 N/A ASP 236.A N GLU 255.A OE2 no hydrogen 2.895 N/A LYS 237.A N GLY 225.A O no hydrogen 3.051 N/A TYR 239.A N LEU 223.A O no hydrogen 2.787 N/A ILE 240.A N LYS 246.A O no hydrogen 2.939 N/A TYR 241.A N ILE 221.A O no hydrogen 2.874 N/A ASP 242.A N GLU 244.A O no hydrogen 3.293 N/A GLU 244.A N ASP 242.A OD1 no hydrogen 2.661 N/A LYS 246.A N ILE 240.A O no hydrogen 2.858 N/A ILE 252.A N LEU 249.A O no hydrogen 2.978 N/A ARG 254.A NH1 ASP 253.A O no hydrogen 2.547 N/A ARG 254.A NH2 GLU 273.A OE2 no hydrogen 2.806 N/A VAL 256.A N ASP 236.A O no hydrogen 2.930 N/A ALA 257.A N THR 269.A O no hydrogen 2.961 N/A LYS 260.A N TYR 267.A O no hydrogen 2.743 N/A LYS 260.A NZ PHE 298.A O no hydrogen 2.969 N/A ILE 261.A N ASP 215.A OD2 no hydrogen 2.950 N/A ARG 262.A N LYS 265.A O no hydrogen 2.904 N/A GLY 264.A N ASP 217.A OD2 no hydrogen 3.216 N/A LYS 265.A N ARG 262.A O no hydrogen 3.244 N/A VAL 266.A N TRP 281.A O no hydrogen 2.950 N/A TYR 267.A N LYS 260.A O no hydrogen 2.759 N/A PHE 268.A N TYR 279.A O no hydrogen 3.081 N/A THR 269.A N GLN 258.A O no hydrogen 2.871 N/A THR 269.A OG1 GLN 258.A O no hydrogen 3.565 N/A LEU 270.A N ASN 277.A O no hydrogen 2.940 N/A PHE 271.A N GLU 255.A O no hydrogen 2.961 N/A GLU 272.A N SER 275.A O no hydrogen 2.850 N/A GLU 273.A N GLY 410.A O no hydrogen 2.758 N/A SER 275.A N GLU 272.A O no hydrogen 2.702 N/A SER 275.A OG GLY 291.A O no hydrogen 3.138 N/A VAL 276.A N HIS 293.A O no hydrogen 3.001 N/A ASN 277.A N LEU 270.A O no hydrogen 3.007 N/A ASN 277.A ND2 GLU 272.A OE1 no hydrogen 2.667 N/A LEU 278.A N ALA 289.A O no hydrogen 2.750 N/A TYR 279.A N PHE 268.A O no hydrogen 2.727 N/A TYR 279.A OH GLU 272.A OE1 no hydrogen 2.779 N/A TYR 279.A OH GLU 272.A OE2 no hydrogen 3.163 N/A LEU 280.A N ARG 286.A O no hydrogen 2.855 N/A TRP 281.A N VAL 266.A O no hydrogen 2.786 N/A ASP 282.A N GLU 284.A O no hydrogen 3.239 N/A GLU 284.A N ASP 282.A OD1 no hydrogen 3.199 N/A ARG 286.A N LEU 280.A O no hydrogen 2.826 N/A ARG 286.A NH1 ASP 282.A OD2 no hydrogen 3.359 N/A ILE 288.A N LEU 278.A O no hydrogen 3.130 N/A ALA 289.A N LEU 278.A O no hydrogen 3.121 N/A GLY 291.A N ASN 277.A OD1 no hydrogen 2.969 N/A TRP 294.A N GLU 309.A O no hydrogen 2.821 N/A TRP 294.A NE1 GLY 274.A O no hydrogen 3.151 N/A ILE 295.A N VAL 276.A O no hydrogen 3.043 N/A MET 296.A N LEU 307.A O no hydrogen 2.937 N/A ASP 299.A N ILE 305.A O no hydrogen 2.963 N/A ALA 300.A N ASP 299.A OD1 no hydrogen 2.958 N/A ASP 301.A N ARG 303.A O no hydrogen 3.107 N/A ILE 305.A N ASP 299.A O no hydrogen 3.016 N/A TYR 306.A N TYR 318.A O no hydrogen 2.918 N/A TYR 306.A OH GLU 324.A OE1 no hydrogen 2.651 N/A LEU 307.A N GLY 297.A O no hydrogen 2.801 N/A LYS 308.A N GLU 316.A O no hydrogen 2.878 N/A LYS 308.A NZ GLU 324.A OE2 no hydrogen 2.899 N/A GLU 309.A N TRP 294.A O no hydrogen 2.886 N/A THR 310.A N ARG 313.A O no hydrogen 3.129 N/A THR 312.A OG1 PHE 341.A O no hydrogen 3.537 N/A THR 312.A OG1 GLU 342.A OE2 no hydrogen 3.479 N/A ARG 313.A N THR 310.A O no hydrogen 3.358 N/A ARG 313.A NH1.A GLU 316.A OE1 no hydrogen 3.216 N/A ARG 313.A NH1.A ASP 329.A OD1 no hydrogen 3.210 N/A GLU 316.A N LYS 308.A O no hydrogen 2.974 N/A LEU 317.A N THR 328.A OG1 no hydrogen 2.677 N/A TYR 318.A N TYR 306.A O no hydrogen 2.714 N/A LEU 319.A N ARG 325.A O no hydrogen 2.926 N/A TRP 320.A N LEU 304.A O no hydrogen 3.087 N/A ASP 321.A N GLU 323.A O no hydrogen 2.942 N/A ARG 325.A N LEU 319.A O no hydrogen 2.796 N/A GLN 326.A NE2 THR 328.A O no hydrogen 3.049 N/A LEU 327.A N LEU 317.A O no hydrogen 2.776 N/A THR 328.A N LEU 317.A O no hydrogen 3.318 N/A THR 328.A OG1 GLU 316.A OE2 no hydrogen 2.679 N/A TYR 330.A OH TYR 26.A OH no hydrogen 2.637 N/A ASN 331.A N GLU 316.A OE1 no hydrogen 3.151 N/A ASN 331.A ND2 ALA 12.A O no hydrogen 3.197 N/A GLY 332.A N ASP 329.A O no hydrogen 2.553 N/A PHE 335.A N ASN 331.A O no hydrogen 2.942 N/A LYS 337.A N ILE 334.A O no hydrogen 3.279 N/A PHE 341.A N GLN 391.A OE1 no hydrogen 2.915 N/A ARG 344.A N TYR 359.A O no hydrogen 2.687 N/A HIS 345.A NE2 ASP 356.A OD1 no hydrogen 2.729 N/A PHE 346.A N GLY 357.A O no hydrogen 2.902 N/A ARG 347.A NH1 ASP 356.A OD1 no hydrogen 2.920 N/A ARG 347.A NH2 GLU 354.A OE1 no hydrogen 3.031 N/A PHE 348.A N LEU 355.A O no hydrogen 3.040 N/A SER 350.A N LEU 353.A O no hydrogen 2.962 N/A SER 350.A OG ASP 430.A OD1 no hydrogen 2.653 N/A ASP 352.A N ASP 352.A OD1 no hydrogen 2.542 N/A LEU 353.A N SER 350.A O no hydrogen 3.001 N/A LEU 355.A N PHE 348.A O no hydrogen 2.909 N/A TRP 358.A N TYR 402.A O no hydrogen 2.915 N/A TRP 358.A NE1 TYR 384.A OH no hydrogen 2.887 N/A TYR 359.A N ARG 344.A O no hydrogen 3.007 N/A TYR 359.A OH GLU 442.A OE1 no hydrogen 2.689 N/A ILE 360.A N ILE 400.A O no hydrogen 2.708 N/A LYS 361.A NZ GLN 444.A OE1 no hydrogen 3.212 N/A ALA 368.A N GLN 444.A O no hydrogen 2.938 N/A VAL 370.A N ARG 449.A O no hydrogen 2.935 N/A ILE 371.A N TYR 399.A O no hydrogen 2.820 N/A VAL 372.A N GLY 451.A O no hydrogen 2.749 N/A PHE 373.A N VAL 401.A O no hydrogen 2.902 N/A VAL 374.A N THR 453.A O no hydrogen 3.018 N/A HIS 375.A ND1 GLY 376.A O no hydrogen 2.476 N/A HIS 375.A NE2 SER 408.A OG no hydrogen 2.724 N/A LYS 379.A NZ SER 233.A O no hydrogen 2.654 N/A LYS 379.A NZ HIS 235.A ND1 no hydrogen 3.222 N/A LYS 379.A NZ GLU 255.A OE1 no hydrogen 3.270 N/A LYS 379.A NZ GLU 255.A OE2 no hydrogen 3.428 N/A TYR 382.A N ASN 404.A OD1 no hydrogen 3.005 N/A TYR 384.A N GLY 274.A O no hydrogen 2.820 N/A PHE 386.A N GLU 309.A OE1 no hydrogen 2.783 N/A LYS 387.A NZ GLU 389.A OE1 no hydrogen 3.230 N/A TYR 388.A OH ASP 4.A O no hydrogen 2.606 N/A GLU 389.A N GLU 389.A OE1 no hydrogen 2.681 N/A MET 390.A N LYS 387.A O no hydrogen 3.144 N/A GLN 391.A N LYS 387.A O no hydrogen 3.422 N/A GLN 391.A NE2 PHE 341.A O no hydrogen 3.243 N/A LEU 392.A N TYR 388.A O no hydrogen 2.917 N/A MET 393.A N GLU 389.A O no hydrogen 2.868 N/A ALA 394.A N MET 390.A O no hydrogen 3.043 N/A SER 395.A N GLN 391.A O no hydrogen 3.020 N/A SER 395.A OG LEU 392.A O no hydrogen 2.802 N/A LYS 396.A N MET 393.A O no hydrogen 3.291 N/A GLY 397.A N ALA 394.A O no hydrogen 2.913 N/A TYR 398.A N MET 393.A O no hydrogen 3.022 N/A TYR 398.A OH GLU 591.A OE1 no hydrogen 2.791 N/A TYR 399.A N PRO 369.A O no hydrogen 2.862 N/A TYR 399.A OH GLU 442.A OE2 no hydrogen 2.810 N/A ILE 400.A N ILE 360.A O no hydrogen 3.021 N/A VAL 401.A N ILE 371.A O no hydrogen 3.037 N/A TYR 402.A N TRP 358.A O no hydrogen 3.089 N/A ASN 404.A N ASP 356.A O no hydrogen 3.396 N/A ASN 404.A ND2 TYR 382.A O no hydrogen 3.371 N/A ASN 404.A ND2 TYR 411.A OH no hydrogen 3.418 N/A ARG 406.A N ASP 430.A OD2 no hydrogen 2.729 N/A ARG 406.A NE ASP 430.A OD1 no hydrogen 3.227 N/A ARG 406.A NE ASP 430.A OD2 no hydrogen 2.845 N/A ARG 406.A NH1 ASP 352.A OD1 no hydrogen 3.386 N/A ARG 406.A NH2 ASP 352.A OD1 no hydrogen 3.392 N/A ARG 406.A NH2 ASP 430.A OD1 no hydrogen 3.121 N/A GLY 407.A N PHE 415.A O no hydrogen 2.744 N/A SER 408.A N PRO 405.A O no hydrogen 3.156 N/A SER 408.A OG HIS 375.A NE2 no hydrogen 2.724 N/A SER 408.A OG PRO 405.A O no hydrogen 2.751 N/A ASN 409.A N GLY 380.A O no hydrogen 3.346 N/A GLY 410.A N ASN 409.A OD1 no hydrogen 2.809 N/A TYR 411.A OH ASP 356.A OD2 no hydrogen 2.458 N/A GLU 413.A N ASP 253.A OD1 no hydrogen 3.401 N/A GLU 413.A N ASP 253.A OD2 no hydrogen 3.123 N/A PHE 415.A N SER 412.A OG no hydrogen 3.336 N/A ALA 416.A N SER 412.A O no hydrogen 3.185 N/A ALA 416.A N GLU 413.A O no hydrogen 3.027 N/A LEU 417.A N GLU 413.A O no hydrogen 3.024 N/A ARG 418.A N ASP 414.A O no hydrogen 3.128 N/A LEU 420.A N LEU 417.A O no hydrogen 3.005 N/A GLU 421.A N VAL 501.A O no hydrogen 2.851 N/A ARG 422.A N VAL 419.A O no hydrogen 2.894 N/A ARG 422.A NE GLU 426.A OE1 no hydrogen 3.026 N/A ARG 422.A NH2 GLU 426.A OE2 no hydrogen 2.873 N/A THR 423.A OG1 VAL 501.A O no hydrogen 3.553 N/A GLY 424.A N ASP 427.A OD1 no hydrogen 3.136 N/A LEU 425.A N ARG 422.A O no hydrogen 2.926 N/A GLN 429.A N LEU 425.A O no hydrogen 3.140 N/A ASP 430.A N GLU 426.A O no hydrogen 2.731 N/A ILE 431.A N ASP 427.A O no hydrogen 3.229 N/A LEU 432.A N PHE 428.A O no hydrogen 3.023 N/A ASN 433.A N GLN 429.A O no hydrogen 2.795 N/A ASN 433.A ND2 SER 350.A OG no hydrogen 2.896 N/A GLY 434.A N ASP 430.A O no hydrogen 2.813 N/A ILE 435.A N ILE 431.A O no hydrogen 3.081 N/A GLU 436.A N LEU 432.A O no hydrogen 2.921 N/A GLU 437.A N ASN 433.A O no hydrogen 3.079 N/A PHE 438.A N GLY 434.A O no hydrogen 3.066 N/A LEU 439.A N ILE 435.A O no hydrogen 2.975 N/A ARG 440.A N GLU 436.A O no hydrogen 3.160 N/A ARG 440.A NE GLU 437.A OE2 no hydrogen 2.917 N/A ARG 440.A NH2 GLU 437.A OE1 no hydrogen 2.799 N/A ARG 440.A NH2 GLU 437.A OE2 no hydrogen 3.531 N/A LEU 441.A N GLU 437.A O no hydrogen 3.039 N/A GLU 442.A N LEU 439.A O no hydrogen 3.377 N/A ALA 445.A N GLU 442.A O no hydrogen 3.008 N/A ASP 446.A N ALA 368.A O no hydrogen 2.952 N/A GLU 448.A N ASP 446.A OD1 no hydrogen 2.731 N/A ARG 449.A N ASP 446.A O no hydrogen 3.016 N/A ARG 449.A NE ASP 446.A OD2 no hydrogen 2.948 N/A ARG 449.A NH1 LYS 595.A O no hydrogen 3.038 N/A ARG 449.A NH2 LYS 367.A O no hydrogen 3.210 N/A ARG 449.A NH2 ASP 446.A OD2 no hydrogen 3.479 N/A GLY 451.A N VAL 370.A O no hydrogen 2.692 N/A ILE 452.A N ALA 474.A O no hydrogen 3.098 N/A THR 453.A N VAL 372.A O no hydrogen 2.844 N/A THR 453.A OG1 ILE 476.A O no hydrogen 2.877 N/A GLY 454.A N ILE 476.A O no hydrogen 3.254 N/A ALA 456.A N GLU 478.A O no hydrogen 2.727 N/A TYR 457.A OH ASP 427.A OD2 no hydrogen 2.587 N/A GLY 458.A N ILE 455.A O no hydrogen 2.878 N/A TYR 460.A N ALA 456.A O no hydrogen 2.863 N/A TYR 460.A OH LEU 515.A O no hydrogen 2.862 N/A MET 461.A N TYR 457.A O no hydrogen 2.772 N/A THR 462.A N GLY 458.A O no hydrogen 2.976 N/A THR 462.A OG1 GLY 458.A O no hydrogen 2.976 N/A ASN 463.A N GLY 459.A O no hydrogen 2.978 N/A ASN 463.A ND2 SER 477.A OG no hydrogen 3.014 N/A TRP 464.A N TYR 460.A O no hydrogen 2.844 N/A TRP 464.A NE1 GLY 424.A O no hydrogen 2.692 N/A ALA 465.A N MET 461.A O no hydrogen 2.766 N/A LEU 466.A N THR 462.A O no hydrogen 3.096 N/A THR 467.A N ASN 463.A O no hydrogen 3.116 N/A THR 467.A OG1 TRP 464.A O no hydrogen 2.900 N/A GLN 468.A N TRP 464.A O no hydrogen 2.809 N/A GLN 468.A NE2 THR 467.A OG1 no hydrogen 3.250 N/A LEU 471.A N SER 469.A OG no hydrogen 3.123 N/A LYS 473.A N ILE 450.A O no hydrogen 2.960 N/A LYS 473.A NZ GLU 448.A O no hydrogen 3.118 N/A GLY 475.A N PRO 527.A O no hydrogen 3.359 N/A ILE 476.A N ILE 452.A O no hydrogen 2.993 N/A SER 477.A N LEU 529.A O no hydrogen 2.969 N/A SER 477.A OG GLY 459.A O no hydrogen 3.170 N/A GLU 478.A N GLY 454.A O no hydrogen 3.014 N/A ASN 479.A N ILE 531.A O no hydrogen 3.141 N/A ASN 479.A ND2 SER 533.A OG no hydrogen 3.292 N/A ASN 479.A ND2 ASP 536.A OD2 no hydrogen 2.720 N/A SER 482.A OG GLN 543.A O no hydrogen 2.615 N/A TYR 483.A N GLN 543.A OE1 no hydrogen 2.957 N/A TRP 484.A N SER 516.A OG no hydrogen 2.804 N/A THR 486.A OG1 TYR 483.A O no hydrogen 3.332 N/A THR 486.A OG1 ASP 542.A OD1 no hydrogen 2.752 N/A SER 487.A N TYR 483.A O no hydrogen 3.329 N/A SER 487.A OG ASP 498.A OD1 no hydrogen 2.744 N/A SER 487.A OG ASP 498.A OD2 no hydrogen 3.110 N/A TYR 488.A N TRP 484.A O no hydrogen 2.881 N/A ALA 489.A N LEU 485.A O no hydrogen 2.939 N/A PHE 490.A N THR 486.A O no hydrogen 2.753 N/A SER 491.A N SER 487.A O no hydrogen 3.252 N/A SER 491.A OG SER 487.A O no hydrogen 2.569 N/A ASP 492.A N TYR 537.A O no hydrogen 2.786 N/A ILE 493.A N ASP 492.A OD1 no hydrogen 2.703 N/A GLY 494.A N SER 491.A O no hydrogen 3.387 N/A TRP 496.A N ILE 493.A O no hydrogen 3.328 N/A PHE 497.A N ILE 493.A O no hydrogen 3.116 N/A ASP 498.A N GLY 494.A O no hydrogen 2.974 N/A LYS 499.A N TRP 496.A O no hydrogen 2.860 N/A GLU 500.A N TRP 496.A O no hydrogen 3.438 N/A GLU 500.A N PHE 497.A O no hydrogen 3.233 N/A VAL 501.A N PHE 497.A O no hydrogen 3.110 N/A ILE 502.A N ASP 498.A O no hydrogen 2.887 N/A GLY 503.A N ASP 498.A O no hydrogen 3.117 N/A GLU 508.A N ASN 505.A O no hydrogen 2.636 N/A ASN 509.A N ASN 505.A O no hydrogen 2.669 N/A ASN 509.A ND2 ASP 504.A O no hydrogen 3.358 N/A ASN 511.A N ASN 509.A OD1 no hydrogen 2.686 N/A ASN 511.A ND2 GLU 421.A O no hydrogen 3.064 N/A ASN 511.A ND2 ILE 502.A O no hydrogen 3.287 N/A TYR 512.A N ASN 509.A O no hydrogen 3.354 N/A TYR 512.A OH GLY 503.A O no hydrogen 2.770 N/A ARG 513.A N GLU 510.A O no hydrogen 3.193 N/A LYS 514.A N GLU 510.A O no hydrogen 3.129 N/A LEU 515.A N ASN 511.A O no hydrogen 3.177 N/A SER 516.A N ARG 513.A O no hydrogen 3.207 N/A SER 516.A OG TYR 512.A O no hydrogen 2.505 N/A LEU 518.A N SER 482.A O no hydrogen 2.898 N/A PHE 519.A N SER 516.A O no hydrogen 3.394 N/A TYR 520.A N PRO 517.A O no hydrogen 2.840 N/A TYR 520.A OH LYS 514.A O no hydrogen 2.714 N/A ALA 521.A N LEU 518.A O no hydrogen 3.256 N/A ASN 523.A N TYR 520.A O no hydrogen 2.705 N/A ASN 523.A ND2 THR 467.A O no hydrogen 2.887 N/A VAL 524.A N ALA 521.A O no hydrogen 3.173 N/A LEU 528.A N GLU 557.A O no hydrogen 3.197 N/A LEU 529.A N GLY 475.A O no hydrogen 3.080 N/A LEU 530.A N TYR 559.A O no hydrogen 2.679 N/A ILE 531.A N SER 477.A O no hydrogen 2.891 N/A HIS 532.A N ALA 561.A O no hydrogen 2.955 N/A HIS 532.A ND1 SER 544.A OG no hydrogen 2.430 N/A SER 533.A OG GLY 566.A O no hydrogen 2.989 N/A SER 533.A OG ALA 567.A O no hydrogen 3.057 N/A LEU 534.A N PHE 563.A O no hydrogen 3.143 N/A GLU 535.A N GLY 566.A O no hydrogen 3.064 N/A ASP 536.A N SER 533.A O no hydrogen 3.457 N/A ARG 538.A NE ASP 492.A OD1 no hydrogen 2.926 N/A ARG 538.A NE ASP 492.A OD2 no hydrogen 3.201 N/A ARG 538.A NH1 ASP 492.A OD2 no hydrogen 2.796 N/A CYS 539.A N ASP 536.A OD1 no hydrogen 2.808 N/A CYS 539.A SG ASN 479.A O no hydrogen 3.221 N/A GLN 543.A N PRO 540.A O no hydrogen 3.080 N/A GLN 543.A NE2 TYR 483.A O no hydrogen 3.116 N/A SER 544.A N LEU 541.A O no hydrogen 3.255 N/A SER 544.A OG HIS 532.A ND1 no hydrogen 2.430 N/A LEU 545.A N LEU 541.A O no hydrogen 3.102 N/A MET 546.A N ASP 542.A O no hydrogen 2.750 N/A TYR 548.A N SER 544.A O no hydrogen 2.881 N/A HIS 549.A N LEU 545.A O no hydrogen 2.829 N/A VAL 550.A N MET 546.A O no hydrogen 2.962 N/A LEU 551.A N PHE 547.A O no hydrogen 2.940 N/A LYS 552.A N TYR 548.A O no hydrogen 3.117 N/A ASP 553.A N HIS 549.A O no hydrogen 2.861 N/A LEU 554.A N VAL 550.A O no hydrogen 3.098 N/A LEU 554.A N LEU 551.A O no hydrogen 3.002 N/A GLY 555.A N LYS 552.A O no hydrogen 2.958 N/A LYS 556.A N LEU 551.A O no hydrogen 3.040 N/A LYS 556.A NZ LYS 522.A O no hydrogen 3.208 N/A LYS 556.A NZ VAL 524.A O no hydrogen 3.106 N/A TYR 559.A N LEU 528.A O no hydrogen 2.939 N/A TYR 559.A OH GLU 557.A OE1 no hydrogen 2.768 N/A ALA 561.A N LEU 530.A O no hydrogen 2.874 N/A PHE 563.A N HIS 532.A O no hydrogen 2.711 N/A GLY 566.A N GLU 535.A OE1 no hydrogen 2.704 N/A HIS 568.A N ASP 134.A OD1 no hydrogen 2.864 N/A HIS 568.A ND1 ASP 536.A OD2 no hydrogen 2.621 N/A HIS 570.A N ALA 567.A O no hydrogen 2.876 N/A HIS 570.A ND1 HIS 578.A NE2 no hydrogen 2.992 N/A HIS 570.A NE2 ASN 479.A OD1 no hydrogen 3.121 N/A ARG 573.A N GLY 569.A O no hydrogen 2.946 N/A GLY 574.A N HIS 570.A O no hydrogen 2.994 N/A SER 575.A OG ASN 36.A OD1 no hydrogen 3.234 N/A ARG 577.A N ASN 36.A OD1 no hydrogen 2.942 N/A HIS 578.A N SER 575.A OG no hydrogen 3.309 N/A HIS 578.A NE2 HIS 570.A ND1 no hydrogen 2.992 N/A ARG 579.A N SER 575.A O no hydrogen 2.800 N/A ARG 579.A NE SER 571.A O no hydrogen 2.814 N/A ARG 579.A NH1 TYR 38.A OH no hydrogen 3.011 N/A ARG 579.A NH2 TYR 583.A OH no hydrogen 3.061 N/A MET 580.A N PRO 576.A O no hydrogen 2.934 N/A LYS 581.A N ARG 577.A O no hydrogen 3.153 N/A ARG 582.A N HIS 578.A O no hydrogen 3.045 N/A ARG 582.A NE GLU 478.A OE1 no hydrogen 2.880 N/A ARG 582.A NH1 GLU 389.A OE2 no hydrogen 3.221 N/A ARG 582.A NH1 GLU 478.A OE1 no hydrogen 3.288 N/A ARG 582.A NH1 GLU 478.A OE2 no hydrogen 2.715 N/A ARG 582.A NH2 GLU 389.A OE2 no hydrogen 3.062 N/A TYR 583.A N ARG 579.A O no hydrogen 2.956 N/A LYS 584.A N MET 580.A O no hydrogen 2.859 N/A LYS 584.A NZ GLU 588.A OE2 no hydrogen 2.962 N/A LEU 585.A N LYS 581.A O no hydrogen 2.811 N/A PHE 586.A N ARG 582.A O no hydrogen 2.672 N/A MET 587.A N TYR 583.A O no hydrogen 2.781 N/A GLU 588.A N LYS 584.A O no hydrogen 2.946 N/A PHE 589.A N LEU 585.A O no hydrogen 3.107 N/A PHE 590.A N PHE 586.A O no hydrogen 3.518 N/A GLU 591.A N MET 587.A O no hydrogen 3.019 N/A ARG 592.A N GLU 588.A O no hydrogen 2.832 N/A ARG 592.A NE GLU 588.A OE1 no hydrogen 2.976 N/A ARG 592.A NH1 GLU 598.A OE2 no hydrogen 2.862 N/A ARG 592.A NH2 GLU 588.A OE1 no hydrogen 3.374 N/A LYS 593.A N PHE 589.A O no hydrogen 2.581 N/A LYS 593.A NZ GLU 557.A OE1 no hydrogen 2.804 N/A LYS 593.A NZ TYR 559.A OH no hydrogen 3.496 N/A LYS 593.A NZ GLU 598.A O no hydrogen 2.752 N/A LYS 593.A NZ GLY 600.A O no hydrogen 3.025 N/A LEU 594.A N PHE 590.A O no hydrogen 3.026 N/A LYS 595.A N PHE 590.A O no hydrogen 3.197 N/A LYS 595.A NZ LYS 396.A O no hydrogen 2.832 N/A LYS 595.A NZ GLU 591.A OE1 no hydrogen 2.971 N/A LYS 596.A N GLU 591.A O no hydrogen 3.461 N/A TYR 597.A OH GLU 557.A OE2 no hydrogen 2.801 N/A GLU 598.A N ARG 592.A O no hydrogen 3.084 N/A ILE 606.A N ASP 602.A O no hydrogen 2.857 N/A LEU 607.A N VAL 603.A O no hydrogen 2.972 N/A LYS 608.A N LYS 605.A O no hydrogen 3.410 N/A