Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 2nxw_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLY 5.A N GLU 169.A OE1 no hydrogen 3.060 N/A GLY 5.A N GLU 169.A OE2 no hydrogen 3.189 N/A SER 6.A OG MET 8.A O no hydrogen 3.442 N/A SER 6.A OG VAL 170.A O no hydrogen 2.629 N/A HIS 7.A N GLU 169.A OE2 no hydrogen 2.803 N/A MET 8.A N SER 6.A OG no hydrogen 3.159 N/A LYS 9.A N GLU 12.A OE1 no hydrogen 2.796 N/A LEU 10.A N ALA 168.A O no hydrogen 2.766 N/A ALA 11.A N VAL 166.A O no hydrogen 3.054 N/A ALA 13.A N LYS 9.A O no hydrogen 2.907 N/A LEU 14.A N LEU 10.A O no hydrogen 2.970 N/A LEU 15.A N ALA 11.A O no hydrogen 2.966 N/A ARG 16.A N GLU 12.A O no hydrogen 2.877 N/A ALA 17.A N ALA 13.A O no hydrogen 2.925 N/A LEU 18.A N LEU 14.A O no hydrogen 2.968 N/A LYS 19.A N LEU 15.A O no hydrogen 3.002 N/A ASP 20.A N ARG 16.A O no hydrogen 2.830 N/A ARG 21.A N ALA 17.A O no hydrogen 3.269 N/A ARG 21.A N LEU 18.A O no hydrogen 3.034 N/A ARG 21.A NE ASP 176.A OD1 no hydrogen 2.778 N/A ARG 21.A NH1 ALA 17.A O no hydrogen 3.046 N/A ARG 21.A NH2 GLY 174.A O no hydrogen 2.945 N/A ARG 21.A NH2 ASP 176.A OD1 no hydrogen 2.831 N/A GLY 22.A N LYS 19.A O no hydrogen 3.008 N/A ALA 23.A N LEU 18.A O no hydrogen 3.044 N/A MET 26.A N PRO 48.A O no hydrogen 2.843 N/A PHE 27.A N VAL 74.A O no hydrogen 2.955 N/A GLY 28.A N HIS 50.A O no hydrogen 2.997 N/A ILE 29.A N ALA 76.A O no hydrogen 3.096 N/A ALA 34.A N GLY 31.A O no hydrogen 2.888 N/A LEU 35.A N ASP 32.A O no hydrogen 3.290 N/A PHE 38.A N ALA 34.A O no hydrogen 3.032 N/A LYS 39.A N LEU 35.A O no hydrogen 2.954 N/A VAL 40.A N PRO 36.A O no hydrogen 3.204 N/A ALA 41.A N PHE 37.A O no hydrogen 3.035 N/A GLU 42.A N PHE 38.A O no hydrogen 2.859 N/A GLU 43.A N LYS 39.A O no hydrogen 2.885 N/A THR 44.A N VAL 40.A O no hydrogen 2.894 N/A THR 44.A OG1 VAL 40.A O no hydrogen 2.708 N/A GLN 45.A N ALA 41.A O no hydrogen 2.977 N/A GLN 45.A NE2 GLU 42.A O no hydrogen 2.829 N/A HIS 50.A N MET 26.A O no hydrogen 2.858 N/A SER 53.A N GLU 436.A OE1 no hydrogen 2.888 N/A SER 53.A OG GLU 436.A OE1 no hydrogen 3.502 N/A HIS 54.A N GLU 436.A OE2 no hydrogen 2.930 N/A GLU 55.A N GLU 55.A OE1 no hydrogen 2.837 N/A ALA 57.A N HIS 54.A O no hydrogen 3.023 N/A GLY 59.A N GLU 55.A O no hydrogen 3.088 N/A PHE 60.A N PRO 56.A O no hydrogen 2.907 N/A ALA 61.A N ALA 57.A O no hydrogen 2.839 N/A ALA 62.A N VAL 58.A O no hydrogen 3.012 N/A ASP 63.A N GLY 59.A O no hydrogen 2.940 N/A ALA 64.A N PHE 60.A O no hydrogen 2.844 N/A ALA 65.A N ALA 61.A O no hydrogen 2.884 N/A ALA 66.A N ALA 62.A O no hydrogen 3.009 N/A ARG 67.A N ASP 63.A O no hydrogen 2.926 N/A ARG 67.A NE ASP 63.A OD1 no hydrogen 2.738 N/A ARG 67.A NH1 GLU 96.A OE1 no hydrogen 3.057 N/A ARG 67.A NH1 ALA 395.A O no hydrogen 3.397 N/A ARG 67.A NH2 ASP 63.A OD1 no hydrogen 3.525 N/A ARG 67.A NH2 ASP 63.A OD2 no hydrogen 2.907 N/A ARG 67.A NH2 GLU 96.A OE1 no hydrogen 2.748 N/A TYR 68.A N ALA 64.A O no hydrogen 2.805 N/A SER 69.A N ALA 65.A O no hydrogen 3.301 N/A SER 69.A OG GLN 24.A OE1 no hydrogen 2.592 N/A SER 70.A OG ARG 212.A O no hydrogen 3.348 N/A THR 71.A N ALA 66.A O no hydrogen 3.068 N/A THR 71.A OG1 ARG 21.A O no hydrogen 3.115 N/A LEU 72.A N THR 71.A OG1 no hydrogen 2.736 N/A GLY 73.A N PRO 99.A O no hydrogen 2.966 N/A ALA 75.A N VAL 101.A O no hydrogen 2.979 N/A ALA 76.A N PHE 27.A O no hydrogen 2.760 N/A VAL 77.A N ILE 103.A O no hydrogen 2.957 N/A TYR 79.A OH ASP 117.A OD2 no hydrogen 3.072 N/A GLY 80.A N GLN 119.A OE1 no hydrogen 2.818 N/A ALA 83.A N THR 78.A O no hydrogen 3.051 N/A PHE 84.A N GLY 80.A O no hydrogen 2.932 N/A ASN 85.A N ALA 81.A O no hydrogen 2.892 N/A ASN 85.A ND2 GLU 55.A OE1 no hydrogen 2.933 N/A MET 86.A N ALA 83.A O no hydrogen 2.964 N/A VAL 87.A N PHE 84.A O no hydrogen 3.359 N/A VAL 90.A N MET 86.A O no hydrogen 3.033 N/A ALA 91.A N VAL 87.A O no hydrogen 2.894 N/A GLY 92.A N ASN 88.A O no hydrogen 2.911 N/A ALA 93.A N ALA 89.A O no hydrogen 3.055 N/A TYR 94.A N VAL 90.A O no hydrogen 2.882 N/A ALA 95.A N ALA 91.A O no hydrogen 2.825 N/A GLU 96.A N GLY 92.A O no hydrogen 3.033 N/A LYS 97.A N TYR 94.A O no hydrogen 3.174 N/A LYS 97.A NZ GLN 153.A O no hydrogen 2.799 N/A LYS 97.A NZ GLU 210.A OE2 no hydrogen 2.766 N/A LYS 97.A NZ ASP 300.A OD1 no hydrogen 2.855 N/A SER 98.A N ALA 93.A O no hydrogen 2.880 N/A SER 98.A OG ASP 63.A O no hydrogen 3.426 N/A SER 98.A OG ASP 63.A OD1 no hydrogen 2.559 N/A VAL 100.A N SER 98.A O no hydrogen 3.025 N/A VAL 101.A N GLY 73.A O no hydrogen 2.754 N/A VAL 102.A N VAL 157.A O no hydrogen 2.884 N/A ILE 103.A N ALA 75.A O no hydrogen 2.910 N/A SER 104.A N LEU 159.A O no hydrogen 2.861 N/A SER 104.A OG GLY 105.A O no hydrogen 2.805 N/A GLY 105.A N VAL 77.A O no hydrogen 3.031 N/A THR 109.A N ASN 164.A OD1 no hydrogen 2.825 N/A GLU 111.A N GLY 108.A O no hydrogen 2.966 N/A GLN 119.A NE2 SER 104.A OG no hydrogen 2.974 N/A GLN 119.A NE2 TYR 158.A OH no hydrogen 2.808 N/A PHE 120.A N ASP 117.A OD2 no hydrogen 3.033 N/A GLN 121.A N ASP 117.A O no hydrogen 2.946 N/A VAL 122.A N THR 118.A O no hydrogen 2.947 N/A PHE 123.A N GLN 119.A O no hydrogen 2.987 N/A LYS 124.A N PHE 120.A O no hydrogen 2.929 N/A GLU 125.A N VAL 122.A O no hydrogen 3.071 N/A ILE 126.A N PHE 123.A O no hydrogen 3.046 N/A THR 127.A OG1 PHE 123.A O no hydrogen 2.718 N/A VAL 128.A N PRO 156.A O no hydrogen 2.922 N/A GLN 130.A NE2 THR 127.A OG1 no hydrogen 2.904 N/A ALA 131.A N TYR 158.A O no hydrogen 2.935 N/A LEU 133.A N GLU 160.A O no hydrogen 2.840 N/A ALA 137.A N ASP 135.A OD1 no hydrogen 2.980 N/A LYS 138.A N ASP 135.A O no hydrogen 2.957 N/A ALA 139.A N ASP 135.A O no hydrogen 2.909 N/A GLU 142.A N LYS 138.A O no hydrogen 3.089 N/A ILE 143.A N ALA 139.A O no hydrogen 2.850 N/A ALA 144.A N PRO 140.A O no hydrogen 3.037 N/A ARG 145.A N ALA 141.A O no hydrogen 2.892 N/A ARG 145.A NE GLU 142.A OE2 no hydrogen 2.959 N/A ARG 145.A NH2 GLN 130.A O no hydrogen 2.880 N/A ARG 145.A NH2 GLU 142.A OE1 no hydrogen 2.829 N/A VAL 146.A N GLU 142.A O no hydrogen 2.882 N/A LEU 147.A N ILE 143.A O no hydrogen 2.830 N/A GLY 148.A N ALA 144.A O no hydrogen 2.869 N/A ALA 149.A N ARG 145.A O no hydrogen 2.979 N/A ALA 150.A N VAL 146.A O no hydrogen 3.115 N/A ARG 151.A N LEU 147.A O no hydrogen 3.108 N/A ARG 151.A NE ASP 176.A OD2 no hydrogen 2.537 N/A ARG 151.A NH2 ASP 176.A OD2 no hydrogen 3.228 N/A ALA 152.A N GLY 148.A O no hydrogen 2.855 N/A GLN 153.A N ALA 149.A O no hydrogen 3.058 N/A GLN 153.A NE2 ASP 300.A O no hydrogen 3.270 N/A SER 154.A OG LYS 97.A O no hydrogen 2.774 N/A ARG 155.A NH1 TYR 94.A O no hydrogen 2.757 N/A ARG 155.A NH2 ASP 300.A OD1 no hydrogen 3.385 N/A ARG 155.A NH2 ASP 300.A OD2 no hydrogen 3.097 N/A VAL 157.A N VAL 100.A O no hydrogen 3.025 N/A TYR 158.A N ALA 129.A O no hydrogen 3.042 N/A TYR 158.A OH GLU 160.A OE1 no hydrogen 2.621 N/A LEU 159.A N VAL 102.A O no hydrogen 2.792 N/A GLU 160.A N ALA 131.A O no hydrogen 2.960 N/A ILE 161.A N SER 104.A O no hydrogen 2.889 N/A ARG 163.A N ALA 106.A O no hydrogen 2.845 N/A ARG 163.A NE GLU 111.A OE1 no hydrogen 2.836 N/A ARG 163.A NH2 GLU 111.A OE1 no hydrogen 3.466 N/A ARG 163.A NH2 GLU 111.A OE2 no hydrogen 3.230 N/A ASN 164.A ND2 THR 109.A OG1 no hydrogen 2.886 N/A MET 165.A N PRO 162.A O no hydrogen 2.944 N/A ALA 168.A N MET 165.A O no hydrogen 3.093 N/A VAL 170.A N MET 8.A O no hydrogen 2.968 N/A ASP 182.A N ASP 312.A O no hydrogen 2.999 N/A ALA 185.A N ASP 182.A OD1 no hydrogen 2.948 N/A LEU 186.A N ASP 182.A O no hydrogen 2.885 N/A ALA 187.A N ARG 183.A O no hydrogen 3.151 N/A ALA 188.A N ASP 184.A O no hydrogen 3.072 N/A CYS 189.A N ALA 185.A O no hydrogen 2.787 N/A ALA 190.A N LEU 186.A O no hydrogen 2.917 N/A ASP 191.A N ALA 187.A O no hydrogen 3.110 N/A GLU 192.A N ALA 188.A O no hydrogen 2.991 N/A VAL 193.A N CYS 189.A O no hydrogen 2.826 N/A LEU 194.A N ALA 190.A O no hydrogen 3.085 N/A ALA 195.A N ASP 191.A O no hydrogen 3.019 N/A ALA 196.A N GLU 192.A O no hydrogen 2.929 N/A MET 197.A N VAL 193.A O no hydrogen 2.934 N/A ARG 198.A N LEU 194.A O no hydrogen 2.941 N/A SER 199.A N ALA 195.A O no hydrogen 3.030 N/A SER 199.A OG ALA 195.A O no hydrogen 3.170 N/A SER 199.A OG ALA 196.A O no hydrogen 3.321 N/A ALA 200.A N ALA 196.A O no hydrogen 3.131 N/A THR 201.A N ASP 269.A OD2 no hydrogen 2.780 N/A THR 201.A OG1.B ASP 269.A OD1 no hydrogen 3.328 N/A THR 201.A OG1.B ASP 269.A OD2 no hydrogen 2.830 N/A SER 202.A N ASP 269.A OD1 no hydrogen 2.698 N/A VAL 204.A N GLY 270.A O no hydrogen 2.878 N/A LEU 205.A N PRO 230.A O no hydrogen 2.839 N/A MET 206.A N PHE 272.A O no hydrogen 2.841 N/A VAL 207.A N VAL 232.A O no hydrogen 2.845 N/A CYS 208.A N LEU 274.A O no hydrogen 3.151 N/A CYS 208.A SG MET 206.A O no hydrogen 3.313 N/A GLU 210.A N GLY 275.A O no hydrogen 3.131 N/A VAL 211.A N CYS 208.A O no hydrogen 3.023 N/A ARG 212.A NE MET 236.A O no hydrogen 3.265 N/A ARG 212.A NH2 MET 236.A O no hydrogen 3.079 N/A ARG 212.A NH2 ARG 238.A O no hydrogen 2.800 N/A ARG 213.A N VAL 209.A O no hydrogen 2.943 N/A ARG 213.A NE LYS 97.A O no hydrogen 2.749 N/A ARG 213.A NH2 GLU 96.A O no hydrogen 2.979 N/A TYR 214.A N GLU 210.A O no hydrogen 2.929 N/A GLY 215.A N ARG 212.A O no hydrogen 3.126 N/A LEU 216.A N VAL 211.A O no hydrogen 2.944 N/A LYS 219.A NZ ASP 320.A OD1 no hydrogen 3.022 N/A VAL 220.A N LEU 216.A O no hydrogen 2.891 N/A ALA 221.A N GLU 217.A O no hydrogen 2.860 N/A GLU 222.A N ALA 218.A O no hydrogen 3.165 N/A LEU 223.A N LYS 219.A O no hydrogen 2.921 N/A ALA 224.A N VAL 220.A O no hydrogen 2.811 N/A GLN 225.A N ALA 221.A O no hydrogen 3.154 N/A GLN 225.A NE2 ARG 331.A O no hydrogen 2.850 N/A ARG 226.A N GLU 222.A O no hydrogen 3.067 N/A ARG 226.A NE GLU 222.A OE2 no hydrogen 2.767 N/A ARG 226.A NH1 LEU 326.A O no hydrogen 2.887 N/A ARG 226.A NH2 GLU 222.A OE2 no hydrogen 3.261 N/A LEU 227.A N LEU 223.A O no hydrogen 2.753 N/A VAL 232.A N LEU 205.A O no hydrogen 2.951 N/A THR 233.A N GLY 250.A O no hydrogen 3.108 N/A THR 233.A OG1 GLY 250.A O no hydrogen 3.525 N/A THR 234.A N VAL 207.A O no hydrogen 3.207 N/A MET 236.A N TYR 398.A OH no hydrogen 3.168 N/A GLY 237.A N THR 234.A O no hydrogen 2.902 N/A ARG 238.A N PHE 235.A O no hydrogen 3.171 N/A ARG 238.A NH1 ASP 390.A OD2 no hydrogen 2.806 N/A ARG 238.A NH2 MET 386.A O no hydrogen 3.344 N/A ARG 238.A NH2 ASP 390.A OD2 no hydrogen 3.465 N/A LEU 240.A N GLY 237.A O no hydrogen 3.017 N/A LEU 241.A N GLU 217.A OE2 no hydrogen 2.787 N/A ALA 244.A N LEU 241.A O no hydrogen 3.063 N/A THR 246.A OG1 THR 246.A O no hydrogen 2.621 N/A LEU 249.A N VAL 231.A O no hydrogen 2.812 N/A THR 251.A OG1 THR 233.A OG1 no hydrogen 3.010 N/A TYR 252.A N THR 233.A O no hydrogen 2.858 N/A TYR 252.A OH GLU 266.A OE2 no hydrogen 2.734 N/A GLY 257.A N GLY 254.A O no hydrogen 2.968 N/A ILE 261.A N ASP 258.A OD2 no hydrogen 3.020 N/A THR 262.A N ASP 258.A O no hydrogen 2.962 N/A THR 262.A OG1 GLY 254.A O no hydrogen 3.180 N/A THR 262.A OG1 ASP 258.A O no hydrogen 3.046 N/A ARG 263.A N ALA 259.A O no hydrogen 2.968 N/A LEU 264.A N GLU 260.A O no hydrogen 2.954 N/A VAL 265.A N ILE 261.A O no hydrogen 3.052 N/A GLU 266.A N THR 262.A O no hydrogen 2.909 N/A GLU 267.A N ARG 263.A O no hydrogen 2.895 N/A SER 268.A N VAL 265.A O no hydrogen 3.316 N/A SER 268.A OG SER 202.A O no hydrogen 2.787 N/A GLY 270.A N SER 268.A OG no hydrogen 3.152 N/A LEU 271.A N LYS 294.A O no hydrogen 3.092 N/A PHE 272.A N VAL 204.A O no hydrogen 2.832 N/A LEU 273.A N ILE 296.A O no hydrogen 2.721 N/A LEU 274.A N MET 206.A O no hydrogen 2.980 N/A GLY 275.A N ALA 298.A O no hydrogen 2.721 N/A SER 279.A N VAL 285.A O no hydrogen 3.024 N/A THR 281.A N SER 279.A OG no hydrogen 3.148 N/A PHE 283.A N GLY 397.A O no hydrogen 3.213 N/A ALA 284.A N THR 281.A O no hydrogen 3.155 N/A SER 286.A OG ASP 280.A OD1 no hydrogen 2.563 N/A ARG 288.A N SER 286.A OG no hydrogen 3.034 N/A LYS 289.A N SER 286.A O no hydrogen 2.886 N/A ILE 290.A N SER 286.A O no hydrogen 3.345 N/A ARG 293.A N ASP 291.A OD1 no hydrogen 3.320 N/A ARG 293.A NE ASP 291.A OD1 no hydrogen 2.974 N/A ARG 293.A NH2 ASP 291.A OD2 no hydrogen 3.362 N/A LYS 294.A N ASP 291.A O no hydrogen 2.923 N/A THR 295.A N LEU 292.A O no hydrogen 3.118 N/A THR 295.A OG1 ASP 291.A O no hydrogen 2.816 N/A ILE 296.A N LEU 271.A O no hydrogen 2.789 N/A HIS 297.A N THR 304.A O no hydrogen 2.840 N/A ALA 298.A N LEU 273.A O no hydrogen 2.998 N/A PHE 299.A N ALA 302.A O no hydrogen 2.967 N/A ASP 300.A N GLU 210.A OE2 no hydrogen 2.949 N/A ARG 301.A NH2 PRO 180.A O no hydrogen 3.240 N/A ALA 302.A N PHE 299.A O no hydrogen 3.035 N/A VAL 303.A N TYR 310.A O no hydrogen 2.943 N/A THR 304.A N HIS 297.A O no hydrogen 2.887 N/A THR 304.A OG1 THR 309.A OG1 no hydrogen 2.827 N/A LEU 305.A N HIS 308.A O no hydrogen 2.984 N/A HIS 308.A N LEU 305.A O no hydrogen 2.909 N/A HIS 308.A ND1.B GLY 306.A O no hydrogen 2.555 N/A HIS 308.A NE2.B GLU 192.A OE1 no hydrogen 2.685 N/A THR 309.A OG1 THR 304.A OG1 no hydrogen 2.827 N/A TYR 310.A N VAL 303.A O no hydrogen 2.771 N/A TYR 310.A OH GLU 192.A OE1 no hydrogen 2.580 N/A ILE 313.A N ARG 301.A O no hydrogen 2.852 N/A LEU 318.A N PRO 314.A O no hydrogen 3.040 N/A VAL 319.A N LEU 315.A O no hydrogen 3.000 N/A ASP 320.A N ALA 316.A O no hydrogen 3.051 N/A ALA 321.A N GLY 317.A O no hydrogen 2.934 N/A LEU 322.A N LEU 318.A O no hydrogen 2.937 N/A LEU 323.A N VAL 319.A O no hydrogen 2.979 N/A GLU 324.A N ASP 320.A O no hydrogen 3.055 N/A ARG 325.A N LEU 322.A O no hydrogen 3.074 N/A ARG 325.A NE ASP 191.A OD1 no hydrogen 2.846 N/A ARG 325.A NH1 ALA 321.A O no hydrogen 2.749 N/A LEU 326.A N LEU 323.A O no hydrogen 3.183 N/A ARG 331.A N SER 329.A OG no hydrogen 3.162 N/A ARG 331.A NE GLN 225.A O no hydrogen 3.139 N/A ARG 331.A NH2 ALA 224.A O no hydrogen 2.775 N/A THR 332.A OG1 ASP 330.A O no hydrogen 2.972 N/A THR 333.A N PRO 245.A O no hydrogen 2.830 N/A ARG 334.A NH1 ALA 242.A O no hydrogen 2.880 N/A ARG 334.A NH1 ALA 244.A O no hydrogen 2.868 N/A GLY 344.A N ASP 363.A OD1 no hydrogen 2.804 N/A LEU 345.A N ASP 363.A OD2 no hydrogen 2.823 N/A GLN 346.A NE2 GLY 344.A O no hydrogen 2.985 N/A ASP 348.A N GLN 346.A O no hydrogen 2.802 N/A GLU 350.A N ASP 348.A OD1 no hydrogen 2.957 N/A ALA 353.A N ASP 356.A OD2 no hydrogen 2.881 N/A ASP 356.A N ALA 353.A O no hydrogen 2.882 N/A ILE 357.A N ALA 353.A O no hydrogen 3.427 N/A ILE 357.A N PRO 354.A O no hydrogen 2.996 N/A ALA 358.A N PRO 354.A O no hydrogen 3.181 N/A ARG 359.A N MET 355.A O no hydrogen 2.916 N/A ARG 359.A NH1 THR 343.A O no hydrogen 3.101 N/A ALA 360.A N ASP 356.A O no hydrogen 2.870 N/A VAL 361.A N ILE 357.A O no hydrogen 3.119 N/A ASN 362.A N ALA 358.A O no hydrogen 2.911 N/A ASN 362.A ND2 PRO 342.A O no hydrogen 2.905 N/A ASN 362.A ND2 ASP 387.A O no hydrogen 2.915 N/A ASP 363.A N ARG 359.A O no hydrogen 2.816 N/A ARG 364.A N ALA 360.A O no hydrogen 3.326 N/A ARG 364.A NH1 ASP 502.A OD1 no hydrogen 2.904 N/A VAL 365.A N VAL 361.A O no hydrogen 3.288 N/A ARG 366.A N ASN 362.A O no hydrogen 2.895 N/A ALA 367.A N ASP 363.A O no hydrogen 2.959 N/A ALA 367.A N ARG 364.A O no hydrogen 3.182 N/A GLY 368.A N VAL 365.A O no hydrogen 2.949 N/A GLN 369.A N ARG 364.A O no hydrogen 3.091 N/A ILE 374.A N GLY 392.A O no hydrogen 2.868 N/A ALA 375.A N LEU 422.A O no hydrogen 2.896 N/A ALA 376.A N MET 394.A O no hydrogen 2.866 N/A ASP 377.A N VAL 424.A O no hydrogen 3.130 N/A MET 378.A N ASP 377.A OD1 no hydrogen 2.760 N/A CYS 381.A SG ASP 377.A O no hydrogen 3.309 N/A CYS 381.A SG VAL 424.A O no hydrogen 3.713 N/A LEU 382.A N GLY 379.A O no hydrogen 3.014 N/A THR 384.A N ASP 380.A O no hydrogen 2.820 N/A THR 384.A OG1 ASP 380.A O no hydrogen 2.756 N/A ALA 385.A N CYS 381.A O no hydrogen 2.934 N/A MET 386.A N LEU 382.A O no hydrogen 3.191 N/A ASP 387.A N THR 384.A O no hydrogen 2.929 N/A MET 388.A N ALA 385.A O no hydrogen 2.945 N/A ILE 389.A N ASN 362.A OD1 no hydrogen 2.786 N/A ALA 391.A N LEU 372.A O no hydrogen 3.085 N/A GLY 392.A N ASP 390.A OD1 no hydrogen 2.715 N/A MET 394.A N ILE 374.A O no hydrogen 2.790 N/A TYR 398.A N GLU 96.A OE2 no hydrogen 2.835 N/A TYR 399.A N GLU 96.A OE2 no hydrogen 2.828 N/A TYR 399.A OH ASN 88.A OD1 no hydrogen 2.645 N/A ALA 400.A N PRO 396.A O no hydrogen 2.851 N/A GLY 403.A N ASP 377.A OD1 no hydrogen 2.812 N/A GLY 403.A N ASP 377.A OD2 no hydrogen 3.071 N/A GLY 405.A N ASP 377.A OD2 no hydrogen 2.902 N/A ALA 408.A N PHE 404.A O no hydrogen 2.822 N/A GLY 409.A N GLY 405.A O no hydrogen 2.965 N/A ILE 410.A N VAL 406.A O no hydrogen 2.959 N/A GLY 411.A N PRO 407.A O no hydrogen 2.840 N/A ALA 412.A N ALA 408.A O no hydrogen 2.866 N/A GLN 413.A N GLY 409.A O no hydrogen 2.949 N/A CYS 414.A N ILE 410.A O no hydrogen 2.944 N/A CYS 414.A SG ILE 410.A O no hydrogen 3.299 N/A VAL 415.A N ALA 412.A O no hydrogen 3.082 N/A SER 416.A N GLN 413.A O no hydrogen 3.255 N/A SER 416.A OG GLN 413.A O no hydrogen 3.102 N/A SER 416.A OG LYS 419.A O no hydrogen 2.689 N/A LYS 419.A N SER 416.A O no hydrogen 3.206 N/A ARG 420.A NE ASP 446.A O no hydrogen 2.693 N/A ARG 420.A NH1 ALA 504.A O no hydrogen 2.912 N/A ARG 420.A NH1 THR 507.A O no hydrogen 3.375 N/A ARG 420.A NH2 ASP 446.A O no hydrogen 2.942 N/A ARG 420.A NH2 THR 507.A O no hydrogen 2.839 N/A LEU 422.A N LEU 373.A O no hydrogen 3.076 N/A THR 423.A N ILE 448.A O no hydrogen 2.775 N/A VAL 424.A N ALA 375.A O no hydrogen 2.934 N/A VAL 425.A N ILE 450.A O no hydrogen 3.131 N/A ASP 427.A N PHE 452.A O no hydrogen 3.066 N/A PHE 430.A N GLY 426.A O no hydrogen 2.907 N/A GLN 431.A N ASP 427.A O no hydrogen 3.092 N/A MET 432.A N ALA 429.A O no hydrogen 2.981 N/A THR 433.A N ALA 429.A O no hydrogen 3.205 N/A THR 433.A OG1 GLY 403.A O no hydrogen 2.681 N/A GLY 434.A N PHE 430.A O no hydrogen 2.804 N/A TRP 435.A NE1 GLN 431.A O no hydrogen 2.896 N/A GLU 436.A N THR 433.A O no hydrogen 3.238 N/A LEU 437.A N GLY 434.A O no hydrogen 3.092 N/A GLY 438.A N TRP 435.A O no hydrogen 3.005 N/A ASN 439.A N GLU 436.A O no hydrogen 2.960 N/A ASN 439.A ND2 SER 53.A OG no hydrogen 2.916 N/A ASN 439.A ND2 GLU 436.A O no hydrogen 3.160 N/A CYS 440.A N LEU 437.A O no hydrogen 3.040 N/A CYS 440.A SG LEU 437.A O no hydrogen 3.374 N/A ARG 442.A NH1.A ASN 439.A OD1 no hydrogen 3.353 N/A ARG 442.A NH2.A THR 51.A O no hydrogen 3.388 N/A ARG 442.A NH2.A ASN 439.A OD1 no hydrogen 2.437 N/A LEU 443.A N ASN 439.A O no hydrogen 3.064 N/A GLY 444.A N ARG 441.A O no hydrogen 3.047 N/A ILE 445.A N CYS 440.A O no hydrogen 3.096 N/A ASP 446.A N GLN 413.A OE1 no hydrogen 3.257 N/A ILE 448.A N ILE 421.A O no hydrogen 3.093 N/A VAL 449.A N GLN 512.A O no hydrogen 2.738 N/A ILE 450.A N THR 423.A O no hydrogen 2.799 N/A LEU 451.A N ILE 514.A O no hydrogen 2.834 N/A PHE 452.A N VAL 425.A O no hydrogen 2.782 N/A ASN 453.A N ALA 516.A O no hydrogen 2.823 N/A ASN 453.A ND2 TRP 475.A O no hydrogen 3.398 N/A ASN 453.A ND2 GLU 515.A OE2 no hydrogen 2.775 N/A ALA 455.A N ASN 453.A OD1 no hydrogen 3.062 N/A SER 456.A N ASP 427.A OD2 no hydrogen 2.984 N/A SER 456.A OG GLU 458.A OE1 no hydrogen 2.693 N/A SER 456.A OG ASN 470.A O no hydrogen 3.404 N/A TRP 457.A N ASN 470.A O no hydrogen 2.986 N/A LEU 460.A N TRP 457.A O no hydrogen 3.119 N/A ARG 461.A N TRP 457.A O no hydrogen 3.160 N/A ARG 461.A NE SER 456.A OG no hydrogen 3.400 N/A ARG 461.A NE GLU 458.A OE1 no hydrogen 2.843 N/A ARG 461.A NH1 ASP 471.A OD1 no hydrogen 3.111 N/A ARG 461.A NH2 SER 456.A OG no hydrogen 2.932 N/A ARG 461.A NH2 ASP 471.A OD1 no hydrogen 2.648 N/A THR 462.A N GLU 458.A O no hydrogen 3.019 N/A THR 462.A OG1 MET 459.A O no hydrogen 2.736 N/A PHE 463.A N LEU 460.A O no hydrogen 3.101 N/A GLN 464.A N LEU 460.A O no hydrogen 2.930 N/A GLN 464.A NE2 SER 467.A OG no hydrogen 2.818 N/A GLU 466.A N GLU 466.A OE1 no hydrogen 2.728 N/A SER 467.A N GLN 464.A O no hydrogen 3.255 N/A ASP 471.A N ALA 468.A O no hydrogen 3.078 N/A LEU 472.A N ALA 455.A O no hydrogen 2.963 N/A ASP 474.A N ASP 473.A OD1 no hydrogen 2.771 N/A ARG 476.A NH2 ASP 474.A OD2 no hydrogen 2.805 N/A PHE 477.A N GLU 515.A OE2 no hydrogen 3.280 N/A ALA 478.A N GLU 515.A OE1 no hydrogen 3.088 N/A MET 480.A N PHE 477.A O no hydrogen 2.894 N/A ALA 481.A N ALA 478.A O no hydrogen 3.184 N/A MET 484.A N ALA 481.A O no hydrogen 2.925 N/A GLY 485.A N ALA 482.A O no hydrogen 2.987 N/A GLY 486.A N ALA 481.A O no hydrogen 3.071 N/A ASP 487.A N PHE 511.A O no hydrogen 2.912 N/A VAL 489.A N LEU 513.A O no hydrogen 2.938 N/A ARG 490.A NE GLU 515.A OE1 no hydrogen 2.970 N/A ARG 490.A NH1 ASP 474.A OD1 no hydrogen 3.401 N/A ARG 490.A NH2 ASP 474.A OD1 no hydrogen 3.111 N/A ARG 490.A NH2 GLU 515.A OE2 no hydrogen 2.913 N/A VAL 491.A N GLU 515.A O no hydrogen 2.846 N/A ARG 492.A N GLU 496.A OE1 no hydrogen 2.763 N/A THR 493.A N GLU 496.A OE1 no hydrogen 3.099 N/A ARG 494.A N GLU 350.A O no hydrogen 2.986 N/A ARG 494.A NE ASP 348.A OD1 no hydrogen 3.031 N/A ARG 494.A NH1 ASP 356.A OD1 no hydrogen 3.367 N/A ARG 494.A NH2 ASP 348.A OD1 no hydrogen 3.378 N/A ARG 494.A NH2 ASP 348.A OD2 no hydrogen 2.898 N/A ALA 495.A N ASP 348.A O no hydrogen 2.904 N/A GLU 496.A N THR 493.A OG1 no hydrogen 3.139 N/A LEU 497.A N THR 493.A O no hydrogen 2.915 N/A LYS 498.A N ARG 494.A O no hydrogen 3.018 N/A LYS 498.A NZ ASP 502.A OD2 no hydrogen 2.786 N/A ALA 499.A N ALA 495.A O no hydrogen 3.099 N/A ALA 500.A N GLU 496.A O no hydrogen 2.878 N/A LEU 501.A N LEU 497.A O no hydrogen 2.954 N/A ASP 502.A N LYS 498.A O no hydrogen 3.189 N/A LYS 503.A N ALA 499.A O no hydrogen 2.978 N/A ALA 504.A N ALA 500.A O no hydrogen 2.878 N/A PHE 505.A N LEU 501.A O no hydrogen 3.059 N/A ALA 506.A N ASP 502.A O no hydrogen 2.948 N/A THR 507.A N ALA 504.A O no hydrogen 3.175 N/A THR 507.A OG1 LYS 503.A O no hydrogen 2.713 N/A ARG 508.A NE ASP 446.A OD2 no hydrogen 2.851 N/A ARG 508.A NH1 GLY 418.A O no hydrogen 3.081 N/A ARG 508.A NH2 GLY 418.A O no hydrogen 2.963 N/A ARG 508.A NH2 ASP 446.A OD1 no hydrogen 2.890 N/A GLY 509.A N ASP 446.A OD2 no hydrogen 2.782 N/A ARG 510.A NE ASP 487.A OD1 no hydrogen 2.852 N/A ARG 510.A NH2 GLY 486.A O no hydrogen 3.221 N/A ARG 510.A NH2 ASP 487.A OD1 no hydrogen 3.306 N/A GLN 512.A N PRO 447.A O no hydrogen 2.998 N/A GLN 512.A NE2 ASP 487.A OD2 no hydrogen 2.886 N/A GLN 512.A NE2 ARG 510.A O no hydrogen 3.080 N/A LEU 513.A N ASP 487.A O no hydrogen 2.785 N/A ILE 514.A N VAL 449.A O no hydrogen 2.814 N/A GLU 515.A N VAL 489.A O no hydrogen 2.801 N/A ALA 516.A N LEU 451.A O no hydrogen 2.864 N/A MET 517.A N VAL 491.A O no hydrogen 2.960 N/A ILE 518.A N ASN 453.A O no hydrogen 2.986 N/A ARG 520.A NE ALA 455.A O no hydrogen 3.046 N/A ARG 520.A NH2 ALA 455.A O no hydrogen 2.949 N/A GLY 521.A N GLU 458.A OE2 no hydrogen 2.737 N/A SER 524.A N ASP 380.A OD2 no hydrogen 2.937 N/A SER 524.A OG ASP 380.A OD1 no hydrogen 2.638 N/A THR 526.A OG1 ASP 387.A OD2 no hydrogen 3.360 N/A LEU 527.A N SER 524.A OG no hydrogen 3.027 N/A ALA 528.A N SER 524.A O no hydrogen 2.969 N/A ARG 529.A N ASP 525.A O no hydrogen 2.945 N/A ARG 529.A NE ALA 256.A O no hydrogen 3.046 N/A ARG 529.A NH2 ALA 256.A O no hydrogen 3.051 N/A PHE 530.A N THR 526.A O no hydrogen 2.978 N/A VAL 531.A N LEU 527.A O no hydrogen 2.917 N/A GLN 532.A N ALA 528.A O no hydrogen 3.022 N/A GLY 533.A N ARG 529.A O no hydrogen 2.788 N/A GLN 534.A N PHE 530.A O no hydrogen 3.097 N/A LYS 535.A N VAL 531.A O no hydrogen 3.255 N/A ARG 536.A N GLN 532.A O no hydrogen 3.004 N/A LEU 537.A N GLN 534.A O no hydrogen 3.088 N/A