Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1e2u_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): MET 1.A N THR 16.A O no hydrogen 3.089 N/A MET 1.A N GLU 25.A OE1 no hydrogen 2.688 N/A MET 1.A N GLU 25.A OE2 no hydrogen 3.488 N/A CYS 3.A N CYS 15.A O no hydrogen 3.072 N/A GLN 5.A NE2 THR 69.A O no hydrogen 3.028 N/A GLN 7.A N TYR 492.A O no hydrogen 2.868 N/A GLN 7.A NE2 GLN 409.A OE1 no hydrogen 2.911 N/A GLN 7.A NE2 THR 516.A OG1 no hydrogen 2.902 N/A THR 9.A N CYS 6.A O no hydrogen 3.212 N/A THR 9.A OG1 CYS 3.A O no hydrogen 3.170 N/A ASN 12.A N THR 9.A O no hydrogen 3.095 N/A ASN 12.A ND2 LEU 517.A O no hydrogen 2.898 N/A THR 13.A N ALA 10.A O no hydrogen 2.917 N/A THR 13.A OG1 ALA 10.A O no hydrogen 3.410 N/A GLY 14.A N ALA 10.A O no hydrogen 3.021 N/A CYS 15.A N CYS 3.A O no hydrogen 2.842 N/A CYS 15.A SG THR 9.A OG1 no hydrogen 3.680 N/A GLY 19.A N LYS 23.A O no hydrogen 2.749 N/A GLY 22.A N GLY 19.A O no hydrogen 2.885 N/A LYS 23.A NZ GLN 31.A OE1 no hydrogen 3.097 N/A THR 27.A OG1 ASP 77.A OD1 no hydrogen 2.581 N/A ALA 28.A N PRO 24.A O no hydrogen 2.882 N/A ASN 29.A N GLU 25.A O no hydrogen 2.896 N/A ASN 29.A ND2 GLU 25.A OE2 no hydrogen 2.861 N/A LEU 30.A N GLU 26.A O no hydrogen 3.026 N/A GLN 31.A N THR 27.A O no hydrogen 2.988 N/A ASP 32.A N ALA 28.A O no hydrogen 3.082 N/A LEU 33.A N ASN 29.A O no hydrogen 2.943 N/A LEU 34.A N LEU 30.A O no hydrogen 2.925 N/A ILE 35.A N GLN 31.A O no hydrogen 3.026 N/A PHE 36.A N ASP 32.A O no hydrogen 2.980 N/A VAL 37.A N LEU 33.A O no hydrogen 2.979 N/A LEU 38.A N LEU 34.A O no hydrogen 2.882 N/A ARG 39.A N ILE 35.A O no hydrogen 2.912 N/A ARG 39.A NE THR 186.A OG1 no hydrogen 2.829 N/A GLY 40.A N PHE 36.A O no hydrogen 3.151 N/A ILE 41.A N VAL 37.A O no hydrogen 3.001 N/A ALA 42.A N LEU 38.A O no hydrogen 2.928 N/A ILE 43.A N ARG 39.A O no hydrogen 2.888 N/A TYR 44.A N GLY 40.A O no hydrogen 3.451 N/A TYR 44.A OH ALA 118.A O no hydrogen 2.842 N/A GLY 45.A N ILE 41.A O no hydrogen 2.848 N/A GLU 46.A N ALA 42.A O no hydrogen 2.853 N/A LYS 47.A N ILE 43.A O no hydrogen 3.163 N/A LEU 48.A N TYR 44.A O no hydrogen 2.855 N/A LYS 49.A N GLY 45.A O no hydrogen 3.159 N/A GLU 50.A N GLU 46.A O no hydrogen 3.007 N/A LEU 51.A N LYS 47.A O no hydrogen 2.981 N/A GLY 52.A N LYS 49.A O no hydrogen 3.012 N/A GLN 53.A N LEU 48.A O no hydrogen 2.968 N/A ARG 56.A NE ASP 59.A OD1 no hydrogen 2.826 N/A SER 57.A N ASP 55.A OD1 no hydrogen 2.818 N/A SER 57.A OG ASP 55.A OD1 no hydrogen 2.666 N/A ASP 59.A N ARG 56.A O no hydrogen 3.155 N/A VAL 62.A N ASN 58.A O no hydrogen 2.972 N/A LEU 63.A N ASP 59.A O no hydrogen 3.144 N/A GLN 64.A N ASP 60.A O no hydrogen 2.919 N/A GLN 64.A NE2 GLU 163.A OE2 no hydrogen 3.140 N/A GLY 65.A N PHE 61.A O no hydrogen 2.865 N/A LEU 66.A N VAL 62.A O no hydrogen 3.071 N/A PHE 67.A N LEU 63.A O no hydrogen 2.964 N/A ALA 68.A N GLN 64.A O no hydrogen 2.904 N/A THR 69.A N LEU 66.A O no hydrogen 3.041 N/A THR 69.A OG1 LEU 66.A O no hydrogen 2.829 N/A ILE 70.A N PHE 67.A O no hydrogen 2.977 N/A THR 71.A N GLN 494.A OE1 no hydrogen 2.972 N/A ASN 72.A ND2 TYR 492.A OH no hydrogen 3.049 N/A ALA 73.A N ILE 70.A O no hydrogen 3.021 N/A ASN 74.A ND2 VAL 331.A O no hydrogen 2.844 N/A TRP 75.A N GLY 333.A O no hydrogen 2.919 N/A TRP 75.A NE1 LEU 313.A O no hydrogen 2.825 N/A ASP 76.A N ASN 74.A OD1 no hydrogen 2.946 N/A ALA 78.A N ASP 76.A OD1 no hydrogen 3.052 N/A ARG 79.A N ASP 76.A O no hydrogen 2.981 N/A ARG 79.A NH1 VAL 332.A O no hydrogen 2.767 N/A ARG 79.A NH2 GLY 330.A O no hydrogen 3.090 N/A ARG 79.A NH2 VAL 332.A O no hydrogen 3.383 N/A PHE 80.A N ASP 76.A O no hydrogen 3.319 N/A GLU 81.A N ASP 77.A O no hydrogen 2.898 N/A ALA 82.A N ALA 78.A O no hydrogen 2.925 N/A MET 83.A N ARG 79.A O no hydrogen 2.949 N/A ILE 84.A N PHE 80.A O no hydrogen 2.839 N/A SER 85.A N GLU 81.A O no hydrogen 2.925 N/A SER 85.A OG GLU 81.A O no hydrogen 3.228 N/A GLU 86.A N ALA 82.A O no hydrogen 2.940 N/A GLY 87.A N MET 83.A O no hydrogen 2.781 N/A LEU 88.A N ILE 84.A O no hydrogen 2.948 N/A ALA 89.A N SER 85.A O no hydrogen 3.178 N/A ARG 90.A N GLU 86.A O no hydrogen 2.913 N/A ARG 90.A NE GLU 86.A OE2 no hydrogen 2.743 N/A ARG 90.A NH1 SER 57.A O no hydrogen 3.244 N/A ARG 90.A NH1 ASN 58.A OD1 no hydrogen 2.888 N/A ARG 90.A NH2 GLU 86.A OE2 no hydrogen 2.931 N/A ARG 91.A N GLY 87.A O no hydrogen 2.788 N/A ARG 91.A NE ASP 92.A OD1 no hydrogen 3.144 N/A ARG 91.A NH1 ALA 117.A O no hydrogen 2.854 N/A ARG 91.A NH1 TRP 120.A O no hydrogen 2.781 N/A ARG 91.A NH2 ASP 92.A OD1 no hydrogen 3.049 N/A ARG 91.A NH2 TRP 120.A O no hydrogen 2.784 N/A ASP 92.A N LEU 88.A O no hydrogen 2.922 N/A LYS 93.A N ALA 89.A O no hydrogen 3.093 N/A LEU 94.A N ARG 90.A O no hydrogen 3.173 N/A ARG 95.A N ARG 91.A O no hydrogen 2.852 N/A ARG 95.A NH1 TYR 44.A OH no hydrogen 2.880 N/A ASN 96.A N ASP 92.A O no hydrogen 2.932 N/A ALA 97.A N LYS 93.A O no hydrogen 3.083 N/A PHE 98.A N LEU 94.A O no hydrogen 2.849 N/A LEU 99.A N ARG 95.A O no hydrogen 2.811 N/A ALA 100.A N ASN 96.A O no hydrogen 3.303 N/A VAL 101.A N ALA 97.A O no hydrogen 3.108 N/A TYR 102.A N PHE 98.A O no hydrogen 2.775 N/A LYS 103.A N LEU 99.A O no hydrogen 3.038 N/A ALA 104.A N ALA 100.A O no hydrogen 3.032 N/A LYS 105.A N VAL 101.A O no hydrogen 2.958 N/A ASN 106.A N TYR 102.A O no hydrogen 2.857 N/A ASN 106.A ND2 TYR 102.A O no hydrogen 2.841 N/A GLY 107.A N LYS 103.A O no hydrogen 2.825 N/A ALA 118.A N PRO 115.A O no hydrogen 2.986 N/A THR 119.A N GLU 116.A O no hydrogen 2.982 N/A THR 119.A OG1 GLU 116.A O no hydrogen 3.556 N/A TRP 120.A N GLU 116.A O no hydrogen 2.860 N/A THR 125.A N ASP 123.A OD1 no hydrogen 3.077 N/A THR 125.A OG1 ASP 123.A OD1 no hydrogen 2.553 N/A ALA 126.A N ASP 123.A O no hydrogen 3.069 N/A PHE 127.A N SER 124.A O no hydrogen 3.183 N/A LYS 130.A N ALA 126.A O no hydrogen 3.188 N/A LYS 130.A NZ GLU 116.A OE1 no hydrogen 3.152 N/A LYS 130.A NZ GLU 116.A OE2 no hydrogen 2.532 N/A ALA 131.A N PHE 127.A O no hydrogen 2.892 N/A LYS 132.A N GLU 129.A O no hydrogen 3.308 N/A LYS 132.A NZ GLU 129.A OE1 no hydrogen 3.297 N/A SER 133.A N LYS 130.A O no hydrogen 3.122 N/A SER 133.A OG LYS 130.A O no hydrogen 3.209 N/A VAL 134.A N ALA 131.A O no hydrogen 3.397 N/A ALA 138.A N GLY 135.A O no hydrogen 3.099 N/A THR 139.A N ILE 136.A O no hydrogen 3.250 N/A ASP 143.A N ASN 141.A OD1 no hydrogen 2.899 N/A VAL 144.A N ASN 141.A OD1 no hydrogen 3.125 N/A ARG 145.A N ASN 141.A O no hydrogen 2.843 N/A ARG 145.A NH1 THR 139.A O no hydrogen 2.897 N/A SER 146.A N GLU 142.A O no hydrogen 2.969 N/A SER 146.A OG PHE 520.A O no hydrogen 2.681 N/A LEU 147.A N ASP 143.A O no hydrogen 2.981 N/A ARG 148.A N VAL 144.A O no hydrogen 2.851 N/A ARG 148.A NH1 THR 139.A OG1 no hydrogen 3.100 N/A ARG 148.A NH2 LYS 188.A O no hydrogen 2.879 N/A GLU 149.A N ARG 145.A O no hydrogen 2.893 N/A LEU 150.A N SER 146.A O no hydrogen 2.823 N/A LEU 151.A N LEU 147.A O no hydrogen 3.153 N/A ILE 152.A N ARG 148.A O no hydrogen 2.998 N/A ILE 153.A N GLU 149.A O no hydrogen 2.796 N/A GLY 154.A N LEU 150.A O no hydrogen 2.937 N/A LEU 155.A N LEU 151.A O no hydrogen 2.791 N/A LYS 156.A N ILE 152.A O no hydrogen 2.853 N/A LYS 156.A NZ GLN 5.A OE1 no hydrogen 2.748 N/A LYS 156.A NZ THR 69.A OG1 no hydrogen 2.897 N/A GLY 157.A N ILE 153.A O no hydrogen 3.223 N/A VAL 158.A N GLY 154.A O no hydrogen 2.980 N/A ALA 159.A N LEU 155.A O no hydrogen 2.823 N/A ALA 160.A N LYS 156.A O no hydrogen 2.995 N/A TYR 161.A N GLY 157.A O no hydrogen 3.344 N/A ALA 162.A N VAL 158.A O no hydrogen 2.890 N/A GLU 163.A N ALA 159.A O no hydrogen 2.829 N/A HIS 164.A N ALA 160.A O no hydrogen 3.119 N/A HIS 164.A ND1 ASP 245.A OD2 no hydrogen 2.895 N/A ALA 165.A N TYR 161.A O no hydrogen 3.056 N/A ALA 166.A N ALA 162.A O no hydrogen 2.870 N/A VAL 167.A N GLU 163.A O no hydrogen 2.919 N/A LEU 168.A N HIS 164.A O no hydrogen 3.355 N/A LEU 168.A N ALA 165.A O no hydrogen 3.058 N/A GLY 169.A N ALA 166.A O no hydrogen 2.923 N/A PHE 170.A N ALA 165.A O no hydrogen 2.864 N/A ARG 171.A NE ASP 176.A OD1 no hydrogen 3.191 N/A ARG 171.A NE ASP 176.A OD2 no hydrogen 2.590 N/A ARG 171.A NH1 ASP 60.A OD1.A no hydrogen 2.748 N/A ARG 171.A NH2 ASP 60.A OD1.A no hydrogen 3.269 N/A ARG 171.A NH2 ASP 176.A OD1 no hydrogen 2.478 N/A THR 173.A OG1 GLU 177.A OE2 no hydrogen 2.919 N/A GLU 174.A N GLU 174.A OE1 no hydrogen 2.918 N/A ILE 175.A N LYS 172.A O no hydrogen 2.989 N/A GLU 177.A N THR 173.A O no hydrogen 2.903 N/A PHE 178.A N GLU 174.A O no hydrogen 2.943 N/A MET 179.A N ILE 175.A O no hydrogen 3.019 N/A GLU 181.A N GLU 177.A O no hydrogen 2.990 N/A ALA 182.A N PHE 178.A O no hydrogen 2.790 N/A LEU 183.A N MET 179.A O no hydrogen 3.049 N/A ALA 184.A N LEU 180.A O no hydrogen 2.860 N/A SER 185.A N GLU 181.A O no hydrogen 2.954 N/A SER 185.A OG ALA 182.A O no hydrogen 2.735 N/A THR 186.A N LEU 183.A O no hydrogen 3.191 N/A THR 186.A OG1 LEU 183.A O no hydrogen 2.719 N/A THR 187.A N ALA 184.A O no hydrogen 2.994 N/A THR 187.A OG1 ALA 184.A O no hydrogen 2.718 N/A LYS 188.A N SER 185.A O no hydrogen 3.006 N/A LYS 188.A NZ GLU 46.A OE1 no hydrogen 2.851 N/A SER 191.A N GLU 194.A OE1 no hydrogen 2.900 N/A SER 191.A OG GLU 194.A OE1 no hydrogen 3.367 N/A GLU 194.A N SER 191.A OG no hydrogen 3.079 N/A MET 195.A N SER 191.A O no hydrogen 2.914 N/A VAL 196.A N VAL 192.A O no hydrogen 2.858 N/A ALA 197.A N ASP 193.A O no hydrogen 2.925 N/A LEU 198.A N GLU 194.A O no hydrogen 3.098 N/A VAL 199.A N MET 195.A O no hydrogen 3.258 N/A MET 200.A N VAL 196.A O no hydrogen 2.919 N/A LYS 201.A N ALA 197.A O no hydrogen 2.863 N/A LYS 201.A NZ GLU 181.A OE1 no hydrogen 2.792 N/A ALA 202.A N LEU 198.A O no hydrogen 2.893 N/A GLY 203.A N VAL 199.A O no hydrogen 3.064 N/A GLY 204.A N MET 200.A O no hydrogen 3.031 N/A MET 205.A N LYS 201.A O no hydrogen 2.839 N/A ALA 206.A N ALA 202.A O no hydrogen 2.752 N/A VAL 207.A N GLY 203.A O no hydrogen 3.024 N/A THR 208.A N GLY 204.A O no hydrogen 3.083 N/A THR 208.A OG1 GLY 204.A O no hydrogen 3.349 N/A THR 209.A N MET 205.A O no hydrogen 2.834 N/A THR 209.A OG1 MET 205.A O no hydrogen 2.835 N/A MET 210.A N ALA 206.A O no hydrogen 2.795 N/A ALA 211.A N VAL 207.A O no hydrogen 2.855 N/A LEU 212.A N THR 208.A O no hydrogen 2.930 N/A LEU 213.A N THR 209.A O no hydrogen 2.877 N/A ASP 214.A N MET 210.A O no hydrogen 2.959 N/A GLU 215.A N ALA 211.A O no hydrogen 2.925 N/A ALA 216.A N LEU 212.A O no hydrogen 2.861 N/A ASN 217.A N LEU 213.A O no hydrogen 2.820 N/A THR 218.A N ASP 214.A O no hydrogen 2.992 N/A THR 218.A OG1 ASP 214.A O no hydrogen 2.806 N/A THR 218.A OG1 GLU 215.A O no hydrogen 3.490 N/A THR 219.A N GLU 215.A O no hydrogen 2.842 N/A THR 219.A OG1 GLU 215.A O no hydrogen 2.893 N/A THR 220.A N ALA 216.A O no hydrogen 3.106 N/A THR 220.A OG1 ALA 216.A O no hydrogen 2.717 N/A TYR 221.A N ASN 217.A O no hydrogen 2.900 N/A GLY 222.A N THR 218.A O no hydrogen 2.885 N/A GLU 225.A N TYR 274.A O no hydrogen 3.027 N/A ILE 226.A N GLN 380.A OE1 no hydrogen 2.976 N/A THR 227.A N GLY 374.A O no hydrogen 2.836 N/A THR 227.A OG1 GLU 225.A O no hydrogen 2.811 N/A VAL 229.A N ILE 372.A O no hydrogen 2.720 N/A ILE 231.A N GLY 370.A O no hydrogen 3.056 N/A GLY 232.A N ASN 230.A OD1 no hydrogen 2.944 N/A VAL 233.A N GLU 366.A OE2 no hydrogen 3.081 N/A GLY 234.A N TYR 264.A OH no hydrogen 2.786 N/A ASN 236.A ND2 ASP 262.A OD1 no hydrogen 3.378 N/A ASN 236.A ND2 ASP 262.A OD2 no hydrogen 3.487 N/A ILE 239.A N ASP 262.A O no hydrogen 2.912 N/A LEU 240.A N PRO 305.A O no hydrogen 2.935 N/A ILE 241.A N TYR 264.A O no hydrogen 2.909 N/A SER 242.A N LEU 307.A O no hydrogen 2.824 N/A SER 242.A OG HIS 266.A ND1 no hydrogen 2.700 N/A HIS 244.A ND1 THR 310.A OG1 no hydrogen 2.881 N/A HIS 244.A NE2 GLU 268.A OE2 no hydrogen 3.035 N/A ASP 245.A N THR 309.A OG1 no hydrogen 3.073 N/A ASP 248.A N ASP 245.A OD1 no hydrogen 2.938 N/A MET 249.A N ASP 245.A O no hydrogen 3.446 N/A ALA 250.A N LEU 246.A O no hydrogen 2.964 N/A GLU 251.A N LYS 247.A O no hydrogen 3.088 N/A LEU 252.A N ASP 248.A O no hydrogen 2.863 N/A LEU 253.A N MET 249.A O no hydrogen 2.893 N/A LYS 254.A N ALA 250.A O no hydrogen 3.097 N/A GLN 255.A N GLU 251.A O no hydrogen 2.964 N/A GLN 255.A NE2 LYS 349.A O no hydrogen 2.840 N/A THR 256.A N LEU 252.A O no hydrogen 2.971 N/A THR 256.A OG1 LEU 252.A O no hydrogen 2.709 N/A THR 256.A OG1 LEU 253.A O no hydrogen 3.250 N/A THR 256.A OG1 HIS 283.A NE2 no hydrogen 2.776 N/A GLU 257.A N LYS 254.A O no hydrogen 3.392 N/A THR 259.A N THR 256.A O no hydrogen 3.161 N/A THR 259.A OG1 THR 256.A O no hydrogen 2.734 N/A VAL 261.A N THR 259.A OG1 no hydrogen 3.202 N/A ASP 262.A N PRO 237.A O no hydrogen 2.961 N/A VAL 263.A N HIS 283.A O no hydrogen 2.954 N/A TYR 264.A N ILE 239.A O no hydrogen 3.000 N/A THR 265.A N GLY 286.A O no hydrogen 2.907 N/A THR 265.A OG1 GLY 286.A O no hydrogen 3.357 N/A THR 265.A OG1 ASN 287.A OD1 no hydrogen 2.670 N/A HIS 266.A N ILE 241.A O no hydrogen 2.930 N/A HIS 266.A ND1 SER 242.A OG no hydrogen 2.700 N/A MET 269.A N HIS 266.A O no hydrogen 2.949 N/A LEU 270.A N GLY 267.A O no hydrogen 3.365 N/A ALA 272.A N MET 269.A O no hydrogen 2.896 N/A ASN 273.A N LEU 270.A O no hydrogen 2.940 N/A ASN 273.A ND2 THR 265.A OG1 no hydrogen 2.892 N/A ASN 273.A ND2 LEU 270.A O no hydrogen 2.793 N/A TYR 274.A N PRO 271.A O no hydrogen 2.872 N/A TYR 274.A OH ASP 454.A OD2 no hydrogen 2.694 N/A TYR 275.A N ALA 272.A O no hydrogen 3.396 N/A ALA 277.A N TYR 221.A O no hydrogen 3.176 N/A PHE 278.A N TYR 275.A O no hydrogen 2.959 N/A LYS 279.A N TYR 275.A O no hydrogen 3.152 N/A LYS 279.A NZ GLU 225.A OE2 no hydrogen 2.840 N/A LYS 279.A NZ THR 227.A OG1 no hydrogen 2.870 N/A TYR 281.A N PHE 278.A O no hydrogen 3.391 N/A HIS 283.A NE2 THR 256.A OG1 no hydrogen 2.776 N/A PHE 284.A N TYR 281.A O no hydrogen 3.111 N/A VAL 285.A N VAL 263.A O no hydrogen 2.926 N/A ASN 287.A N ASN 230.A O no hydrogen 3.044 N/A ASN 287.A ND2 TYR 436.A OH no hydrogen 3.411 N/A TYR 288.A N THR 265.A O no hydrogen 2.827 N/A TYR 288.A OH SER 301.A OG no hydrogen 2.849 N/A TYR 288.A OH VAL 365.A O no hydrogen 2.677 N/A GLY 290.A N GLU 298.A OE1 no hydrogen 2.757 N/A SER 291.A N GLN 294.A OE1 no hydrogen 3.202 N/A SER 291.A OG ASP 406.A OD2 no hydrogen 2.794 N/A TRP 292.A NE1 ASP 406.A O no hydrogen 2.937 N/A TRP 293.A NE1 ASP 406.A OD2 no hydrogen 2.890 N/A GLN 294.A N SER 291.A O no hydrogen 3.046 N/A GLN 295.A N TRP 292.A O no hydrogen 3.167 N/A GLN 295.A NE2 TRP 292.A O no hydrogen 2.871 N/A GLN 295.A NE2 CYS 312.A O no hydrogen 2.926 N/A ASN 296.A ND2 PRO 315.A O no hydrogen 3.211 N/A ASN 296.A ND2 TYR 322.A OH no hydrogen 2.973 N/A PHE 299.A N GLN 295.A O no hydrogen 2.718 N/A GLU 300.A N ASN 296.A O no hydrogen 3.285 N/A SER 301.A N PRO 297.A O no hydrogen 2.944 N/A SER 301.A OG TYR 288.A OH no hydrogen 2.849 N/A SER 301.A OG PRO 297.A O no hydrogen 3.270 N/A SER 301.A OG GLU 298.A O no hydrogen 3.389 N/A PHE 302.A N GLU 298.A O no hydrogen 2.918 N/A ASN 303.A N GLU 300.A O no hydrogen 3.287 N/A ASN 303.A ND2 PRO 363.A O no hydrogen 2.889 N/A GLY 304.A N PHE 302.A O no hydrogen 2.942 N/A ILE 306.A N ARG 325.A O no hydrogen 2.943 N/A LEU 307.A N LEU 240.A O no hydrogen 2.759 N/A LEU 308.A N TYR 327.A O no hydrogen 2.887 N/A THR 309.A N SER 242.A O no hydrogen 3.032 N/A THR 309.A OG1 SER 242.A O no hydrogen 2.839 N/A THR 310.A OG1 HIS 244.A ND1 no hydrogen 2.881 N/A THR 310.A OG1 ASN 311.A O no hydrogen 2.632 N/A ASN 311.A ND2 THR 71.A O no hydrogen 3.119 N/A ASN 311.A ND2 GLU 493.A OE2 no hydrogen 2.969 N/A LEU 313.A N ASN 72.A O no hydrogen 2.875 N/A VAL 314.A N GLN 295.A OE1 no hydrogen 2.876 N/A LEU 316.A N TYR 334.A OH no hydrogen 2.992 N/A LYS 317.A N ASN 320.A OD1 no hydrogen 2.740 N/A GLU 319.A N GLU 319.A OE1 no hydrogen 2.884 N/A ASN 320.A N LYS 317.A O no hydrogen 2.985 N/A THR 321.A N GLU 300.A OE1 no hydrogen 2.798 N/A THR 321.A OG1 GLU 300.A OE1 no hydrogen 3.400 N/A THR 321.A OG1 GLU 300.A OE2 no hydrogen 2.368 N/A ARG 325.A N TYR 322.A O no hydrogen 2.971 N/A ARG 325.A NH1 PHE 299.A O no hydrogen 2.939 N/A ARG 325.A NH1 GLY 304.A O no hydrogen 2.890 N/A ARG 325.A NH2 GLU 300.A O no hydrogen 2.902 N/A LEU 326.A N LEU 323.A O no hydrogen 3.177 N/A TYR 327.A N ILE 306.A O no hydrogen 2.817 N/A TYR 327.A OH GLN 357.A OE1 no hydrogen 2.627 N/A THR 328.A N LYS 338.A O no hydrogen 2.833 N/A THR 328.A OG1 HIS 339.A ND1 no hydrogen 2.727 N/A THR 329.A N LEU 308.A O no hydrogen 3.151 N/A THR 329.A OG1 ILE 340.A O no hydrogen 2.893 N/A VAL 332.A N THR 329.A O no hydrogen 3.173 N/A ALA 337.A N TYR 334.A O no hydrogen 3.020 N/A LYS 338.A NZ ASP 324.A O no hydrogen 2.806 N/A HIS 339.A ND1 THR 328.A OG1 no hydrogen 2.727 N/A ILE 340.A N THR 328.A O no hydrogen 2.816 N/A ARG 343.A NE GLU 251.A OE1 no hydrogen 3.387 N/A ARG 343.A NE GLU 251.A OE2 no hydrogen 2.790 N/A ARG 343.A NH2 ASP 248.A OD1 no hydrogen 2.942 N/A ARG 343.A NH2 GLU 251.A OE1 no hydrogen 2.838 N/A GLY 347.A N PRO 344.A O no hydrogen 2.851 N/A LYS 349.A N GLU 251.A OE1 no hydrogen 2.847 N/A LYS 349.A NZ ASP 248.A OD1 no hydrogen 2.888 N/A LYS 349.A NZ ASP 248.A OD2 no hydrogen 3.359 N/A LYS 349.A NZ THR 329.A OG1 no hydrogen 2.891 N/A PHE 351.A N GLN 255.A OE1 no hydrogen 2.930 N/A SER 352.A N ASP 350.A OD1 no hydrogen 2.949 N/A SER 352.A OG ASP 350.A OD1 no hydrogen 2.618 N/A SER 352.A OG ASP 350.A OD2 no hydrogen 3.545 N/A LEU 354.A N PHE 351.A O no hydrogen 3.025 N/A ILE 355.A N PHE 351.A O no hydrogen 3.269 N/A ALA 356.A N SER 352.A O no hydrogen 2.930 N/A GLN 357.A N ALA 353.A O no hydrogen 2.968 N/A GLN 357.A NE2 ASP 324.A O no hydrogen 3.046 N/A ALA 358.A N LEU 354.A O no hydrogen 2.847 N/A LYS 359.A N ILE 355.A O no hydrogen 3.166 N/A LYS 360.A N GLN 357.A O no hydrogen 2.907 N/A CYS 361.A N ALA 358.A O no hydrogen 2.945 N/A CYS 361.A SG ASN 303.A O no hydrogen 3.395 N/A CYS 361.A SG GLN 357.A O no hydrogen 3.414 N/A VAL 365.A N SER 301.A O no hydrogen 3.022 N/A ILE 372.A N VAL 229.A O no hydrogen 2.897 N/A GLY 374.A N THR 227.A O no hydrogen 3.059 N/A GLY 375.A N ASP 454.A O no hydrogen 2.965 N/A PHE 376.A N ASP 454.A O no hydrogen 2.888 N/A HIS 378.A N SER 463.A OG no hydrogen 2.891 N/A HIS 378.A NE2 ASP 214.A OD1 no hydrogen 2.817 N/A GLN 380.A NE2 GLN 380.A O no hydrogen 2.840 N/A VAL 381.A N ALA 377.A O no hydrogen 2.993 N/A LEU 382.A N HIS 378.A O no hydrogen 2.871 N/A ALA 383.A N HIS 379.A O no hydrogen 2.874 N/A LEU 384.A N VAL 381.A O no hydrogen 2.975 N/A ALA 385.A N LEU 382.A O no hydrogen 3.162 N/A LYS 387.A NZ GLY 447.A O no hydrogen 3.052 N/A VAL 388.A N LEU 384.A O no hydrogen 2.926 N/A VAL 389.A N ALA 385.A O no hydrogen 2.806 N/A GLU 390.A N ASP 386.A O no hydrogen 2.961 N/A ALA 391.A N LYS 387.A O no hydrogen 3.128 N/A VAL 392.A N VAL 388.A O no hydrogen 3.025 N/A LYS 393.A N VAL 389.A O no hydrogen 2.905 N/A SER 394.A N GLU 390.A O no hydrogen 2.918 N/A SER 394.A OG GLU 390.A O no hydrogen 3.533 N/A SER 394.A OG ALA 391.A O no hydrogen 3.274 N/A GLY 395.A N ALA 391.A O no hydrogen 3.291 N/A GLY 395.A N VAL 392.A O no hydrogen 3.167 N/A ALA 396.A N SER 394.A OG no hydrogen 3.196 N/A ILE 397.A N ALA 391.A O no hydrogen 3.046 N/A LYS 398.A N ASP 425.A O no hydrogen 2.735 N/A LYS 398.A NZ ASP 425.A OD1 no hydrogen 3.166 N/A ARG 399.A NH1 SER 486.A OG no hydrogen 2.990 N/A PHE 400.A N PRO 484.A O no hydrogen 2.933 N/A VAL 401.A N VAL 427.A O no hydrogen 2.855 N/A VAL 402.A N SER 486.A O no hydrogen 2.738 N/A MET 403.A N LEU 429.A O no hydrogen 2.857 N/A GLY 405.A N ALA 431.A O no hydrogen 2.942 N/A ARG 408.A N GLU 8.A OE2 no hydrogen 2.771 N/A ARG 408.A NH1 GLU 8.A OE1 no hydrogen 3.166 N/A ARG 412.A N GLN 409.A O no hydrogen 3.065 N/A ARG 412.A NH2 GLN 7.A OE1 no hydrogen 2.894 N/A ARG 412.A NH2 TRP 491.A O no hydrogen 2.844 N/A SER 413.A N LYS 410.A O no hydrogen 3.091 N/A SER 413.A OG LYS 410.A O no hydrogen 3.216 N/A SER 413.A OG GLU 417.A OE2 no hydrogen 3.461 N/A TYR 414.A N SER 411.A O no hydrogen 3.192 N/A TYR 414.A OH ASP 488.A OD1 no hydrogen 3.329 N/A TYR 414.A OH ASP 488.A OD2 no hydrogen 2.658 N/A TYR 414.A OH ASP 544.A OD2 no hydrogen 2.482 N/A TYR 415.A N ARG 412.A O no hydrogen 3.040 N/A THR 416.A OG1 ARG 437.A O no hydrogen 2.669 N/A GLU 417.A N SER 413.A O no hydrogen 2.834 N/A VAL 418.A N TYR 414.A O no hydrogen 2.809 N/A ALA 419.A N TYR 415.A O no hydrogen 3.079 N/A GLU 420.A N THR 416.A O no hydrogen 2.946 N/A ASN 421.A N GLU 417.A O no hydrogen 3.020 N/A ASN 421.A N VAL 418.A O no hydrogen 3.208 N/A ASN 421.A ND2 GLU 417.A O no hydrogen 2.871 N/A LEU 422.A N VAL 418.A O no hydrogen 2.965 N/A THR 426.A N PRO 423.A O no hydrogen 3.191 N/A THR 426.A OG1 PRO 423.A O no hydrogen 2.715 N/A VAL 427.A N ARG 399.A O no hydrogen 3.064 N/A ILE 428.A N ARG 451.A O no hydrogen 2.734 N/A LEU 429.A N VAL 401.A O no hydrogen 2.936 N/A THR 430.A N LEU 453.A O no hydrogen 2.901 N/A THR 430.A OG1 TYR 438.A OH no hydrogen 2.677 N/A GLY 432.A N GLY 456.A O no hydrogen 2.906 N/A ALA 434.A N GLY 405.A O no hydrogen 3.025 N/A LYS 435.A N GLY 432.A O no hydrogen 3.081 N/A LYS 435.A NZ ASP 454.A OD1 no hydrogen 2.939 N/A LYS 435.A NZ ASP 454.A OD2 no hydrogen 2.777 N/A LYS 435.A NZ GLY 456.A O no hydrogen 2.761 N/A TYR 436.A N CYS 433.A O no hydrogen 3.020 N/A TYR 436.A OH GLY 267.A O no hydrogen 2.742 N/A ARG 437.A N ALA 434.A O no hydrogen 3.193 N/A ARG 437.A NE ASP 406.A OD1 no hydrogen 2.882 N/A ARG 437.A NH2 GLY 407.A O no hydrogen 2.870 N/A TYR 438.A N LYS 435.A O no hydrogen 3.036 N/A TYR 438.A OH MET 403.A O no hydrogen 2.685 N/A TYR 438.A OH THR 430.A OG1 no hydrogen 2.677 N/A LYS 440.A NZ GLY 289.A O no hydrogen 2.726 N/A LYS 440.A NZ GLU 368.A OE1 no hydrogen 3.250 N/A LYS 440.A NZ GLU 368.A OE2 no hydrogen 2.719 N/A ILE 446.A N ILE 449.A O no hydrogen 2.782 N/A GLY 448.A N ASP 445.A OD1 no hydrogen 2.877 N/A ILE 449.A N ILE 446.A O no hydrogen 2.941 N/A ARG 451.A N GLY 444.A O no hydrogen 2.929 N/A ARG 451.A NE THR 426.A O no hydrogen 2.828 N/A ARG 451.A NH2 THR 426.A O no hydrogen 3.234 N/A ARG 451.A NH2 THR 426.A OG1 no hydrogen 3.079 N/A LEU 453.A N ILE 428.A O no hydrogen 2.794 N/A ALA 455.A N THR 430.A O no hydrogen 2.905 N/A GLY 456.A N ASP 454.A OD1 no hydrogen 2.872 N/A GLN 457.A N ASP 460.A OD2 no hydrogen 2.801 N/A GLN 457.A NE2 HIS 244.A O no hydrogen 2.912 N/A GLN 457.A NE2 GLU 268.A O no hydrogen 2.923 N/A CYS 458.A N GLU 268.A OE2 no hydrogen 2.832 N/A CYS 458.A SG TYR 161.A OH no hydrogen 3.154 N/A CYS 458.A SG HIS 244.A NE2 no hydrogen 3.675 N/A CYS 458.A SG GLU 268.A OE2 no hydrogen 3.327 N/A CYS 458.A SG ASN 459.A OD1 no hydrogen 4.007 N/A ASN 459.A ND2 GLN 457.A OE1 no hydrogen 3.063 N/A ASP 460.A N GLN 457.A O no hydrogen 2.720 N/A SER 461.A N CYS 458.A O no hydrogen 2.969 N/A SER 461.A OG CYS 458.A O no hydrogen 2.912 N/A TYR 462.A N ASN 459.A O no hydrogen 3.078 N/A SER 463.A N ASP 460.A O no hydrogen 2.934 N/A ALA 465.A N SER 461.A O no hydrogen 3.098 N/A VAL 466.A N TYR 462.A O no hydrogen 2.997 N/A ILE 467.A N SER 463.A O no hydrogen 2.930 N/A ALA 468.A N LEU 464.A O no hydrogen 3.001 N/A LEU 469.A N ALA 465.A O no hydrogen 2.843 N/A LYS 470.A N VAL 466.A O no hydrogen 2.972 N/A LEU 471.A N ILE 467.A O no hydrogen 2.921 N/A LYS 472.A N ALA 468.A O no hydrogen 2.913 N/A LYS 472.A NZ LEU 477.A O no hydrogen 2.842 N/A LYS 472.A NZ ASP 478.A O no hydrogen 3.432 N/A GLU 473.A N LEU 469.A O no hydrogen 3.245 N/A VAL 474.A N LYS 470.A O no hydrogen 2.939 N/A PHE 475.A N LEU 471.A O no hydrogen 2.925 N/A GLY 476.A N GLU 473.A O no hydrogen 3.085 N/A LEU 477.A N LYS 472.A O no hydrogen 3.031 N/A ASN 481.A N ASP 479.A OD1 no hydrogen 2.852 N/A ASN 481.A ND2 ASP 479.A OD1 no hydrogen 2.909 N/A ASN 481.A ND2 GLY 507.A O no hydrogen 2.851 N/A ASP 482.A N ASP 479.A O no hydrogen 2.945 N/A LEU 483.A N ILE 480.A O no hydrogen 3.319 N/A VAL 485.A N LEU 483.A O no hydrogen 2.797 N/A SER 486.A N PHE 400.A O no hydrogen 2.880 N/A SER 486.A OG MET 548.A O no hydrogen 3.259 N/A ASP 488.A N VAL 402.A O no hydrogen 2.810 N/A ILE 489.A N ARG 512.A O no hydrogen 2.952 N/A ALA 490.A N ALA 404.A O no hydrogen 3.331 N/A TRP 491.A N GLY 514.A O no hydrogen 2.969 N/A TRP 491.A NE1 THR 516.A O no hydrogen 2.839 N/A GLN 494.A NE2 GLN 5.A O no hydrogen 2.967 N/A GLN 494.A NE2 THR 71.A OG1 no hydrogen 2.903 N/A LYS 495.A N GLU 493.A OE1 no hydrogen 2.958 N/A LYS 495.A NZ ASN 311.A OD1 no hydrogen 2.914 N/A VAL 497.A N GLU 493.A O no hydrogen 3.360 N/A ALA 498.A N GLN 494.A O no hydrogen 2.964 N/A VAL 499.A N LYS 495.A O no hydrogen 2.958 N/A LEU 500.A N ALA 496.A O no hydrogen 2.912 N/A LEU 501.A N VAL 497.A O no hydrogen 2.920 N/A ALA 502.A N ALA 498.A O no hydrogen 2.964 N/A LEU 503.A N VAL 499.A O no hydrogen 2.962 N/A LEU 504.A N LEU 500.A O no hydrogen 2.902 N/A PHE 505.A N LEU 501.A O no hydrogen 2.864 N/A LEU 506.A N ALA 502.A O no hydrogen 2.940 N/A GLY 507.A N LEU 504.A O no hydrogen 2.971 N/A VAL 508.A N LEU 503.A O no hydrogen 3.049 N/A LYS 509.A N ASN 481.A OD1 no hydrogen 2.852 N/A GLY 510.A N PHE 533.A O no hydrogen 3.006 N/A ARG 512.A N TYR 487.A O no hydrogen 2.978 N/A ARG 512.A NH1 LYS 552.A O no hydrogen 2.894 N/A ARG 512.A NH1 LYS 552.A OXT no hydrogen 3.505 N/A ARG 512.A NH2 LYS 552.A OXT no hydrogen 3.003 N/A LEU 513.A N LYS 536.A O no hydrogen 2.859 N/A GLY 514.A N ILE 489.A O no hydrogen 3.094 N/A LEU 521.A N PRO 518.A O no hydrogen 3.458 N/A SER 522.A N SER 146.A OG no hydrogen 3.045 N/A SER 522.A OG ASP 143.A OD1 no hydrogen 2.743 N/A ASN 524.A ND2 ASP 143.A OD2 no hydrogen 2.758 N/A VAL 525.A N SER 522.A OG no hydrogen 3.298 N/A ALA 526.A N SER 522.A O no hydrogen 2.765 N/A LYS 527.A N PRO 523.A O no hydrogen 3.029 N/A LYS 527.A NZ GLU 531.A OE2 no hydrogen 2.644 N/A VAL 528.A N ASN 524.A O no hydrogen 3.305 N/A LEU 529.A N VAL 525.A O no hydrogen 3.113 N/A VAL 530.A N ALA 526.A O no hydrogen 2.966 N/A GLU 531.A N LYS 527.A O no hydrogen 2.803 N/A ASN 532.A N VAL 528.A O no hydrogen 2.706 N/A PHE 533.A N LEU 529.A O no hydrogen 2.824 N/A ASN 534.A N VAL 530.A O no hydrogen 2.868 N/A LYS 536.A N ILE 511.A O no hydrogen 2.897 N/A GLY 539.A N ASP 544.A OD2 no hydrogen 2.801 N/A ASP 543.A N THR 540.A OG1 no hydrogen 3.032 N/A ASP 544.A N THR 540.A O no hydrogen 2.920 N/A ILE 545.A N VAL 541.A O no hydrogen 2.970 N/A ALA 546.A N GLN 542.A O no hydrogen 3.071 N/A ALA 547.A N ASP 543.A O no hydrogen 2.964 N/A MET 548.A N ASP 544.A O no hydrogen 2.852 N/A MET 549.A N ILE 545.A O no hydrogen 2.920 N/A ALA 550.A N ALA 546.A O no hydrogen 3.231 N/A ALA 550.A N ALA 547.A O no hydrogen 3.006 N/A GLY 551.A N MET 548.A O no hydrogen 2.898 N/A LYS 552.A N ALA 547.A O no hydrogen 2.851 N/A