Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3we0_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LYS 2.A NZ ASP 171.A OD1 no hydrogen 3.483 N/A ILE 6.A N SER 95.A O no hydrogen 3.067 N/A PHE 13.A N PHE 11.A O no hydrogen 2.653 N/A PHE 15.A N PHE 13.A O no hydrogen 3.022 N/A ASP 17.A N ASP 16.A OD1 no hydrogen 2.789 N/A TRP 18.A N ALA 14.A O no hydrogen 3.099 N/A LEU 19.A N PHE 15.A O no hydrogen 2.938 N/A GLU 20.A N ASP 16.A O no hydrogen 2.914 N/A HIS 21.A N ASP 17.A O no hydrogen 2.896 N/A ALA 23.A N HIS 21.A ND1 no hydrogen 2.876 N/A GLY 24.A N HIS 21.A O no hydrogen 3.209 N/A SER 27.A N LYS 518.A O no hydrogen 2.943 N/A ARG 32.A N PRO 29.A O no hydrogen 2.976 N/A ARG 32.A NH2 GLU 35.A OE1 no hydrogen 2.862 N/A HIS 33.A N ALA 30.A O no hydrogen 2.962 N/A HIS 33.A NE2 ILE 28.A O no hydrogen 3.078 N/A GLY 34.A N GLY 57.A O no hydrogen 2.642 N/A GLU 35.A N ARG 32.A O no hydrogen 3.322 N/A VAL 37.A N LYS 59.A O no hydrogen 3.109 N/A ALA 38.A N ALA 315.A O no hydrogen 3.128 N/A ILE 39.A N VAL 61.A O no hydrogen 2.872 N/A VAL 40.A N LEU 317.A O no hydrogen 2.807 N/A GLY 41.A N TYR 63.A O no hydrogen 2.743 N/A ALA 42.A N GLU 64.A OE1 no hydrogen 2.893 N/A LEU 47.A N GLY 43.A O no hydrogen 3.002 N/A VAL 48.A N ILE 44.A O no hydrogen 2.932 N/A ALA 49.A N ALA 45.A O no hydrogen 3.242 N/A ALA 50.A N GLY 46.A O no hydrogen 3.000 N/A TYR 51.A N LEU 47.A O no hydrogen 2.852 N/A TYR 51.A OH HIS 264.A ND1 no hydrogen 3.271 N/A GLU 52.A N VAL 48.A O no hydrogen 2.971 N/A LEU 53.A N ALA 49.A O no hydrogen 2.890 N/A MET 54.A N ALA 50.A O no hydrogen 2.919 N/A LYS 55.A N TYR 51.A O no hydrogen 3.124 N/A LYS 55.A NZ GLU 52.A OE1 no hydrogen 2.844 N/A LEU 56.A N GLU 52.A O no hydrogen 3.276 N/A LEU 56.A N LEU 53.A O no hydrogen 3.095 N/A GLY 57.A N MET 54.A O no hydrogen 2.981 N/A LEU 58.A N LEU 53.A O no hydrogen 3.109 N/A LYS 59.A N GLU 35.A O no hydrogen 2.814 N/A LYS 59.A NZ GLU 36.A OE2 no hydrogen 3.430 N/A VAL 61.A N VAL 37.A O no hydrogen 2.916 N/A VAL 62.A N HIS 282.A NE2 no hydrogen 2.948 N/A TYR 63.A N ILE 39.A O no hydrogen 2.770 N/A TYR 63.A OH TYR 313.A OH no hydrogen 2.457 N/A GLU 64.A N ARG 287.A O no hydrogen 2.877 N/A SER 66.A N GLU 64.A OE2 no hydrogen 2.673 N/A GLY 69.A N ALA 42.A O no hydrogen 2.800 N/A GLY 70.A N LYS 67.A O no hydrogen 3.338 N/A ARG 71.A NH1 ALA 452.A O no hydrogen 2.741 N/A ARG 71.A NH1 ASP 488.A OD1 no hydrogen 3.456 N/A ARG 71.A NH1 ASP 488.A OD2 no hydrogen 2.671 N/A ARG 71.A NH2 ASP 488.A OD1 no hydrogen 2.845 N/A LEU 72.A N GLY 69.A O no hydrogen 3.087 N/A ARG 73.A NH2 GLY 70.A O no hydrogen 3.118 N/A SER 74.A N GLU 255.A OE1 no hydrogen 2.909 N/A SER 74.A OG GLU 86.A OE1 no hydrogen 2.641 N/A GLN 75.A N ALA 85.A O no hydrogen 2.965 N/A PHE 77.A N ILE 83.A O no hydrogen 3.117 N/A ASN 78.A N ASP 437.A OD1 no hydrogen 2.761 N/A THR 80.A N PHE 77.A O no hydrogen 3.266 N/A THR 80.A OG1 PHE 77.A O no hydrogen 2.819 N/A ALA 85.A N GLN 75.A O no hydrogen 2.858 N/A LEU 87.A N ARG 73.A O no hydrogen 2.903 N/A GLY 89.A N ARG 71.A O no hydrogen 2.957 N/A ARG 91.A NE GLN 247.A OE1 no hydrogen 3.178 N/A ARG 91.A NH2 ASN 115.A OD1 no hydrogen 2.878 N/A PHE 92.A N HIS 248.A O no hydrogen 2.904 N/A VAL 94.A N HIS 246.A O no hydrogen 2.954 N/A SER 95.A OG THR 241.A O no hydrogen 2.762 N/A SER 95.A OG ASN 242.A O no hydrogen 3.511 N/A SER 96.A N PRO 93.A O no hydrogen 2.753 N/A SER 96.A OG PRO 93.A O no hydrogen 2.758 N/A THR 97.A OG1 ASP 16.A OD2 no hydrogen 2.736 N/A ALA 98.A N GLU 498.A OE2 no hydrogen 2.852 N/A PHE 99.A N GLU 498.A OE1 no hydrogen 2.821 N/A TYR 100.A N SER 96.A O no hydrogen 3.098 N/A TYR 100.A OH PHE 92.A O no hydrogen 2.824 N/A HIS 101.A N THR 97.A O no hydrogen 3.058 N/A TYR 102.A N PHE 99.A O no hydrogen 2.873 N/A TYR 102.A OH GLU 52.A OE2 no hydrogen 2.596 N/A VAL 103.A N PHE 99.A O no hydrogen 3.135 N/A ASP 104.A N TYR 100.A O no hydrogen 2.904 N/A LYS 105.A N HIS 101.A O no hydrogen 2.948 N/A LEU 106.A N TYR 102.A O no hydrogen 3.195 N/A LEU 106.A N VAL 103.A O no hydrogen 3.262 N/A GLY 107.A N ASP 104.A O no hydrogen 2.925 N/A LEU 108.A N VAL 103.A O no hydrogen 3.147 N/A THR 110.A OG1 HIS 248.A ND1 no hydrogen 2.917 N/A LYS 111.A N LEU 249.A O no hydrogen 2.976 N/A LYS 111.A NZ ASP 392.A O no hydrogen 2.648 N/A PHE 113.A N GLN 247.A O no hydrogen 2.880 N/A ASN 115.A N PHE 113.A O no hydrogen 2.769 N/A ASN 115.A ND2 GLN 247.A OE1 no hydrogen 2.844 N/A LEU 117.A N THR 124.A OG1 no hydrogen 3.289 N/A THR 118.A OG1 ASN 115.A O no hydrogen 2.861 N/A ALA 120.A N THR 118.A OG1 no hydrogen 3.186 N/A SER 121.A N THR 118.A O no hydrogen 2.962 N/A SER 123.A OG ASP 374.A OD2 no hydrogen 3.290 N/A SER 123.A OG SER 377.A OG no hydrogen 2.101 N/A THR 124.A N ALA 135.A O no hydrogen 2.801 N/A VAL 125.A N MET 378.A O no hydrogen 2.885 N/A ILE 126.A N TYR 133.A O no hydrogen 2.937 N/A ASP 127.A N LEU 380.A O no hydrogen 2.857 N/A LEU 128.A N GLN 131.A O no hydrogen 2.835 N/A GLU 129.A N ASP 382.A OD2 no hydrogen 2.733 N/A GLN 131.A N LEU 128.A O no hydrogen 2.779 N/A THR 132.A OG1 ASP 127.A OD1 no hydrogen 2.761 N/A TYR 133.A N ILE 126.A O no hydrogen 2.762 N/A TYR 134.A OH GLU 136.A OE2 no hydrogen 2.670 N/A ALA 135.A N THR 124.A O no hydrogen 2.829 N/A GLU 136.A N ASP 140.A OD2 no hydrogen 2.780 N/A LYS 137.A N ASP 140.A OD2 no hydrogen 3.301 N/A ASP 140.A N LYS 137.A O no hydrogen 3.039 N/A LEU 141.A N ALA 138.A O no hydrogen 3.109 N/A PHE 145.A N PRO 142.A O no hydrogen 3.070 N/A GLN 146.A NE2 ASP 150.A OD1 no hydrogen 2.743 N/A GLU 147.A N ALA 143.A O no hydrogen 2.971 N/A VAL 148.A N LEU 144.A O no hydrogen 3.075 N/A THR 149.A N PHE 145.A O no hydrogen 2.939 N/A THR 149.A OG1 PHE 145.A O no hydrogen 2.554 N/A ASP 150.A N GLN 146.A O no hydrogen 2.888 N/A ALA 151.A N GLU 147.A O no hydrogen 2.993 N/A TRP 152.A N VAL 148.A O no hydrogen 2.987 N/A ALA 153.A N THR 149.A O no hydrogen 3.168 N/A ASP 154.A N ASP 150.A O no hydrogen 2.872 N/A ALA 155.A N ALA 151.A O no hydrogen 2.791 N/A LEU 156.A N TRP 152.A O no hydrogen 3.046 N/A GLU 157.A N ALA 153.A O no hydrogen 2.764 N/A SER 158.A N ASP 154.A O no hydrogen 2.780 N/A SER 158.A OG ASP 154.A O no hydrogen 2.845 N/A GLY 159.A N ALA 155.A O no hydrogen 2.773 N/A ALA 160.A N LEU 156.A O no hydrogen 2.872 N/A ARG 161.A N GLU 157.A O no hydrogen 3.141 N/A ARG 161.A NE ASP 164.A OD2 no hydrogen 3.261 N/A ARG 161.A NH2 ASP 164.A OD2 no hydrogen 2.983 N/A GLY 163.A N GLU 157.A OE2 no hydrogen 2.556 N/A ILE 165.A N ARG 161.A O no hydrogen 2.938 N/A GLN 166.A N PHE 162.A O no hydrogen 2.859 N/A GLN 167.A N GLY 163.A O no hydrogen 3.038 N/A GLN 167.A NE2 ASP 171.A OD1 no hydrogen 2.890 N/A GLN 167.A NE2 ASP 171.A OD2 no hydrogen 3.491 N/A ALA 168.A N ASP 164.A O no hydrogen 3.035 N/A ILE 169.A N ILE 165.A O no hydrogen 2.872 N/A ARG 170.A N GLN 166.A O no hydrogen 2.830 N/A ARG 170.A NH1 LYS 2.A O no hydrogen 2.793 N/A ASP 171.A N GLN 167.A O no hydrogen 2.942 N/A ARG 172.A N ILE 169.A O no hydrogen 2.989 N/A ARG 172.A NH1 ASP 16.A OD1 no hydrogen 3.036 N/A ARG 172.A NH1 ASP 17.A OD1 no hydrogen 3.567 N/A ARG 172.A NH2 THR 5.A OG1 no hydrogen 2.990 N/A ARG 172.A NH2 ASP 16.A OD1 no hydrogen 3.326 N/A ARG 172.A NH2 ASP 16.A OD2 no hydrogen 2.845 N/A ASP 173.A N ALA 168.A O no hydrogen 3.028 N/A ARG 176.A N ASP 173.A OD1 no hydrogen 3.258 N/A ARG 176.A NE ASP 173.A OD2 no hydrogen 2.866 N/A ARG 176.A NH1 ASP 171.A OD2 no hydrogen 3.146 N/A ARG 176.A NH2 ASP 171.A OD2 no hydrogen 3.194 N/A ARG 176.A NH2 ASP 173.A OD2 no hydrogen 2.444 N/A LEU 177.A N ASP 173.A O no hydrogen 2.930 N/A LYS 178.A N VAL 174.A O no hydrogen 2.907 N/A LYS 178.A NZ ASP 10.A O no hydrogen 2.914 N/A LYS 178.A NZ ILE 533.A O no hydrogen 2.864 N/A GLU 179.A N PRO 175.A O no hydrogen 2.985 N/A LEU 180.A N ARG 176.A O no hydrogen 3.029 N/A TRP 181.A N LEU 177.A O no hydrogen 2.899 N/A TRP 181.A NE1 ASP 10.A OD1 no hydrogen 3.084 N/A ASN 182.A N LYS 178.A O no hydrogen 2.795 N/A LEU 184.A N TRP 181.A O no hydrogen 2.758 N/A VAL 185.A N TRP 181.A O no hydrogen 3.269 N/A TRP 188.A N LEU 184.A O no hydrogen 2.958 N/A ASP 189.A N VAL 185.A O no hydrogen 3.058 N/A ARG 191.A N TRP 188.A O no hydrogen 3.325 N/A THR 192.A N ASP 195.A OD2 no hydrogen 3.283 N/A THR 192.A OG1 ASP 195.A OD2 no hydrogen 2.679 N/A PHE 193.A N ASN 230.A O no hydrogen 2.989 N/A TYR 194.A N PHE 228.A O no hydrogen 2.961 N/A ASP 195.A N THR 192.A OG1 no hydrogen 2.920 N/A PHE 196.A N THR 192.A O no hydrogen 2.921 N/A VAL 197.A N PHE 193.A O no hydrogen 2.974 N/A ALA 198.A N TYR 194.A O no hydrogen 2.890 N/A THR 199.A N ASP 195.A O no hydrogen 2.990 N/A THR 199.A OG1 ASP 195.A O no hydrogen 3.043 N/A SER 200.A N VAL 197.A O no hydrogen 3.235 N/A SER 200.A OG VAL 197.A O no hydrogen 3.152 N/A PHE 203.A N SER 200.A OG no hydrogen 3.285 N/A ALA 204.A N SER 200.A O no hydrogen 3.055 N/A LEU 206.A N PHE 203.A O no hydrogen 3.094 N/A SER 207.A OG HIS 210.A ND1 no hydrogen 2.697 N/A HIS 210.A N SER 207.A O no hydrogen 3.112 N/A HIS 210.A ND1 SER 207.A OG no hydrogen 2.697 N/A HIS 210.A NE2 GLU 147.A OE1 no hydrogen 2.592 N/A GLU 212.A N PHE 208.A O no hydrogen 3.113 N/A VAL 213.A N GLN 209.A O no hydrogen 2.771 N/A PHE 214.A N HIS 210.A O no hydrogen 2.955 N/A GLY 215.A N ARG 211.A O no hydrogen 3.160 N/A GLN 216.A N GLU 212.A O no hydrogen 3.086 N/A VAL 217.A N VAL 213.A O no hydrogen 2.831 N/A GLY 218.A N VAL 213.A O no hydrogen 3.153 N/A GLY 220.A N VAL 217.A O no hydrogen 3.073 N/A GLY 222.A N VAL 217.A O no hydrogen 3.027 N/A TRP 224.A N GLY 215.A O no hydrogen 3.045 N/A ASP 225.A N GLY 215.A O no hydrogen 2.861 N/A ASP 227.A N TRP 224.A O no hydrogen 2.875 N/A PHE 228.A N ASP 225.A O no hydrogen 3.349 N/A ASN 230.A N ASP 227.A O no hydrogen 2.916 N/A SER 231.A N ALA 456.A O no hydrogen 2.883 N/A SER 231.A OG ASP 189.A O no hydrogen 3.265 N/A MET 232.A N ARG 191.A O no hydrogen 2.866 N/A LEU 233.A N SER 231.A OG no hydrogen 3.202 N/A GLU 234.A N SER 231.A O no hydrogen 3.043 N/A PHE 236.A N MET 232.A O no hydrogen 3.008 N/A ARG 237.A N LEU 233.A O no hydrogen 3.093 N/A ARG 237.A NE ASP 10.A OD2 no hydrogen 2.696 N/A ARG 237.A NH2 ASP 10.A OD1 no hydrogen 2.925 N/A VAL 238.A N GLU 234.A O no hydrogen 3.123 N/A VAL 239.A N ILE 235.A O no hydrogen 3.045 N/A MET 240.A N PHE 236.A O no hydrogen 2.774 N/A THR 241.A N ARG 237.A O no hydrogen 3.258 N/A THR 241.A OG1 ARG 237.A O no hydrogen 2.769 N/A ASN 242.A N VAL 239.A O no hydrogen 3.231 N/A CYS 243.A N VAL 238.A O no hydrogen 2.928 N/A CYS 243.A SG THR 241.A OG1 no hydrogen 3.387 N/A ASP 244.A N ASP 244.A OD1 no hydrogen 2.627 N/A ASP 245.A N ASN 242.A O no hydrogen 3.449 N/A HIS 246.A ND1 ASP 245.A OD2 no hydrogen 2.224 N/A GLN 247.A NE2 CYS 243.A O no hydrogen 2.902 N/A HIS 248.A N PHE 92.A O no hydrogen 3.021 N/A HIS 248.A ND1 THR 110.A OG1 no hydrogen 2.917 N/A LEU 249.A N LYS 111.A O no hydrogen 2.758 N/A VAL 251.A N GLU 109.A O no hydrogen 2.900 N/A GLY 253.A N VAL 250.A O no hydrogen 3.019 N/A VAL 254.A N GLU 86.A OE2 no hydrogen 2.746 N/A GLU 255.A N SER 74.A OG no hydrogen 2.972 N/A GLN 256.A N GLY 253.A O no hydrogen 3.128 N/A VAL 257.A N VAL 254.A O no hydrogen 2.789 N/A GLN 259.A N GLU 255.A O no hydrogen 3.078 N/A GLN 259.A NE2 GLU 255.A OE2 no hydrogen 2.918 N/A GLY 260.A N GLN 256.A O no hydrogen 2.812 N/A ILE 261.A N VAL 257.A O no hydrogen 2.879 N/A TRP 262.A N PRO 258.A O no hydrogen 3.022 N/A TRP 262.A NE1 GLY 284.A O no hydrogen 3.251 N/A ARG 263.A N GLY 260.A O no hydrogen 3.109 N/A ARG 263.A NH1 GLN 259.A O no hydrogen 3.000 N/A ARG 263.A NH1 GLN 259.A OE1 no hydrogen 2.979 N/A HIS 264.A N ILE 261.A O no hydrogen 3.424 N/A HIS 264.A ND1 TYR 51.A OH no hydrogen 3.271 N/A ARG 268.A NH1 PRO 22.A O no hydrogen 2.648 N/A CYS 269.A SG MET 54.A O no hydrogen 3.784 N/A CYS 269.A SG ALA 270.A O no hydrogen 3.953 N/A ALA 270.A N LYS 55.A O no hydrogen 2.827 N/A TRP 272.A N ALA 270.A O no hydrogen 2.724 N/A TRP 272.A NE1 LEU 58.A O no hydrogen 2.981 N/A THR 276.A N PRO 273.A O no hydrogen 3.126 N/A THR 276.A OG1 PRO 273.A O no hydrogen 2.780 N/A SER 277.A N SER 280.A OG no hydrogen 2.924 N/A SER 279.A N TRP 262.A O no hydrogen 2.851 N/A SER 280.A N SER 277.A OG no hydrogen 2.994 N/A SER 280.A OG SER 277.A O no hydrogen 3.276 N/A LEU 281.A N SER 277.A O no hydrogen 3.044 N/A HIS 282.A N LEU 278.A O no hydrogen 3.105 N/A HIS 282.A N SER 279.A O no hydrogen 3.220 N/A HIS 282.A ND1 LEU 278.A O no hydrogen 2.593 N/A GLY 283.A N SER 280.A O no hydrogen 2.970 N/A GLY 284.A N SER 279.A O no hydrogen 2.856 N/A ARG 287.A N VAL 62.A O no hydrogen 2.822 N/A GLY 289.A N THR 288.A OG1 no hydrogen 2.851 N/A LYS 291.A N THR 304.A O no hydrogen 2.822 N/A ARG 292.A N THR 304.A O no hydrogen 3.232 N/A ILE 293.A N ASP 330.A O no hydrogen 2.987 N/A ALA 294.A N ALA 302.A O no hydrogen 3.053 N/A ARG 295.A N GLU 332.A OE1 no hydrogen 2.478 N/A ARG 295.A NH1 GLY 299.A O no hydrogen 3.032 N/A ARG 295.A NH2 GLU 479.A O no hydrogen 2.911 N/A ARG 295.A NH2 ARG 481.A O no hydrogen 3.018 N/A ALA 296.A N ARG 300.A O no hydrogen 2.759 N/A GLY 299.A N ALA 296.A O no hydrogen 2.977 N/A ARG 300.A N ASP 298.A OD1 no hydrogen 2.829 N/A LEU 301.A N TYR 313.A O no hydrogen 2.912 N/A ALA 302.A N ALA 294.A O no hydrogen 2.870 N/A VAL 303.A N ARG 311.A O no hydrogen 2.736 N/A THR 304.A N ARG 292.A O no hydrogen 2.939 N/A ASP 305.A N ASP 309.A O no hydrogen 2.967 N/A ASN 306.A N GLY 289.A O no hydrogen 2.772 N/A TRP 307.A N ASP 305.A OD1 no hydrogen 2.879 N/A GLY 308.A N ASP 305.A O no hydrogen 2.923 N/A ASP 309.A N ASP 305.A OD1 no hydrogen 3.118 N/A CYS 310.A SG THR 304.A OG1 no hydrogen 3.547 N/A ARG 311.A N VAL 303.A O no hydrogen 2.939 N/A ARG 311.A NE ASP 309.A OD2 no hydrogen 2.906 N/A HIS 312.A ND1 ASP 298.A OD2 no hydrogen 2.738 N/A TYR 313.A N LEU 301.A O no hydrogen 2.777 N/A TYR 313.A OH TYR 63.A OH no hydrogen 2.457 N/A VAL 316.A N GLY 482.A O no hydrogen 2.977 N/A LEU 317.A N ALA 38.A O no hydrogen 2.674 N/A THR 318.A N PHE 484.A O no hydrogen 2.813 N/A THR 318.A OG1 PHE 484.A O no hydrogen 3.564 N/A THR 319.A N VAL 40.A O no hydrogen 2.870 N/A THR 319.A OG1 VAL 40.A O no hydrogen 2.859 N/A THR 319.A OG1 GLY 41.A O no hydrogen 3.537 N/A CYS 320.A SG GLN 321.A O no hydrogen 3.854 N/A GLN 321.A NE2 GLY 451.A O no hydrogen 3.173 N/A SER 322.A N ASP 489.A OD2 no hydrogen 2.892 N/A TRP 323.A N TYR 349.A OH no hydrogen 3.413 N/A TRP 323.A NE1 ASP 345.A O no hydrogen 3.119 N/A LEU 324.A N GLN 321.A O no hydrogen 3.100 N/A LEU 325.A N SER 322.A O no hydrogen 3.123 N/A THR 326.A N TRP 323.A O no hydrogen 3.017 N/A THR 326.A OG1 TRP 323.A O no hydrogen 2.750 N/A THR 327.A N LEU 324.A O no hydrogen 3.220 N/A GLN 328.A N THR 327.A OG1 no hydrogen 2.633 N/A ILE 329.A N LEU 324.A O no hydrogen 2.839 N/A ASP 330.A N LYS 291.A O no hydrogen 2.912 N/A GLU 332.A N ILE 293.A O no hydrogen 3.020 N/A SER 334.A OG GLU 332.A OE2 no hydrogen 2.834 N/A LEU 335.A N GLU 332.A O no hydrogen 2.963 N/A PHE 336.A N GLU 333.A O no hydrogen 3.410 N/A MET 340.A N SER 337.A OG no hydrogen 3.007 N/A TRP 341.A N SER 337.A O no hydrogen 2.860 N/A TRP 341.A NE1 GLU 333.A O no hydrogen 2.907 N/A MET 342.A N GLN 338.A O no hydrogen 3.050 N/A ALA 343.A N LYS 339.A O no hydrogen 3.033 N/A LEU 344.A N MET 340.A O no hydrogen 2.878 N/A ASP 345.A N TRP 341.A O no hydrogen 2.844 N/A ARG 346.A N ALA 343.A O no hydrogen 3.127 N/A ARG 346.A NE TYR 463.A OH no hydrogen 3.358 N/A ARG 348.A NH1 ASP 345.A O no hydrogen 2.878 N/A ARG 348.A NH1 THR 347.A O no hydrogen 2.845 N/A TYR 349.A OH ASP 489.A OD2 no hydrogen 2.768 N/A MET 350.A N PHE 453.A O no hydrogen 2.850 N/A GLN 351.A NE2 LEU 450.A O no hydrogen 2.869 N/A SER 352.A N GLU 444.A OE1 no hydrogen 3.214 N/A SER 353.A N ALA 406.A O no hydrogen 3.037 N/A SER 353.A OG ILE 441.A O no hydrogen 3.331 N/A SER 353.A OG SER 442.A OG no hydrogen 3.386 N/A LYS 354.A N ILE 441.A O no hydrogen 3.325 N/A LYS 354.A NZ GLY 88.A O no hydrogen 2.639 N/A THR 355.A N SER 404.A O no hydrogen 3.021 N/A THR 355.A OG1 THR 440.A OG1 no hydrogen 2.802 N/A PHE 356.A N ILE 439.A O no hydrogen 2.829 N/A VAL 357.A N ILE 401.A O no hydrogen 2.964 N/A VAL 359.A N GLY 399.A O no hydrogen 2.946 N/A ASP 360.A N HIS 433.A O no hydrogen 2.939 N/A ARG 361.A NH1 ASP 366.A OD1 no hydrogen 3.372 N/A ARG 361.A NH2 ASP 366.A OD2 no hydrogen 3.028 N/A PHE 363.A N ARG 361.A O no hydrogen 2.780 N/A LYS 365.A N PRO 362.A O no hydrogen 3.281 N/A LYS 365.A NZ ASP 392.A OD2 no hydrogen 2.812 N/A LYS 365.A NZ ASP 395.A OD1 no hydrogen 3.189 N/A ASP 366.A N PHE 363.A O no hydrogen 2.963 N/A LYS 367.A NZ ASP 374.A OD1 no hydrogen 2.655 N/A ASP 368.A N ARG 373.A O no hydrogen 2.964 N/A GLY 372.A N ASP 368.A O no hydrogen 3.039 N/A ARG 373.A N THR 371.A OG1 no hydrogen 3.049 N/A ASP 374.A N TYR 134.A OH no hydrogen 2.998 N/A LEU 375.A N ASP 366.A O no hydrogen 2.995 N/A MET 376.A N TRP 364.A O no hydrogen 3.501 N/A SER 377.A N TYR 425.A OH no hydrogen 3.052 N/A SER 377.A OG SER 123.A OG no hydrogen 2.101 N/A MET 378.A N SER 123.A O no hydrogen 3.215 N/A THR 379.A N THR 388.A O no hydrogen 3.058 N/A THR 379.A OG1 SER 377.A O no hydrogen 2.550 N/A THR 379.A OG1 TYR 425.A OH no hydrogen 2.603 N/A LEU 380.A N VAL 125.A O no hydrogen 2.784 N/A THR 381.A N ARG 386.A O no hydrogen 2.964 N/A THR 381.A OG1 ASP 127.A O no hydrogen 2.923 N/A THR 381.A OG1 ASP 127.A OD2 no hydrogen 3.485 N/A THR 381.A OG1 ASP 382.A OD1 no hydrogen 3.534 N/A ASP 382.A N ASP 127.A O no hydrogen 3.163 N/A ARG 383.A N THR 381.A OG1 no hydrogen 3.086 N/A ARG 383.A NE ASP 127.A OD2 no hydrogen 2.990 N/A ARG 386.A NE THR 381.A O no hydrogen 3.210 N/A ARG 386.A NH1 ASP 225.A OD1 no hydrogen 3.453 N/A ARG 386.A NH1 ASP 225.A OD2 no hydrogen 2.945 N/A ARG 386.A NH2 GLN 216.A O no hydrogen 2.985 N/A ARG 386.A NH2 ASP 225.A OD1 no hydrogen 3.207 N/A ARG 386.A NH2 ASP 225.A OD2 no hydrogen 3.548 N/A GLY 387.A N THR 385.A O no hydrogen 2.785 N/A THR 388.A N THR 379.A O no hydrogen 2.844 N/A THR 388.A OG1 LEU 403.A O no hydrogen 2.845 N/A TYR 389.A N CYS 402.A O no hydrogen 2.927 N/A PHE 391.A N VAL 400.A O no hydrogen 2.928 N/A ASN 393.A ND2 PRO 398.A O no hydrogen 2.862 N/A GLY 394.A N ASP 392.A OD1 no hydrogen 2.729 N/A ASP 396.A N ASP 396.A OD1 no hydrogen 2.466 N/A LYS 397.A N GLY 394.A O no hydrogen 3.242 N/A GLY 399.A N VAL 359.A O no hydrogen 3.028 N/A VAL 400.A N PHE 391.A O no hydrogen 3.195 N/A ILE 401.A N VAL 357.A O no hydrogen 2.749 N/A CYS 402.A N TYR 389.A O no hydrogen 2.917 N/A CYS 402.A SG SER 404.A O no hydrogen 3.716 N/A LEU 403.A N THR 355.A O no hydrogen 2.797 N/A SER 404.A OG THR 385.A O no hydrogen 3.029 N/A TYR 405.A N GLY 387.A O no hydrogen 3.092 N/A ALA 406.A N SER 353.A O no hydrogen 2.981 N/A GLU 411.A N GLU 411.A OE1 no hydrogen 2.891 N/A ARG 413.A N PRO 409.A O no hydrogen 3.022 N/A ARG 413.A NH1 THR 440.A OG1 no hydrogen 3.046 N/A ARG 413.A NH1 SER 442.A OG no hydrogen 2.938 N/A ARG 413.A NH2 SER 442.A OG no hydrogen 3.067 N/A VAL 414.A N VAL 410.A O no hydrogen 2.858 N/A GLN 415.A N GLU 411.A O no hydrogen 2.948 N/A LEU 416.A N LYS 412.A O no hydrogen 2.867 N/A ALA 417.A N ARG 413.A O no hydrogen 3.171 N/A LEU 418.A N VAL 414.A O no hydrogen 2.895 N/A ASP 419.A N GLN 415.A O no hydrogen 2.910 N/A ALA 420.A N LEU 416.A O no hydrogen 3.188 N/A LEU 421.A N ALA 417.A O no hydrogen 2.817 N/A LYS 422.A N LEU 418.A O no hydrogen 2.897 N/A LYS 423.A N ASP 419.A O no hydrogen 3.228 N/A ILE 424.A N ALA 420.A O no hydrogen 3.202 N/A TYR 425.A N LEU 421.A O no hydrogen 2.687 N/A TYR 425.A OH THR 379.A OG1 no hydrogen 2.603 N/A THR 428.A N TYR 425.A O no hydrogen 3.200 N/A THR 428.A OG1 LEU 375.A O no hydrogen 2.744 N/A GLY 432.A N ASP 429.A OD1 no hydrogen 3.054 N/A HIS 433.A N ILE 430.A O no hydrogen 2.813 N/A HIS 433.A ND1 ASP 360.A OD1 no hydrogen 2.974 N/A ILE 434.A N ALA 431.A O no hydrogen 3.028 N/A ILE 435.A N MET 358.A O no hydrogen 3.006 N/A ILE 439.A N PHE 356.A O no hydrogen 2.949 N/A THR 440.A OG1 LYS 354.A O no hydrogen 3.157 N/A THR 440.A OG1 THR 355.A OG1 no hydrogen 2.802 N/A ILE 441.A N LYS 354.A O no hydrogen 3.084 N/A SER 442.A OG SER 353.A OG no hydrogen 3.386 N/A TRP 443.A NE1 LEU 87.A O no hydrogen 2.803 N/A ALA 445.A N SER 442.A O no hydrogen 3.398 N/A ASP 446.A N TRP 443.A O no hydrogen 3.391 N/A HIS 448.A N ASP 446.A OD1 no hydrogen 2.942 N/A LEU 450.A N GLN 321.A OE1 no hydrogen 2.860 N/A ALA 452.A N MET 350.A O no hydrogen 2.955 N/A LYS 454.A NZ ASN 464.A OD1 no hydrogen 3.159 N/A LYS 454.A NZ ASP 489.A O no hydrogen 3.185 N/A GLY 455.A N ARG 348.A O no hydrogen 3.092 N/A ALA 456.A N GLU 234.A OE1 no hydrogen 2.981 N/A GLY 459.A N ASP 189.A O no hydrogen 2.874 N/A HIS 460.A N LEU 457.A O no hydrogen 3.099 N/A TYR 461.A N ASP 189.A OD1 no hydrogen 2.978 N/A TYR 461.A OH ILE 536.A O no hydrogen 2.589 N/A ARG 462.A NE ALA 539.A O no hydrogen 3.427 N/A ARG 462.A NH2 ALA 539.A O no hydrogen 2.841 N/A ASN 464.A N HIS 460.A O no hydrogen 3.025 N/A GLN 465.A N TYR 461.A O no hydrogen 2.793 N/A ARG 466.A N ARG 462.A O no hydrogen 3.106 N/A MET 467.A N TYR 463.A O no hydrogen 3.006 N/A TYR 468.A N ASN 464.A O no hydrogen 2.908 N/A ALA 469.A N GLN 465.A O no hydrogen 3.169 N/A HIS 470.A N MET 467.A O no hydrogen 3.161 N/A MET 472.A N ALA 469.A O no hydrogen 2.912 N/A GLN 473.A NE2 HIS 470.A O no hydrogen 3.209 N/A GLN 473.A NE2 ILE 483.A O no hydrogen 2.868 N/A MET 476.A N GLN 473.A O no hydrogen 3.257 N/A GLN 480.A N PRO 477.A O no hydrogen 2.727 N/A GLN 480.A NE2 GLU 479.A OE2 no hydrogen 3.061 N/A ARG 481.A N VAL 478.A O no hydrogen 3.098 N/A GLY 482.A N GLN 473.A OE1 no hydrogen 2.963 N/A PHE 484.A N VAL 316.A O no hydrogen 2.893 N/A ALA 486.A N THR 318.A O no hydrogen 3.006 N/A GLY 487.A N THR 503.A OG1 no hydrogen 2.854 N/A VAL 490.A N GLY 487.A O no hydrogen 3.044 N/A SER 491.A N ASP 488.A O no hydrogen 3.020 N/A SER 491.A OG ASP 488.A O no hydrogen 2.846 N/A THR 493.A N SER 491.A OG no hydrogen 3.173 N/A TRP 496.A N THR 493.A O no hydrogen 3.155 N/A GLY 499.A N TRP 496.A O no hydrogen 3.095 N/A VAL 501.A N VAL 497.A O no hydrogen 2.981 N/A GLN 502.A N GLU 498.A O no hydrogen 2.796 N/A GLN 502.A NE2 ILE 6.A O no hydrogen 2.973 N/A GLN 502.A NE2 GLU 498.A OE2 no hydrogen 3.122 N/A THR 503.A N GLY 499.A O no hydrogen 3.115 N/A THR 503.A OG1 GLY 487.A O no hydrogen 3.094 N/A THR 503.A OG1 GLY 499.A O no hydrogen 2.885 N/A THR 503.A OG1 ALA 500.A O no hydrogen 3.260 N/A SER 504.A N ALA 500.A O no hydrogen 3.153 N/A SER 504.A OG ALA 45.A O no hydrogen 2.776 N/A LEU 505.A N VAL 501.A O no hydrogen 2.910 N/A ASN 506.A N GLN 502.A O no hydrogen 2.920 N/A ASN 506.A ND2 TYR 468.A OH no hydrogen 3.153 N/A ALA 507.A N THR 503.A O no hydrogen 2.949 N/A VAL 508.A N SER 504.A O no hydrogen 2.846 N/A TRP 509.A N LEU 505.A O no hydrogen 3.042 N/A TRP 509.A NE1 ASP 528.A OD2 no hydrogen 3.112 N/A GLY 510.A N ASN 506.A O no hydrogen 2.893 N/A ILE 511.A N ALA 507.A O no hydrogen 2.683 N/A MET 512.A N VAL 508.A O no hydrogen 2.735 N/A ASN 513.A N TRP 509.A O no hydrogen 2.901 N/A HIS 514.A N GLY 510.A O no hydrogen 2.851 N/A PHE 515.A N ILE 511.A O no hydrogen 2.973 N/A GLY 516.A N ASN 513.A O no hydrogen 2.889 N/A GLY 517.A N MET 512.A O no hydrogen 2.746 N/A LYS 518.A N SER 27.A O no hydrogen 3.056 N/A THR 519.A OG1 ASP 528.A OD2 no hydrogen 2.775 N/A ASN 523.A N HIS 520.A O no hydrogen 3.019 N/A ASN 523.A ND2 TRP 18.A O no hydrogen 2.970 N/A ASN 523.A ND2 GLY 24.A O no hydrogen 2.877 N/A GLY 525.A N ASP 528.A OD2 no hydrogen 2.746 N/A ASP 528.A N GLY 525.A O no hydrogen 3.049 N/A VAL 529.A N PRO 526.A O no hydrogen 3.244 N/A ILE 533.A N VAL 529.A O no hydrogen 3.093 N/A GLY 534.A N PHE 530.A O no hydrogen 2.740 N/A