Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4hdh_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LYS 5.A N SER 1.A O no hydrogen 3.162 N/A ILE 6.A N ASN 2.A O no hydrogen 3.192 N/A ILE 6.A N GLN 3.A O no hydrogen 3.263 N/A LYS 7.A NZ GLU 4.A OE1 no hydrogen 3.193 N/A ARG 9.A NH1 CYS 175.A O no hydrogen 3.264 N/A ARG 9.A NH1 LEU 296.A O no hydrogen 2.928 N/A ARG 9.A NH1 HIS 300.A O no hydrogen 3.349 N/A ARG 9.A NH2 LYS 5.A O no hydrogen 3.028 N/A ARG 9.A NH2 LEU 296.A O no hydrogen 2.932 N/A ARG 9.A NH2 HIS 300.A O no hydrogen 3.205 N/A ILE 10.A N ILE 6.A O no hydrogen 3.087 N/A GLN 11.A N LYS 7.A O no hydrogen 2.821 N/A LYS 12.A N LYS 8.A O no hydrogen 2.945 N/A LEU 13.A N ARG 9.A O no hydrogen 3.337 N/A LYS 14.A N ILE 10.A O no hydrogen 2.790 N/A GLU 15.A N GLN 11.A O no hydrogen 3.050 N/A GLU 16.A N LYS 12.A O no hydrogen 2.994 N/A PHE 17.A N LEU 13.A O no hydrogen 3.108 N/A ALA 18.A N GLU 15.A O no hydrogen 3.273 N/A THR 20.A N PHE 17.A O no hydrogen 3.064 N/A TRP 21.A N PHE 17.A O no hydrogen 3.052 N/A HIS 22.A N SER 37.A O no hydrogen 2.885 N/A HIS 22.A ND1 THR 20.A O no hydrogen 2.819 N/A TYR 29.A N HIS 27.A ND1 no hydrogen 3.103 N/A TYR 29.A OH ASP 317.A OD2 no hydrogen 2.639 N/A ARG 30.A N ASP 85.A OD1 no hydrogen 3.356 N/A ARG 30.A N ASP 85.A OD2 no hydrogen 3.013 N/A THR 31.A N ASP 85.A OD1 no hydrogen 2.820 N/A THR 31.A OG1 ASP 85.A OD1 no hydrogen 2.637 N/A TRP 32.A NE1 VAL 84.A O no hydrogen 3.026 N/A THR 33.A N SER 320.A O no hydrogen 2.765 N/A TYR 34.A OH SER 37.A OG no hydrogen 2.552 N/A HIS 35.A N VAL 318.A O no hydrogen 2.889 N/A HIS 35.A NE2 SER 320.A OG no hydrogen 2.712 N/A SER 37.A N HIS 22.A O no hydrogen 2.870 N/A SER 37.A OG TYR 34.A OH no hydrogen 2.552 N/A SER 37.A OG ASP 317.A OD1 no hydrogen 2.959 N/A TYR 38.A N MET 316.A O no hydrogen 3.125 N/A GLU 39.A N THR 20.A OG1 no hydrogen 3.096 N/A VAL 40.A N THR 314.A O no hydrogen 3.065 N/A THR 43.A OG1 THR 71.A O no hydrogen 2.669 N/A ASN 47.A N ARG 467.A O no hydrogen 2.736 N/A ASN 47.A ND2 THR 479.A O no hydrogen 3.019 N/A VAL 50.A N ASN 47.A OD1 no hydrogen 3.190 N/A LYS 51.A N ASN 47.A O no hydrogen 2.860 N/A LEU 52.A N GLY 48.A O no hydrogen 2.948 N/A MET 53.A N VAL 49.A O no hydrogen 3.114 N/A MET 53.A N VAL 50.A O no hydrogen 2.974 N/A SER 54.A N LYS 51.A O no hydrogen 2.878 N/A SER 54.A OG VAL 50.A O no hydrogen 2.676 N/A SER 54.A OG LYS 51.A O no hydrogen 3.261 N/A TRP 57.A N SER 54.A O no hydrogen 2.818 N/A ASP 58.A N LYS 55.A O no hydrogen 3.063 N/A ALA 59.A N PRO 56.A O no hydrogen 3.130 N/A ILE 60.A N TRP 57.A O no hydrogen 3.230 N/A ASN 62.A ND2 ASP 460.A OD2 no hydrogen 3.528 N/A VAL 63.A N ILE 60.A O no hydrogen 2.963 N/A THR 64.A N ILE 60.A O no hydrogen 3.011 N/A THR 65.A N ALA 61.A O no hydrogen 3.101 N/A THR 65.A OG1 ALA 61.A O no hydrogen 2.722 N/A MET 66.A N VAL 63.A O no hydrogen 3.473 N/A ASP 70.A N LYS 182.A O no hydrogen 2.914 N/A THR 72.A N ASP 70.A OD1 no hydrogen 3.188 N/A THR 72.A OG1 ASP 70.A OD1 no hydrogen 2.663 N/A GLY 75.A N THR 72.A OG1 no hydrogen 3.052 N/A GLN 76.A N THR 72.A O no hydrogen 2.906 N/A GLN 76.A NE2 THR 71.A O no hydrogen 3.163 N/A GLN 76.A NE2 THR 72.A O no hydrogen 3.644 N/A GLN 77.A N PRO 73.A O no hydrogen 2.851 N/A GLN 77.A NE2 TYR 29.A OH no hydrogen 3.045 N/A GLN 77.A NE2 MET 306.A O no hydrogen 2.759 N/A ARG 78.A N PHE 74.A O no hydrogen 2.969 N/A ARG 78.A NH2 ASP 70.A OD2 no hydrogen 3.305 N/A VAL 79.A N GLY 75.A O no hydrogen 2.932 N/A PHE 80.A N GLN 76.A O no hydrogen 2.813 N/A LYS 81.A N GLN 77.A O no hydrogen 2.839 N/A GLU 82.A N ARG 78.A O no hydrogen 2.946 N/A LYS 83.A N VAL 79.A O no hydrogen 2.936 N/A LYS 83.A NZ SER 196.A O no hydrogen 3.123 N/A LYS 83.A NZ SER 196.A OG no hydrogen 3.075 N/A VAL 84.A N PHE 80.A O no hydrogen 2.887 N/A ASP 85.A N PHE 80.A O no hydrogen 2.787 N/A GLY 94.A N GLU 361.A O no hydrogen 3.195 N/A VAL 95.A N LEU 360.A O no hydrogen 3.300 N/A ARG 96.A N PRO 92.A O no hydrogen 3.074 N/A GLU 97.A N ALA 93.A O no hydrogen 3.007 N/A GLU 97.A N GLY 94.A O no hydrogen 2.912 N/A VAL 98.A N GLY 94.A O no hydrogen 2.938 N/A LEU 99.A N VAL 95.A O no hydrogen 2.870 N/A ASN 100.A N ARG 96.A O no hydrogen 2.808 N/A GLU 101.A N GLU 97.A O no hydrogen 3.082 N/A THR 102.A N VAL 98.A O no hydrogen 2.959 N/A THR 102.A OG1 VAL 98.A O no hydrogen 2.525 N/A THR 103.A N LEU 99.A O no hydrogen 2.816 N/A THR 103.A OG1 LEU 99.A O no hydrogen 2.672 N/A THR 103.A OG1 ASN 100.A O no hydrogen 3.257 N/A ASN 104.A N ASN 100.A O no hydrogen 2.948 N/A TRP 105.A N GLU 101.A O no hydrogen 3.002 N/A LEU 106.A N THR 102.A O no hydrogen 3.035 N/A TRP 107.A N THR 103.A O no hydrogen 2.893 N/A TRP 107.A NE1 ASN 274.A O no hydrogen 3.058 N/A ALA 108.A N ASN 104.A O no hydrogen 3.026 N/A HIS 109.A N TRP 105.A O no hydrogen 2.863 N/A LEU 110.A N LEU 106.A O no hydrogen 2.799 N/A SER 111.A N TRP 107.A O no hydrogen 3.022 N/A SER 111.A OG TRP 107.A O no hydrogen 2.777 N/A SER 111.A OG ALA 108.A O no hydrogen 3.541 N/A ARG 112.A N HIS 109.A O no hydrogen 3.246 N/A ARG 112.A NH1 HIS 109.A O no hydrogen 2.878 N/A ARG 112.A NH1 ASN 227.A O no hydrogen 2.768 N/A ARG 112.A NH2 GLU 226.A O no hydrogen 3.291 N/A LYS 114.A NZ ASP 220.A O no hydrogen 2.747 N/A ARG 117.A NE ASP 220.A OD1 no hydrogen 3.444 N/A ARG 117.A NE ASP 220.A OD2 no hydrogen 2.721 N/A ARG 117.A NH1 LEU 118.A O no hydrogen 2.834 N/A ARG 117.A NH1 GLU 123.A OE2 no hydrogen 2.851 N/A ARG 117.A NH2 GLU 123.A OE1 no hydrogen 2.796 N/A ARG 117.A NH2 ASP 220.A OD1 no hydrogen 2.990 N/A CYS 119.A N GLU 212.A O no hydrogen 3.096 N/A THR 120.A N GLU 123.A OE2 no hydrogen 3.265 N/A THR 120.A OG1 GLU 122.A OE1 no hydrogen 3.554 N/A GLU 123.A N THR 120.A OG1 no hydrogen 3.164 N/A PHE 124.A N THR 120.A O no hydrogen 2.864 N/A ILE 125.A N LYS 121.A O no hydrogen 2.855 N/A LYS 126.A N GLU 122.A O no hydrogen 3.022 N/A LYS 127.A N GLU 123.A O no hydrogen 2.834 N/A VAL 128.A N PHE 124.A O no hydrogen 2.719 N/A ASN 129.A N ILE 125.A O no hydrogen 2.880 N/A SER 130.A N VAL 128.A O no hydrogen 2.834 N/A SER 130.A OG LYS 127.A O no hydrogen 3.248 N/A GLU 140.A N MET 202.A O no hydrogen 3.460 N/A GLN 143.A N GLN 141.A O no hydrogen 3.023 N/A TRP 144.A NE1 ASP 153.A OD2 no hydrogen 2.806 N/A SER 145.A N GLN 141.A O no hydrogen 3.154 N/A SER 145.A OG TRP 144.A O no hydrogen 2.551 N/A GLU 149.A N THR 146.A OG1 no hydrogen 3.385 N/A ALA 150.A N THR 146.A O no hydrogen 3.421 N/A VAL 151.A N ALA 147.A O no hydrogen 2.871 N/A ASN 152.A N ARG 148.A O no hydrogen 3.191 N/A ASN 152.A N GLU 149.A O no hydrogen 3.143 N/A ASP 153.A N ALA 150.A O no hydrogen 3.149 N/A ARG 155.A N ASP 153.A OD1 no hydrogen 2.895 N/A TRP 157.A NE1 VAL 151.A O no hydrogen 2.596 N/A GLU 158.A N PRO 154.A O no hydrogen 3.011 N/A GLU 158.A N ARG 155.A O no hydrogen 3.060 N/A MET 159.A N ARG 155.A O no hydrogen 3.017 N/A VAL 160.A N PHE 156.A O no hydrogen 2.906 N/A ASP 161.A N TRP 157.A O no hydrogen 2.919 N/A GLU 162.A N GLU 158.A O no hydrogen 3.056 N/A GLU 163.A N MET 159.A O no hydrogen 3.074 N/A ARG 164.A N VAL 160.A O no hydrogen 2.822 N/A ARG 164.A NE GLU 212.A OE1 no hydrogen 3.447 N/A ARG 164.A NE GLU 212.A OE2 no hydrogen 2.792 N/A ARG 164.A NH2 GLU 285.A OE1 no hydrogen 3.165 N/A GLU 165.A N ASP 161.A O no hydrogen 2.777 N/A ASN 166.A N GLU 162.A O no hydrogen 2.906 N/A HIS 167.A N GLU 163.A O no hydrogen 2.837 N/A LEU 168.A N ARG 164.A O no hydrogen 2.806 N/A ARG 169.A N GLU 165.A O no hydrogen 2.953 N/A GLY 170.A N HIS 167.A O no hydrogen 2.708 N/A GLU 171.A N ASN 166.A O no hydrogen 2.767 N/A CYS 172.A SG GLU 163.A OE2 no hydrogen 3.443 N/A CYS 172.A SG HIS 167.A NE2 no hydrogen 3.829 N/A HIS 173.A N GLU 163.A OE2 no hydrogen 2.679 N/A HIS 173.A NE2 GLU 171.A OE2 no hydrogen 2.939 N/A THR 174.A N GLU 163.A OE2 no hydrogen 3.309 N/A CYS 175.A SG GLU 163.A OE2 no hydrogen 3.742 N/A CYS 175.A SG HIS 167.A NE2 no hydrogen 3.436 N/A TYR 177.A N VAL 302.A O no hydrogen 2.859 N/A TYR 177.A OH THR 297.A O no hydrogen 3.232 N/A ASN 178.A N PHE 201.A O no hydrogen 2.804 N/A MET 179.A N LYS 304.A O no hydrogen 2.998 N/A MET 180.A N ILE 199.A O no hydrogen 2.747 N/A LYS 182.A N ASP 70.A O no hydrogen 2.903 N/A ARG 183.A N ARG 197.A O no hydrogen 2.725 N/A GLU 184.A N MET 68.A O no hydrogen 2.735 N/A LYS 186.A N LYS 194.A O no hydrogen 3.091 N/A GLY 191.A N ASP 418.A OD2 no hydrogen 2.679 N/A LYS 192.A N GLU 189.A O no hydrogen 2.824 N/A LYS 192.A NZ ALA 257.A O no hydrogen 2.717 N/A LYS 192.A NZ ASP 259.A OD1 no hydrogen 2.806 N/A ALA 193.A N GLU 189.A O no hydrogen 3.246 N/A LYS 194.A NZ ASP 259.A OD2 no hydrogen 3.152 N/A LYS 194.A NZ ASP 391.A OD2 no hydrogen 2.740 N/A LYS 194.A NZ ASP 392.A OD1 no hydrogen 2.733 N/A ARG 197.A N ARG 183.A O no hydrogen 2.917 N/A ILE 199.A N GLY 181.A O no hydrogen 2.959 N/A PHE 201.A N ASN 178.A O no hydrogen 2.780 N/A LEU 204.A N GLU 140.A O no hydrogen 2.815 N/A ALA 206.A N TRP 203.A O no hydrogen 2.865 N/A ARG 207.A N TRP 203.A O no hydrogen 3.234 N/A ARG 207.A NE VAL 137.A O no hydrogen 3.285 N/A ARG 207.A NH1 GLY 328.A O no hydrogen 2.471 N/A ARG 207.A NH2 VAL 137.A O no hydrogen 2.989 N/A ARG 207.A NH2 GLY 328.A O no hydrogen 2.693 N/A TYR 208.A N LEU 204.A O no hydrogen 2.851 N/A TYR 208.A OH GLU 212.A OE1 no hydrogen 2.795 N/A LEU 209.A N GLY 205.A O no hydrogen 3.010 N/A GLU 210.A N ALA 206.A O no hydrogen 3.033 N/A PHE 211.A N ARG 207.A O no hydrogen 2.927 N/A GLU 212.A N TYR 208.A O no hydrogen 2.755 N/A ALA 213.A N LEU 209.A O no hydrogen 3.079 N/A LEU 214.A N GLU 210.A O no hydrogen 2.906 N/A GLY 215.A N PHE 211.A O no hydrogen 2.781 N/A LEU 217.A N LEU 214.A O no hydrogen 3.206 N/A ASN 218.A N GLY 215.A O no hydrogen 2.938 N/A ASN 218.A ND2 VAL 330.A O no hydrogen 3.004 N/A GLU 219.A N GLY 215.A O no hydrogen 2.925 N/A ASP 220.A N PHE 216.A O no hydrogen 2.833 N/A HIS 221.A N ASN 218.A O no hydrogen 2.873 N/A HIS 221.A ND1 GLU 233.A OE1 no hydrogen 2.865 N/A TRP 222.A N LEU 217.A O no hydrogen 3.022 N/A SER 224.A N HIS 221.A O no hydrogen 3.294 N/A SER 224.A OG HIS 221.A O no hydrogen 3.108 N/A ARG 225.A NE GLY 231.A O no hydrogen 3.297 N/A ARG 225.A NH1 MET 386.A O no hydrogen 3.315 N/A ARG 225.A NH2 MET 386.A O no hydrogen 2.494 N/A ASN 227.A N SER 224.A OG no hydrogen 3.158 N/A ASN 227.A ND2 LEU 110.A O no hydrogen 2.920 N/A ASN 227.A ND2 TRP 222.A O no hydrogen 3.192 N/A SER 228.A N SER 224.A O no hydrogen 2.821 N/A SER 228.A OG LEU 223.A O no hydrogen 3.323 N/A SER 228.A OG SER 224.A O no hydrogen 3.001 N/A GLY 229.A N ARG 225.A O no hydrogen 2.669 N/A GLY 231.A N SER 228.A OG no hydrogen 2.949 N/A GLU 233.A N LEU 223.A O no hydrogen 3.231 N/A SER 235.A N VAL 232.A O no hydrogen 3.207 N/A SER 235.A OG VAL 232.A O no hydrogen 3.409 N/A VAL 237.A N HIS 526.A O no hydrogen 2.931 N/A GLN 238.A N GLN 238.A OE1 no hydrogen 2.752 N/A GLN 238.A NE2 GLU 530.A OE1 no hydrogen 2.951 N/A LYS 239.A N GLY 236.A O no hydrogen 2.906 N/A LYS 239.A NZ GLU 548.A O no hydrogen 3.326 N/A LYS 239.A NZ GLU 550.A OE2 no hydrogen 3.443 N/A LEU 240.A N VAL 237.A O no hydrogen 3.172 N/A ILE 243.A N LYS 239.A O no hydrogen 3.066 N/A LEU 244.A N LEU 240.A O no hydrogen 2.863 N/A ARG 245.A N GLY 241.A O no hydrogen 2.888 N/A ARG 245.A NE GLU 443.A OE1 no hydrogen 3.290 N/A ARG 245.A NH2 GLU 443.A OE1 no hydrogen 3.022 N/A ASP 246.A N TYR 242.A O no hydrogen 3.029 N/A ILE 247.A N ILE 243.A O no hydrogen 3.010 N/A ALA 248.A N LEU 244.A O no hydrogen 2.788 N/A GLY 249.A N ARG 245.A O no hydrogen 3.012 N/A GLY 249.A N ASP 246.A O no hydrogen 2.876 N/A LYS 250.A N ILE 247.A O no hydrogen 3.120 N/A GLY 253.A N PRO 397.A O no hydrogen 2.940 N/A LYS 254.A N ASP 400.A OD1 no hydrogen 2.915 N/A MET 255.A N TRP 428.A O no hydrogen 2.932 N/A TYR 256.A N VAL 395.A O no hydrogen 2.899 N/A TYR 256.A OH ASP 400.A OD1 no hydrogen 2.678 N/A ALA 261.A N VAL 415.A O no hydrogen 2.849 N/A TRP 263.A NE1 ASN 336.A OD1 no hydrogen 2.749 N/A THR 265.A N GLY 262.A O no hydrogen 3.047 N/A THR 265.A OG1 GLY 262.A O no hydrogen 2.974 N/A ARG 266.A N TRP 263.A O no hydrogen 2.939 N/A ARG 266.A NE ALA 261.A O no hydrogen 2.883 N/A ARG 266.A NH1 SER 413.A O no hydrogen 3.286 N/A THR 268.A N ASP 271.A OD2 no hydrogen 3.103 N/A ARG 269.A N GLU 90.A OE2 no hydrogen 2.881 N/A THR 270.A N GLU 90.A OE1 no hydrogen 2.878 N/A THR 270.A OG1 GLU 90.A OE1 no hydrogen 3.083 N/A ASP 271.A N THR 268.A OG1 no hydrogen 3.346 N/A LEU 272.A N THR 268.A O no hydrogen 3.098 N/A GLU 273.A N ARG 269.A O no hydrogen 2.831 N/A ASN 274.A N THR 270.A O no hydrogen 2.991 N/A GLU 275.A N ASP 271.A O no hydrogen 2.925 N/A ALA 276.A N LEU 272.A O no hydrogen 2.736 N/A LYS 277.A N ASN 274.A O no hydrogen 3.253 N/A LYS 277.A NZ ASN 100.A OD1 no hydrogen 2.748 N/A LYS 277.A NZ THR 103.A OG1 no hydrogen 2.918 N/A LYS 277.A NZ ASN 104.A OD1 no hydrogen 2.796 N/A LYS 277.A NZ ASN 274.A OD1 no hydrogen 3.257 N/A VAL 278.A N GLU 275.A O no hydrogen 3.143 N/A LEU 279.A N ALA 276.A O no hydrogen 2.941 N/A GLU 280.A N LYS 277.A O no hydrogen 2.932 N/A LEU 281.A N VAL 278.A O no hydrogen 3.009 N/A LEU 282.A N LEU 279.A O no hydrogen 2.979 N/A HIS 286.A NE2 ALA 213.A O no hydrogen 2.812 N/A ARG 287.A N ASP 283.A O no hydrogen 3.277 N/A MET 288.A N GLY 284.A O no hydrogen 3.213 N/A LEU 289.A N GLU 285.A O no hydrogen 2.858 N/A ALA 290.A N HIS 286.A O no hydrogen 2.911 N/A ARG 291.A N ARG 287.A O no hydrogen 2.762 N/A ALA 292.A N MET 288.A O no hydrogen 3.066 N/A ILE 293.A N LEU 289.A O no hydrogen 3.011 N/A ILE 294.A N ALA 290.A O no hydrogen 2.919 N/A GLU 295.A N ARG 291.A O no hydrogen 2.913 N/A LEU 296.A N ALA 292.A O no hydrogen 2.819 N/A THR 297.A N ILE 293.A O no hydrogen 2.947 N/A THR 297.A OG1 ILE 293.A O no hydrogen 2.659 N/A TYR 298.A N ILE 293.A O no hydrogen 3.018 N/A TYR 298.A N ILE 294.A O no hydrogen 3.208 N/A TYR 298.A OH GLU 210.A OE2 no hydrogen 2.230 N/A HIS 300.A N GLU 295.A O no hydrogen 3.374 N/A LYS 301.A N ARG 299.A O no hydrogen 3.119 N/A LYS 301.A N ARG 321.A O no hydrogen 3.150 N/A LYS 301.A NZ TYR 298.A O no hydrogen 2.715 N/A LYS 301.A NZ ASP 323.A OD1 no hydrogen 2.705 N/A VAL 303.A N ILE 319.A O no hydrogen 2.854 N/A LYS 304.A N TYR 177.A O no hydrogen 2.729 N/A VAL 305.A N ASP 317.A O no hydrogen 3.209 N/A MET 306.A N GLN 76.A OE1 no hydrogen 2.918 N/A ARG 307.A N VAL 315.A O no hydrogen 2.873 N/A ARG 307.A NE ASP 317.A OD2 no hydrogen 2.612 N/A ARG 307.A NH1 PRO 25.A O no hydrogen 3.448 N/A ARG 307.A NH2 ASP 317.A OD1 no hydrogen 2.924 N/A ARG 307.A NH2 ASP 317.A OD2 no hydrogen 3.420 N/A ALA 309.A N LYS 313.A O no hydrogen 2.732 N/A LYS 313.A NZ GLU 39.A OE1 no hydrogen 2.872 N/A VAL 315.A N ARG 307.A O no hydrogen 2.969 N/A MET 316.A N TYR 38.A O no hydrogen 2.752 N/A ASP 317.A N VAL 305.A O no hydrogen 2.803 N/A VAL 318.A N GLY 36.A O no hydrogen 2.948 N/A ILE 319.A N VAL 303.A O no hydrogen 2.987 N/A SER 320.A N THR 33.A O no hydrogen 2.883 N/A SER 320.A OG HIS 35.A NE2 no hydrogen 2.712 N/A ARG 321.A N LYS 301.A O no hydrogen 3.245 N/A ARG 321.A NE ASP 323.A OD2 no hydrogen 2.826 N/A ARG 321.A NH1 THR 31.A O no hydrogen 3.482 N/A ARG 321.A NH1 THR 86.A O no hydrogen 2.979 N/A ARG 321.A NH2 THR 86.A O no hydrogen 2.706 N/A ARG 321.A NH2 ASP 323.A OD2 no hydrogen 3.054 N/A ASP 323.A N ARG 299.A O no hydrogen 2.763 N/A ARG 325.A NE ASN 336.A OD1 no hydrogen 2.975 N/A ARG 325.A NH1 GLU 275.A OE1 no hydrogen 2.922 N/A ARG 325.A NH2 GLU 275.A OE1 no hydrogen 3.505 N/A ARG 325.A NH2 GLU 275.A OE2 no hydrogen 2.736 N/A ARG 325.A NH2 ASN 336.A OD1 no hydrogen 3.010 N/A GLN 329.A N THR 332.A OG1 no hydrogen 3.076 N/A VAL 330.A N GLU 210.A OE1 no hydrogen 3.036 N/A VAL 331.A N GLU 210.A OE2 no hydrogen 2.968 N/A THR 332.A N GLN 329.A O no hydrogen 3.125 N/A THR 332.A OG1 GLN 329.A O no hydrogen 3.173 N/A THR 332.A OG1 GLN 329.A OE1 no hydrogen 3.261 N/A TYR 333.A OH SER 389.A OG no hydrogen 2.623 N/A LEU 335.A N VAL 331.A O no hydrogen 2.964 N/A ASN 336.A N THR 332.A O no hydrogen 2.855 N/A ASN 336.A ND2 ASP 264.A OD1 no hydrogen 3.189 N/A THR 337.A N TYR 333.A O no hydrogen 2.930 N/A THR 337.A OG1 TYR 333.A O no hydrogen 2.743 N/A PHE 338.A N ALA 334.A O no hydrogen 2.884 N/A THR 339.A N LEU 335.A O no hydrogen 2.956 N/A THR 339.A OG1 GLU 275.A OE2 no hydrogen 2.695 N/A THR 339.A OG1 LEU 335.A O no hydrogen 3.522 N/A ASN 340.A N ASN 336.A O no hydrogen 2.974 N/A ASN 340.A ND2 GLY 390.A O no hydrogen 2.942 N/A ILE 341.A N THR 337.A O no hydrogen 2.867 N/A ALA 342.A N PHE 338.A O no hydrogen 3.031 N/A VAL 343.A N THR 339.A O no hydrogen 2.825 N/A GLN 344.A N ASN 340.A O no hydrogen 2.916 N/A GLN 344.A NE2 ASN 340.A OD1 no hydrogen 2.979 N/A LEU 345.A N ILE 341.A O no hydrogen 2.932 N/A VAL 346.A N ALA 342.A O no hydrogen 2.972 N/A ARG 347.A N VAL 343.A O no hydrogen 2.972 N/A ARG 347.A NE PHE 402.A O no hydrogen 3.251 N/A ARG 347.A NE ALA 405.A O no hydrogen 3.210 N/A ARG 347.A NH1 ASP 258.A OD2 no hydrogen 2.775 N/A ARG 347.A NH2 ASP 258.A OD2 no hydrogen 3.558 N/A ARG 347.A NH2 PHE 402.A O no hydrogen 2.842 N/A ARG 347.A NH2 SER 425.A OG no hydrogen 2.839 N/A LEU 348.A N GLN 344.A O no hydrogen 2.840 N/A MET 349.A N LEU 345.A O no hydrogen 2.988 N/A GLU 350.A N VAL 346.A O no hydrogen 3.031 N/A ALA 351.A N ARG 347.A O no hydrogen 2.813 N/A GLU 352.A N MET 349.A O no hydrogen 3.292 N/A GLY 353.A N GLU 350.A O no hydrogen 3.001 N/A VAL 354.A N MET 349.A O no hydrogen 2.931 N/A GLY 356.A N HIS 359.A ND1 no hydrogen 2.758 N/A HIS 359.A N GLY 356.A O no hydrogen 2.914 N/A ASN 367.A N PRO 364.A O no hydrogen 2.821 N/A ASN 367.A ND2 VAL 354.A O no hydrogen 3.266 N/A LYS 368.A N PRO 364.A O no hydrogen 3.078 N/A ILE 369.A N ARG 365.A O no hydrogen 2.993 N/A ALA 370.A N LYS 366.A O no hydrogen 3.034 N/A VAL 371.A N ASN 367.A O no hydrogen 2.748 N/A ARG 372.A N LYS 368.A O no hydrogen 2.944 N/A ARG 372.A NE GLU 101.A OE1 no hydrogen 3.015 N/A ARG 372.A NH2 GLU 101.A OE1 no hydrogen 3.190 N/A ARG 372.A NH2 GLU 101.A OE2 no hydrogen 2.717 N/A THR 373.A N ILE 369.A O no hydrogen 2.915 N/A THR 373.A OG1 ILE 369.A O no hydrogen 3.095 N/A TRP 374.A N ALA 370.A O no hydrogen 2.733 N/A TRP 374.A NE1 GLU 352.A OE1 no hydrogen 2.643 N/A LEU 375.A N VAL 371.A O no hydrogen 2.932 N/A PHE 376.A N ARG 372.A O no hydrogen 2.917 N/A GLU 377.A N THR 373.A O no hydrogen 2.852 N/A ASN 378.A N TRP 374.A O no hydrogen 2.704 N/A ASN 378.A ND2 TRP 374.A O no hydrogen 3.512 N/A GLY 379.A N LEU 375.A O no hydrogen 2.911 N/A GLU 381.A N ASN 378.A O no hydrogen 2.837 N/A ARG 382.A N ASN 378.A O no hydrogen 2.782 N/A ARG 382.A NE GLU 352.A OE2 no hydrogen 2.637 N/A ARG 382.A NH1 GLU 381.A OE1 no hydrogen 2.969 N/A ARG 382.A NH2 GLU 352.A OE1 no hydrogen 2.908 N/A ARG 382.A NH2 GLU 352.A OE2 no hydrogen 3.425 N/A VAL 383.A N GLY 379.A O no hydrogen 3.048 N/A THR 384.A N GLU 381.A O no hydrogen 3.087 N/A THR 384.A OG1 GLU 381.A O no hydrogen 2.835 N/A ARG 385.A N ARG 382.A O no hydrogen 2.779 N/A ARG 385.A NE LYS 396.A O no hydrogen 2.873 N/A ARG 385.A NH1 GLN 251.A O no hydrogen 3.551 N/A ARG 385.A NH1 GLU 381.A OE2 no hydrogen 2.795 N/A ARG 385.A NH2 GLN 251.A O no hydrogen 2.587 N/A ARG 385.A NH2 LYS 396.A O no hydrogen 3.462 N/A ARG 385.A NH2 PRO 397.A O no hydrogen 3.462 N/A MET 386.A N VAL 383.A O no hydrogen 3.289 N/A ALA 387.A N VAL 394.A O no hydrogen 2.828 N/A ILE 388.A N GLY 230.A O no hydrogen 2.730 N/A SER 389.A N ASP 392.A O no hydrogen 2.931 N/A SER 389.A OG TYR 333.A OH no hydrogen 2.623 N/A GLY 390.A N THR 337.A OG1 no hydrogen 2.980 N/A ASP 392.A N SER 389.A O no hydrogen 2.909 N/A CYS 393.A SG ASP 258.A O no hydrogen 3.387 N/A VAL 394.A N ALA 387.A O no hydrogen 2.877 N/A VAL 395.A N TYR 256.A O no hydrogen 2.917 N/A LYS 396.A N ARG 385.A O no hydrogen 2.778 N/A LYS 396.A NZ ALA 248.A O no hydrogen 2.983 N/A LYS 396.A NZ LYS 250.A O no hydrogen 2.691 N/A ARG 401.A N ASP 399.A OD1 no hydrogen 3.081 N/A ARG 401.A NE ASP 399.A OD1 no hydrogen 2.818 N/A ARG 401.A NE ASP 399.A OD2 no hydrogen 3.449 N/A ARG 401.A NH2 ASP 399.A OD2 no hydrogen 2.795 N/A PHE 402.A N ASP 399.A O no hydrogen 3.409 N/A ALA 403.A N ASP 400.A O no hydrogen 2.988 N/A THR 404.A N ARG 401.A O no hydrogen 2.952 N/A THR 404.A OG1 ARG 401.A O no hydrogen 2.827 N/A ALA 405.A N PHE 402.A O no hydrogen 3.217 N/A HIS 407.A N GLU 350.A OE2 no hydrogen 3.024 N/A PHE 408.A N GLU 350.A OE1 no hydrogen 2.838 N/A ASN 410.A N LEU 406.A O no hydrogen 2.782 N/A ASN 410.A ND2 GLU 421.A O no hydrogen 3.060 N/A ALA 411.A N HIS 407.A O no hydrogen 2.940 N/A MET 412.A N PHE 408.A O no hydrogen 2.971 N/A MET 412.A N LEU 409.A O no hydrogen 3.295 N/A SER 413.A N ASN 410.A O no hydrogen 2.847 N/A SER 413.A OG PRO 89.A O no hydrogen 3.213 N/A LYS 414.A N LEU 409.A O no hydrogen 3.151 N/A LYS 414.A NZ ARG 266.A O no hydrogen 3.093 N/A LYS 414.A NZ ASP 271.A OD2 no hydrogen 2.686 N/A LYS 414.A NZ MET 412.A O no hydrogen 3.004 N/A ARG 416.A NH1 LYS 423.A O no hydrogen 2.823 N/A ARG 416.A NH1 SER 425.A OG no hydrogen 2.937 N/A ARG 416.A NH2 GLU 421.A O no hydrogen 2.798 N/A ARG 416.A NH2 LYS 423.A O no hydrogen 3.003 N/A LYS 417.A N ASP 259.A O no hydrogen 2.833 N/A LYS 417.A NZ ALA 193.A O no hydrogen 2.952 N/A LYS 417.A NZ ASP 259.A OD2 no hydrogen 2.724 N/A LYS 423.A N GLN 420.A O no hydrogen 3.027 N/A SER 425.A N ALA 403.A O no hydrogen 2.989 N/A SER 425.A OG ASP 258.A OD2 no hydrogen 2.455 N/A TRP 428.A N MET 255.A O no hydrogen 2.880 N/A GLN 432.A N ASP 430.A OD1 no hydrogen 2.939 N/A GLN 433.A N ASP 430.A O no hydrogen 2.975 N/A VAL 434.A N TRP 431.A O no hydrogen 3.185 N/A PHE 436.A N ASN 439.A O no hydrogen 2.860 N/A CYS 437.A N ASP 392.A OD2 no hydrogen 3.021 N/A ASN 439.A N PHE 436.A O no hydrogen 3.203 N/A ASN 439.A ND2 CYS 437.A O no hydrogen 2.827 N/A HIS 440.A N CYS 456.A O no hydrogen 2.874 N/A GLN 442.A N VAL 454.A O no hydrogen 3.080 N/A GLN 442.A NE2 GLN 432.A O no hydrogen 3.660 N/A GLN 442.A NE2 HIS 440.A ND1 no hydrogen 3.357 N/A GLU 443.A N GLN 432.A OE1 no hydrogen 2.832 N/A ILE 444.A N ILE 452.A O no hydrogen 2.711 N/A MET 446.A N ARG 450.A O no hydrogen 2.744 N/A LYS 447.A NZ ASP 563.A OD2 no hydrogen 2.980 N/A GLY 449.A N MET 446.A O no hydrogen 3.118 N/A ARG 450.A N ASP 448.A OD1 no hydrogen 3.188 N/A ARG 450.A NE ASP 448.A OD1 no hydrogen 2.963 N/A ARG 450.A NH1 ASP 554.A O no hydrogen 2.809 N/A ARG 450.A NH1 THR 556.A O no hydrogen 2.995 N/A ARG 450.A NH2 ASP 448.A OD2 no hydrogen 2.852 N/A ARG 450.A NH2 THR 556.A O no hydrogen 3.055 N/A ILE 452.A N ILE 444.A O no hydrogen 2.886 N/A VAL 453.A N TYR 242.A OH no hydrogen 3.180 N/A VAL 454.A N GLN 442.A O no hydrogen 2.951 N/A CYS 456.A N HIS 440.A O no hydrogen 2.899 N/A CYS 456.A SG HIS 440.A NE2 no hydrogen 3.820 N/A ARG 457.A NE GLU 461.A OE2 no hydrogen 3.423 N/A ARG 457.A NH2 GLU 461.A OE2 no hydrogen 2.813 N/A GLN 459.A N CYS 575.A O no hydrogen 3.075 N/A GLN 459.A NE2 ASP 499.A OD2 no hydrogen 2.957 N/A ILE 463.A N GLN 459.A O no hydrogen 2.975 N/A GLY 464.A N ASP 460.A O no hydrogen 2.738 N/A ARG 465.A N GLU 461.A O no hydrogen 2.935 N/A ALA 466.A N LEU 462.A O no hydrogen 3.045 N/A ARG 467.A N ILE 463.A O no hydrogen 3.052 N/A ARG 467.A NE SER 54.A OG no hydrogen 2.957 N/A ARG 467.A NH1 ASP 58.A OD1 no hydrogen 2.924 N/A ARG 467.A NH2 SER 54.A O no hydrogen 2.845 N/A ARG 467.A NH2 SER 54.A OG no hydrogen 3.255 N/A ARG 467.A NH2 ASP 58.A OD1 no hydrogen 2.523 N/A ILE 468.A N ARG 465.A O no hydrogen 2.962 N/A SER 469.A N LEU 45.A O no hydrogen 3.076 N/A THR 479.A N ASN 475.A O no hydrogen 3.183 N/A THR 479.A OG1 ASN 475.A O no hydrogen 3.119 N/A ALA 480.A N VAL 476.A O no hydrogen 3.102 N/A CYS 481.A N LYS 477.A O no hydrogen 2.920 N/A CYS 481.A SG LYS 477.A O no hydrogen 3.089 N/A CYS 481.A SG VAL 516.A O no hydrogen 3.258 N/A LEU 482.A N ASP 478.A O no hydrogen 2.936 N/A ALA 483.A N THR 479.A O no hydrogen 2.862 N/A LYS 484.A N ALA 480.A O no hydrogen 2.904 N/A LYS 484.A NZ PRO 512.A O no hydrogen 3.241 N/A LYS 484.A NZ VAL 513.A O no hydrogen 3.084 N/A LYS 484.A NZ TRP 515.A O no hydrogen 2.701 N/A ALA 485.A N CYS 481.A O no hydrogen 2.870 N/A TYR 486.A N LEU 482.A O no hydrogen 2.990 N/A ALA 487.A N ALA 483.A O no hydrogen 2.959 N/A GLN 488.A N LYS 484.A O no hydrogen 2.910 N/A GLN 488.A NE2 TRP 531.A O no hydrogen 2.736 N/A GLN 488.A NE2 THR 533.A O no hydrogen 2.927 N/A MET 489.A N ALA 485.A O no hydrogen 2.908 N/A TRP 490.A N TYR 486.A O no hydrogen 2.911 N/A LEU 491.A N ALA 487.A O no hydrogen 2.955 N/A LEU 492.A N GLN 488.A O no hydrogen 2.988 N/A LEU 492.A N MET 489.A O no hydrogen 3.031 N/A LEU 493.A N MET 489.A O no hydrogen 2.925 N/A TYR 494.A N TRP 490.A O no hydrogen 2.814 N/A TYR 494.A OH ASN 439.A OD1 no hydrogen 2.633 N/A HIS 496.A NE2 LEU 493.A O no hydrogen 2.938 N/A ARG 497.A N TYR 494.A O no hydrogen 2.987 N/A ARG 497.A NE ASP 572.A OD1 no hydrogen 2.782 N/A ARG 497.A NH1 ARG 457.A O no hydrogen 3.001 N/A ARG 497.A NH2 ASP 572.A OD1 no hydrogen 2.997 N/A ARG 497.A NH2 CYS 575.A O no hydrogen 2.910 N/A ARG 498.A N ASP 572.A OD2 no hydrogen 3.060 N/A ARG 498.A NH1 VAL 567.A O no hydrogen 2.577 N/A ARG 498.A NH1 ASP 572.A OD2 no hydrogen 3.033 N/A ARG 498.A NH2 VAL 567.A O no hydrogen 3.151 N/A ARG 501.A N ARG 497.A O no hydrogen 2.880 N/A ARG 501.A NH1 PHE 495.A O no hydrogen 2.730 N/A ARG 501.A NH1 VAL 564.A O no hydrogen 3.430 N/A ARG 501.A NH1 PRO 565.A O no hydrogen 3.404 N/A ARG 501.A NH2 VAL 564.A O no hydrogen 2.713 N/A LEU 502.A N ARG 498.A O no hydrogen 2.982 N/A MET 503.A N ASP 499.A O no hydrogen 2.840 N/A ALA 504.A N LEU 500.A O no hydrogen 2.820 N/A ASN 505.A N ARG 501.A O no hydrogen 3.037 N/A ALA 506.A N LEU 502.A O no hydrogen 3.037 N/A ILE 507.A N MET 503.A O no hydrogen 2.946 N/A CYS 508.A N ALA 504.A O no hydrogen 2.894 N/A CYS 508.A SG ALA 504.A O no hydrogen 3.428 N/A SER 509.A N ASN 505.A O no hydrogen 2.813 N/A SER 509.A OG ASN 505.A O no hydrogen 2.782 N/A ALA 510.A N ILE 507.A O no hydrogen 3.077 N/A VAL 513.A N ASN 606.A O no hydrogen 2.918 N/A TRP 515.A N PRO 512.A O no hydrogen 2.981 N/A ARG 520.A NH1 SER 522.A O no hydrogen 3.156 N/A SER 522.A OG SER 527.A OG no hydrogen 2.785 N/A SER 524.A N SER 522.A OG no hydrogen 2.977 N/A HIS 526.A N SER 524.A OG no hydrogen 2.903 N/A SER 527.A N SER 524.A O no hydrogen 3.020 N/A SER 527.A OG SER 522.A OG no hydrogen 2.785 N/A SER 527.A OG SER 524.A O no hydrogen 3.205 N/A LYS 528.A NZ GLY 234.A O no hydrogen 3.234 N/A GLU 530.A N GLU 530.A OE2 no hydrogen 2.694 N/A MET 532.A N GLY 529.A O no hydrogen 3.029 N/A THR 533.A N TRP 531.A O no hydrogen 2.750 N/A GLU 535.A N THR 533.A OG1 no hydrogen 3.191 N/A GLN 539.A N ASP 536.A O no hydrogen 3.156 N/A VAL 540.A N ASP 536.A O no hydrogen 3.477 N/A TRP 541.A N MET 537.A O no hydrogen 2.761 N/A ASN 542.A N LEU 538.A O no hydrogen 2.821 N/A ASN 542.A ND2 LEU 538.A O no hydrogen 2.919 N/A ASN 542.A ND2 ILE 558.A O no hydrogen 2.793 N/A ARG 543.A N GLN 539.A O no hydrogen 2.920 N/A ARG 543.A NH1 GLU 535.A OE1 no hydrogen 3.197 N/A ARG 543.A NH2 GLU 535.A OE2 no hydrogen 2.714 N/A VAL 544.A N VAL 540.A O no hydrogen 2.859 N/A TRP 545.A N TRP 541.A O no hydrogen 2.716 N/A TRP 545.A NE1 LEU 492.A O no hydrogen 2.814 N/A ILE 546.A N ASN 542.A O no hydrogen 2.959 N/A GLU 547.A N ASN 542.A O no hydrogen 2.949 N/A GLU 548.A N ARG 543.A O no hydrogen 2.676 N/A ASN 549.A ND2 TYR 242.A OH no hydrogen 3.126 N/A ASN 549.A ND2 TRP 545.A O no hydrogen 2.988 N/A GLU 550.A N GLU 550.A OE2 no hydrogen 3.212 N/A TRP 551.A N ASN 549.A OD1 no hydrogen 3.019 N/A TRP 551.A NE1 ASP 246.A OD2 no hydrogen 2.780 N/A MET 552.A N ASN 549.A O no hydrogen 2.699 N/A LYS 555.A NZ ILE 546.A O no hydrogen 2.893 N/A LYS 555.A NZ GLU 547.A O no hydrogen 3.059 N/A LYS 555.A NZ MET 552.A O no hydrogen 2.925 N/A THR 556.A N ASP 554.A OD2 no hydrogen 2.837 N/A THR 556.A OG1 ASP 554.A OD1 no hydrogen 3.446 N/A THR 556.A OG1 ASP 554.A OD2 no hydrogen 2.663 N/A ILE 558.A N ASN 542.A OD1 no hydrogen 2.688 N/A THR 562.A N SER 560.A OG no hydrogen 3.302 N/A ASP 563.A N SER 560.A O no hydrogen 2.745 N/A VAL 564.A N TRP 561.A O no hydrogen 2.964 N/A VAL 567.A N HIS 496.A O no hydrogen 2.929 N/A ASP 572.A N GLY 568.A O no hydrogen 3.104 N/A ILE 573.A N LYS 569.A O no hydrogen 2.936 N/A TRP 574.A N ARG 570.A O no hydrogen 2.947 N/A CYS 575.A N GLU 571.A O no hydrogen 2.909 N/A CYS 575.A SG HIS 440.A NE2 no hydrogen 3.299 N/A GLY 576.A N ILE 573.A O no hydrogen 3.175 N/A SER 577.A N ASP 572.A O no hydrogen 2.798 N/A SER 577.A OG ASP 499.A OD1 no hydrogen 3.464 N/A SER 577.A OG ASP 499.A OD2 no hydrogen 3.281 N/A LEU 578.A N ASP 499.A OD2 no hydrogen 2.739 N/A ILE 579.A N SER 577.A OG no hydrogen 3.353 N/A THR 581.A N LEU 578.A O no hydrogen 3.271 N/A THR 581.A OG1 LEU 578.A O no hydrogen 2.652 N/A ARG 584.A N THR 581.A OG1 no hydrogen 3.310 N/A ARG 584.A NH1 ASP 499.A OD1 no hydrogen 2.897 N/A ALA 585.A N THR 581.A O no hydrogen 3.144 N/A THR 586.A N ARG 582.A O no hydrogen 2.894 N/A THR 586.A OG1 ARG 582.A O no hydrogen 3.182 N/A TRP 587.A N SER 583.A O no hydrogen 2.981 N/A ALA 588.A N ARG 584.A O no hydrogen 2.909 N/A GLU 589.A N ALA 585.A O no hydrogen 3.110 N/A ASN 590.A N THR 586.A O no hydrogen 3.004 N/A ASN 590.A N TRP 587.A O no hydrogen 3.320 N/A ALA 593.A N ASN 590.A O no hydrogen 2.979 N/A ILE 595.A N ILE 591.A O no hydrogen 2.889 N/A ASN 596.A N TYR 592.A O no hydrogen 2.794 N/A GLN 597.A N ALA 593.A O no hydrogen 2.911 N/A VAL 598.A N ALA 594.A O no hydrogen 3.025 N/A ARG 599.A N ILE 595.A O no hydrogen 2.893 N/A ARG 599.A NE SER 509.A O no hydrogen 2.863 N/A ARG 599.A NH2 SER 509.A O no hydrogen 2.968 N/A ALA 600.A N ASN 596.A O no hydrogen 2.798 N/A VAL 601.A N GLN 597.A O no hydrogen 3.028 N/A ILE 602.A N VAL 598.A O no hydrogen 2.836 N/A GLY 603.A N ARG 599.A O no hydrogen 3.003 N/A TYR 607.A OH ARG 599.A O no hydrogen 3.353 N/A TYR 607.A OH GLY 603.A O no hydrogen 2.945 N/A TYR 610.A N SER 509.A OG no hydrogen 2.978 N/A MET 611.A N ASP 609.A OD1 no hydrogen 3.004 N/A