Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4upk_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLN 1.A N ASN 200.A OD1 no hydrogen 3.210 N/A SER 2.A N ASN 200.A OD1 no hydrogen 2.994 N/A ASN 3.A N ASP 307.A O no hydrogen 3.379 N/A ASN 3.A ND2 GLN 304.A OE1 no hydrogen 3.560 N/A ASN 3.A ND2 THR 308.A OG1 no hydrogen 3.143 N/A VAL 4.A N TRP 201.A O no hydrogen 2.889 N/A LEU 5.A N LEU 309.A O no hydrogen 2.835 N/A PHE 6.A N ALA 203.A O no hydrogen 2.992 N/A ILE 7.A N VAL 311.A O no hydrogen 2.770 N/A ILE 8.A N LEU 205.A O no hydrogen 3.062 N/A ILE 9.A N THR 313.A O no hydrogen 2.942 N/A ASP 10.A N TYR 207.A O no hydrogen 2.751 N/A GLN 11.A NE2 HIS 316.A NE2 no hydrogen 2.945 N/A ARG 13.A N TYR 281.A OH no hydrogen 3.079 N/A ARG 13.A NE ASP 15.A OD1 no hydrogen 2.818 N/A ARG 13.A NH1 GLU 318.A O no hydrogen 2.909 N/A ARG 13.A NH1 ASP 322.A OD2 no hydrogen 3.246 N/A ARG 13.A NH2 ASP 15.A OD2 no hydrogen 2.790 N/A ARG 13.A NH2 ASP 322.A OD2 no hydrogen 2.905 N/A ALA 14.A N HIS 337.A O no hydrogen 3.391 N/A CYS 16.A N ARG 13.A O no hydrogen 3.359 N/A LEU 17.A N ALA 14.A O no hydrogen 3.172 N/A TRP 18.A N ALA 14.A O no hydrogen 3.230 N/A LEU 21.A N ASP 15.A O no hydrogen 3.070 N/A ALA 22.A N GLY 19.A O no hydrogen 3.321 N/A HIS 24.A N LEU 21.A O no hydrogen 2.982 N/A VAL 25.A N ALA 22.A O no hydrogen 3.474 N/A GLU 26.A N TYR 224.A OH no hydrogen 2.870 N/A HIS 29.A N ASP 289.A OD2 no hydrogen 2.859 N/A LEU 30.A N ASP 289.A OD1 no hydrogen 2.942 N/A ARG 31.A N LEU 27.A O no hydrogen 2.977 N/A ARG 31.A NE LEU 17.A O no hydrogen 3.294 N/A ARG 31.A NH1 VAL 25.A O no hydrogen 2.904 N/A ARG 31.A NH2 CYS 16.A O no hydrogen 2.835 N/A ARG 31.A NH2 ALA 22.A O no hydrogen 2.865 N/A ARG 31.A NH2 VAL 25.A O no hydrogen 3.142 N/A ALA 32.A N PRO 28.A O no hydrogen 2.819 N/A LEU 33.A N HIS 29.A O no hydrogen 2.994 N/A ALA 34.A N LEU 30.A O no hydrogen 3.047 N/A GLN 35.A N ARG 31.A O no hydrogen 3.096 N/A ASP 36.A N ALA 32.A O no hydrogen 3.186 N/A ASP 36.A N LEU 33.A O no hydrogen 3.054 N/A ALA 37.A N ALA 34.A O no hydrogen 3.207 N/A VAL 38.A N ILE 342.A O no hydrogen 3.092 N/A SER 39.A N HIS 351.A O no hydrogen 2.945 N/A PHE 40.A N LEU 340.A O no hydrogen 2.965 N/A ARG 41.A N VAL 353.A O no hydrogen 2.788 N/A ARG 42.A NH2 ASP 432.A O no hydrogen 3.556 N/A HIS 43.A ND1 THR 357.A OG1 no hydrogen 2.878 N/A TYR 44.A N THR 357.A O no hydrogen 3.109 N/A SER 45.A N TYR 336.A O no hydrogen 2.929 N/A SER 45.A OG THR 47.A O no hydrogen 2.673 N/A SER 45.A OG SER 53.A OG no hydrogen 2.586 N/A SER 45.A OG ASP 315.A O no hydrogen 3.106 N/A VAL 46.A N SER 359.A OG no hydrogen 3.123 N/A THR 47.A OG1 GLU 402.A O no hydrogen 2.901 N/A ASN 48.A ND2 ALA 335.A O no hydrogen 2.981 N/A GLY 51.A N ASN 71.A OD1 no hydrogen 3.065 N/A SER 53.A N PRO 49.A O no hydrogen 2.767 N/A SER 53.A OG SER 45.A OG no hydrogen 2.586 N/A SER 53.A OG THR 47.A O no hydrogen 3.129 N/A SER 53.A OG ASP 315.A O no hydrogen 2.745 N/A SER 53.A OG ASP 315.A OD2 no hydrogen 3.001 N/A ARG 54.A N CYS 50.A O no hydrogen 2.705 N/A ARG 54.A NE ASP 315.A OD1 no hydrogen 2.686 N/A ALA 55.A N GLY 51.A O no hydrogen 2.833 N/A SER 56.A N PRO 52.A O no hydrogen 3.031 N/A SER 56.A OG PRO 52.A O no hydrogen 3.518 N/A SER 56.A OG GLN 61.A O no hydrogen 2.962 N/A SER 56.A OG HIS 66.A NE2 no hydrogen 2.795 N/A ILE 57.A N SER 53.A O no hydrogen 3.386 N/A LEU 58.A N ARG 54.A O no hydrogen 2.929 N/A THR 59.A N ALA 55.A O no hydrogen 2.988 N/A THR 59.A OG1 ALA 55.A O no hydrogen 2.576 N/A GLY 60.A N SER 56.A O no hydrogen 2.821 N/A GLN 61.A N THR 59.A OG1 no hydrogen 3.420 N/A TYR 62.A N ASP 379.A OD2 no hydrogen 2.839 N/A TYR 62.A OH GLU 358.A OE1 no hydrogen 2.645 N/A MET 64.A N GLU 402.A OE2 no hydrogen 3.034 N/A ASN 65.A N TYR 62.A O no hydrogen 2.927 N/A ASN 65.A ND2 ASP 379.A OD2 no hydrogen 2.675 N/A ASN 65.A ND2 ASN 484.A O no hydrogen 2.928 N/A HIS 66.A N TYR 62.A O no hydrogen 2.941 N/A HIS 66.A NE2 SER 56.A OG no hydrogen 2.795 N/A ARG 67.A N ALA 63.A O no hydrogen 2.919 N/A SER 68.A N HIS 66.A ND1 no hydrogen 3.092 N/A SER 68.A OG THR 73.A O no hydrogen 2.500 N/A ARG 70.A N THR 73.A OG1 no hydrogen 3.207 N/A ARG 70.A NE ASP 404.A OD1 no hydrogen 3.195 N/A ARG 70.A NE SER 406.A O no hydrogen 2.867 N/A ARG 70.A NH2 SER 406.A OG no hydrogen 3.211 N/A THR 73.A N ARG 70.A O no hydrogen 2.981 N/A THR 73.A OG1 ARG 70.A O no hydrogen 2.942 N/A LEU 75.A N SER 102.A O no hydrogen 3.009 N/A HIS 77.A N ASP 104.A OD2 no hydrogen 2.795 N/A THR 79.A N ARG 76.A O no hydrogen 3.283 N/A THR 79.A OG1 ARG 76.A O no hydrogen 2.999 N/A ASN 81.A N THR 84.A OG1 no hydrogen 2.912 N/A ASN 81.A ND2 ARG 123.A O no hydrogen 3.176 N/A ILE 82.A N LEU 58.A O no hydrogen 2.857 N/A THR 84.A N ASN 81.A OD1 no hydrogen 2.947 N/A THR 84.A OG1 ASN 81.A O no hydrogen 2.926 N/A THR 84.A OG1 GLU 85.A OE2 no hydrogen 3.159 N/A GLU 85.A N ASN 81.A O no hydrogen 3.088 N/A MET 86.A N ILE 82.A O no hydrogen 2.918 N/A ARG 87.A N ALA 83.A O no hydrogen 2.896 N/A ARG 87.A NE GLY 124.A O no hydrogen 2.786 N/A ARG 87.A NH2 GLY 124.A O no hydrogen 3.187 N/A LYS 88.A NZ GLU 85.A OE1 no hydrogen 2.884 N/A LYS 88.A NZ GLU 85.A OE2 no hydrogen 3.337 N/A ALA 89.A N MET 86.A O no hydrogen 3.102 N/A GLY 90.A N ARG 87.A O no hydrogen 3.136 N/A TYR 91.A N MET 86.A O no hydrogen 3.034 N/A TYR 91.A OH SER 2.A O no hydrogen 2.613 N/A LEU 94.A N PHE 202.A O no hydrogen 2.749 N/A LEU 95.A N HIS 126.A O no hydrogen 2.729 N/A PHE 96.A N HIS 204.A O no hydrogen 2.754 N/A GLY 97.A N THR 129.A O no hydrogen 2.981 N/A TYR 98.A N THR 206.A OG1 no hydrogen 2.987 N/A TYR 98.A OH ASP 10.A OD2 no hydrogen 2.715 N/A THR 99.A OG1 THR 101.A OG1 no hydrogen 2.997 N/A THR 99.A OG1 PHE 120.A O no hydrogen 3.262 N/A THR 101.A N PHE 120.A O no hydrogen 3.128 N/A THR 101.A OG1 THR 99.A OG1 no hydrogen 2.997 N/A GLN 103.A NE2 THR 101.A O no hydrogen 2.825 N/A ARG 106.A N ASP 104.A OD1 no hydrogen 3.255 N/A ARG 106.A NE ASP 104.A OD1 no hydrogen 2.884 N/A ARG 106.A NE ASP 104.A OD2 no hydrogen 3.258 N/A ARG 106.A NH2 ASP 104.A OD2 no hydrogen 2.813 N/A ALA 107.A N ASP 104.A O no hydrogen 3.042 N/A ASN 111.A N ASP 109.A OD2 no hydrogen 3.322 N/A ASP 112.A N ASP 109.A O no hydrogen 3.007 N/A ALA 114.A N ASP 112.A OD1 no hydrogen 3.157 N/A LEU 115.A N ASP 112.A O no hydrogen 3.063 N/A LYS 116.A N PRO 113.A O no hydrogen 2.887 N/A LYS 116.A NZ ASN 111.A OD1 no hydrogen 2.977 N/A GLU 119.A N THR 117.A OG1 no hydrogen 3.303 N/A MET 122.A N THR 99.A OG1 no hydrogen 2.850 N/A ARG 123.A NH1 HIS 77.A O no hydrogen 2.867 N/A PHE 125.A N MET 122.A O no hydrogen 3.113 N/A HIS 126.A N PRO 93.A O no hydrogen 2.703 N/A VAL 128.A N LEU 95.A O no hydrogen 2.930 N/A THR 129.A N LEU 95.A O no hydrogen 3.291 N/A MET 131.A N GLY 97.A O no hydrogen 2.959 N/A ARG 132.A N GLU 130.A OE2 no hydrogen 3.127 N/A ARG 132.A NH2 GLU 127.A OE2 no hydrogen 3.119 N/A GLU 134.A N GLU 119.A OE2 no hydrogen 2.965 N/A MET 135.A N ARG 132.A O no hydrogen 2.919 N/A SER 136.A N GLU 130.A OE2 no hydrogen 2.860 N/A SER 136.A OG ARG 132.A O no hydrogen 2.782 N/A TYR 137.A N GLU 130.A OE1 no hydrogen 3.008 N/A TRP 139.A NE1 ASP 179.A O no hydrogen 2.830 N/A GLN 140.A N SER 136.A O no hydrogen 2.807 N/A GLN 140.A NE2 MET 135.A O no hydrogen 2.855 N/A SER 141.A N TYR 137.A O no hydrogen 2.867 N/A SER 141.A OG TYR 137.A O no hydrogen 2.943 N/A HIS 142.A N PRO 138.A O no hydrogen 2.986 N/A LEU 143.A N TRP 139.A O no hydrogen 3.064 N/A LYS 144.A N GLN 140.A O no hydrogen 3.129 N/A ASN 145.A N SER 141.A O no hydrogen 2.928 N/A ARG 146.A N HIS 142.A O no hydrogen 3.018 N/A GLY 147.A N LYS 144.A O no hydrogen 3.056 N/A TYR 148.A N LEU 143.A O no hydrogen 2.949 N/A TYR 148.A OH ASP 179.A OD2 no hydrogen 2.667 N/A ASP 151.A N GLN 155.A OE1 no hydrogen 3.002 N/A TYR 153.A OH LEU 133.A O no hydrogen 2.577 N/A TYR 153.A OH TYR 157.A OH no hydrogen 2.491 N/A GLN 155.A N ASP 152.A O no hydrogen 3.174 N/A VAL 156.A N TYR 153.A O no hydrogen 3.257 N/A TYR 157.A OH TYR 153.A OH no hydrogen 2.491 N/A VAL 158.A N GLN 155.A O no hydrogen 3.410 N/A ARG 160.A N PRO 172.A O no hydrogen 2.788 N/A ARG 160.A NH2 MET 174.A O no hydrogen 3.372 N/A ASP 162.A N THR 166.A O no hydrogen 2.824 N/A GLY 165.A N ASP 162.A O no hydrogen 2.837 N/A THR 166.A N ASP 164.A OD1 no hydrogen 3.283 N/A THR 166.A OG1 ASP 164.A OD1 no hydrogen 2.661 N/A ARG 168.A NE ASP 162.A OD1 no hydrogen 3.240 N/A ARG 168.A NH2 ASP 162.A OD2 no hydrogen 3.294 N/A GLY 171.A N ARG 168.A O no hydrogen 3.217 N/A ALA 173.A N ALA 216.A O no hydrogen 3.091 N/A ARG 176.A N TYR 148.A OH no hydrogen 3.091 N/A GLU 178.A N GLU 178.A OE1 no hydrogen 2.917 N/A ASP 179.A N ARG 176.A O no hydrogen 2.928 N/A SER 180.A N ALA 177.A O no hydrogen 3.237 N/A SER 180.A OG ALA 177.A O no hydrogen 3.302 N/A SER 180.A OG GLU 287.A OE2 no hydrogen 2.789 N/A THR 182.A N ASP 181.A OD1 no hydrogen 3.027 N/A ALA 183.A N SER 180.A OG no hydrogen 3.115 N/A PHE 184.A N SER 180.A O no hydrogen 2.861 N/A LEU 185.A N ASP 181.A O no hydrogen 3.129 N/A THR 186.A N THR 182.A O no hydrogen 3.312 N/A THR 186.A OG1 THR 182.A O no hydrogen 2.730 N/A THR 186.A OG1 TYR 207.A OH no hydrogen 2.912 N/A ASP 187.A N ALA 183.A O no hydrogen 2.850 N/A GLN 188.A N PHE 184.A O no hydrogen 2.953 N/A PHE 189.A N LEU 185.A O no hydrogen 3.010 N/A LEU 190.A N THR 186.A O no hydrogen 2.960 N/A ALA 191.A N ASP 187.A O no hydrogen 2.800 N/A ASN 192.A N PHE 189.A O no hydrogen 3.219 N/A ASN 192.A ND2 GLN 188.A O no hydrogen 2.712 N/A MET 193.A N PHE 189.A O no hydrogen 2.855 N/A TRP 196.A N MET 193.A O no hydrogen 2.852 N/A ALA 197.A N PRO 194.A O no hydrogen 3.424 N/A GLN 199.A N TRP 196.A O no hydrogen 3.280 N/A TRP 201.A N ASN 3.A OD1 no hydrogen 3.157 N/A TRP 201.A NE1 GLN 304.A OE1 no hydrogen 2.780 N/A ALA 203.A N VAL 4.A O no hydrogen 2.967 N/A HIS 204.A N LEU 94.A O no hydrogen 2.738 N/A HIS 204.A ND1 PHE 6.A O no hydrogen 2.848 N/A LEU 205.A N PHE 6.A O no hydrogen 3.043 N/A THR 206.A N PHE 96.A O no hydrogen 2.985 N/A THR 206.A OG1 PHE 96.A O no hydrogen 3.227 N/A THR 206.A OG1 TYR 98.A O no hydrogen 3.556 N/A TYR 207.A N ILE 8.A O no hydrogen 3.114 N/A TYR 207.A OH THR 186.A OG1 no hydrogen 2.912 N/A ARG 209.A NE ASP 181.A OD2 no hydrogen 2.628 N/A ARG 209.A NH1 PRO 213.A O no hydrogen 2.935 N/A ARG 209.A NH2 ASP 181.A OD2 no hydrogen 3.265 N/A HIS 211.A ND1 PRO 212.A O no hydrogen 2.794 N/A LEU 214.A N PHE 260.A O no hydrogen 2.805 N/A ASN 221.A ND2 ASN 170.A O no hydrogen 2.922 N/A TYR 224.A OH THR 286.A OG1 no hydrogen 2.600 N/A ALA 227.A N ASP 225.A OD1 no hydrogen 3.105 N/A LYS 228.A N ASP 225.A O no hydrogen 3.089 N/A ALA 233.A N ASP 322.A OD1 no hydrogen 3.053 N/A ARG 234.A NH1 ASP 271.A OD1 no hydrogen 3.468 N/A ARG 234.A NH2 ASP 271.A OD1 no hydrogen 2.911 N/A LEU 235.A N GLU 241.A OE2 no hydrogen 2.646 N/A GLY 237.A N ASP 240.A OD2 no hydrogen 2.725 N/A ARG 238.A NH2 THR 252.A O no hydrogen 3.002 N/A ASP 240.A N GLY 237.A O no hydrogen 3.191 N/A GLU 241.A N GLY 237.A O no hydrogen 3.451 N/A THR 242.A N ARG 238.A O no hydrogen 3.185 N/A THR 242.A OG1 ARG 238.A O no hydrogen 3.243 N/A THR 242.A OG1 ASP 239.A O no hydrogen 3.146 N/A ALA 243.A N ASP 239.A O no hydrogen 2.980 N/A GLU 244.A N GLU 241.A O no hydrogen 3.397 N/A HIS 245.A N THR 242.A O no hydrogen 3.249 N/A HIS 245.A NE2 PRO 445.A O no hydrogen 2.543 N/A PHE 247.A N HIS 245.A ND1 no hydrogen 3.128 N/A PHE 248.A N HIS 245.A O no hydrogen 3.269 N/A GLY 249.A N PRO 246.A O no hydrogen 3.165 N/A ALA 251.A N PHE 247.A O no hydrogen 3.146 N/A THR 252.A N PHE 248.A O no hydrogen 2.787 N/A THR 252.A OG1 PHE 248.A O no hydrogen 2.748 N/A THR 252.A OG1 GLY 249.A O no hydrogen 3.233 N/A ARG 253.A N GLY 249.A O no hydrogen 3.257 N/A ARG 253.A N PRO 250.A O no hydrogen 3.197 N/A ARG 253.A NH1 GLU 417.A OE1 no hydrogen 3.162 N/A ARG 253.A NH2 GLU 417.A OE1 no hydrogen 3.060 N/A SER 256.A N SER 259.A OG no hydrogen 3.058 N/A SER 259.A N SER 256.A O no hydrogen 3.009 N/A SER 259.A OG SER 256.A O no hydrogen 3.003 N/A PHE 260.A N PRO 257.A O no hydrogen 3.032 N/A THR 270.A N GLU 268.A O no hydrogen 2.773 N/A THR 270.A OG1 THR 273.A OG1 no hydrogen 3.033 N/A THR 273.A N THR 270.A OG1 no hydrogen 3.288 N/A THR 273.A OG1 GLU 268.A O no hydrogen 3.037 N/A THR 273.A OG1 THR 270.A OG1 no hydrogen 3.033 N/A ILE 274.A N THR 270.A O no hydrogen 2.944 N/A GLN 275.A N ASP 271.A O no hydrogen 3.038 N/A GLN 275.A NE2 PRO 226.A O no hydrogen 3.651 N/A GLN 275.A NE2 PRO 230.A O no hydrogen 2.891 N/A THR 276.A N GLU 272.A O no hydrogen 3.192 N/A THR 276.A OG1 GLU 272.A O no hydrogen 2.604 N/A LEU 277.A N THR 273.A O no hydrogen 3.118 N/A ARG 278.A N ILE 274.A O no hydrogen 3.106 N/A ARG 278.A NE GLN 275.A OE1 no hydrogen 2.976 N/A ARG 278.A NH1 LEU 320.A O no hydrogen 2.810 N/A ARG 278.A NH2 PRO 230.A O no hydrogen 3.093 N/A ALA 279.A N GLN 275.A O no hydrogen 2.898 N/A VAL 280.A N THR 276.A O no hydrogen 2.913 N/A TYR 281.A N LEU 277.A O no hydrogen 2.951 N/A TYR 281.A OH GLN 11.A O no hydrogen 2.496 N/A LEU 282.A N ARG 278.A O no hydrogen 3.114 N/A GLY 283.A N ALA 279.A O no hydrogen 3.063 N/A LEU 284.A N VAL 280.A O no hydrogen 3.064 N/A ALA 285.A N TYR 281.A O no hydrogen 3.153 N/A THR 286.A N LEU 282.A O no hydrogen 3.073 N/A THR 286.A OG1 GLU 26.A O no hydrogen 2.626 N/A THR 286.A OG1 TYR 224.A OH no hydrogen 2.600 N/A THR 286.A OG1 LEU 282.A O no hydrogen 3.436 N/A GLU 287.A N GLY 283.A O no hydrogen 3.099 N/A VAL 288.A N LEU 284.A O no hydrogen 2.974 N/A ASP 289.A N ALA 285.A O no hydrogen 2.942 N/A THR 290.A N THR 286.A O no hydrogen 3.015 N/A THR 290.A OG1 THR 286.A O no hydrogen 3.194 N/A HIS 291.A N GLU 287.A O no hydrogen 3.303 N/A ILE 292.A N VAL 288.A O no hydrogen 2.994 N/A GLY 293.A N ASP 289.A O no hydrogen 3.188 N/A ARG 294.A N HIS 291.A O no hydrogen 3.254 N/A ARG 294.A NH1 ASP 187.A OD1 no hydrogen 3.013 N/A ARG 294.A NH1 HIS 291.A ND1 no hydrogen 2.847 N/A ARG 294.A NH2 ASP 187.A OD1 no hydrogen 2.666 N/A VAL 295.A N HIS 291.A O no hydrogen 3.408 N/A ILE 296.A N ILE 292.A O no hydrogen 3.009 N/A ALA 297.A N GLY 293.A O no hydrogen 2.869 N/A HIS 298.A N ARG 294.A O no hydrogen 3.086 N/A LEU 299.A N VAL 295.A O no hydrogen 3.323 N/A LYS 300.A N ILE 296.A O no hydrogen 3.091 N/A GLU 301.A N ALA 297.A O no hydrogen 2.897 N/A THR 302.A N HIS 298.A O no hydrogen 3.099 N/A THR 302.A OG1 HIS 298.A O no hydrogen 2.725 N/A THR 302.A OG1 LEU 299.A O no hydrogen 3.212 N/A GLY 303.A N LYS 300.A O no hydrogen 3.139 N/A GLN 304.A N LEU 299.A O no hydrogen 2.675 N/A GLN 304.A NE2 THR 302.A OG1 no hydrogen 2.826 N/A TYR 305.A N LEU 299.A O no hydrogen 3.125 N/A TYR 305.A OH ASP 36.A OD2 no hydrogen 2.582 N/A THR 308.A OG1 GLN 304.A O no hydrogen 2.485 N/A LEU 309.A N ASN 3.A O no hydrogen 2.969 N/A ILE 310.A N ARG 343.A O no hydrogen 2.770 N/A VAL 311.A N LEU 5.A O no hydrogen 2.826 N/A VAL 312.A N ILE 341.A O no hydrogen 2.863 N/A THR 313.A N ILE 7.A O no hydrogen 3.167 N/A THR 313.A OG1 ALA 314.A O no hydrogen 3.286 N/A THR 313.A OG1 PRO 339.A O no hydrogen 2.863 N/A HIS 316.A ND1 ASP 315.A OD2 no hydrogen 2.702 N/A GLY 317.A N ALA 335.A O no hydrogen 2.909 N/A GLU 318.A N ALA 334.A O no hydrogen 3.217 N/A MET 319.A N GLY 327.A O no hydrogen 2.792 N/A LEU 320.A N GLU 318.A OE2 no hydrogen 2.898 N/A GLY 321.A N SER 325.A O no hydrogen 2.923 N/A ASP 322.A N MET 319.A O no hydrogen 3.079 N/A ARG 323.A N ALA 233.A O no hydrogen 2.880 N/A ARG 323.A NE GLU 241.A OE2 no hydrogen 2.958 N/A ARG 323.A NH1 GLU 456.A O no hydrogen 2.911 N/A ARG 323.A NH2 GLU 241.A OE1 no hydrogen 2.894 N/A ARG 323.A NH2 GLU 456.A O no hydrogen 3.410 N/A HIS 324.A N GLY 321.A O no hydrogen 3.249 N/A HIS 324.A NE2 LEU 235.A O no hydrogen 2.663 N/A SER 325.A N ASP 322.A O no hydrogen 3.233 N/A SER 325.A OG ASP 322.A O no hydrogen 2.999 N/A GLY 327.A N GLU 318.A OE2 no hydrogen 2.795 N/A VAL 331.A N THR 330.A OG1 no hydrogen 2.755 N/A ASP 333.A N GLU 456.A OE2 no hydrogen 2.927 N/A ALA 335.A N TYR 332.A O no hydrogen 3.112 N/A TYR 336.A N ASP 333.A O no hydrogen 2.836 N/A TYR 336.A OH THR 330.A O no hydrogen 2.675 N/A HIS 337.A N ASP 333.A O no hydrogen 2.696 N/A HIS 337.A NE2 ARG 41.A O no hydrogen 2.749 N/A THR 338.A N HIS 43.A O no hydrogen 2.958 N/A THR 338.A OG1 TYR 336.A O no hydrogen 3.383 N/A ILE 341.A N VAL 312.A O no hydrogen 2.785 N/A ILE 342.A N VAL 38.A O no hydrogen 2.876 N/A ARG 343.A N ILE 310.A O no hydrogen 2.876 N/A ARG 343.A NE ASP 36.A OD2 no hydrogen 2.967 N/A CYS 347.A N ALA 344.A O no hydrogen 2.985 N/A CYS 347.A SG ALA 344.A O no hydrogen 3.364 N/A LYS 348.A N LEU 387.A O no hydrogen 2.915 N/A GLY 350.A N ALA 37.A O no hydrogen 2.782 N/A HIS 351.A N LYS 348.A O no hydrogen 3.340 N/A VAL 353.A N SER 39.A O no hydrogen 2.712 N/A THR 357.A N ARG 42.A O no hydrogen 2.975 N/A THR 357.A OG1 HIS 43.A ND1 no hydrogen 2.878 N/A GLU 358.A N ASP 361.A OD2 no hydrogen 3.009 N/A SER 359.A N TYR 44.A O no hydrogen 3.103 N/A ASP 361.A N GLU 358.A O no hydrogen 2.987 N/A LEU 362.A N SER 359.A O no hydrogen 3.492 N/A THR 365.A OG1 ASP 361.A O no hydrogen 2.492 N/A ILE 366.A N LEU 362.A O no hydrogen 3.198 N/A LEU 367.A N MET 363.A O no hydrogen 3.167 N/A ASP 368.A N PRO 364.A O no hydrogen 3.034 N/A TRP 369.A N THR 365.A O no hydrogen 3.041 N/A VAL 370.A N ILE 366.A O no hydrogen 3.032 N/A GLY 371.A N ASP 368.A O no hydrogen 2.954 N/A GLN 372.A N LEU 367.A O no hydrogen 2.806 N/A ASN 376.A ND2 GLN 502.A O no hydrogen 2.781 N/A VAL 378.A N PRO 375.A O no hydrogen 3.274 N/A ASP 379.A N GLY 60.A O no hydrogen 2.823 N/A GLY 380.A N GLY 60.A O no hydrogen 2.984 N/A ARG 381.A N ASP 361.A OD1 no hydrogen 3.071 N/A ARG 381.A NH1 ASP 394.A O no hydrogen 2.911 N/A ARG 381.A NH2 ASP 394.A OD1 no hydrogen 2.857 N/A SER 382.A OG ASP 368.A OD2 no hydrogen 2.657 N/A LEU 383.A N THR 365.A OG1 no hydrogen 2.833 N/A ARG 384.A N SER 382.A OG no hydrogen 3.284 N/A ARG 384.A NH1 ASP 368.A OD1 no hydrogen 3.132 N/A LEU 387.A N ARG 384.A O no hydrogen 3.005 N/A THR 388.A OG1 PRO 385.A O no hydrogen 3.385 N/A THR 388.A OG1 GLU 390.A OE2 no hydrogen 3.025 N/A GLY 389.A N PHE 386.A O no hydrogen 3.113 N/A GLU 390.A N PRO 385.A O no hydrogen 3.263 N/A TRP 395.A NE1 PRO 356.A O no hydrogen 2.899 N/A ARG 396.A NH1 PRO 356.A O no hydrogen 3.222 N/A ARG 396.A NH1 ASP 361.A OD2 no hydrogen 2.668 N/A ARG 396.A NH2 ASP 361.A OD1 no hydrogen 2.645 N/A TYR 398.A OH HIS 480.A ND1 no hydrogen 2.772 N/A SER 399.A N ARG 431.A O no hydrogen 3.049 N/A PHE 400.A N GLU 358.A OE2 no hydrogen 2.786 N/A SER 401.A N ILE 429.A O no hydrogen 2.997 N/A SER 401.A OG SER 45.A O no hydrogen 2.696 N/A GLU 402.A N VAL 46.A O no hydrogen 2.776 N/A LEU 403.A N VAL 427.A O no hydrogen 2.959 N/A ILE 405.A N GLY 425.A O no hydrogen 2.707 N/A SER 406.A N ASP 404.A OD1 no hydrogen 2.965 N/A SER 406.A OG ASP 404.A OD1 no hydrogen 2.699 N/A SER 406.A OG PRO 422.A O no hydrogen 3.430 N/A GLU 407.A N GLN 415.A OE1 no hydrogen 2.896 N/A THR 412.A N GLN 415.A OE1 no hydrogen 3.264 N/A THR 412.A OG1 ILE 405.A O no hydrogen 2.609 N/A TRP 414.A NE1 PHE 247.A O no hydrogen 2.901 N/A GLN 415.A N THR 412.A OG1 no hydrogen 3.286 N/A GLN 415.A NE2 PHE 420.A O no hydrogen 3.179 N/A GLN 416.A N THR 412.A O no hydrogen 2.966 N/A GLN 416.A NE2 PRO 411.A O no hydrogen 2.783 N/A GLN 416.A NE2 THR 412.A O no hydrogen 3.144 N/A GLU 417.A N LEU 413.A O no hydrogen 3.059 N/A PHE 418.A N TRP 414.A O no hydrogen 2.781 N/A GLY 419.A N GLN 415.A O no hydrogen 2.827 N/A ALA 424.A N GLY 421.A O no hydrogen 3.105 N/A VAL 427.A N LEU 403.A O no hydrogen 2.777 N/A ALA 428.A N GLU 439.A O no hydrogen 2.933 N/A ILE 429.A N SER 401.A O no hydrogen 2.805 N/A LEU 430.A N LEU 437.A O no hydrogen 2.940 N/A ARG 431.A N SER 399.A O no hydrogen 2.904 N/A ARG 431.A NE ASP 333.A OD1 no hydrogen 2.882 N/A ARG 431.A NH1 SER 399.A OG no hydrogen 3.109 N/A ARG 431.A NH1 SER 401.A OG no hydrogen 2.856 N/A ARG 431.A NH2 SER 401.A OG no hydrogen 2.892 N/A ASP 432.A N PHE 435.A O no hydrogen 2.752 N/A ARG 434.A N ASP 432.A OD2 no hydrogen 3.380 N/A ARG 434.A NE ASP 450.A OD1 no hydrogen 2.891 N/A ARG 434.A NH2 ASP 450.A OD2 no hydrogen 3.042 N/A PHE 435.A N ASP 432.A OD2 no hydrogen 3.170 N/A THR 436.A N PHE 449.A O no hydrogen 2.951 N/A THR 436.A OG1 HIS 451.A NE2 no hydrogen 2.825 N/A LEU 437.A N LEU 430.A O no hydrogen 3.053 N/A VAL 438.A N MET 447.A O no hydrogen 3.009 N/A GLU 439.A N ALA 428.A O no hydrogen 2.922 N/A ALA 441.A N ALA 426.A O no hydrogen 2.926 N/A LEU 444.A N ALA 442.A O no hydrogen 2.790 N/A MET 447.A N VAL 438.A O no hydrogen 2.949 N/A LEU 448.A N ASN 459.A OD1 no hydrogen 3.008 N/A PHE 449.A N THR 436.A O no hydrogen 2.910 N/A HIS 451.A N ARG 434.A O no hydrogen 2.727 N/A HIS 451.A NE2 THR 436.A OG1 no hydrogen 2.825 N/A GLN 452.A N ASP 450.A OD1 no hydrogen 2.996 N/A GLY 453.A N ASP 450.A O no hydrogen 3.163 N/A GLY 455.A N ASP 450.A O no hydrogen 2.773 N/A PHE 457.A N GLU 454.A O no hydrogen 3.373 N/A ASN 459.A N GLU 244.A OE1 no hydrogen 2.866 N/A ASN 459.A ND2 GLU 244.A O no hydrogen 2.837 N/A VAL 460.A N LEU 448.A O no hydrogen 2.746 N/A ALA 461.A N ASN 459.A OD1 no hydrogen 3.132 N/A ASP 463.A N VAL 460.A O no hydrogen 3.132 N/A ALA 465.A N ASP 463.A OD1 no hydrogen 3.217 N/A HIS 466.A N ASP 463.A O no hydrogen 2.972 N/A HIS 466.A ND1 ASP 469.A OD2 no hydrogen 3.127 N/A ALA 467.A N PRO 464.A O no hydrogen 3.281 N/A LEU 470.A N HIS 466.A O no hydrogen 2.935 N/A ALA 471.A N ALA 467.A O no hydrogen 3.038 N/A ARG 472.A N ALA 468.A O no hydrogen 3.078 N/A ARG 472.A NH2 ASP 469.A OD1 no hydrogen 3.257 N/A LEU 473.A N ASP 469.A O no hydrogen 2.921 N/A SER 474.A N LEU 470.A O no hydrogen 3.037 N/A SER 474.A OG GLU 439.A OE2 no hydrogen 2.593 N/A ARG 475.A N ALA 471.A O no hydrogen 3.111 N/A GLN 476.A N ARG 472.A O no hydrogen 3.105 N/A MET 477.A N LEU 473.A O no hydrogen 2.831 N/A LEU 478.A N SER 474.A O no hydrogen 2.794 N/A ARG 479.A N ARG 475.A O no hydrogen 2.803 N/A HIS 480.A N GLN 476.A O no hydrogen 3.074 N/A HIS 480.A ND1 TYR 398.A OH no hydrogen 2.772 N/A ARG 481.A N MET 477.A O no hydrogen 3.287 N/A ARG 481.A NH1 GLU 402.A OE1 no hydrogen 3.494 N/A ARG 481.A NH2 GLU 402.A OE1 no hydrogen 3.364 N/A MET 482.A N LEU 478.A O no hydrogen 3.135 N/A ARG 483.A N ARG 479.A O no hydrogen 2.738 N/A ASN 484.A ND2 HIS 480.A O no hydrogen 2.753 N/A HIS 487.A ND1 MET 485.A O no hydrogen 2.621 N/A THR 488.A N ASP 486.A OD1 no hydrogen 3.085 N/A THR 488.A OG1 ASP 486.A OD1 no hydrogen 2.616 N/A SER 490.A OG ASP 486.A O no hydrogen 3.454 N/A CYS 492.A N LEU 489.A O no hydrogen 3.056 N/A CYS 492.A SG ARG 500.A O no hydrogen 3.829 N/A SER 493.A N ARG 500.A O no hydrogen 2.723 N/A THR 495.A N GLY 498.A O no hydrogen 2.917 N/A THR 495.A OG1 GLY 498.A O no hydrogen 2.677 N/A GLU 497.A N THR 495.A OG1 no hydrogen 3.355 N/A GLY 498.A N THR 495.A O no hydrogen 2.984 N/A ARG 500.A N SER 493.A O no hydrogen 2.781 N/A ARG 500.A NH1 ALA 499.A O no hydrogen 3.339 N/A GLN 502.A N LEU 491.A O no hydrogen 3.101 N/A ARG 504.A N ASN 376.A OD1 no hydrogen 2.964 N/A ARG 504.A NH1 ASN 376.A O no hydrogen 3.188 N/A ARG 504.A NH1 ASP 379.A OD1 no hydrogen 2.832 N/A ARG 504.A NH2 ASP 379.A OD1 no hydrogen 2.969 N/A TYR 505.A OH ASP 379.A O no hydrogen 2.647 N/A