Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4gu5_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ALA 4.A N ARG 98.A O no hydrogen 2.846 N/A ASN 5.A N ALA 33.A O no hydrogen 2.822 N/A ASN 5.A ND2 ALA 24.A O no hydrogen 3.123 N/A ASN 5.A ND2 ASP 27.A OD2 no hydrogen 3.076 N/A VAL 6.A N ARG 101.A O no hydrogen 2.875 N/A ILE 7.A N ILE 35.A O no hydrogen 3.212 N/A TRP 8.A N CYS 103.A O no hydrogen 2.874 N/A PHE 9.A N VAL 37.A O no hydrogen 2.815 N/A ARG 10.A N HIS 11.A O no hydrogen 3.188 N/A ARG 10.A NH1 ASP 116.A OD1 no hydrogen 2.711 N/A ARG 10.A NH2 GLU 105.A O no hydrogen 2.934 N/A ARG 10.A NH2 ASP 116.A OD1 no hydrogen 3.562 N/A ARG 10.A NH2 ASP 116.A OD2 no hydrogen 3.534 N/A HIS 11.A ND1 ASP 107.A OD1 no hydrogen 2.783 N/A LEU 13.A N PHE 270.A O no hydrogen 3.164 N/A ARG 14.A N GLY 12.A O no hydrogen 2.903 N/A ARG 14.A NE HIS 16.A O no hydrogen 2.996 N/A ARG 14.A NE ASP 17.A O no hydrogen 3.178 N/A ARG 14.A NH1 GLY 271.A O no hydrogen 2.932 N/A ARG 14.A NH2 ASP 17.A O no hydrogen 2.948 N/A ARG 14.A NH2 SER 135.A O no hydrogen 3.296 N/A LEU 15.A N GLU 225.A OE1 no hydrogen 2.777 N/A LEU 15.A N GLU 225.A OE2 no hydrogen 3.421 N/A HIS 16.A N GLU 225.A OE2 no hydrogen 3.248 N/A HIS 16.A ND1 GLU 225.A OE2 no hydrogen 2.521 N/A ASN 18.A ND2 ARG 14.A O no hydrogen 2.738 N/A LEU 21.A N ASN 18.A OD1 no hydrogen 3.006 N/A LEU 22.A N ASN 18.A O no hydrogen 3.092 N/A ALA 23.A N PRO 19.A O no hydrogen 3.129 N/A ALA 24.A N ALA 20.A O no hydrogen 3.032 N/A LEU 25.A N LEU 21.A O no hydrogen 2.967 N/A ALA 26.A N ALA 23.A O no hydrogen 3.405 N/A LYS 28.A N LEU 25.A O no hydrogen 3.060 N/A LYS 28.A NZ ARG 177.A O no hydrogen 2.970 N/A LYS 28.A NZ ASP 180.A OD1 no hydrogen 2.716 N/A LYS 28.A NZ ASP 180.A OD2 no hydrogen 3.155 N/A GLN 30.A N ASP 27.A O no hydrogen 3.034 N/A GLY 31.A N LYS 28.A O no hydrogen 3.013 N/A ILE 32.A N ASP 27.A O no hydrogen 3.352 N/A ALA 33.A N GLY 3.A O no hydrogen 2.953 N/A LEU 34.A N THR 182.A O no hydrogen 2.838 N/A ILE 35.A N ASN 5.A O no hydrogen 2.841 N/A VAL 37.A N ILE 7.A O no hydrogen 2.960 N/A PHE 38.A N LEU 80.A O no hydrogen 2.872 N/A PHE 40.A N PHE 82.A O no hydrogen 3.046 N/A GLU 43.A N ASP 41.A OD1 no hydrogen 2.984 N/A SER 44.A N ASP 41.A OD1 no hydrogen 2.685 N/A SER 44.A OG ASP 41.A OD1 no hydrogen 3.336 N/A SER 44.A OG ASP 41.A OD2 no hydrogen 2.821 N/A GLY 46.A N GLU 43.A O no hydrogen 3.156 N/A THR 47.A N GLU 43.A O no hydrogen 2.952 N/A THR 47.A OG1 SER 44.A O no hydrogen 2.666 N/A ASN 49.A ND2 GLN 400.A O no hydrogen 3.483 N/A GLY 51.A N LYS 404.A O no hydrogen 2.989 N/A ASN 53.A ND2 ALA 370.A O no hydrogen 2.960 N/A ARG 54.A NH1 LYS 404.A O no hydrogen 2.968 N/A ARG 54.A NH1 LEU 406.A O no hydrogen 3.063 N/A ARG 54.A NH2 GLY 46.A O no hydrogen 2.836 N/A ARG 54.A NH2 ASN 49.A O no hydrogen 3.032 N/A MET 55.A N GLY 51.A O no hydrogen 3.238 N/A ARG 56.A N TYR 52.A O no hydrogen 2.757 N/A PHE 57.A N ASN 53.A O no hydrogen 3.041 N/A LEU 58.A N ARG 54.A O no hydrogen 2.874 N/A LEU 59.A N MET 55.A O no hydrogen 3.038 N/A ASP 60.A N ARG 56.A O no hydrogen 2.965 N/A SER 61.A N PHE 57.A O no hydrogen 3.160 N/A SER 61.A N LEU 58.A O no hydrogen 2.954 N/A SER 61.A OG PHE 57.A O no hydrogen 2.919 N/A LEU 62.A N LEU 58.A O no hydrogen 2.964 N/A GLN 63.A N LEU 59.A O no hydrogen 2.854 N/A ASP 64.A N ASP 60.A O no hydrogen 3.069 N/A ILE 65.A N SER 61.A O no hydrogen 3.136 N/A ASP 66.A N LEU 62.A O no hydrogen 3.014 N/A ASP 67.A N GLN 63.A O no hydrogen 2.787 N/A GLN 68.A N ASP 64.A O no hydrogen 2.957 N/A GLN 68.A NE2 ASP 64.A O no hydrogen 3.696 N/A GLN 68.A NE2 ASP 64.A OD1 no hydrogen 3.114 N/A GLN 68.A NE2 GLU 225.A OE1 no hydrogen 2.761 N/A LEU 69.A N ILE 65.A O no hydrogen 2.858 N/A GLN 70.A N ASP 66.A O no hydrogen 2.909 N/A GLN 70.A NE2 ASP 66.A OD1 no hydrogen 3.520 N/A ALA 71.A N ASP 67.A O no hydrogen 2.873 N/A ALA 72.A N GLN 68.A O no hydrogen 3.042 N/A THR 73.A N GLN 70.A O no hydrogen 3.366 N/A THR 73.A OG1 LEU 69.A O no hydrogen 2.643 N/A THR 73.A OG1 GLN 70.A O no hydrogen 3.551 N/A GLY 75.A N GLN 70.A O no hydrogen 2.863 N/A ARG 76.A N THR 73.A O no hydrogen 3.095 N/A ARG 76.A NE THR 73.A O no hydrogen 3.127 N/A ARG 76.A NH1 ALA 181.A O no hydrogen 3.177 N/A ARG 76.A NH2 ALA 181.A O no hydrogen 3.326 N/A GLY 77.A N THR 73.A OG1 no hydrogen 3.000 N/A ARG 78.A NE ASP 66.A OD1 no hydrogen 2.916 N/A ARG 78.A NH2 ASP 66.A OD1 no hydrogen 3.460 N/A ARG 78.A NH2 ASP 66.A OD2 no hydrogen 2.684 N/A LEU 79.A N ASP 66.A OD1 no hydrogen 3.034 N/A LEU 80.A N PRO 36.A O no hydrogen 2.937 N/A PHE 82.A N PHE 38.A O no hydrogen 2.846 N/A GLU 83.A N LYS 195.A O no hydrogen 3.143 N/A GLY 84.A N PHE 40.A O no hydrogen 3.026 N/A ILE 89.A N GLU 85.A O no hydrogen 2.892 N/A PHE 90.A N PRO 86.A O no hydrogen 2.671 N/A ARG 91.A N ALA 87.A O no hydrogen 3.000 N/A ARG 91.A NH1 GLU 125.A OE2 no hydrogen 3.134 N/A ARG 91.A NH2 GLU 125.A OE1 no hydrogen 3.094 N/A ARG 91.A NH2 GLU 125.A OE2 no hydrogen 3.170 N/A ARG 92.A N TYR 88.A O no hydrogen 3.473 N/A ARG 92.A NH1 TYR 88.A O no hydrogen 3.210 N/A LEU 93.A N ILE 89.A O no hydrogen 2.890 N/A HIS 94.A N PHE 90.A O no hydrogen 2.964 N/A GLU 95.A N ARG 91.A O no hydrogen 3.248 N/A GLN 96.A N ARG 92.A O no hydrogen 3.228 N/A VAL 97.A N LEU 93.A O no hydrogen 2.853 N/A LEU 99.A N HIS 94.A ND1 no hydrogen 3.260 N/A HIS 100.A N ALA 4.A O no hydrogen 2.816 N/A ARG 101.A NE ASP 129.A OD2 no hydrogen 3.313 N/A ILE 102.A N ASP 129.A O no hydrogen 2.843 N/A CYS 103.A N VAL 6.A O no hydrogen 2.803 N/A CYS 103.A SG VAL 6.A O no hydrogen 3.847 N/A ILE 104.A N VAL 131.A O no hydrogen 3.001 N/A GLN 106.A N LYS 133.A O no hydrogen 2.679 N/A TRP 112.A N GLU 109.A O no hydrogen 3.105 N/A TRP 112.A NE1 GLU 109.A OE1 no hydrogen 3.016 N/A ASN 113.A N PRO 110.A O no hydrogen 3.174 N/A ARG 115.A NE ASP 116.A OD1 no hydrogen 3.157 N/A ARG 115.A NH1 SER 44.A OG no hydrogen 2.778 N/A ARG 115.A NH1 ASP 107.A OD2 no hydrogen 3.546 N/A ARG 115.A NH2 ASP 107.A OD2 no hydrogen 2.988 N/A ARG 115.A NH2 ASP 116.A OD1 no hydrogen 3.203 N/A ARG 115.A NH2 ASP 116.A OD2 no hydrogen 3.138 N/A ASP 116.A N TRP 112.A O no hydrogen 2.902 N/A GLU 117.A N ASN 113.A O no hydrogen 2.882 N/A GLU 117.A N GLU 114.A O no hydrogen 3.109 N/A SER 118.A N GLU 114.A O no hydrogen 3.127 N/A SER 118.A OG ARG 115.A O no hydrogen 2.572 N/A ARG 120.A N ASP 116.A O no hydrogen 3.087 N/A ARG 120.A NE GLU 117.A OE2 no hydrogen 3.298 N/A ARG 120.A NH1 GLU 132.A OE1 no hydrogen 3.285 N/A ARG 120.A NH2 GLU 132.A OE1 no hydrogen 2.805 N/A SER 121.A N GLU 117.A O no hydrogen 2.992 N/A SER 121.A OG GLU 117.A O no hydrogen 3.165 N/A SER 121.A OG SER 118.A O no hydrogen 3.062 N/A LEU 122.A N SER 118.A O no hydrogen 3.170 N/A CYS 123.A N ILE 119.A O no hydrogen 2.773 N/A CYS 123.A SG ILE 119.A O no hydrogen 3.264 N/A ARG 124.A N ARG 120.A O no hydrogen 3.050 N/A GLU 125.A N SER 121.A O no hydrogen 3.145 N/A LEU 126.A N LEU 122.A O no hydrogen 3.126 N/A ILE 128.A N CYS 123.A O no hydrogen 2.822 N/A ASP 129.A N HIS 100.A O no hydrogen 2.896 N/A VAL 131.A N ILE 102.A O no hydrogen 3.069 N/A LYS 133.A N ILE 104.A O no hydrogen 3.103 N/A SER 135.A OG ASP 17.A O no hydrogen 3.377 N/A SER 135.A OG GLU 105.A OE1 no hydrogen 2.687 N/A HIS 136.A NE2 TYR 317.A OH no hydrogen 2.728 N/A THR 137.A OG1 TRP 139.A O no hydrogen 2.968 N/A LEU 138.A N GLU 314.A OE1 no hydrogen 2.697 N/A TRP 139.A N GLU 314.A OE2 no hydrogen 2.728 N/A TRP 139.A NE1 GLY 167.A O no hydrogen 2.984 N/A GLN 142.A N ASP 140.A OD1 no hydrogen 2.986 N/A ILE 145.A N PRO 141.A O no hydrogen 3.038 N/A GLU 146.A N GLN 142.A O no hydrogen 2.729 N/A THR 147.A N LEU 143.A O no hydrogen 2.916 N/A THR 147.A OG1 LEU 143.A O no hydrogen 2.682 N/A ASN 148.A N VAL 144.A O no hydrogen 3.035 N/A ASN 148.A N ILE 145.A O no hydrogen 3.079 N/A ASN 148.A ND2 ILE 151.A O no hydrogen 2.732 N/A GLY 149.A N GLU 146.A O no hydrogen 3.397 N/A GLY 150.A N ILE 145.A O no hydrogen 2.779 N/A TYR 156.A OH GLY 308.A O no hydrogen 2.803 N/A GLN 157.A N SER 524.A OG no hydrogen 2.957 N/A MET 158.A N THR 155.A OG1 no hydrogen 3.044 N/A PHE 159.A N THR 155.A O no hydrogen 2.940 N/A LEU 160.A N TYR 156.A O no hydrogen 2.946 N/A HIS 161.A N GLN 157.A O no hydrogen 2.987 N/A THR 162.A N MET 158.A O no hydrogen 3.066 N/A THR 162.A OG1 MET 158.A O no hydrogen 2.848 N/A VAL 163.A N PHE 159.A O no hydrogen 2.942 N/A GLN 164.A N LEU 160.A O no hydrogen 2.913 N/A ILE 165.A N HIS 161.A O no hydrogen 3.157 N/A ILE 166.A N THR 162.A O no hydrogen 3.009 N/A GLY 167.A N VAL 163.A O no hydrogen 2.835 N/A ARG 171.A NH1 ASP 284.A OD2 no hydrogen 3.137 N/A ARG 171.A NH2 ASP 284.A OD1 no hydrogen 3.089 N/A THR 173.A N ASP 17.A OD1 no hydrogen 2.722 N/A THR 173.A OG1 ASP 17.A OD1 no hydrogen 3.485 N/A THR 173.A OG1 ALA 174.A O no hydrogen 3.067 N/A ARG 177.A NE GLU 179.A OE1 no hydrogen 3.517 N/A GLU 179.A N GLU 179.A OE2 no hydrogen 2.702 N/A ALA 181.A N LEU 178.A O no hydrogen 2.988 N/A CYS 191.A N ASP 187.A O no hydrogen 3.143 N/A CYS 191.A SG ASP 187.A O no hydrogen 3.572 N/A ARG 192.A N PRO 188.A O no hydrogen 2.987 N/A ARG 192.A NE GLU 189.A OE1 no hydrogen 3.484 N/A SER 193.A N GLU 189.A O no hydrogen 2.802 N/A LEU 194.A N PHE 190.A O no hydrogen 2.867 N/A LYS 195.A N ARG 192.A O no hydrogen 3.186 N/A LEU 196.A N CYS 191.A O no hydrogen 2.908 N/A PHE 197.A N VAL 81.A O no hydrogen 2.774 N/A THR 202.A OG1 GLU 204.A OE1 no hydrogen 3.396 N/A GLU 204.A N GLU 204.A OE1 no hydrogen 2.765 N/A HIS 205.A N THR 202.A O no hydrogen 2.723 N/A PHE 206.A N PRO 203.A O no hydrogen 2.759 N/A ASN 207.A N GLU 204.A O no hydrogen 2.729 N/A VAL 208.A N PRO 203.A O no hydrogen 3.230 N/A TYR 209.A OH ASN 207.A OD1 no hydrogen 3.282 N/A LYS 218.A N GLU 371.A OE2 no hydrogen 2.889 N/A ILE 219.A N GLU 371.A OE2 no hydrogen 3.367 N/A GLY 223.A N ASP 60.A OD2 no hydrogen 3.155 N/A THR 226.A N ASP 64.A OD2 no hydrogen 2.765 N/A THR 226.A OG1 ASP 64.A OD1 no hydrogen 2.910 N/A THR 226.A OG1 ASP 64.A OD2 no hydrogen 2.895 N/A ALA 228.A N GLY 224.A O no hydrogen 3.162 N/A LEU 229.A N GLU 225.A O no hydrogen 3.101 N/A LEU 230.A N THR 226.A O no hydrogen 3.121 N/A LEU 231.A N GLN 227.A O no hydrogen 2.940 N/A LEU 232.A N ALA 228.A O no hydrogen 2.924 N/A ASP 233.A N LEU 229.A O no hydrogen 3.101 N/A GLU 234.A N LEU 230.A O no hydrogen 3.013 N/A ARG 235.A N LEU 231.A O no hydrogen 2.888 N/A LEU 236.A N LEU 232.A O no hydrogen 2.809 N/A LYS 237.A N ASP 233.A O no hydrogen 2.795 N/A VAL 238.A N GLU 234.A O no hydrogen 2.950 N/A GLU 239.A N ARG 235.A O no hydrogen 2.889 N/A GLN 240.A N LEU 236.A O no hydrogen 2.754 N/A GLN 240.A NE2 GLU 244.A OE2 no hydrogen 3.507 N/A HIS 241.A N LYS 237.A O no hydrogen 3.266 N/A ALA 242.A N VAL 238.A O no hydrogen 3.172 N/A PHE 243.A N GLU 239.A O no hydrogen 2.594 N/A GLU 244.A N GLN 240.A O no hydrogen 2.872 N/A ARG 245.A N HIS 241.A O no hydrogen 2.764 N/A ARG 245.A NE PHE 247.A O no hydrogen 2.796 N/A ARG 245.A NH2 PHE 247.A O no hydrogen 2.886 N/A GLY 246.A N ALA 242.A O no hydrogen 2.685 N/A PHE 247.A N ALA 242.A O no hydrogen 3.094 N/A TYR 248.A OH GLU 239.A OE1 no hydrogen 2.993 N/A TYR 248.A OH GLU 239.A OE2 no hydrogen 2.328 N/A LEU 249.A N GLN 252.A OE1 no hydrogen 3.225 N/A GLN 252.A N LEU 249.A O no hydrogen 2.890 N/A LEU 254.A N ASN 251.A O no hydrogen 3.298 N/A HIS 258.A N ASN 256.A OD1 no hydrogen 3.443 N/A HIS 258.A NE2 ASP 446.A OD1 no hydrogen 3.065 N/A SER 263.A OG SER 265.A OG no hydrogen 3.283 N/A SER 265.A N SER 263.A OG no hydrogen 3.119 N/A SER 265.A OG SER 263.A OG no hydrogen 3.283 N/A SER 265.A OG ASP 408.A OD2 no hydrogen 2.589 N/A HIS 267.A NE2 ARG 222.A O no hydrogen 3.120 N/A LEU 268.A N MET 264.A O no hydrogen 2.915 N/A ARG 269.A N SER 265.A O no hydrogen 2.987 N/A ARG 269.A NE HIS 11.A NE2 no hydrogen 3.164 N/A ARG 269.A NH1 HIS 11.A NE2 no hydrogen 3.259 N/A ARG 269.A NH2 ASP 408.A O no hydrogen 2.793 N/A PHE 270.A N ALA 266.A O no hydrogen 3.028 N/A GLY 271.A N HIS 267.A O no hydrogen 2.833 N/A CYS 272.A SG SER 61.A OG no hydrogen 3.358 N/A LEU 273.A N HIS 267.A O no hydrogen 3.276 N/A SER 274.A N HIS 16.A NE2 no hydrogen 3.133 N/A SER 274.A OG ASP 17.A OD2 no hydrogen 2.468 N/A ARG 276.A NE THR 137.A O no hydrogen 3.244 N/A ARG 276.A NE LEU 138.A O no hydrogen 3.442 N/A ARG 276.A NH1 VAL 134.A O no hydrogen 3.256 N/A ARG 276.A NH2 LEU 138.A O no hydrogen 3.416 N/A ARG 277.A N SER 274.A OG no hydrogen 3.078 N/A PHE 278.A N SER 274.A O no hydrogen 3.169 N/A TYR 279.A N VAL 275.A O no hydrogen 3.005 N/A TRP 280.A N ARG 276.A O no hydrogen 2.809 N/A TRP 280.A NE1 PRO 169.A O no hydrogen 2.932 N/A TRP 280.A NE1 PRO 170.A O no hydrogen 2.938 N/A SER 281.A N ARG 277.A O no hydrogen 2.928 N/A SER 281.A OG ARG 277.A O no hydrogen 2.791 N/A SER 281.A OG PHE 278.A O no hydrogen 3.133 N/A VAL 282.A N PHE 278.A O no hydrogen 3.136 N/A HIS 283.A N TYR 279.A O no hydrogen 2.977 N/A ASP 284.A N TRP 280.A O no hydrogen 2.918 N/A LEU 285.A N SER 281.A O no hydrogen 3.154 N/A PHE 286.A N VAL 282.A O no hydrogen 3.263 N/A LYS 287.A NZ ASP 284.A OD1 no hydrogen 3.468 N/A LEU 291.A N THR 301.A OG1 no hydrogen 2.999 N/A CYS 294.A SG.A ARG 292.A O no hydrogen 3.771 N/A VAL 295.A N VAL 298.A O no hydrogen 2.698 N/A ARG 296.A NH1 ALA 253.A O no hydrogen 3.011 N/A VAL 298.A N VAL 295.A O no hydrogen 2.881 N/A MET 300.A N ALA 293.A O no hydrogen 3.338 N/A GLY 303.A N MET 300.A O no hydrogen 2.828 N/A ALA 304.A N THR 301.A O no hydrogen 3.451 N/A HIS 305.A NE2 GLU 239.A OE1 no hydrogen 3.314 N/A ILE 306.A N GLY 303.A O no hydrogen 2.684 N/A THR 307.A N GLY 303.A O no hydrogen 2.960 N/A THR 307.A OG1 ALA 304.A O no hydrogen 3.553 N/A GLY 308.A N ALA 304.A O no hydrogen 2.795 N/A GLN 309.A N ILE 306.A O no hydrogen 2.806 N/A LEU 310.A N THR 307.A O no hydrogen 2.830 N/A ILE 311.A N THR 307.A O no hydrogen 3.167 N/A TRP 312.A N GLY 308.A O no hydrogen 3.306 N/A ARG 313.A N GLN 309.A O no hydrogen 3.336 N/A ARG 313.A NH1 HIS 136.A O no hydrogen 2.985 N/A ARG 313.A NH2 HIS 136.A O no hydrogen 2.866 N/A ARG 313.A NH2 LEU 268.A O no hydrogen 3.303 N/A GLU 314.A N LEU 310.A O no hydrogen 3.022 N/A TYR 315.A N ILE 311.A O no hydrogen 2.844 N/A TYR 315.A N TRP 312.A O no hydrogen 3.058 N/A TYR 315.A OH LEU 154.A O no hydrogen 2.996 N/A PHE 316.A N TRP 312.A O no hydrogen 3.220 N/A TYR 317.A N ARG 313.A O no hydrogen 3.031 N/A TYR 317.A OH ASP 410.A OD2 no hydrogen 2.370 N/A THR 318.A N GLU 314.A O no hydrogen 2.901 N/A THR 318.A OG1 GLU 314.A O no hydrogen 2.809 N/A MET 319.A N TYR 315.A O no hydrogen 3.319 N/A MET 319.A N PHE 316.A O no hydrogen 3.194 N/A SER 320.A N TYR 317.A O no hydrogen 3.278 N/A SER 320.A OG TYR 317.A O no hydrogen 2.716 N/A ASN 322.A ND2 GLN 142.A OE1 no hydrogen 3.115 N/A ASN 323.A N SER 320.A O no hydrogen 2.846 N/A ASN 323.A ND2 ASN 332.A OD1 no hydrogen 2.806 N/A ASN 325.A N ASN 323.A OD1 no hydrogen 2.988 N/A ASN 325.A ND2 GLY 331.A O no hydrogen 3.439 N/A TYR 326.A N ASN 323.A O no hydrogen 2.978 N/A ARG 328.A N ASN 325.A O no hydrogen 3.188 N/A ARG 328.A NE ASN 325.A OD1 no hydrogen 3.032 N/A ARG 328.A NH2 PRO 324.A O no hydrogen 3.278 N/A MET 329.A N GLU 396.A OE2 no hydrogen 2.682 N/A ASN 332.A N MET 329.A O no hydrogen 2.940 N/A ASN 332.A ND2 ARG 328.A O no hydrogen 3.292 N/A ILE 334.A N ASN 332.A OD1 no hydrogen 3.319 N/A CYS 335.A N ASN 332.A O no hydrogen 3.482 N/A CYS 335.A SG LEU 336.A O no hydrogen 3.295 N/A TRP 340.A N ILE 338.A O no hydrogen 2.921 N/A ALA 341.A N TRP 392.A O no hydrogen 2.918 N/A ASN 344.A N GLN 393.A OE1 no hydrogen 3.060 N/A LEU 347.A N ASN 344.A OD1 no hydrogen 2.995 N/A LEU 348.A N ASN 344.A O no hydrogen 2.913 N/A GLN 349.A N GLU 345.A O no hydrogen 2.855 N/A SER 350.A N ASN 346.A O no hydrogen 2.995 N/A SER 350.A OG ASN 346.A O no hydrogen 3.084 N/A TRP 351.A N LEU 347.A O no hydrogen 3.056 N/A TRP 351.A NE1 VAL 382.A O no hydrogen 3.110 N/A ARG 352.A N LEU 348.A O no hydrogen 2.917 N/A ARG 352.A NH1 GLU 345.A OE2 no hydrogen 3.505 N/A ARG 352.A NH1 GLN 349.A OE1 no hydrogen 3.023 N/A LEU 353.A N GLN 349.A O no hydrogen 2.855 N/A GLY 354.A N TRP 351.A O no hydrogen 3.253 N/A GLN 355.A N SER 350.A O no hydrogen 2.705 N/A THR 356.A N ASP 362.A OD1 no hydrogen 2.811 N/A THR 356.A OG1 ASP 362.A OD1 no hydrogen 2.505 N/A GLY 357.A N ASP 362.A OD2 no hydrogen 2.865 N/A PHE 358.A N THR 356.A OG1 no hydrogen 3.217 N/A ASP 362.A N PHE 358.A O no hydrogen 2.859 N/A GLY 363.A N PRO 359.A O no hydrogen 2.850 N/A ALA 364.A N LEU 360.A O no hydrogen 3.084 N/A MET 365.A N ILE 361.A O no hydrogen 3.007 N/A ARG 366.A N ASP 362.A O no hydrogen 2.906 N/A ARG 366.A NE GLY 354.A O no hydrogen 3.152 N/A ARG 366.A NH1 GLU 458.A OE1 no hydrogen 3.361 N/A ARG 366.A NH1 GLU 458.A OE2 no hydrogen 2.888 N/A ARG 366.A NH2 GLY 354.A O no hydrogen 3.075 N/A ARG 366.A NH2 GLU 458.A OE1 no hydrogen 2.947 N/A GLN 367.A N GLY 363.A O no hydrogen 2.847 N/A GLN 367.A NE2 GLU 371.A OE1 no hydrogen 3.040 N/A LEU 368.A N ALA 364.A O no hydrogen 2.994 N/A LEU 369.A N MET 365.A O no hydrogen 3.135 N/A ALA 370.A N ARG 366.A O no hydrogen 3.007 N/A GLU 371.A N GLN 367.A O no hydrogen 2.789 N/A GLY 372.A N LEU 368.A O no hydrogen 2.915 N/A TRP 373.A NE1 SER 265.A OG no hydrogen 3.065 N/A HIS 375.A ND1 THR 377.A OG1 no hydrogen 3.029 N/A HIS 376.A NE2 PHE 532.A O no hydrogen 2.952 N/A THR 377.A N HIS 375.A ND1 no hydrogen 3.000 N/A THR 377.A OG1 HIS 375.A ND1 no hydrogen 3.029 N/A LEU 378.A N HIS 375.A O no hydrogen 3.010 N/A ARG 379.A N HIS 375.A O no hydrogen 3.072 N/A ARG 379.A NE LEU 374.A O no hydrogen 2.720 N/A ARG 379.A NH1 ASP 408.A OD1 no hydrogen 3.120 N/A ARG 379.A NH1 ASP 408.A OD2 no hydrogen 3.461 N/A ARG 379.A NH2 LEU 374.A O no hydrogen 3.278 N/A ARG 379.A NH2 ASP 408.A OD2 no hydrogen 2.899 N/A ASN 380.A N HIS 376.A O no hydrogen 3.007 N/A ASN 380.A ND2 PHE 532.A O no hydrogen 3.291 N/A THR 381.A N THR 377.A O no hydrogen 3.066 N/A VAL 382.A N LEU 378.A O no hydrogen 3.001 N/A ALA 383.A N ARG 379.A O no hydrogen 3.090 N/A THR 384.A N ASN 380.A O no hydrogen 2.990 N/A THR 384.A OG1 ASN 380.A O no hydrogen 3.288 N/A THR 384.A OG1 THR 381.A O no hydrogen 3.161 N/A PHE 385.A N THR 381.A O no hydrogen 2.935 N/A LEU 386.A N VAL 382.A O no hydrogen 3.058 N/A THR 387.A N ALA 383.A O no hydrogen 3.031 N/A THR 387.A OG1 ALA 383.A O no hydrogen 2.696 N/A ARG 388.A NE ASP 431.A OD1 no hydrogen 3.300 N/A ARG 388.A NE ASP 431.A OD2 no hydrogen 3.345 N/A ARG 388.A NH1 VAL 421.A O no hydrogen 2.921 N/A ARG 388.A NH1 SER 424.A O no hydrogen 3.064 N/A ARG 388.A NH1 SER 424.A OG no hydrogen 3.177 N/A ARG 388.A NH2 SER 424.A O no hydrogen 2.936 N/A ARG 388.A NH2 ASP 431.A OD2 no hydrogen 2.676 N/A GLY 389.A N THR 384.A O no hydrogen 2.890 N/A GLY 390.A N THR 387.A O no hydrogen 3.420 N/A LEU 391.A N PHE 385.A O no hydrogen 2.975 N/A TRP 392.A N THR 387.A O no hydrogen 2.847 N/A TRP 392.A NE1 PRO 339.A O no hydrogen 3.088 N/A GLN 393.A N LEU 386.A O no hydrogen 3.186 N/A GLU 396.A N SER 394.A OG no hydrogen 3.028 N/A LEU 399.A N TRP 395.A O no hydrogen 2.942 N/A GLN 400.A N GLU 396.A O no hydrogen 2.876 N/A HIS 401.A N HIS 397.A O no hydrogen 3.220 N/A PHE 402.A N GLY 398.A O no hydrogen 2.888 N/A LEU 403.A N LEU 399.A O no hydrogen 2.887 N/A LYS 404.A NZ TYR 405.A OH no hydrogen 3.125 N/A TYR 405.A N HIS 401.A O no hydrogen 3.362 N/A LEU 406.A N PHE 402.A O no hydrogen 2.923 N/A LEU 407.A N GLY 372.A O no hydrogen 2.665 N/A ALA 409.A N ASP 408.A OD1 no hydrogen 2.689 N/A TRP 411.A NE1 ASP 327.A OD2 no hydrogen 3.193 N/A SER 412.A N GLU 109.A OE2 no hydrogen 2.736 N/A SER 412.A OG GLU 109.A OE2 no hydrogen 2.747 N/A CYS 414.A N ASP 410.A O no hydrogen 3.010 N/A ALA 415.A N TRP 411.A O no hydrogen 3.200 N/A GLY 416.A N SER 412.A O no hydrogen 2.891 N/A ASN 417.A N VAL 413.A O no hydrogen 2.874 N/A ASN 417.A ND2 VAL 413.A O no hydrogen 2.770 N/A TRP 418.A N CYS 414.A O no hydrogen 2.956 N/A MET 419.A N ALA 415.A O no hydrogen 2.853 N/A TRP 420.A N GLY 416.A O no hydrogen 2.819 N/A VAL 421.A N ASN 417.A O no hydrogen 3.002 N/A SER 422.A N TRP 418.A O no hydrogen 3.103 N/A SER 422.A OG TRP 418.A O no hydrogen 2.811 N/A SER 422.A OG SER 423.A OG no hydrogen 2.989 N/A SER 423.A N MET 419.A O no hydrogen 2.872 N/A SER 423.A OG SER 422.A OG no hydrogen 2.989 N/A SER 424.A OG TRP 420.A O no hydrogen 2.752 N/A GLU 427.A N SER 424.A O no hydrogen 3.361 N/A LEU 430.A N GLU 427.A O no hydrogen 2.830 N/A ASP 431.A N ARG 428.A O no hydrogen 2.970 N/A SER 432.A N LEU 429.A O no hydrogen 2.856 N/A SER 432.A OG LEU 429.A O no hydrogen 2.441 N/A VAL 435.A N SER 432.A O no hydrogen 3.232 N/A THR 436.A N SER 432.A O no hydrogen 3.160 N/A THR 436.A OG1 SER 432.A O no hydrogen 3.065 N/A CYS 437.A N SER 433.A O no hydrogen 3.370 N/A LEU 441.A N CYS 437.A O no hydrogen 3.270 N/A ALA 442.A N PRO 438.A O no hydrogen 2.811 N/A LYS 443.A N VAL 439.A O no hydrogen 3.095 N/A LYS 443.A NZ GLU 469.A OE1 no hydrogen 3.463 N/A ARG 444.A N ALA 440.A O no hydrogen 3.274 N/A ARG 444.A N LEU 441.A O no hydrogen 2.939 N/A ARG 444.A NE ALA 440.A O no hydrogen 3.586 N/A LEU 445.A N LEU 441.A O no hydrogen 2.926 N/A ASP 446.A N ALA 442.A O no hydrogen 2.890 N/A GLY 449.A N ASP 446.A O no hydrogen 3.181 N/A THR 450.A OG1 ASP 446.A OD1 no hydrogen 3.322 N/A TYR 451.A N ASP 446.A OD1 no hydrogen 3.007 N/A TYR 451.A OH GLN 367.A OE1 no hydrogen 2.623 N/A ILE 452.A N ASP 446.A OD2 no hydrogen 2.980 N/A LYS 453.A N GLY 449.A O no hydrogen 2.812 N/A LYS 453.A NZ ASP 448.A O no hydrogen 3.493 N/A GLN 454.A N THR 450.A O no hydrogen 3.015 N/A TYR 455.A N TYR 451.A O no hydrogen 3.285 N/A TYR 455.A N ILE 452.A O no hydrogen 3.166 N/A TYR 455.A OH GLU 371.A OE1 no hydrogen 2.777 N/A TYR 455.A OH GLU 371.A OE2 no hydrogen 2.572 N/A VAL 456.A N ILE 452.A O no hydrogen 2.672 N/A GLU 458.A N GLU 458.A OE2 no hydrogen 2.922 N/A LEU 459.A N VAL 456.A O no hydrogen 2.996 N/A MET 460.A N PRO 457.A O no hydrogen 3.130 N/A VAL 462.A N LEU 459.A O no hydrogen 2.901 N/A LYS 464.A NZ ASP 448.A OD1 no hydrogen 3.032 N/A PHE 466.A N PRO 463.A O no hydrogen 2.903 N/A HIS 468.A NE2 ASP 446.A O no hydrogen 2.706 N/A GLU 469.A N PHE 466.A O no hydrogen 3.102 N/A ARG 472.A N GLU 469.A O no hydrogen 3.022 N/A MET 473.A N PRO 470.A O no hydrogen 3.091 N/A SER 474.A N GLN 477.A OE1 no hydrogen 2.684 N/A SER 474.A OG GLN 477.A OE1 no hydrogen 2.944 N/A GLU 476.A N GLU 476.A OE1 no hydrogen 2.814 N/A GLN 477.A N SER 474.A OG no hydrogen 3.387 N/A GLN 478.A N SER 474.A O no hydrogen 3.037 N/A GLN 478.A NE2 MET 473.A O no hydrogen 3.282 N/A GLN 478.A NE2 SER 474.A O no hydrogen 3.688 N/A GLU 479.A N ALA 475.A O no hydrogen 3.138 N/A GLN 480.A N GLU 476.A O no hydrogen 3.003 N/A TYR 481.A N GLN 477.A O no hydrogen 2.870 N/A GLU 482.A N GLU 479.A O no hydrogen 3.405 N/A CYS 483.A N GLN 478.A O no hydrogen 2.882 N/A CYS 483.A SG GLU 458.A O no hydrogen 3.870 N/A LEU 484.A N HIS 488.A ND1 no hydrogen 2.997 N/A ILE 485.A N GLN 478.A OE1 no hydrogen 2.704 N/A GLY 486.A N TYR 489.A O no hydrogen 2.827 N/A VAL 487.A N LEU 484.A O no hydrogen 3.240 N/A HIS 488.A N LEU 484.A O no hydrogen 3.135 N/A TYR 489.A OH ASP 362.A OD2 no hydrogen 2.732 N/A ILE 493.A N THR 356.A O no hydrogen 2.987 N/A ALA 499.A N ASP 495.A O no hydrogen 2.864 N/A VAL 500.A N LEU 496.A O no hydrogen 2.773 N/A LYS 501.A N SER 497.A O no hydrogen 2.967 N/A ARG 502.A N MET 498.A O no hydrogen 2.886 N/A ASN 503.A N ALA 499.A O no hydrogen 2.931 N/A ASN 503.A ND2 ARG 388.A O no hydrogen 3.580 N/A ASN 503.A ND2 GLY 390.A O no hydrogen 3.085 N/A MET 504.A N VAL 500.A O no hydrogen 2.791 N/A LEU 505.A N LYS 501.A O no hydrogen 3.004 N/A ALA 506.A N ARG 502.A O no hydrogen 3.160 N/A MET 507.A N ASN 503.A O no hydrogen 3.103 N/A LYS 508.A N MET 504.A O no hydrogen 3.013 N/A SER 509.A N LEU 505.A O no hydrogen 2.832 N/A LEU 510.A N MET 507.A O no hydrogen 2.868 N/A ARG 511.A N MET 507.A O no hydrogen 2.839 N/A ARG 511.A NH1 ALA 425.A O no hydrogen 2.750 N/A ASN 512.A N LYS 508.A O no hydrogen 3.134 N/A SER 513.A N LEU 510.A O no hydrogen 3.414 N/A SER 513.A OG SER 509.A O no hydrogen 3.342 N/A ILE 515.A N ARG 511.A O no hydrogen 2.798 N/A THR 516.A N LEU 514.A O no hydrogen 2.753 N/A HIS 520.A ND1 PRO 518.A O no hydrogen 2.900 N/A CYS 521.A N ILE 334.A O no hydrogen 2.879 N/A ARG 522.A N LEU 154.A O no hydrogen 3.252 N/A SER 524.A N GLU 528.A OE1 no hydrogen 2.939 N/A SER 524.A OG GLU 528.A OE1 no hydrogen 3.274 N/A SER 524.A OG GLU 528.A OE2 no hydrogen 2.375 N/A GLU 528.A N ASN 525.A OD1 no hydrogen 2.758 N/A ARG 530.A N GLU 526.A O no hydrogen 3.079 N/A ARG 530.A NE GLU 527.A OE2 no hydrogen 3.001 N/A ARG 530.A NH2 GLU 527.A OE2 no hydrogen 3.355 N/A GLN 531.A N GLU 527.A O no hydrogen 2.961 N/A GLN 531.A NE2 GLU 527.A OE1 no hydrogen 3.506 N/A PHE 532.A N GLU 528.A O no hydrogen 2.863 N/A PHE 533.A N VAL 529.A O no hydrogen 2.991 N/A TRP 534.A N GLN 531.A O no hydrogen 2.846 N/A LEU 535.A N ARG 530.A O no hydrogen 2.940 N/A