Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3s8v_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): PHE 5.A N PHE 254.A O no hydrogen 3.314 N/A LEU 6.A N ILE 17.A O no hydrogen 2.692 N/A LEU 7.A N LEU 252.A O no hydrogen 3.006 N/A PHE 8.A N ARG 15.A O no hydrogen 3.020 N/A SER 9.A N MET 249.A O no hydrogen 3.395 N/A SER 9.A OG SER 37.A O no hydrogen 2.953 N/A SER 9.A OG MET 249.A O no hydrogen 2.737 N/A ARG 10.A N ASP 13.A O no hydrogen 2.821 N/A ARG 10.A NH1 ASP 246.A O no hydrogen 3.096 N/A ARG 11.A NH1 GLU 35.A OE1 no hydrogen 3.401 N/A ALA 12.A N ARG 10.A O no hydrogen 2.536 N/A ARG 15.A N PHE 8.A O no hydrogen 2.734 N/A ARG 15.A NH1 ASP 13.A OD1 no hydrogen 2.905 N/A ARG 15.A NH2 ASN 25.A O no hydrogen 3.535 N/A ARG 16.A N VAL 26.A O no hydrogen 2.941 N/A ARG 16.A NH2 GLU 3.A OE2 no hydrogen 2.631 N/A ILE 17.A N LEU 6.A O no hydrogen 2.929 N/A SER 18.A OG ASN 23.A OD1 no hydrogen 3.348 N/A GLU 20.A N SER 18.A OG no hydrogen 2.813 N/A THR 21.A N GLU 20.A OE1 no hydrogen 3.431 N/A ASN 23.A N GLU 20.A O no hydrogen 3.484 N/A ASN 23.A ND2 ASN 24.A OD1 no hydrogen 3.340 N/A ASN 25.A ND2 VAL 26.A O no hydrogen 3.550 N/A VAL 26.A N ARG 16.A O no hydrogen 3.317 N/A ILE 28.A N ILE 14.A O no hydrogen 2.891 N/A LEU 30.A N ILE 28.A O no hydrogen 2.792 N/A LYS 34.A N ASP 52.A OD2 no hydrogen 2.720 N/A GLU 35.A N ASP 52.A OD1 no hydrogen 3.194 N/A GLU 35.A N ASP 52.A OD2 no hydrogen 3.103 N/A ALA 36.A N ARG 11.A O no hydrogen 2.925 N/A SER 37.A N THR 51.A O no hydrogen 2.731 N/A PHE 41.A N ASP 40.A OD1 no hydrogen 2.622 N/A ASP 42.A N ARG 47.A O no hydrogen 2.789 N/A VAL 43.A N GLN 259.A OE1 no hydrogen 2.901 N/A ASN 46.A N VAL 43.A O no hydrogen 3.102 N/A ARG 47.A N ASP 42.A O no hydrogen 3.022 N/A ARG 47.A NE ASP 45.A OD1 no hydrogen 3.294 N/A ILE 48.A N ALA 61.A O no hydrogen 2.793 N/A TYR 49.A N ASP 40.A O no hydrogen 2.648 N/A TRP 50.A N SER 59.A O no hydrogen 2.982 N/A THR 51.A N ALA 38.A O no hydrogen 3.044 N/A ASP 52.A N THR 57.A O no hydrogen 2.820 N/A ILE 53.A N GLU 35.A O no hydrogen 2.887 N/A SER 54.A N ASP 52.A OD1 no hydrogen 2.764 N/A LEU 55.A N ASP 52.A OD1 no hydrogen 2.854 N/A LYS 56.A NZ ILE 53.A O no hydrogen 2.780 N/A LYS 56.A NZ ASP 77.A O no hydrogen 2.843 N/A THR 57.A N ASP 52.A O no hydrogen 2.989 N/A ILE 58.A N VAL 72.A O no hydrogen 3.079 N/A SER 59.A N TRP 50.A O no hydrogen 2.867 N/A SER 59.A OG HIS 70.A ND1 no hydrogen 2.885 N/A ARG 60.A N GLU 69.A O no hydrogen 3.099 N/A ARG 60.A NE GLU 69.A OE2 no hydrogen 3.421 N/A ARG 60.A NH1 TYR 49.A OH no hydrogen 2.684 N/A ARG 60.A NH2 GLU 69.A OE2 no hydrogen 3.565 N/A ALA 61.A N ILE 48.A O no hydrogen 3.180 N/A PHE 62.A N SER 66.A O no hydrogen 3.222 N/A MET 63.A N ASN 46.A O no hydrogen 3.307 N/A GLY 65.A N PHE 62.A O no hydrogen 2.736 N/A GLU 69.A N ARG 60.A O no hydrogen 3.056 N/A HIS 70.A ND1 SER 59.A OG no hydrogen 2.885 N/A VAL 71.A N ILE 58.A O no hydrogen 2.878 N/A VAL 72.A N ILE 58.A O no hydrogen 3.090 N/A ASP 77.A N ASP 95.A OD2 no hydrogen 2.724 N/A TYR 78.A N ASP 95.A OD1 no hydrogen 3.099 N/A GLY 81.A N ALA 94.A O no hydrogen 3.366 N/A ALA 83.A N TYR 92.A O no hydrogen 2.716 N/A VAL 84.A N ASP 40.A OD2 no hydrogen 3.137 N/A ASP 85.A N ASN 90.A O no hydrogen 2.974 N/A LEU 87.A N ASP 85.A OD1 no hydrogen 3.115 N/A GLY 88.A N ASP 85.A OD1 no hydrogen 3.212 N/A LYS 89.A NZ TRP 86.A O no hydrogen 2.640 N/A ASN 90.A N ASP 85.A O no hydrogen 3.270 N/A ASN 90.A ND2 ASP 85.A OD2 no hydrogen 3.130 N/A ASN 90.A ND2 CYS 276.A O no hydrogen 2.807 N/A LEU 91.A N SER 104.A O no hydrogen 2.708 N/A TYR 92.A N ALA 83.A O no hydrogen 2.845 N/A TYR 92.A OH MET 150.A O no hydrogen 3.060 N/A TRP 93.A N GLU 102.A O no hydrogen 3.216 N/A TRP 93.A NE1 GLU 102.A OE1 no hydrogen 2.692 N/A ALA 94.A N GLY 81.A O no hydrogen 2.772 N/A ASP 95.A N ARG 100.A O no hydrogen 2.936 N/A THR 96.A N TYR 78.A O no hydrogen 2.730 N/A GLY 97.A N ASP 95.A OD1 no hydrogen 2.807 N/A THR 98.A N ASP 95.A OD1 no hydrogen 2.752 N/A ARG 100.A N ASP 95.A O no hydrogen 3.206 N/A ARG 100.A NH1 ASP 324.A O no hydrogen 2.828 N/A ARG 100.A NH2 ASP 324.A O no hydrogen 2.756 N/A ILE 101.A N VAL 115.A O no hydrogen 3.066 N/A GLU 102.A N TRP 93.A O no hydrogen 2.842 N/A VAL 103.A N GLN 112.A O no hydrogen 2.895 N/A SER 104.A N LEU 91.A O no hydrogen 3.101 N/A SER 104.A OG LYS 105.A O no hydrogen 2.880 N/A LYS 105.A N GLN 109.A O no hydrogen 2.951 N/A LEU 106.A N LYS 89.A O no hydrogen 3.272 N/A GLY 108.A N LYS 105.A O no hydrogen 2.845 N/A GLN 109.A N ASP 107.A OD2 no hydrogen 3.172 N/A ARG 111.A NE GLU 102.A OE2 no hydrogen 2.719 N/A ARG 111.A NH1 PHE 74.A O no hydrogen 2.539 N/A ARG 111.A NH2 PHE 74.A O no hydrogen 3.316 N/A ARG 111.A NH2 GLU 102.A OE1 no hydrogen 2.943 N/A ARG 111.A NH2 GLU 102.A OE2 no hydrogen 2.979 N/A GLN 112.A N VAL 103.A O no hydrogen 2.687 N/A GLN 112.A NE2 CYS 286.A O no hydrogen 2.820 N/A VAL 113.A N GLN 112.A OE1 no hydrogen 2.772 N/A LEU 114.A N ILE 101.A O no hydrogen 3.055 N/A VAL 115.A N ILE 101.A O no hydrogen 3.304 N/A SER 121.A OG THR 96.A O no hydrogen 3.490 N/A SER 121.A OG THR 96.A OG1 no hydrogen 3.427 N/A SER 121.A OG ASP 120.A O no hydrogen 3.254 N/A ARG 123.A N THR 137.A O no hydrogen 3.025 N/A ARG 123.A NE ASN 166.A OD1 no hydrogen 2.960 N/A ARG 123.A NH1 GLU 80.A OE1 no hydrogen 2.838 N/A ALA 124.A N THR 137.A OG1 no hydrogen 2.775 N/A ALA 126.A N TYR 135.A O no hydrogen 2.761 N/A ASP 128.A N PHE 133.A O no hydrogen 3.032 N/A GLU 131.A N ASP 128.A O no hydrogen 3.295 N/A GLY 132.A N PRO 129.A O no hydrogen 3.187 N/A PHE 133.A N ASP 128.A O no hydrogen 3.239 N/A MET 134.A N ALA 148.A O no hydrogen 2.734 N/A TYR 135.A N ALA 126.A O no hydrogen 2.803 N/A TYR 135.A OH MET 192.A O no hydrogen 3.250 N/A TRP 136.A N ASP 146.A O no hydrogen 2.999 N/A TRP 136.A NE1 GLU 138.A OE2 no hydrogen 3.049 N/A THR 137.A N ALA 124.A O no hydrogen 2.943 N/A THR 137.A OG1 ALA 165.A O no hydrogen 3.255 N/A GLU 138.A N LYS 144.A O no hydrogen 2.775 N/A TRP 139.A N SER 121.A O no hydrogen 2.870 N/A TRP 139.A NE1 ALA 165.A O no hydrogen 2.789 N/A GLY 141.A N ASP 120.A OD1 no hydrogen 3.132 N/A LYS 142.A NZ PRO 160.A O no hydrogen 2.641 N/A LYS 142.A NZ ASN 161.A OD1 no hydrogen 3.261 N/A LYS 144.A N GLU 138.A O no hydrogen 3.197 N/A LYS 144.A NZ GLU 138.A OE1 no hydrogen 2.844 N/A ILE 145.A N VAL 159.A O no hydrogen 2.752 N/A ASP 146.A N TRP 136.A O no hydrogen 3.061 N/A ARG 147.A N THR 156.A O no hydrogen 2.754 N/A ALA 148.A N MET 134.A O no hydrogen 3.012 N/A ALA 149.A N SER 153.A O no hydrogen 2.832 N/A MET 150.A N GLY 132.A O no hydrogen 2.830 N/A GLY 152.A N ALA 149.A O no hydrogen 2.854 N/A SER 153.A N ASP 151.A OD1 no hydrogen 3.033 N/A SER 153.A OG ASP 151.A OD1 no hydrogen 2.658 N/A SER 153.A OG ASP 151.A OD2 no hydrogen 3.413 N/A ARG 155.A NE ASP 146.A OD2 no hydrogen 2.892 N/A ARG 155.A NH1 LYS 117.A O no hydrogen 3.091 N/A ARG 155.A NH1 ASP 118.A O no hydrogen 3.332 N/A ARG 155.A NH2 ASP 118.A O no hydrogen 3.340 N/A ARG 155.A NH2 ASP 146.A OD2 no hydrogen 3.135 N/A THR 156.A N ARG 147.A O no hydrogen 2.809 N/A VAL 159.A N ILE 145.A O no hydrogen 3.060 N/A GLY 163.A N ASP 181.A OD2 no hydrogen 2.804 N/A ARG 164.A N ASP 183.A OD1 no hydrogen 3.088 N/A ARG 164.A NE ASP 183.A OD1 no hydrogen 3.129 N/A ARG 164.A NH2 ASP 183.A OD2 no hydrogen 2.726 N/A ASN 166.A N THR 180.A O no hydrogen 3.092 N/A ASN 166.A ND2 PHE 208.A O no hydrogen 2.788 N/A ASN 166.A ND2 ASP 250.A OD1 no hydrogen 3.509 N/A GLY 167.A N THR 180.A OG1 no hydrogen 2.947 N/A THR 169.A N TYR 178.A O no hydrogen 3.104 N/A THR 169.A OG1 TYR 178.A O no hydrogen 3.556 N/A ASP 171.A N ARG 176.A O no hydrogen 2.855 N/A TYR 172.A OH LEU 127.A O no hydrogen 2.604 N/A LYS 174.A N ASP 171.A OD1 no hydrogen 3.265 N/A ARG 175.A N ASP 171.A O no hydrogen 2.808 N/A ARG 175.A NH1 ASP 128.A OD1 no hydrogen 2.487 N/A ARG 175.A NH2 ASP 128.A OD1 no hydrogen 3.119 N/A ARG 176.A NE SER 189.A OG no hydrogen 3.063 N/A ARG 176.A NH1 ASN 196.A OD1 no hydrogen 3.249 N/A ARG 176.A NH2 SER 189.A OG no hydrogen 3.364 N/A ARG 176.A NH2 ASN 196.A O no hydrogen 3.043 N/A LEU 177.A N SER 190.A O no hydrogen 3.026 N/A TYR 178.A N THR 169.A O no hydrogen 3.155 N/A TRP 179.A N GLU 188.A O no hydrogen 2.970 N/A THR 180.A OG1 PHE 208.A O no hydrogen 2.795 N/A ASP 181.A N LEU 186.A O no hydrogen 2.725 N/A LEU 182.A N ARG 164.A O no hydrogen 2.843 N/A ASP 183.A N ASP 181.A OD1 no hydrogen 2.934 N/A THR 184.A N ASP 181.A OD1 no hydrogen 3.084 N/A THR 184.A OG1 ASP 181.A OD1 no hydrogen 3.325 N/A LEU 186.A N ASP 181.A O no hydrogen 3.249 N/A ILE 187.A N ALA 201.A O no hydrogen 2.902 N/A GLU 188.A N TRP 179.A O no hydrogen 2.908 N/A SER 189.A N GLU 198.A O no hydrogen 3.303 N/A SER 189.A OG LEU 177.A O no hydrogen 3.171 N/A SER 189.A OG SER 190.A O no hydrogen 3.553 N/A SER 190.A N LEU 177.A O no hydrogen 2.914 N/A SER 190.A OG ASN 191.A O no hydrogen 3.251 N/A ASN 191.A N LEU 195.A O no hydrogen 3.028 N/A LEU 193.A N ASN 191.A OD1 no hydrogen 2.935 N/A GLY 194.A N ASN 191.A O no hydrogen 2.878 N/A ARG 197.A NE GLU 188.A OE1 no hydrogen 2.791 N/A ARG 197.A NH1 ASN 161.A O no hydrogen 3.236 N/A ARG 197.A NH2 ASN 161.A O no hydrogen 2.617 N/A ILE 200.A N ILE 187.A O no hydrogen 2.751 N/A HIS 206.A N ASP 221.A OD1 no hydrogen 3.352 N/A HIS 206.A N ASP 221.A OD2 no hydrogen 3.205 N/A PHE 208.A N THR 220.A O no hydrogen 2.925 N/A GLY 209.A N THR 220.A OG1 no hydrogen 2.833 N/A THR 211.A N TYR 218.A O no hydrogen 2.798 N/A THR 211.A OG1 ILE 251.A O no hydrogen 2.573 N/A GLN 212.A NE2 GLN 214.A O no hydrogen 2.674 N/A TYR 213.A N TYR 216.A O no hydrogen 3.046 N/A TYR 213.A OH HIS 255.A ND1 no hydrogen 2.704 N/A ILE 217.A N ALA 230.A O no hydrogen 2.695 N/A TYR 218.A N THR 211.A O no hydrogen 2.714 N/A TRP 219.A N GLU 228.A O no hydrogen 2.884 N/A THR 220.A N GLY 209.A O no hydrogen 3.193 N/A THR 220.A OG1 VAL 248.A O no hydrogen 2.978 N/A ASP 221.A N SER 226.A O no hydrogen 3.081 N/A TRP 222.A N HIS 206.A O no hydrogen 2.923 N/A ARG 224.A N ASP 221.A OD1 no hydrogen 2.798 N/A ARG 225.A N TRP 222.A O no hydrogen 3.241 N/A ARG 225.A NE ASP 246.A OD1 no hydrogen 2.961 N/A ARG 225.A NH2 ASP 246.A OD2 no hydrogen 2.662 N/A SER 226.A N ASP 221.A O no hydrogen 3.120 N/A SER 226.A OG GLU 228.A OE2 no hydrogen 2.546 N/A ILE 227.A N GLN 242.A O no hydrogen 2.681 N/A GLU 228.A N TRP 219.A O no hydrogen 2.849 N/A ARG 229.A N THR 239.A O no hydrogen 2.984 N/A ALA 230.A N ILE 217.A O no hydrogen 2.897 N/A ASN 231.A N GLN 236.A O no hydrogen 2.776 N/A ASN 231.A ND2 ASP 215.A O no hydrogen 3.004 N/A LYS 232.A N ASP 215.A O no hydrogen 2.980 N/A LYS 232.A NZ ASP 171.A OD2 no hydrogen 2.725 N/A LYS 232.A NZ GLN 214.A O no hydrogen 3.106 N/A SER 234.A N ASN 231.A OD1 no hydrogen 3.283 N/A SER 234.A OG ASN 231.A OD1 no hydrogen 2.754 N/A GLY 235.A N ASN 231.A O no hydrogen 2.912 N/A GLN 236.A N SER 234.A OG no hydrogen 3.290 N/A ILE 241.A N ILE 227.A O no hydrogen 2.800 N/A GLN 242.A N ILE 227.A O no hydrogen 3.137 N/A GLN 242.A NE2 ASN 23.A O no hydrogen 3.449 N/A LEU 245.A N ARG 225.A O no hydrogen 3.028 N/A LEU 252.A N LEU 7.A O no hydrogen 2.925 N/A PHE 254.A N PHE 5.A O no hydrogen 2.660 N/A ARG 258.A N HIS 255.A O no hydrogen 3.232 N/A GLN 259.A NE2 PHE 41.A O no hydrogen 2.592 N/A ASN 263.A ND2 GLY 281.A O no hydrogen 3.627 N/A ALA 266.A N ASN 263.A O no hydrogen 3.313 N/A SER 267.A N GLU 264.A O no hydrogen 3.361 N/A ASN 269.A ND2 CYS 272.A O no hydrogen 3.545 N/A ASN 269.A ND2 HIS 274.A O no hydrogen 3.339 N/A HIS 271.A N SER 268.A O no hydrogen 3.238 N/A CYS 272.A N ASN 269.A O no hydrogen 3.392 N/A CYS 272.A SG ASN 269.A O no hydrogen 3.497 N/A CYS 272.A SG GLY 270.A O no hydrogen 3.865 N/A SER 273.A N ARG 297.A O no hydrogen 2.961 N/A SER 273.A OG HIS 274.A ND1 no hydrogen 2.729 N/A SER 273.A OG ARG 297.A O no hydrogen 3.238 N/A HIS 274.A ND1 SER 273.A OG no hydrogen 2.729 N/A LEU 275.A N GLY 285.A O no hydrogen 3.100 N/A CYS 276.A SG ASN 269.A O no hydrogen 3.426 N/A LEU 277.A N VAL 283.A O no hydrogen 3.040 N/A VAL 279.A N GLY 281.A O no hydrogen 3.373 N/A VAL 283.A N LEU 277.A O no hydrogen 3.018 N/A GLY 285.A N LEU 275.A O no hydrogen 2.679 N/A ALA 288.A N ARG 111.A O no hydrogen 2.981 N/A HIS 289.A NE2 PRO 323.A O no hydrogen 2.832 N/A TYR 290.A N PRO 287.A O no hydrogen 2.904 N/A SER 291.A N SER 300.A O no hydrogen 3.060 N/A ASN 293.A N THR 298.A O no hydrogen 2.877 N/A ASN 296.A N ASN 293.A O no hydrogen 3.024 N/A ARG 297.A N ASP 295.A OD1 no hydrogen 2.928 N/A THR 298.A N ASP 295.A OD1 no hydrogen 2.842 N/A THR 298.A OG1 ASP 295.A OD1 no hydrogen 3.159 N/A THR 298.A OG1 ASP 295.A OD2 no hydrogen 2.916 N/A CYS 299.A SG HIS 274.A ND1 no hydrogen 3.429 N/A CYS 299.A SG GLY 285.A O no hydrogen 3.746 N/A SER 300.A N SER 291.A O no hydrogen 2.963 N/A SER 300.A OG SER 291.A O no hydrogen 3.004 N/A SER 300.A OG ASN 293.A OD1 no hydrogen 3.003 N/A PHE 305.A N VAL 551.A O no hydrogen 2.980 N/A LEU 306.A N MET 317.A O no hydrogen 2.723 N/A LEU 307.A N HIS 549.A O no hydrogen 2.887 N/A PHE 308.A N ASN 315.A O no hydrogen 3.088 N/A SER 309.A N ASP 547.A O no hydrogen 2.812 N/A SER 309.A OG GLN 310.A O no hydrogen 3.565 N/A SER 309.A OG SER 546.A OG no hydrogen 2.689 N/A GLN 310.A N ALA 313.A O no hydrogen 2.836 N/A GLN 310.A NE2 ASN 315.A OD1 no hydrogen 3.452 N/A ASN 315.A N PHE 308.A O no hydrogen 2.914 N/A ASN 315.A ND2 PHE 308.A O no hydrogen 3.030 N/A ARG 316.A N ILE 325.A O no hydrogen 2.874 N/A ARG 316.A NE HIS 289.A ND1 no hydrogen 2.854 N/A ARG 316.A NH1 GLU 362.A OE2 no hydrogen 3.226 N/A ARG 316.A NH2 HIS 289.A ND1 no hydrogen 3.437 N/A MET 317.A N LEU 306.A O no hydrogen 2.940 N/A ILE 325.A N ARG 316.A O no hydrogen 2.937 N/A LEU 327.A N ILE 314.A O no hydrogen 2.850 N/A ILE 329.A N LEU 327.A O no hydrogen 2.884 N/A ARG 333.A N ASP 351.A OD1 no hydrogen 3.052 N/A ARG 333.A NE LEU 332.A O no hydrogen 3.592 N/A ASN 334.A N ASP 351.A OD2 no hydrogen 3.328 N/A VAL 335.A N LYS 311.A O no hydrogen 2.667 N/A ARG 336.A N ILE 350.A O no hydrogen 2.828 N/A ILE 338.A N ASP 547.A OD2 no hydrogen 2.619 N/A ASP 339.A N TYR 348.A O no hydrogen 2.643 N/A TYR 340.A N ASP 339.A OD1 no hydrogen 2.949 N/A TYR 340.A OH GLU 362.A OE1 no hydrogen 2.580 N/A ASP 341.A N GLN 346.A O no hydrogen 2.882 N/A LEU 343.A N ASP 341.A OD2 no hydrogen 3.407 N/A ASP 344.A N ASP 341.A OD1 no hydrogen 3.221 N/A GLN 346.A N ASP 341.A O no hydrogen 3.005 N/A GLN 346.A NE2 ASP 344.A O no hydrogen 3.105 N/A LEU 347.A N ALA 360.A O no hydrogen 2.758 N/A TYR 348.A N ASP 339.A O no hydrogen 2.917 N/A TRP 349.A N ARG 358.A O no hydrogen 2.810 N/A ILE 350.A N ALA 337.A O no hydrogen 2.924 N/A ASP 351.A N MET 356.A O no hydrogen 3.120 N/A SER 352.A N ASN 334.A O no hydrogen 2.732 N/A MET 356.A N ASP 351.A O no hydrogen 3.449 N/A ILE 357.A N VAL 371.A O no hydrogen 2.957 N/A ARG 358.A N TRP 349.A O no hydrogen 2.735 N/A LYS 359.A N PHE 368.A O no hydrogen 2.816 N/A LYS 359.A NZ GLN 346.A OE1 no hydrogen 2.703 N/A ALA 360.A N LEU 347.A O no hydrogen 3.146 N/A GLY 364.A N GLN 361.A O no hydrogen 2.750 N/A SER 365.A OG ASP 363.A OD2 no hydrogen 2.400 N/A PHE 368.A N LYS 359.A O no hydrogen 2.733 N/A VAL 370.A N ILE 357.A O no hydrogen 2.677 N/A VAL 371.A N ILE 357.A O no hydrogen 3.372 N/A SER 373.A OG ASN 355.A O no hydrogen 3.503 N/A SER 373.A OG ILE 374.A O no hydrogen 3.332 N/A GLN 375.A NE2 ASN 355.A OD1 no hydrogen 3.381 N/A TYR 377.A N THR 391.A O no hydrogen 2.901 N/A LEU 379.A N ASP 378.A OD1 no hydrogen 2.961 N/A SER 380.A N TYR 389.A O no hydrogen 2.836 N/A ASP 382.A N TYR 387.A O no hydrogen 2.974 N/A TYR 384.A N ASP 382.A OD1 no hydrogen 3.191 N/A SER 385.A N ASP 382.A OD1 no hydrogen 2.749 N/A SER 385.A OG ASP 382.A OD2 no hydrogen 3.335 N/A SER 385.A OG ASN 568.A OD1 no hydrogen 3.218 N/A ARG 386.A NH1 ASP 341.A OD1 no hydrogen 3.073 N/A ARG 386.A NH2 ASP 344.A OD1 no hydrogen 2.920 N/A TYR 387.A N ASP 382.A O no hydrogen 3.318 N/A TYR 387.A OH HIS 573.A O no hydrogen 2.736 N/A ILE 388.A N THR 401.A O no hydrogen 2.897 N/A TYR 389.A N SER 380.A O no hydrogen 2.843 N/A TYR 389.A OH LEU 448.A O no hydrogen 3.051 N/A TRP 390.A N ASN 399.A O no hydrogen 3.013 N/A THR 391.A N ASP 378.A O no hydrogen 3.125 N/A THR 391.A OG1 ASP 378.A O no hydrogen 3.201 N/A THR 391.A OG1 ARG 420.A O no hydrogen 2.571 N/A CYS 392.A N VAL 397.A O no hydrogen 2.902 N/A CYS 392.A SG GLN 375.A O no hydrogen 3.662 N/A CYS 392.A SG THR 395.A OG1 no hydrogen 3.040 N/A GLU 393.A N GLN 375.A O no hydrogen 2.651 N/A ILE 398.A N LEU 412.A O no hydrogen 3.000 N/A VAL 400.A N GLY 409.A O no hydrogen 2.664 N/A THR 401.A N ILE 388.A O no hydrogen 3.168 N/A ARG 402.A N ARG 406.A O no hydrogen 2.807 N/A ARG 402.A NH2 SER 572.A O no hydrogen 3.121 N/A ARG 406.A N ASP 404.A OD1 no hydrogen 2.819 N/A VAL 408.A N VAL 400.A O no hydrogen 3.021 N/A GLY 409.A N VAL 400.A O no hydrogen 2.928 N/A VAL 411.A N ILE 398.A O no hydrogen 3.104 N/A ARG 418.A N ASN 435.A OD1 no hydrogen 2.648 N/A ARG 420.A N THR 434.A O no hydrogen 2.655 N/A ARG 420.A NH1 CYS 392.A O no hydrogen 3.430 N/A ARG 420.A NH1 ASN 396.A OD1 no hydrogen 3.257 N/A ARG 420.A NH1 PRO 419.A O no hydrogen 2.611 N/A ARG 420.A NH2 ASN 396.A OD1 no hydrogen 2.451 N/A ILE 422.A N ASP 378.A OD2 no hydrogen 3.240 N/A VAL 423.A N TYR 432.A O no hydrogen 2.917 N/A VAL 424.A N SER 380.A OG no hydrogen 3.176 N/A ASN 425.A N TYR 430.A O no hydrogen 2.972 N/A LYS 428.A N ASN 425.A O no hydrogen 3.190 N/A LYS 428.A NZ SER 471.A O no hydrogen 3.468 N/A GLY 429.A N ASN 425.A O no hydrogen 2.906 N/A TYR 430.A N ASN 425.A O no hydrogen 3.288 N/A TYR 430.A OH GLU 452.A OE2 no hydrogen 2.727 N/A MET 431.A N ALA 446.A O no hydrogen 2.707 N/A TYR 432.A N VAL 423.A O no hydrogen 3.032 N/A PHE 433.A N GLU 444.A O no hydrogen 2.930 N/A THR 434.A N ALA 421.A O no hydrogen 2.769 N/A ASN 435.A N LYS 442.A O no hydrogen 2.947 N/A ASN 435.A ND2 GLU 444.A OE2 no hydrogen 3.356 N/A LEU 436.A N ARG 418.A O no hydrogen 2.966 N/A GLN 437.A N ASN 435.A O no hydrogen 3.080 N/A GLN 437.A NE2 GLN 416.A O no hydrogen 3.168 N/A SER 440.A N GLN 437.A O no hydrogen 3.331 N/A LYS 442.A N ASN 435.A O no hydrogen 2.970 N/A LYS 442.A NZ GLN 437.A OE1 no hydrogen 3.098 N/A LYS 442.A NZ SER 440.A O no hydrogen 3.367 N/A ILE 443.A N PHE 457.A O no hydrogen 3.175 N/A GLU 444.A N PHE 433.A O no hydrogen 2.865 N/A ARG 445.A N GLU 454.A O no hydrogen 2.793 N/A ALA 446.A N MET 431.A O no hydrogen 2.997 N/A ALA 447.A N THR 451.A O no hydrogen 2.772 N/A LEU 448.A N GLY 429.A O no hydrogen 3.314 N/A GLY 450.A N ALA 447.A O no hydrogen 2.802 N/A THR 451.A N ASP 449.A OD2 no hydrogen 3.172 N/A THR 451.A OG1 ASP 449.A OD1 no hydrogen 3.336 N/A THR 451.A OG1 ASP 449.A OD2 no hydrogen 2.630 N/A ARG 453.A NH1 ASP 417.A OD1 no hydrogen 3.264 N/A ARG 453.A NH2 ASP 417.A OD1 no hydrogen 3.375 N/A ARG 453.A NH2 GLU 444.A OE1 no hydrogen 2.718 N/A GLU 454.A N ARG 445.A O no hydrogen 2.762 N/A LEU 456.A N ILE 443.A O no hydrogen 2.825 N/A PHE 457.A N ILE 443.A O no hydrogen 3.208 N/A SER 462.A N ASP 480.A OD2 no hydrogen 2.761 N/A SER 462.A OG ASP 482.A OD2 no hydrogen 2.630 N/A LYS 463.A N ASP 480.A OD1 no hydrogen 2.743 N/A LYS 463.A N ASP 480.A OD2 no hydrogen 3.329 N/A ILE 465.A N ALA 479.A O no hydrogen 3.074 N/A ALA 468.A N PHE 477.A O no hydrogen 2.882 N/A ASP 470.A N LYS 475.A O no hydrogen 2.913 N/A SER 471.A OG ASN 425.A OD1 no hydrogen 3.122 N/A LEU 473.A N ASP 470.A OD1 no hydrogen 3.333 N/A GLY 474.A N ASP 470.A O no hydrogen 2.796 N/A LYS 475.A N ASP 470.A O no hydrogen 3.019 N/A LEU 476.A N SER 489.A O no hydrogen 2.835 N/A PHE 477.A N ALA 468.A O no hydrogen 2.719 N/A TRP 478.A N GLU 487.A O no hydrogen 2.916 N/A ALA 479.A N ALA 466.A O no hydrogen 3.361 N/A ASP 480.A N ARG 485.A O no hydrogen 3.220 N/A SER 481.A N LYS 463.A O no hydrogen 2.808 N/A LEU 483.A N ASP 480.A OD1 no hydrogen 3.182 N/A ARG 484.A NE LEU 505.A O no hydrogen 2.847 N/A ARG 485.A N ASP 480.A O no hydrogen 3.421 N/A ILE 486.A N GLU 500.A O no hydrogen 2.922 N/A GLU 487.A N TRP 478.A O no hydrogen 3.001 N/A SER 488.A N ILE 497.A O no hydrogen 2.942 N/A SER 489.A N LEU 476.A O no hydrogen 2.957 N/A SER 489.A OG ASP 490.A O no hydrogen 2.677 N/A ASP 490.A N ALA 494.A O no hydrogen 2.954 N/A LEU 491.A N GLY 474.A O no hydrogen 3.183 N/A GLY 493.A N ASP 490.A O no hydrogen 2.752 N/A ALA 494.A N SER 492.A OG no hydrogen 3.339 N/A ARG 496.A NH2 SER 459.A O no hydrogen 2.515 N/A ILE 497.A N SER 488.A O no hydrogen 2.835 N/A LEU 499.A N ILE 486.A O no hydrogen 2.695 N/A GLU 500.A N ILE 486.A O no hydrogen 3.447 N/A ASN 503.A ND2 SER 502.A O no hydrogen 3.299 N/A LEU 505.A N ASP 521.A OD2 no hydrogen 2.827 N/A GLN 506.A N ASP 521.A OD1 no hydrogen 2.751 N/A GLN 506.A N ASP 521.A OD2 no hydrogen 3.281 N/A VAL 508.A N ILE 520.A O no hydrogen 3.311 N/A THR 511.A N TYR 518.A O no hydrogen 3.020 N/A PHE 513.A N TRP 516.A O no hydrogen 3.090 N/A LEU 517.A N ILE 530.A O no hydrogen 3.135 N/A TYR 518.A N THR 511.A O no hydrogen 2.971 N/A TRP 519.A N GLU 528.A O no hydrogen 2.800 N/A ILE 520.A N GLY 509.A O no hydrogen 3.059 N/A ASP 521.A N MET 526.A O no hydrogen 3.027 N/A LYS 522.A N GLN 506.A O no hydrogen 3.025 N/A GLN 524.A N ASP 521.A OD1 no hydrogen 3.117 N/A GLN 525.A N LYS 522.A O no hydrogen 3.222 N/A GLN 525.A NE2 ALA 543.A O no hydrogen 2.949 N/A MET 526.A N ASP 521.A O no hydrogen 3.267 N/A ILE 527.A N GLN 539.A O no hydrogen 2.906 N/A GLU 528.A N TRP 519.A O no hydrogen 3.044 N/A LYS 529.A N THR 536.A O no hydrogen 3.013 N/A ILE 530.A N LEU 517.A O no hydrogen 3.333 N/A MET 532.A N ASN 515.A O no hydrogen 3.044 N/A ARG 535.A NE GLU 528.A OE2 no hydrogen 2.489 N/A ARG 535.A NH1 GLU 500.A OE1 no hydrogen 2.764 N/A ARG 535.A NH2 ASN 503.A O no hydrogen 2.901 N/A ARG 535.A NH2 GLU 528.A OE1 no hydrogen 2.793 N/A ARG 535.A NH2 GLU 528.A OE2 no hydrogen 3.215 N/A THR 536.A N LYS 529.A O no hydrogen 2.970 N/A THR 536.A OG1 GLY 534.A O no hydrogen 3.326 N/A VAL 538.A N ILE 527.A O no hydrogen 2.834 N/A GLN 539.A N ILE 527.A O no hydrogen 3.263 N/A GLN 539.A NE2 ALA 540.A O no hydrogen 3.540 N/A ILE 542.A N GLN 525.A O no hydrogen 2.713 N/A GLN 544.A N GLN 310.A OE1 no hydrogen 3.414 N/A SER 546.A N SER 309.A O no hydrogen 2.713 N/A SER 546.A OG SER 309.A O no hydrogen 3.310 N/A SER 546.A OG SER 309.A OG no hydrogen 2.689 N/A SER 546.A OG GLN 310.A O no hydrogen 2.826 N/A SER 546.A OG VAL 335.A O no hydrogen 2.856 N/A HIS 549.A N LEU 307.A O no hydrogen 2.574 N/A ALA 550.A N THR 511.A OG1 no hydrogen 3.122 N/A VAL 551.A N PHE 305.A O no hydrogen 2.850 N/A TYR 559.A N ASN 555.A O no hydrogen 3.050 N/A TYR 559.A OH ILE 383.A O no hydrogen 2.702 N/A ARG 560.A N LEU 556.A O no hydrogen 2.992 N/A HIS 562.A N TYR 559.A O no hydrogen 3.214 N/A CYS 564.A SG HIS 562.A NE2 no hydrogen 3.488 N/A ALA 565.A N HIS 562.A O no hydrogen 3.281 N/A ASN 568.A ND2 CYS 571.A O no hydrogen 3.281 N/A GLY 569.A N GLN 566.A O no hydrogen 3.241 N/A GLY 570.A N ASP 567.A O no hydrogen 3.070 N/A CYS 571.A N ASN 568.A O no hydrogen 3.344 N/A CYS 571.A SG GLY 569.A O no hydrogen 3.881 N/A CYS 571.A SG ILE 574.A O no hydrogen 3.672 N/A SER 572.A N LEU 598.A O no hydrogen 2.864 N/A SER 572.A OG LEU 598.A O no hydrogen 3.106 N/A ILE 574.A N SER 586.A O no hydrogen 2.992 N/A LEU 576.A N ARG 584.A O no hydrogen 3.015 N/A LYS 578.A NZ TYR 430.A OH no hydrogen 3.401 N/A LYS 578.A NZ GLU 452.A OE1 no hydrogen 3.473 N/A GLY 581.A N ASP 580.A OD1 no hydrogen 2.678 N/A THR 582.A OG1 ASP 580.A OD1 no hydrogen 2.810 N/A ARG 584.A N LEU 576.A O no hydrogen 2.994 N/A CYS 585.A SG GLU 597.A O no hydrogen 3.353 N/A SER 586.A N ILE 574.A O no hydrogen 3.000 N/A SER 586.A OG ASP 449.A OD1 no hydrogen 2.690 N/A MET 589.A N VAL 410.A O no hydrogen 2.842 N/A LEU 591.A N PRO 588.A O no hydrogen 3.428 N/A LEU 594.A N SER 599.A O no hydrogen 3.110 N/A SER 599.A N ASP 596.A OD2 no hydrogen 3.286 N/A