Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3s8z_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): PHE 5.A N PHE 254.A O no hydrogen 3.305 N/A LEU 6.A N ILE 17.A O no hydrogen 2.877 N/A LEU 7.A N LEU 252.A O no hydrogen 2.757 N/A PHE 8.A N ARG 15.A O no hydrogen 2.931 N/A SER 9.A N ASP 250.A O no hydrogen 3.202 N/A SER 9.A OG SER 37.A O no hydrogen 2.701 N/A ARG 10.A N ASP 13.A O no hydrogen 2.963 N/A ARG 10.A NH1 ASP 246.A O no hydrogen 3.470 N/A ARG 11.A NH2 ASP 246.A OD1 no hydrogen 3.053 N/A ASP 13.A N ARG 10.A O no hydrogen 2.864 N/A ARG 15.A N PHE 8.A O no hydrogen 2.904 N/A ARG 15.A NE ASN 25.A OD1 no hydrogen 2.582 N/A ARG 15.A NH1 ASP 13.A OD2 no hydrogen 2.729 N/A ARG 15.A NH2 ASN 25.A O no hydrogen 3.205 N/A ARG 15.A NH2 ASN 25.A OD1 no hydrogen 3.550 N/A ARG 16.A N VAL 26.A O no hydrogen 2.787 N/A ILE 17.A N LEU 6.A O no hydrogen 2.926 N/A SER 18.A N ASN 23.A O no hydrogen 2.940 N/A SER 18.A OG GLU 3.A OE2 no hydrogen 3.374 N/A SER 18.A OG LEU 19.A O no hydrogen 3.082 N/A SER 18.A OG THR 21.A OG1 no hydrogen 2.809 N/A THR 21.A OG1 LEU 19.A O no hydrogen 3.189 N/A ASN 22.A ND2 ILE 241.A O no hydrogen 3.249 N/A VAL 26.A N ARG 16.A O no hydrogen 3.085 N/A ILE 28.A N ILE 14.A O no hydrogen 2.819 N/A LYS 34.A N ASP 52.A OD2 no hydrogen 3.162 N/A GLU 35.A N ASP 52.A OD1 no hydrogen 3.331 N/A GLU 35.A N ASP 52.A OD2 no hydrogen 3.466 N/A ALA 36.A N ARG 11.A O no hydrogen 2.860 N/A SER 37.A N THR 51.A O no hydrogen 2.894 N/A SER 37.A OG THR 51.A O no hydrogen 3.490 N/A LEU 39.A N ASP 250.A OD2 no hydrogen 2.793 N/A ASP 40.A N TYR 49.A O no hydrogen 2.999 N/A PHE 41.A N ASP 40.A OD1 no hydrogen 2.781 N/A ASP 42.A N ARG 47.A O no hydrogen 2.976 N/A VAL 43.A N GLN 259.A OE1 no hydrogen 3.349 N/A THR 44.A OG1 ASP 42.A OD1 no hydrogen 3.383 N/A ASN 46.A N VAL 43.A O no hydrogen 3.153 N/A ARG 47.A N ASP 42.A O no hydrogen 3.094 N/A ARG 47.A NE ASP 45.A OD2 no hydrogen 2.539 N/A ARG 47.A NH2 ASP 45.A OD1 no hydrogen 3.394 N/A ARG 47.A NH2 ASP 45.A OD2 no hydrogen 3.387 N/A ILE 48.A N ALA 61.A O no hydrogen 2.776 N/A TYR 49.A N ASP 40.A O no hydrogen 2.920 N/A TYR 49.A OH LEU 106.A O no hydrogen 3.429 N/A TRP 50.A N SER 59.A O no hydrogen 2.977 N/A THR 51.A N ALA 38.A O no hydrogen 2.972 N/A ASP 52.A N THR 57.A O no hydrogen 2.912 N/A ILE 53.A N GLU 35.A O no hydrogen 3.079 N/A SER 54.A N ASP 52.A OD1 no hydrogen 3.248 N/A LEU 55.A N ASP 52.A OD1 no hydrogen 3.006 N/A LYS 56.A N ASP 52.A O no hydrogen 2.710 N/A LYS 56.A NZ ASP 77.A O no hydrogen 2.959 N/A THR 57.A N ASP 52.A O no hydrogen 3.380 N/A ILE 58.A N VAL 72.A O no hydrogen 2.886 N/A SER 59.A N TRP 50.A O no hydrogen 2.944 N/A SER 59.A OG HIS 70.A ND1 no hydrogen 3.211 N/A ARG 60.A N GLU 69.A O no hydrogen 2.973 N/A ARG 60.A NE GLU 69.A OE1 no hydrogen 3.317 N/A ARG 60.A NH1 TYR 49.A OH no hydrogen 2.932 N/A ARG 60.A NH2 GLU 69.A OE1 no hydrogen 3.183 N/A ALA 61.A N ILE 48.A O no hydrogen 3.098 N/A MET 63.A N ASN 46.A O no hydrogen 2.947 N/A SER 66.A OG GLY 65.A O no hydrogen 2.719 N/A GLU 69.A N ARG 60.A O no hydrogen 2.893 N/A VAL 71.A N ILE 58.A O no hydrogen 2.768 N/A VAL 72.A N ILE 58.A O no hydrogen 3.028 N/A ASP 77.A N ASP 95.A OD2 no hydrogen 2.813 N/A TYR 78.A N ASP 95.A OD1 no hydrogen 3.283 N/A GLU 80.A N ALA 94.A O no hydrogen 2.787 N/A GLY 81.A N ARG 123.A O no hydrogen 2.816 N/A ALA 83.A N TYR 92.A O no hydrogen 2.934 N/A VAL 84.A N ASP 40.A OD2 no hydrogen 2.629 N/A ASP 85.A N ASN 90.A O no hydrogen 2.901 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 3.089 N/A LYS 89.A NZ ASP 42.A OD1 no hydrogen 3.490 N/A LYS 89.A NZ ASP 42.A OD2 no hydrogen 3.502 N/A LYS 89.A NZ THR 44.A OG1 no hydrogen 3.236 N/A LYS 89.A NZ TRP 86.A O no hydrogen 3.403 N/A ASN 90.A N ASP 85.A O no hydrogen 3.245 N/A ASN 90.A ND2 ASP 85.A OD2 no hydrogen 3.044 N/A ASN 90.A ND2 CYS 276.A O no hydrogen 2.813 N/A LEU 91.A N SER 104.A O no hydrogen 2.512 N/A TYR 92.A N ALA 83.A O no hydrogen 2.924 N/A TYR 92.A OH MET 150.A O no hydrogen 2.707 N/A TRP 93.A N GLU 102.A O no hydrogen 2.979 N/A ALA 94.A N GLY 81.A O no hydrogen 2.844 N/A ASP 95.A N ARG 100.A O no hydrogen 3.033 N/A THR 96.A N TYR 78.A O no hydrogen 2.766 N/A THR 96.A OG1 PRO 122.A O no hydrogen 2.833 N/A THR 98.A N ASP 95.A OD1 no hydrogen 2.620 N/A ARG 100.A N ASP 95.A O no hydrogen 3.439 N/A ARG 100.A NH1 ASP 328.A O no hydrogen 2.754 N/A ILE 101.A N VAL 115.A O no hydrogen 2.822 N/A GLU 102.A N TRP 93.A O no hydrogen 2.843 N/A VAL 103.A N GLN 112.A O no hydrogen 2.735 N/A SER 104.A N LEU 91.A O no hydrogen 2.883 N/A SER 104.A OG LYS 105.A O no hydrogen 2.850 N/A LYS 105.A N GLN 109.A O no hydrogen 2.833 N/A LYS 105.A NZ GLY 88.A O no hydrogen 3.391 N/A LYS 105.A NZ LYS 89.A O no hydrogen 3.217 N/A GLY 108.A N LYS 105.A O no hydrogen 2.971 N/A GLN 109.A N ASP 107.A OD2 no hydrogen 3.188 N/A ARG 111.A NE GLU 102.A OE2 no hydrogen 2.727 N/A ARG 111.A NH1 PHE 74.A O no hydrogen 2.622 N/A ARG 111.A NH2 PHE 74.A O no hydrogen 3.393 N/A ARG 111.A NH2 GLU 102.A OE1 no hydrogen 3.219 N/A ARG 111.A NH2 GLU 102.A OE2 no hydrogen 2.949 N/A GLN 112.A N VAL 103.A O no hydrogen 2.722 N/A GLN 112.A NE2 CYS 288.A O no hydrogen 2.761 N/A VAL 113.A N GLN 112.A OE1 no hydrogen 2.978 N/A LEU 114.A N ILE 101.A O no hydrogen 2.796 N/A VAL 115.A N ILE 101.A O no hydrogen 3.272 N/A ASP 120.A N GLU 138.A OE1 no hydrogen 2.911 N/A ARG 123.A N THR 137.A O no hydrogen 2.796 N/A ALA 124.A N THR 137.A OG1 no hydrogen 3.008 N/A ALA 126.A N TYR 135.A O no hydrogen 2.836 N/A ASP 128.A N PHE 133.A O no hydrogen 2.804 N/A GLU 131.A N ASP 128.A O no hydrogen 3.081 N/A GLY 132.A N ASP 128.A O no hydrogen 2.749 N/A PHE 133.A N ASP 128.A O no hydrogen 3.171 N/A MET 134.A N ALA 148.A O no hydrogen 2.768 N/A TYR 135.A N ALA 126.A O no hydrogen 2.796 N/A TRP 136.A N ASP 146.A O no hydrogen 3.296 N/A TRP 136.A NE1 GLU 138.A OE2 no hydrogen 3.237 N/A THR 137.A N ALA 124.A O no hydrogen 3.158 N/A THR 137.A OG1 ALA 165.A O no hydrogen 2.961 N/A GLU 138.A N LYS 144.A O no hydrogen 2.765 N/A TRP 139.A N SER 121.A O no hydrogen 2.887 N/A TRP 139.A NE1 ALA 165.A O no hydrogen 2.862 N/A LYS 142.A NZ PRO 160.A O no hydrogen 3.260 N/A LYS 142.A NZ ASN 161.A OD1 no hydrogen 2.782 N/A LYS 144.A N GLU 138.A O no hydrogen 3.213 N/A ILE 145.A N VAL 159.A O no hydrogen 3.090 N/A ASP 146.A N TRP 136.A O no hydrogen 2.781 N/A ARG 147.A N THR 156.A O no hydrogen 3.108 N/A ALA 148.A N MET 134.A O no hydrogen 3.129 N/A ALA 149.A N SER 153.A O no hydrogen 3.044 N/A MET 150.A N GLY 132.A O no hydrogen 3.071 N/A GLY 152.A N ALA 149.A O no hydrogen 2.935 N/A SER 153.A N ASP 151.A OD1 no hydrogen 3.252 N/A SER 153.A OG ASP 151.A OD1 no hydrogen 2.589 N/A SER 153.A OG ASP 151.A OD2 no hydrogen 3.435 N/A ARG 155.A NE ASP 146.A OD2 no hydrogen 3.511 N/A ARG 155.A NH1 LYS 117.A O no hydrogen 2.575 N/A ARG 155.A NH2 ASP 118.A O no hydrogen 3.282 N/A ARG 155.A NH2 GLU 138.A OE2 no hydrogen 3.365 N/A THR 156.A N ARG 147.A O no hydrogen 3.008 N/A THR 157.A OG1 ASP 146.A OD1 no hydrogen 3.515 N/A LEU 158.A N ILE 145.A O no hydrogen 2.903 N/A VAL 159.A N ILE 145.A O no hydrogen 3.034 N/A ARG 164.A N ASP 183.A OD1 no hydrogen 2.840 N/A ASN 166.A N THR 180.A O no hydrogen 3.093 N/A ASN 166.A ND2 PHE 208.A O no hydrogen 2.763 N/A THR 169.A N TYR 178.A O no hydrogen 2.835 N/A THR 169.A OG1 GLY 167.A O no hydrogen 2.785 N/A THR 169.A OG1 LEU 210.A O no hydrogen 3.156 N/A ASP 171.A N ARG 176.A O no hydrogen 2.862 N/A TYR 172.A OH LEU 127.A O no hydrogen 2.609 N/A LYS 174.A N ASP 171.A OD1 no hydrogen 3.450 N/A ARG 175.A NE TYR 172.A O no hydrogen 3.095 N/A ARG 175.A NH1 ASP 128.A OD1 no hydrogen 3.109 N/A ARG 175.A NH2 ASP 128.A OD1 no hydrogen 2.946 N/A ARG 175.A NH2 TYR 172.A O no hydrogen 3.343 N/A ARG 176.A N ASP 171.A O no hydrogen 3.306 N/A ARG 176.A NE SER 189.A OG no hydrogen 3.124 N/A ARG 176.A NH2 SER 189.A OG no hydrogen 3.311 N/A ARG 176.A NH2 ASN 196.A O no hydrogen 3.145 N/A LEU 177.A N SER 190.A O no hydrogen 2.684 N/A TYR 178.A N THR 169.A O no hydrogen 2.897 N/A TRP 179.A N GLU 188.A O no hydrogen 3.187 N/A THR 180.A OG1 PHE 208.A O no hydrogen 3.027 N/A ASP 181.A N LEU 186.A O no hydrogen 2.817 N/A LEU 182.A N ARG 164.A O no hydrogen 3.132 N/A ASP 183.A N ASP 181.A OD1 no hydrogen 3.265 N/A THR 184.A N ASP 181.A OD1 no hydrogen 3.407 N/A THR 184.A OG1 ASP 181.A OD2 no hydrogen 2.764 N/A ASN 185.A ND2 LEU 204.A O no hydrogen 2.977 N/A LEU 186.A N ASP 181.A O no hydrogen 3.274 N/A ILE 187.A N ALA 201.A O no hydrogen 2.942 N/A GLU 188.A N TRP 179.A O no hydrogen 3.081 N/A SER 189.A N GLU 198.A O no hydrogen 2.786 N/A SER 189.A OG LEU 177.A O no hydrogen 2.836 N/A SER 190.A N LEU 177.A O no hydrogen 2.918 N/A SER 190.A OG ASN 191.A O no hydrogen 3.039 N/A ASN 191.A N LEU 195.A O no hydrogen 2.938 N/A LEU 193.A N ASN 191.A OD1 no hydrogen 2.721 N/A GLY 194.A N ASN 191.A O no hydrogen 2.870 N/A ARG 197.A NE GLU 188.A OE1 no hydrogen 3.185 N/A ARG 197.A NH1 ASN 161.A O no hydrogen 3.168 N/A ARG 197.A NH2 ASN 161.A O no hydrogen 3.498 N/A ARG 197.A NH2 GLU 188.A OE1 no hydrogen 2.773 N/A ARG 197.A NH2 GLU 188.A OE2 no hydrogen 3.024 N/A GLU 198.A N SER 189.A O no hydrogen 2.811 N/A ILE 200.A N ILE 187.A O no hydrogen 2.726 N/A HIS 206.A N ASP 221.A OD2 no hydrogen 3.269 N/A PHE 208.A N THR 220.A O no hydrogen 3.094 N/A GLY 209.A N THR 220.A OG1 no hydrogen 3.100 N/A THR 211.A N TYR 218.A O no hydrogen 2.850 N/A THR 211.A OG1 ILE 251.A O no hydrogen 2.517 N/A TYR 213.A N TYR 216.A O no hydrogen 3.074 N/A TYR 213.A OH HIS 255.A ND1 no hydrogen 3.269 N/A ILE 217.A N ALA 230.A O no hydrogen 2.899 N/A TYR 218.A N THR 211.A O no hydrogen 2.750 N/A TRP 219.A N GLU 228.A O no hydrogen 2.946 N/A THR 220.A N GLY 209.A O no hydrogen 3.092 N/A THR 220.A OG1 VAL 248.A O no hydrogen 3.389 N/A ASP 221.A N SER 226.A O no hydrogen 2.771 N/A TRP 222.A N HIS 206.A O no hydrogen 3.039 N/A TRP 222.A NE1 VAL 248.A O no hydrogen 2.932 N/A SER 223.A N ASP 221.A OD1 no hydrogen 2.805 N/A ARG 224.A N ASP 221.A OD1 no hydrogen 3.133 N/A SER 226.A N ASP 221.A O no hydrogen 3.045 N/A ILE 227.A N GLN 242.A O no hydrogen 2.770 N/A GLU 228.A N TRP 219.A O no hydrogen 2.652 N/A ARG 229.A N THR 239.A O no hydrogen 2.955 N/A ARG 229.A NE THR 239.A OG1 no hydrogen 3.309 N/A ARG 229.A NH2 THR 239.A OG1 no hydrogen 3.073 N/A ALA 230.A N ILE 217.A O no hydrogen 3.091 N/A ASN 231.A N GLN 236.A O no hydrogen 3.049 N/A LYS 232.A N ASP 215.A O no hydrogen 2.821 N/A LYS 232.A NZ ASP 171.A OD2 no hydrogen 2.545 N/A LYS 232.A NZ GLN 214.A O no hydrogen 2.927 N/A THR 233.A N ASN 231.A OD1 no hydrogen 3.075 N/A THR 233.A OG1 ASN 231.A OD1 no hydrogen 2.939 N/A GLY 235.A N ASN 231.A O no hydrogen 3.021 N/A GLN 236.A N SER 234.A OG no hydrogen 3.351 N/A THR 239.A N ARG 229.A O no hydrogen 3.000 N/A ILE 241.A N ILE 227.A O no hydrogen 2.955 N/A GLN 242.A N ILE 227.A O no hydrogen 3.125 N/A GLN 242.A NE2 ASN 22.A OD1 no hydrogen 3.295 N/A LEU 245.A N ARG 225.A O no hydrogen 2.696 N/A MET 249.A N SER 9.A O no hydrogen 2.817 N/A ASP 250.A N SER 9.A OG no hydrogen 3.286 N/A LEU 252.A N LEU 7.A O no hydrogen 3.057 N/A PHE 254.A N PHE 5.A O no hydrogen 2.745 N/A HIS 255.A ND1 SER 257.A OG no hydrogen 2.649 N/A SER 257.A N HIS 255.A ND1 no hydrogen 3.379 N/A SER 257.A OG HIS 255.A ND1 no hydrogen 2.649 N/A ARG 258.A N HIS 255.A O no hydrogen 3.275 N/A ARG 258.A NH2 ILE 170.A O no hydrogen 2.413 N/A GLN 259.A N SER 256.A O no hydrogen 2.993 N/A GLN 259.A NE2 PHE 41.A O no hydrogen 2.732 N/A ASN 263.A ND2 PRO 129.A O no hydrogen 2.938 N/A CYS 265.A N ASN 263.A OD1 no hydrogen 2.795 N/A ALA 266.A N ASN 263.A OD1 no hydrogen 3.117 N/A ASN 269.A ND2 CYS 272.A O no hydrogen 3.336 N/A ASN 269.A ND2 HIS 274.A O no hydrogen 3.202 N/A GLY 270.A N SER 267.A O no hydrogen 3.309 N/A HIS 271.A N SER 268.A O no hydrogen 3.182 N/A CYS 272.A N ASN 269.A O no hydrogen 3.166 N/A CYS 272.A SG ASN 269.A O no hydrogen 3.746 N/A CYS 272.A SG GLY 270.A O no hydrogen 3.774 N/A SER 273.A N ARG 299.A O no hydrogen 3.272 N/A SER 273.A OG HIS 274.A ND1 no hydrogen 2.693 N/A SER 273.A OG ARG 299.A O no hydrogen 3.300 N/A HIS 274.A ND1 SER 273.A OG no hydrogen 2.693 N/A LEU 275.A N GLY 287.A O no hydrogen 3.397 N/A LEU 277.A N VAL 285.A O no hydrogen 3.113 N/A VAL 279.A N GLY 283.A O no hydrogen 2.846 N/A PHE 284.A N GLY 282.A O no hydrogen 2.557 N/A VAL 285.A N LEU 277.A O no hydrogen 2.976 N/A CYS 286.A SG ASN 298.A O no hydrogen 3.373 N/A GLY 287.A N LEU 275.A O no hydrogen 2.863 N/A ALA 290.A N ARG 111.A O no hydrogen 2.856 N/A HIS 291.A NE2 ARG 318.A O no hydrogen 3.295 N/A TYR 292.A N PRO 289.A O no hydrogen 3.061 N/A SER 293.A N SER 302.A O no hydrogen 2.923 N/A ASN 295.A N THR 300.A O no hydrogen 2.995 N/A ASN 295.A ND2 THR 300.A OG1 no hydrogen 2.891 N/A ASN 298.A N ASN 295.A O no hydrogen 3.297 N/A ARG 299.A N ASP 297.A OD1 no hydrogen 2.940 N/A THR 300.A N ASP 297.A OD1 no hydrogen 3.061 N/A THR 300.A OG1 ASP 297.A OD1 no hydrogen 3.314 N/A THR 300.A OG1 ASP 297.A OD2 no hydrogen 2.624 N/A CYS 301.A SG HIS 274.A ND1 no hydrogen 3.678 N/A CYS 301.A SG GLY 287.A O no hydrogen 3.469 N/A SER 302.A N SER 293.A O no hydrogen 2.818 N/A SER 302.A OG ASN 295.A OD1 no hydrogen 2.782 N/A PHE 307.A N VAL 557.A O no hydrogen 3.258 N/A LEU 308.A N MET 319.A O no hydrogen 2.820 N/A LEU 309.A N HIS 555.A O no hydrogen 2.757 N/A PHE 310.A N ASN 317.A O no hydrogen 2.901 N/A SER 311.A N ASP 553.A O no hydrogen 2.940 N/A SER 311.A OG SER 552.A OG no hydrogen 2.885 N/A SER 311.A OG ASP 553.A O no hydrogen 3.414 N/A GLN 312.A N ALA 315.A O no hydrogen 2.775 N/A ASN 317.A N PHE 310.A O no hydrogen 2.675 N/A ASN 317.A ND2 PHE 310.A O no hydrogen 3.175 N/A ARG 318.A N ILE 329.A O no hydrogen 3.081 N/A ARG 318.A NH1 GLU 366.A OE2 no hydrogen 3.201 N/A MET 319.A N LEU 308.A O no hydrogen 2.828 N/A GLN 324.A N ASP 322.A OD2 no hydrogen 2.881 N/A ILE 329.A N ARG 318.A O no hydrogen 3.269 N/A LEU 331.A N ILE 316.A O no hydrogen 2.934 N/A ILE 333.A N LEU 331.A O no hydrogen 2.753 N/A HIS 334.A NE2 GLU 73.A OE1 no hydrogen 3.086 N/A ARG 337.A N ASP 355.A OD1 no hydrogen 3.463 N/A ASN 338.A N ASP 355.A OD2 no hydrogen 2.588 N/A VAL 339.A N LYS 313.A O no hydrogen 3.190 N/A ARG 340.A N ILE 354.A O no hydrogen 2.861 N/A ARG 340.A NH1 GLU 396.A OE2 no hydrogen 3.327 N/A ARG 340.A NH2 PRO 379.A O no hydrogen 3.514 N/A ARG 340.A NH2 GLU 396.A OE2 no hydrogen 3.039 N/A ILE 342.A N ASP 553.A OD2 no hydrogen 2.953 N/A ASP 343.A N TYR 352.A O no hydrogen 2.717 N/A TYR 344.A N ASP 343.A OD1 no hydrogen 2.585 N/A TYR 344.A OH GLU 366.A OE1 no hydrogen 3.291 N/A ASP 345.A N GLN 350.A O no hydrogen 2.835 N/A LEU 347.A N ASP 345.A OD2 no hydrogen 3.002 N/A ASP 348.A N ASP 345.A OD1 no hydrogen 3.129 N/A GLN 350.A N ASP 345.A O no hydrogen 3.194 N/A GLN 350.A NE2 ASP 348.A O no hydrogen 3.213 N/A LEU 351.A N ALA 364.A O no hydrogen 2.740 N/A TYR 352.A N ASP 343.A O no hydrogen 2.895 N/A TRP 353.A N ARG 362.A O no hydrogen 2.969 N/A ILE 354.A N ALA 341.A O no hydrogen 3.032 N/A ASP 355.A N MET 360.A O no hydrogen 2.986 N/A SER 356.A N ASN 338.A O no hydrogen 2.853 N/A SER 356.A OG ASN 338.A O no hydrogen 3.472 N/A MET 360.A N ASP 355.A O no hydrogen 3.188 N/A ILE 361.A N VAL 375.A O no hydrogen 2.985 N/A ARG 362.A N TRP 353.A O no hydrogen 2.897 N/A LYS 363.A N PHE 372.A O no hydrogen 2.772 N/A LYS 363.A NZ GLN 350.A OE1 no hydrogen 2.913 N/A LYS 363.A NZ GLN 370.A O no hydrogen 3.416 N/A ALA 364.A N LEU 351.A O no hydrogen 2.911 N/A GLY 368.A N GLN 365.A O no hydrogen 2.741 N/A SER 369.A OG ASP 367.A OD1 no hydrogen 2.663 N/A SER 369.A OG ASP 367.A OD2 no hydrogen 2.973 N/A PHE 372.A N LYS 363.A O no hydrogen 2.820 N/A VAL 374.A N ILE 361.A O no hydrogen 2.723 N/A VAL 375.A N ILE 361.A O no hydrogen 3.248 N/A GLN 378.A NE2 GLU 396.A OE2 no hydrogen 2.874 N/A TYR 380.A N THR 394.A O no hydrogen 2.827 N/A ASP 381.A N THR 394.A OG1 no hydrogen 3.296 N/A LEU 382.A N ASP 381.A OD1 no hydrogen 2.754 N/A SER 383.A N TYR 392.A O no hydrogen 2.733 N/A ILE 384.A N ASP 343.A OD2 no hydrogen 2.973 N/A ASP 385.A N TYR 390.A O no hydrogen 2.709 N/A TYR 387.A N ASP 385.A OD1 no hydrogen 2.990 N/A TYR 387.A OH GLU 430.A OE2 no hydrogen 3.010 N/A SER 388.A N ASP 385.A OD1 no hydrogen 3.016 N/A SER 388.A OG ASN 574.A OD1 no hydrogen 2.814 N/A ARG 389.A NH1 ASP 345.A OD1 no hydrogen 3.306 N/A ARG 389.A NH1 ASP 345.A OD2 no hydrogen 2.819 N/A ARG 389.A NH1 ILE 386.A O no hydrogen 3.382 N/A ARG 389.A NH2 ASP 345.A OD1 no hydrogen 2.668 N/A TYR 390.A N ASP 385.A O no hydrogen 3.174 N/A TYR 390.A OH HIS 579.A O no hydrogen 2.645 N/A ILE 391.A N THR 404.A O no hydrogen 2.689 N/A TYR 392.A N SER 383.A O no hydrogen 2.876 N/A TYR 392.A OH LEU 451.A O no hydrogen 3.269 N/A TRP 393.A N ASN 402.A O no hydrogen 2.833 N/A TRP 393.A NE1 THR 404.A OG1 no hydrogen 3.154 N/A THR 394.A N ASP 381.A O no hydrogen 3.057 N/A THR 394.A OG1 ASP 381.A O no hydrogen 3.520 N/A THR 394.A OG1 ARG 423.A O no hydrogen 2.651 N/A CYS 395.A N VAL 400.A O no hydrogen 3.179 N/A CYS 395.A SG THR 398.A OG1 no hydrogen 3.215 N/A GLU 396.A N GLN 378.A O no hydrogen 2.875 N/A ASN 399.A N CYS 395.A O no hydrogen 2.943 N/A ILE 401.A N LEU 415.A O no hydrogen 3.015 N/A ASN 402.A N TRP 393.A O no hydrogen 2.794 N/A VAL 403.A N GLY 412.A O no hydrogen 2.943 N/A THR 404.A N ILE 391.A O no hydrogen 2.917 N/A ARG 405.A N ARG 409.A O no hydrogen 2.791 N/A LEU 406.A N ARG 389.A O no hydrogen 3.173 N/A GLY 408.A N ARG 405.A O no hydrogen 2.780 N/A VAL 411.A N VAL 403.A O no hydrogen 3.043 N/A GLY 412.A N VAL 403.A O no hydrogen 3.096 N/A VAL 414.A N ILE 401.A O no hydrogen 2.932 N/A ARG 421.A N ASN 438.A OD1 no hydrogen 2.659 N/A ARG 423.A N THR 437.A O no hydrogen 2.892 N/A ARG 423.A NH1 ASN 399.A OD1 no hydrogen 2.771 N/A ARG 423.A NH1 PRO 422.A O no hydrogen 3.000 N/A ARG 423.A NH2 ASN 399.A OD1 no hydrogen 3.303 N/A ILE 425.A N ASP 381.A OD2 no hydrogen 3.125 N/A VAL 426.A N TYR 435.A O no hydrogen 2.946 N/A VAL 427.A N SER 383.A OG no hydrogen 3.053 N/A ASN 428.A N TYR 433.A O no hydrogen 2.751 N/A GLU 430.A N GLU 430.A OE1 no hydrogen 2.829 N/A LYS 431.A N ASN 428.A O no hydrogen 3.180 N/A GLY 432.A N ASN 428.A O no hydrogen 2.972 N/A TYR 433.A N ASN 428.A O no hydrogen 3.203 N/A TYR 433.A OH GLU 455.A OE2 no hydrogen 2.934 N/A MET 434.A N ALA 449.A O no hydrogen 2.830 N/A TYR 435.A N VAL 426.A O no hydrogen 2.909 N/A PHE 436.A N GLU 447.A O no hydrogen 3.014 N/A THR 437.A N ALA 424.A O no hydrogen 2.835 N/A ASN 438.A N LYS 445.A O no hydrogen 2.864 N/A ASN 438.A ND2 GLU 447.A OE2 no hydrogen 2.765 N/A LEU 439.A N ARG 421.A O no hydrogen 2.884 N/A GLN 440.A N ASN 438.A O no hydrogen 2.888 N/A LYS 445.A N ASN 438.A O no hydrogen 3.141 N/A LYS 445.A NZ GLN 440.A OE1 no hydrogen 2.702 N/A LYS 445.A NZ SER 443.A O no hydrogen 3.411 N/A LYS 445.A NZ SER 443.A OG no hydrogen 3.146 N/A GLU 447.A N PHE 436.A O no hydrogen 2.699 N/A ARG 448.A N GLU 457.A O no hydrogen 3.052 N/A ARG 448.A NH2 GLU 457.A OE2 no hydrogen 3.414 N/A ALA 449.A N MET 434.A O no hydrogen 3.109 N/A ALA 450.A N THR 454.A O no hydrogen 2.800 N/A GLY 453.A N ALA 450.A O no hydrogen 2.908 N/A THR 454.A N ASP 452.A OD2 no hydrogen 2.863 N/A THR 454.A OG1 ASP 452.A OD1 no hydrogen 3.388 N/A THR 454.A OG1 ASP 452.A OD2 no hydrogen 2.570 N/A ARG 456.A NH1 ASP 420.A OD2 no hydrogen 2.692 N/A ARG 456.A NH2 ASP 420.A OD2 no hydrogen 3.013 N/A ARG 456.A NH2 GLU 447.A OE1 no hydrogen 2.769 N/A ARG 456.A NH2 GLU 447.A OE2 no hydrogen 3.566 N/A GLU 457.A N ARG 448.A O no hydrogen 2.999 N/A LEU 459.A N ILE 446.A O no hydrogen 2.950 N/A SER 465.A N ASP 483.A OD2 no hydrogen 3.171 N/A SER 465.A OG ASP 485.A OD2 no hydrogen 3.236 N/A LYS 466.A N ASP 483.A OD1 no hydrogen 3.093 N/A ILE 468.A N ALA 482.A O no hydrogen 2.976 N/A ALA 471.A N PHE 480.A O no hydrogen 2.839 N/A ASP 473.A N LYS 478.A O no hydrogen 3.097 N/A LEU 476.A N ASP 473.A OD2 no hydrogen 2.967 N/A GLY 477.A N ASP 473.A O no hydrogen 2.850 N/A LYS 478.A N ASP 473.A O no hydrogen 3.360 N/A LEU 479.A N SER 492.A O no hydrogen 2.772 N/A PHE 480.A N ALA 471.A O no hydrogen 2.815 N/A TRP 481.A N GLU 490.A O no hydrogen 3.395 N/A ALA 482.A N ALA 469.A O no hydrogen 3.255 N/A ASP 483.A N ARG 488.A O no hydrogen 2.994 N/A SER 484.A N LYS 466.A O no hydrogen 3.064 N/A LEU 486.A N ASP 483.A OD1 no hydrogen 3.503 N/A ARG 487.A NE ASP 485.A O no hydrogen 3.342 N/A ILE 489.A N GLU 503.A O no hydrogen 2.872 N/A GLU 490.A N TRP 481.A O no hydrogen 3.183 N/A SER 491.A N ILE 500.A O no hydrogen 2.809 N/A SER 492.A N LEU 479.A O no hydrogen 3.054 N/A LEU 494.A N GLY 477.A O no hydrogen 3.267 N/A LEU 494.A N ASP 493.A OD2 no hydrogen 3.136 N/A ARG 499.A NH1 GLU 490.A OE2 no hydrogen 2.653 N/A ARG 499.A NH2 SER 462.A O no hydrogen 2.400 N/A ILE 500.A N SER 491.A O no hydrogen 2.813 N/A GLU 503.A N ILE 489.A O no hydrogen 3.465 N/A SER 505.A OG GLU 503.A OE1 no hydrogen 3.459 N/A ILE 507.A N SER 505.A O no hydrogen 2.985 N/A LEU 508.A N ASP 524.A OD2 no hydrogen 2.817 N/A GLN 509.A N ASP 524.A OD1 no hydrogen 3.272 N/A GLN 509.A N ASP 524.A OD2 no hydrogen 3.269 N/A VAL 511.A N ILE 523.A O no hydrogen 2.957 N/A THR 514.A N TYR 521.A O no hydrogen 3.081 N/A PHE 516.A N TRP 519.A O no hydrogen 3.047 N/A LEU 520.A N ILE 533.A O no hydrogen 2.792 N/A TYR 521.A N THR 514.A O no hydrogen 2.996 N/A TRP 522.A N GLU 531.A O no hydrogen 2.914 N/A ILE 523.A N GLY 512.A O no hydrogen 3.114 N/A ASP 524.A N MET 529.A O no hydrogen 3.049 N/A LYS 525.A N GLN 509.A O no hydrogen 2.970 N/A LYS 525.A NZ LEU 551.A O no hydrogen 3.251 N/A GLN 527.A N ASP 524.A OD1 no hydrogen 2.915 N/A GLN 527.A NE2 ASN 506.A O no hydrogen 3.317 N/A GLN 527.A NE2 ASN 506.A OD1 no hydrogen 3.442 N/A MET 529.A N ASP 524.A O no hydrogen 3.241 N/A ILE 530.A N GLN 545.A O no hydrogen 2.872 N/A GLU 531.A N TRP 522.A O no hydrogen 3.239 N/A LYS 532.A N THR 542.A O no hydrogen 3.089 N/A ILE 533.A N LEU 520.A O no hydrogen 3.136 N/A MET 535.A N ASN 518.A O no hydrogen 3.068 N/A THR 536.A N ASP 534.A OD2 no hydrogen 3.185 N/A THR 536.A OG1 ASP 534.A OD2 no hydrogen 3.211 N/A ARG 541.A NE GLU 531.A OE2 no hydrogen 2.831 N/A ARG 541.A NH1 GLU 503.A OE1 no hydrogen 2.937 N/A ARG 541.A NH2 ASN 506.A O no hydrogen 2.795 N/A ARG 541.A NH2 GLU 531.A OE1 no hydrogen 3.374 N/A ARG 541.A NH2 GLU 531.A OE2 no hydrogen 3.183 N/A THR 542.A N LYS 532.A O no hydrogen 3.210 N/A THR 542.A OG1 GLY 540.A O no hydrogen 3.007 N/A VAL 544.A N ILE 530.A O no hydrogen 2.913 N/A GLN 545.A N ILE 530.A O no hydrogen 3.482 N/A ILE 548.A N GLN 528.A O no hydrogen 3.198 N/A SER 552.A N SER 311.A O no hydrogen 2.796 N/A SER 552.A OG SER 311.A O no hydrogen 3.364 N/A SER 552.A OG SER 311.A OG no hydrogen 2.885 N/A SER 552.A OG VAL 339.A O no hydrogen 3.030 N/A ILE 554.A N ASP 553.A OD1 no hydrogen 2.796 N/A HIS 555.A N LEU 309.A O no hydrogen 2.734 N/A VAL 557.A N PHE 307.A O no hydrogen 3.017 N/A TYR 565.A N ASN 561.A O no hydrogen 2.841 N/A TYR 565.A OH ILE 386.A O no hydrogen 2.741 N/A ARG 566.A N LEU 562.A O no hydrogen 3.355 N/A HIS 568.A N TYR 565.A O no hydrogen 2.954 N/A ALA 571.A N HIS 568.A O no hydrogen 3.190 N/A GLN 572.A N PRO 569.A O no hydrogen 3.416 N/A ASP 573.A N ALA 571.A O no hydrogen 3.000 N/A ASN 574.A ND2 CYS 577.A O no hydrogen 2.898 N/A ASN 574.A ND2 HIS 579.A O no hydrogen 3.065 N/A GLY 575.A N GLN 572.A O no hydrogen 3.139 N/A GLY 576.A N ASP 573.A O no hydrogen 3.128 N/A CYS 577.A N ASN 574.A O no hydrogen 3.211 N/A CYS 577.A SG ASN 574.A O no hydrogen 3.508 N/A CYS 577.A SG ILE 580.A O no hydrogen 3.467 N/A SER 578.A N LEU 604.A O no hydrogen 3.128 N/A ILE 580.A N SER 592.A O no hydrogen 2.950 N/A CYS 581.A SG ASN 574.A O no hydrogen 3.313 N/A CYS 581.A SG THR 589.A OG1 no hydrogen 3.605 N/A LEU 582.A N ARG 590.A O no hydrogen 2.790 N/A THR 588.A OG1 ASP 586.A OD1 no hydrogen 2.717 N/A ARG 590.A N LEU 582.A O no hydrogen 2.818 N/A CYS 591.A SG LEU 604.A O no hydrogen 3.978 N/A SER 592.A N ILE 580.A O no hydrogen 2.950 N/A SER 592.A OG ASP 452.A OD1 no hydrogen 2.654 N/A CYS 593.A N SER 592.A OG no hydrogen 2.750 N/A MET 595.A N VAL 413.A O no hydrogen 2.867 N/A LEU 597.A N PRO 594.A O no hydrogen 3.447 N/A LEU 600.A N SER 605.A O no hydrogen 2.912 N/A ASP 602.A N LEU 600.A O no hydrogen 2.488 N/A LEU 604.A N ASP 602.A OD2 no hydrogen 2.834 N/A SER 605.A N ASP 602.A OD2 no hydrogen 2.979 N/A SER 605.A OG ASP 602.A OD1 no hydrogen 3.549 N/A CYS 606.A N SER 578.A OG no hydrogen 3.074 N/A CYS 606.A SG SER 578.A OG no hydrogen 3.765 N/A CYS 606.A SG SER 592.A O no hydrogen 3.596 N/A