Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3q8c_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): SER 2.A OG TYR 403.A OH no hydrogen 2.520 N/A LEU 6.A N SER 52.A O no hydrogen 2.929 N/A GLY 7.A N THR 22.A O no hydrogen 2.842 N/A TYR 8.A N ILE 50.A O no hydrogen 2.813 N/A TYR 8.A OH GLY 157.A O no hydrogen 2.580 N/A TYR 9.A N VAL 20.A O no hydrogen 2.913 N/A TYR 9.A OH LEU 29.A O no hydrogen 2.941 N/A PHE 10.A N SER 48.A O no hydrogen 2.909 N/A SER 11.A N ALA 17.A O no hydrogen 3.241 N/A ASN 14.A N ASP 12.A OD2 no hydrogen 2.833 N/A GLN 16.A N ASP 12.A OD1 no hydrogen 3.010 N/A GLN 16.A N ASP 12.A OD2 no hydrogen 3.126 N/A ALA 17.A N ASP 12.A OD1 no hydrogen 2.837 N/A MET 19.A N TYR 9.A O no hydrogen 2.779 N/A VAL 20.A N TYR 9.A O no hydrogen 3.387 N/A VAL 21.A N LEU 178.A O no hydrogen 2.914 N/A THR 22.A N GLY 7.A O no hydrogen 3.068 N/A THR 22.A OG1 THR 176.A O no hydrogen 2.751 N/A SER 24.A N LEU 5.A O no hydrogen 3.368 N/A GLY 27.A N ILE 128.A O no hydrogen 3.071 N/A ASP 28.A N THR 26.A OG1 no hydrogen 2.899 N/A LEU 29.A N PHE 114.A O no hydrogen 3.043 N/A SER 30.A OG ASP 28.A OD1 no hydrogen 2.873 N/A SER 30.A OG ASP 113.A OD1 no hydrogen 3.204 N/A SER 30.A OG PHE 114.A O no hydrogen 3.033 N/A ILE 31.A N LEU 112.A O no hydrogen 2.960 N/A GLU 35.A N PRO 32.A O no hydrogen 2.986 N/A LEU 36.A N SER 33.A O no hydrogen 3.065 N/A ILE 39.A N LEU 36.A O no hydrogen 3.386 N/A ASN 43.A N PRO 40.A O no hydrogen 2.909 N/A GLN 44.A NE2 ILE 39.A O no hydrogen 3.366 N/A GLN 47.A N PHE 10.A O no hydrogen 3.029 N/A GLN 47.A NE2 SER 11.A O no hydrogen 3.467 N/A SER 48.A N PHE 10.A O no hydrogen 3.434 N/A SER 48.A OG ASP 12.A O no hydrogen 2.923 N/A SER 48.A OG LEU 13.A O no hydrogen 3.133 N/A ALA 49.A N TYR 102.A O no hydrogen 3.001 N/A ILE 50.A N TYR 8.A O no hydrogen 2.948 N/A TRP 51.A N ILE 100.A O no hydrogen 2.919 N/A TRP 51.A NE1 TYR 9.A OH no hydrogen 3.204 N/A SER 52.A N LEU 6.A O no hydrogen 2.945 N/A GLY 53.A N ILE 98.A O no hydrogen 3.292 N/A PHE 54.A N GLN 134.A O no hydrogen 2.799 N/A ILE 55.A N TYR 96.A O no hydrogen 2.921 N/A LYS 56.A N ASN 132.A O no hydrogen 3.044 N/A SER 60.A OG LEU 90.A O no hydrogen 3.284 N/A ASP 61.A N LEU 90.A O no hydrogen 3.167 N/A GLU 62.A N ASP 61.A OD1 no hydrogen 2.985 N/A TYR 63.A N ILE 88.A O no hydrogen 2.687 N/A TYR 63.A OH LYS 59.A O no hydrogen 3.096 N/A THR 64.A N THR 119.A O no hydrogen 3.024 N/A THR 64.A OG1 ASN 86.A O no hydrogen 2.781 N/A ALA 66.A N TYR 117.A O no hydrogen 2.841 N/A THR 67.A N ASP 70.A OD1 no hydrogen 2.949 N/A THR 67.A OG1 ASP 70.A OD1 no hydrogen 2.883 N/A SER 68.A N LYS 115.A O no hydrogen 3.090 N/A SER 68.A OG LYS 115.A O no hydrogen 3.257 N/A ALA 69.A N THR 67.A OG1 no hydrogen 3.188 N/A HIS 72.A N ALA 69.A O no hydrogen 2.788 N/A THR 74.A N GLN 101.A O no hydrogen 3.334 N/A THR 74.A OG1 ASN 84.A OD1 no hydrogen 3.422 N/A TRP 76.A N LYS 99.A O no hydrogen 2.939 N/A VAL 77.A N GLN 80.A O no hydrogen 3.050 N/A ASP 78.A N GLN 97.A O no hydrogen 2.855 N/A VAL 82.A N MET 75.A O no hydrogen 2.797 N/A ASN 84.A ND2 GLU 81.A OE1 no hydrogen 2.988 N/A ILE 88.A N TYR 63.A O no hydrogen 3.047 N/A LEU 90.A N ASP 61.A O no hydrogen 2.845 N/A GLY 93.A N VAL 57.A O no hydrogen 3.315 N/A TYR 96.A N ILE 55.A O no hydrogen 2.912 N/A TYR 96.A OH GLU 91.A O no hydrogen 3.397 N/A GLN 97.A N ASP 78.A OD1 no hydrogen 3.168 N/A ILE 98.A N GLY 53.A O no hydrogen 2.968 N/A LYS 99.A N TRP 76.A O no hydrogen 3.207 N/A ILE 100.A N TRP 51.A O no hydrogen 3.025 N/A GLN 101.A N THR 74.A O no hydrogen 3.206 N/A TYR 102.A N ALA 49.A O no hydrogen 2.993 N/A GLN 103.A N HIS 72.A O no hydrogen 3.145 N/A GLN 103.A NE2 LEU 13.A O no hydrogen 3.282 N/A GLN 103.A NE2 ASN 14.A OD1 no hydrogen 3.554 N/A ARG 104.A N GLN 47.A O no hydrogen 2.879 N/A ARG 104.A NE HIS 72.A NE2 no hydrogen 3.693 N/A ASN 106.A N GLN 47.A OE1 no hydrogen 3.089 N/A GLY 111.A N GLN 44.A O no hydrogen 2.969 N/A LEU 112.A N ILE 31.A O no hydrogen 2.994 N/A PHE 114.A N SER 30.A OG no hydrogen 2.983 N/A LEU 116.A N GLY 27.A O no hydrogen 2.866 N/A TYR 117.A N ALA 66.A O no hydrogen 2.687 N/A TRP 118.A N GLU 126.A O no hydrogen 3.114 N/A THR 119.A N THR 64.A O no hydrogen 2.768 N/A ASP 120.A N LYS 124.A O no hydrogen 3.427 N/A SER 121.A OG ASP 61.A OD1 no hydrogen 2.646 N/A SER 121.A OG ASP 61.A OD2 no hydrogen 3.428 N/A ASN 123.A N ASP 120.A O no hydrogen 3.330 N/A LYS 124.A N ASP 120.A OD1 no hydrogen 3.030 N/A ILE 128.A N LEU 116.A O no hydrogen 3.245 N/A SER 130.A OG ASP 131.A OD1 no hydrogen 3.228 N/A ASP 131.A N SER 129.A OG no hydrogen 3.035 N/A ASN 132.A ND2 SER 129.A OG no hydrogen 3.031 N/A LEU 133.A N SER 130.A O no hydrogen 3.114 N/A GLN 134.A N PHE 54.A O no hydrogen 2.937 N/A LYS 139.A NZ GLU 212.A OE2 no hydrogen 2.902 N/A LYS 139.A NZ TYR 403.A O no hydrogen 2.944 N/A SER 143.A OG GLU 137.A OE2 no hydrogen 3.568 N/A ARG 146.A NE GLU 137.A OE1 no hydrogen 3.071 N/A ARG 146.A NH2 LEU 135.A O no hydrogen 2.804 N/A ARG 146.A NH2 GLU 137.A OE1 no hydrogen 3.059 N/A LYS 148.A NZ GLN 140.A O no hydrogen 3.059 N/A ARG 153.A N ASP 160.A OD1 no hydrogen 3.126 N/A ARG 153.A NH1 ASP 160.A OD2 no hydrogen 3.517 N/A ASN 155.A N ASP 152.A O no hydrogen 2.990 N/A ASN 155.A ND2 GLU 137.A O no hydrogen 3.428 N/A ASN 155.A ND2 LYS 139.A O no hydrogen 2.929 N/A ASP 156.A N ASP 154.A OD1 no hydrogen 3.004 N/A GLY 157.A N ASP 152.A OD1 no hydrogen 3.362 N/A ASP 160.A N PRO 151.A O no hydrogen 3.040 N/A GLU 163.A N PRO 159.A O no hydrogen 3.367 N/A GLU 163.A N ASP 160.A O no hydrogen 3.050 N/A VAL 164.A N ASP 160.A O no hydrogen 3.318 N/A VAL 164.A N SER 161.A O no hydrogen 3.266 N/A GLU 165.A N SER 161.A O no hydrogen 3.042 N/A GLY 166.A N LEU 162.A O no hydrogen 3.178 N/A TYR 167.A N TYR 194.A O no hydrogen 2.917 N/A TYR 167.A OH SER 196.A OG no hydrogen 3.022 N/A THR 168.A N SER 179.A O no hydrogen 2.907 N/A THR 168.A OG1 THR 192.A O no hydrogen 2.793 N/A ASP 170.A N PHE 177.A O no hydrogen 3.087 N/A LYS 172.A N ARG 175.A O no hydrogen 2.935 N/A ARG 175.A NH1 GLU 35.A OE1 no hydrogen 3.552 N/A ARG 175.A NH2 SER 23.A O no hydrogen 3.071 N/A PHE 177.A N ASP 170.A O no hydrogen 3.110 N/A SER 179.A N THR 168.A O no hydrogen 3.079 N/A SER 179.A OG MET 19.A O no hydrogen 2.724 N/A ILE 182.A N HIS 186.A ND1 no hydrogen 3.130 N/A ILE 185.A N ILE 182.A O no hydrogen 3.173 N/A HIS 186.A N ILE 182.A O no hydrogen 3.166 N/A HIS 186.A NE2 ASN 38.A O no hydrogen 3.335 N/A GLU 187.A N SER 183.A O no hydrogen 3.055 N/A GLY 190.A N GLU 187.A O no hydrogen 3.354 N/A TYR 194.A N TYR 167.A O no hydrogen 2.796 N/A SER 196.A N GLU 163.A O no hydrogen 3.009 N/A SER 196.A OG GLU 163.A OE2 no hydrogen 2.716 N/A SER 196.A OG TYR 167.A OH no hydrogen 3.022 N/A SER 197.A N THR 203.A OG1 no hydrogen 2.868 N/A SER 197.A OG THR 458.A OG1 no hydrogen 3.284 N/A GLU 199.A N SER 197.A OG no hydrogen 3.135 N/A LYS 200.A N SER 197.A O no hydrogen 3.301 N/A LYS 200.A NZ THR 203.A O no hydrogen 3.566 N/A LYS 200.A NZ SER 205.A OG no hydrogen 2.489 N/A TRP 201.A NE1 LEU 138.A O no hydrogen 2.980 N/A SER 202.A OG ASP 206.A O no hydrogen 3.322 N/A SER 202.A OG ASP 206.A OD1 no hydrogen 2.757 N/A SER 202.A OG TYR 208.A O no hydrogen 3.316 N/A THR 203.A N ASP 210.A OD1 no hydrogen 2.860 N/A THR 203.A OG1 ASP 210.A OD2 no hydrogen 2.711 N/A SER 205.A N SER 202.A O no hydrogen 2.988 N/A SER 205.A OG THR 428.A OG1 no hydrogen 3.297 N/A ASP 206.A N SER 202.A OG no hydrogen 2.941 N/A TYR 208.A N ASP 206.A OD1 no hydrogen 3.360 N/A SER 209.A N GLU 212.A OE1 no hydrogen 3.489 N/A ASP 210.A N TRP 201.A O no hydrogen 3.042 N/A GLU 212.A N SER 209.A OG no hydrogen 2.910 N/A LYS 213.A N SER 209.A O no hydrogen 3.103 N/A LYS 213.A NZ ASP 206.A OD1 no hydrogen 3.426 N/A LYS 213.A NZ ASP 206.A OD2 no hydrogen 2.854 N/A THR 215.A OG1 PHE 211.A O no hydrogen 2.718 N/A ARG 217.A NH1 THR 215.A OG1 no hydrogen 3.284 N/A ARG 217.A NH2 SER 23.A OG no hydrogen 2.878 N/A ILE 218.A N GLY 216.A O no hydrogen 2.742 N/A ASN 221.A N ASP 219.A OD1 no hydrogen 2.925 N/A ASN 221.A ND2 ASP 219.A OD1 no hydrogen 3.247 N/A SER 223.A N THR 312.A O no hydrogen 3.187 N/A GLU 225.A N GLU 225.A OE1 no hydrogen 2.996 N/A ALA 226.A N SER 223.A O no hydrogen 2.964 N/A ARG 227.A NE VAL 222.A O no hydrogen 3.255 N/A ARG 227.A NH2 LYS 220.A O no hydrogen 3.423 N/A ARG 227.A NH2 VAL 222.A O no hydrogen 3.477 N/A HIS 228.A N GLU 225.A O no hydrogen 3.344 N/A LEU 230.A N HIS 228.A ND1 no hydrogen 3.263 N/A VAL 231.A N HIS 228.A O no hydrogen 3.071 N/A ALA 232.A N ARG 445.A O no hydrogen 3.047 N/A ALA 233.A N ASP 206.A OD2 no hydrogen 2.837 N/A TYR 234.A N THR 312.A OG1 no hydrogen 3.110 N/A TYR 234.A OH GLU 443.A OE2 no hydrogen 2.904 N/A ILE 236.A N ASN 309.A OD1 no hydrogen 3.159 N/A HIS 238.A N VAL 308.A O no hydrogen 3.087 N/A ASP 240.A N ARG 306.A O no hydrogen 2.835 N/A MET 241.A N THR 268.A OG1 no hydrogen 3.013 N/A GLU 242.A N ASN 304.A O no hydrogen 2.901 N/A ILE 244.A N LYS 264.A O no hydrogen 2.910 N/A ILE 245.A N ASN 302.A O no hydrogen 2.923 N/A LEU 246.A N ILE 262.A O no hydrogen 2.953 N/A SER 247.A OG ARG 300.A O no hydrogen 3.530 N/A ASN 249.A N THR 298.A O no hydrogen 2.943 N/A ASP 256.A N ASN 254.A OD1 no hydrogen 3.135 N/A ILE 262.A N LEU 246.A O no hydrogen 3.250 N/A LYS 264.A N ILE 244.A O no hydrogen 3.185 N/A LYS 264.A NZ SER 291.A O no hydrogen 3.279 N/A THR 266.A N GLU 242.A O no hydrogen 2.978 N/A SER 267.A N ALA 287.A O no hydrogen 2.928 N/A THR 268.A OG1 ASP 240.A OD1 no hydrogen 3.102 N/A THR 268.A OG1 MET 241.A O no hydrogen 3.018 N/A SER 269.A N THR 285.A O no hydrogen 2.975 N/A THR 271.A N SER 283.A O no hydrogen 3.139 N/A HIS 272.A N ASN 542.A O no hydrogen 3.173 N/A GLY 277.A N HIS 272.A NE2 no hydrogen 3.384 N/A SER 279.A OG SER 281.A OG no hydrogen 2.929 N/A SER 281.A N SER 279.A OG no hydrogen 3.312 N/A SER 281.A OG SER 279.A OG no hydrogen 2.929 N/A ASN 282.A ND2 THR 393.A O no hydrogen 3.582 N/A ASN 282.A ND2 ASP 394.A O no hydrogen 3.252 N/A ASN 282.A ND2 TYR 397.A OH no hydrogen 2.818 N/A SER 283.A OG ASP 392.A OD1 no hydrogen 2.930 N/A SER 284.A N LEU 391.A O no hydrogen 3.009 N/A SER 284.A OG VAL 239.A O no hydrogen 3.021 N/A THR 285.A N SER 269.A O no hydrogen 2.847 N/A VAL 286.A N LEU 389.A O no hydrogen 2.840 N/A ALA 287.A N SER 267.A O no hydrogen 2.868 N/A ILE 288.A N LYS 387.A O no hydrogen 2.956 N/A ASP 289.A N ASN 265.A O no hydrogen 3.026 N/A HIS 290.A NE2 TYR 601.A O no hydrogen 3.122 N/A SER 291.A N ASP 289.A OD1 no hydrogen 3.204 N/A SER 291.A OG ASP 289.A OD1 no hydrogen 2.980 N/A SER 291.A OG ASN 605.A OD1 no hydrogen 3.311 N/A LEU 292.A N ASP 602.A O no hydrogen 3.224 N/A ALA 296.A N ASN 294.A OD1 no hydrogen 2.983 N/A ASP 297.A N ASN 294.A O no hydrogen 2.868 N/A ALA 299.A N MET 375.A O no hydrogen 3.124 N/A ARG 300.A N SER 247.A O no hydrogen 3.066 N/A ARG 300.A NH1 GLU 250.A OE1 no hydrogen 3.458 N/A LEU 301.A N ILE 373.A O no hydrogen 3.243 N/A ASN 302.A N ILE 245.A O no hydrogen 3.004 N/A ASN 302.A ND2 ASN 363.A O no hydrogen 3.576 N/A ALA 303.A N ASN 302.A OD1 no hydrogen 2.958 N/A ASN 304.A N ASN 243.A O no hydrogen 3.201 N/A ASN 304.A ND2 ASN 243.A OD1 no hydrogen 3.051 N/A ILE 305.A N ILE 360.A O no hydrogen 2.969 N/A ARG 306.A N ASP 240.A O no hydrogen 2.921 N/A ARG 306.A NE PRO 353.A O no hydrogen 3.068 N/A ARG 306.A NH1 GLU 242.A OE2 no hydrogen 3.278 N/A ARG 306.A NH2 PRO 353.A O no hydrogen 3.168 N/A ARG 306.A NH2 SER 354.A O no hydrogen 2.847 N/A ARG 306.A NH2 LEU 357.A O no hydrogen 2.689 N/A TYR 307.A N TYR 352.A O no hydrogen 2.820 N/A VAL 308.A N HIS 238.A O no hydrogen 2.916 N/A ASN 309.A N ASN 350.A O no hydrogen 3.033 N/A ASN 309.A ND2 ALA 313.A O no hydrogen 3.077 N/A ASN 309.A ND2 LEU 346.A O no hydrogen 3.313 N/A THR 310.A N ILE 236.A O no hydrogen 2.965 N/A GLY 311.A N ASN 309.A OD1 no hydrogen 3.101 N/A THR 312.A N TYR 234.A O no hydrogen 2.830 N/A THR 312.A OG1 ALA 232.A O no hydrogen 2.930 N/A THR 312.A OG1 TYR 234.A O no hydrogen 3.568 N/A ILE 315.A N LEU 346.A O no hydrogen 3.212 N/A TYR 316.A OH ASP 219.A OD2 no hydrogen 2.610 N/A ASN 317.A ND2 ASN 399.A OD1 no hydrogen 2.896 N/A THR 321.A N ASP 394.A OD1 no hydrogen 3.067 N/A THR 322.A N ILE 335.A O no hydrogen 3.213 N/A THR 322.A OG1 THR 393.A OG1 no hydrogen 2.839 N/A SER 323.A N ASP 392.A O no hydrogen 2.876 N/A LEU 324.A N ALA 333.A O no hydrogen 3.085 N/A VAL 325.A N ARG 390.A O no hydrogen 2.784 N/A LEU 326.A N GLN 330.A O no hydrogen 3.017 N/A GLN 330.A N LEU 326.A O no hydrogen 3.274 N/A GLN 330.A NE2 GLU 382.A OE1 no hydrogen 3.072 N/A LEU 332.A N LEU 324.A O no hydrogen 2.854 N/A ILE 335.A N THR 322.A O no hydrogen 2.845 N/A ASN 340.A N ASN 317.A O no hydrogen 2.983 N/A SER 343.A N TYR 352.A OH no hydrogen 2.893 N/A SER 343.A OG TYR 352.A OH no hydrogen 3.189 N/A GLN 344.A NE2 ILE 345.A O no hydrogen 2.956 N/A GLN 344.A NE2 TYR 351.A O no hydrogen 3.514 N/A LEU 346.A N ILE 315.A O no hydrogen 3.163 N/A TYR 351.A N ASN 350.A OD1 no hydrogen 2.936 N/A TYR 352.A N TYR 307.A O no hydrogen 3.060 N/A SER 354.A N GLN 344.A OE1 no hydrogen 3.282 N/A LEU 357.A N SER 354.A O no hydrogen 2.882 N/A ILE 360.A N ILE 305.A O no hydrogen 3.127 N/A LEU 362.A N ALA 303.A O no hydrogen 3.184 N/A ASN 363.A N ASN 302.A OD1 no hydrogen 3.240 N/A ASN 363.A ND2 LEU 362.A O no hydrogen 3.014 N/A ASN 363.A ND2 THR 371.A O no hydrogen 3.022 N/A SER 370.A OG ASP 367.A O no hydrogen 3.437 N/A MET 375.A N ALA 299.A O no hydrogen 3.023 N/A ASN 376.A N GLN 379.A OE1 no hydrogen 2.903 N/A GLN 379.A N ASN 376.A OD1 no hydrogen 2.956 N/A GLN 379.A NE2 GLN 330.A OE1 no hydrogen 3.236 N/A PHE 380.A N ASN 376.A O no hydrogen 2.972 N/A LEU 381.A N TYR 377.A O no hydrogen 3.247 N/A GLU 382.A N ASN 378.A O no hydrogen 3.063 N/A LEU 383.A N GLN 379.A O no hydrogen 3.035 N/A GLU 384.A N PHE 380.A O no hydrogen 2.847 N/A LYS 385.A N LEU 381.A O no hydrogen 2.930 N/A THR 386.A N LEU 383.A O no hydrogen 3.236 N/A THR 386.A OG1 GLU 382.A O no hydrogen 2.814 N/A THR 386.A OG1 LEU 383.A O no hydrogen 3.553 N/A LYS 387.A N LEU 383.A O no hydrogen 2.644 N/A LYS 387.A NZ GLU 384.A O no hydrogen 2.825 N/A LYS 387.A NZ ILE 649.A O no hydrogen 2.919 N/A LEU 389.A N VAL 286.A O no hydrogen 3.126 N/A ARG 390.A N VAL 325.A O no hydrogen 2.982 N/A ARG 390.A NE ASP 392.A OD1 no hydrogen 3.173 N/A ARG 390.A NE ASP 392.A OD2 no hydrogen 3.319 N/A ARG 390.A NH1 GLY 327.A O no hydrogen 3.353 N/A ARG 390.A NH1 LYS 328.A O no hydrogen 3.177 N/A ARG 390.A NH2 LYS 328.A O no hydrogen 3.172 N/A ARG 390.A NH2 ASP 392.A OD2 no hydrogen 3.156 N/A LEU 391.A N SER 284.A O no hydrogen 2.898 N/A ASP 392.A N SER 323.A O no hydrogen 3.100 N/A THR 393.A N ASN 282.A O no hydrogen 2.908 N/A THR 393.A OG1 THR 322.A OG1 no hydrogen 2.839 N/A ASP 394.A N THR 321.A O no hydrogen 3.237 N/A VAL 396.A N ASP 394.A OD1 no hydrogen 3.272 N/A ASN 399.A N ASN 317.A OD1 no hydrogen 3.158 N/A ASN 399.A ND2 ASP 413.A O no hydrogen 3.553 N/A ASN 399.A ND2 SER 416.A O no hydrogen 2.994 N/A ILE 400.A N SER 416.A O no hydrogen 3.245 N/A THR 402.A OG1 ASP 413.A OD2 no hydrogen 3.160 N/A TYR 403.A OH SER 2.A OG no hydrogen 2.520 N/A ASN 404.A N ARG 409.A O no hydrogen 2.932 N/A GLU 406.A N ASN 404.A OD1 no hydrogen 3.163 N/A GLY 408.A N ASN 404.A O no hydrogen 2.854 N/A ARG 409.A NH1 ASN 407.A O no hydrogen 2.970 N/A ARG 411.A N THR 402.A O no hydrogen 3.210 N/A ASP 413.A N ILE 400.A O no hydrogen 2.979 N/A GLY 415.A N ASP 413.A OD1 no hydrogen 3.060 N/A SER 416.A N ASP 413.A O no hydrogen 2.931 N/A SER 416.A OG ASP 413.A OD2 no hydrogen 2.583 N/A TRP 418.A N GLY 398.A O no hydrogen 2.966 N/A GLU 420.A N ASN 417.A O no hydrogen 3.105 N/A VAL 421.A N TRP 418.A O no hydrogen 2.970 N/A LEU 422.A N TRP 418.A O no hydrogen 3.034 N/A GLN 424.A NE2 GLU 420.A O no hydrogen 2.704 N/A ILE 425.A N VAL 421.A O no hydrogen 2.979 N/A GLN 426.A N LEU 422.A O no hydrogen 2.890 N/A GLN 426.A NE2 GLN 395.A OE1 no hydrogen 3.113 N/A GLU 427.A N PRO 423.A O no hydrogen 3.183 N/A THR 428.A N ILE 425.A O no hydrogen 3.198 N/A THR 428.A OG1 SER 205.A OG no hydrogen 3.297 N/A THR 428.A OG1 GLN 424.A O no hydrogen 3.010 N/A THR 429.A OG1 ILE 425.A O no hydrogen 3.102 N/A ALA 430.A N ILE 446.A O no hydrogen 2.997 N/A ARG 431.A N MET 528.A O no hydrogen 2.829 N/A ARG 431.A NE ASN 529.A OD1 no hydrogen 2.957 N/A ARG 431.A NH1 SER 279.A O no hydrogen 3.290 N/A ARG 431.A NH1 GLU 443.A OE1 no hydrogen 3.148 N/A ARG 431.A NH2 SER 279.A O no hydrogen 3.052 N/A ARG 431.A NH2 ASN 529.A OD1 no hydrogen 2.945 N/A ILE 432.A N ARG 444.A O no hydrogen 3.176 N/A ILE 433.A N ILE 530.A O no hydrogen 2.875 N/A PHE 434.A N VAL 442.A O no hydrogen 2.890 N/A ASN 435.A N ILE 532.A O no hydrogen 3.215 N/A ASN 435.A ND2 TYR 539.A OH no hydrogen 3.310 N/A LYS 437.A NZ ASN 349.A OD1 no hydrogen 2.990 N/A VAL 442.A N PHE 434.A O no hydrogen 2.998 N/A ARG 444.A N ILE 432.A O no hydrogen 2.961 N/A ARG 444.A NE GLU 225.A OE2 no hydrogen 2.738 N/A ARG 444.A NH1 THR 310.A O no hydrogen 2.957 N/A ARG 444.A NH1 GLU 443.A O no hydrogen 2.725 N/A ARG 444.A NH2 GLU 225.A OE2 no hydrogen 3.239 N/A ARG 445.A NH1 THR 429.A O no hydrogen 3.075 N/A ARG 445.A NH1 THR 429.A OG1 no hydrogen 2.903 N/A ILE 446.A N ALA 430.A O no hydrogen 2.971 N/A ALA 447.A N LEU 230.A O no hydrogen 2.860 N/A SER 452.A N ASN 450.A OD1 no hydrogen 3.417 N/A SER 452.A OG ASN 450.A OD1 no hydrogen 3.020 N/A ASP 453.A N ASN 450.A O no hydrogen 3.068 N/A GLU 456.A N ASP 453.A O no hydrogen 3.128 N/A THR 457.A N PRO 454.A O no hydrogen 3.311 N/A THR 458.A N LEU 455.A O no hydrogen 3.165 N/A THR 458.A OG1 SER 197.A OG no hydrogen 3.284 N/A THR 458.A OG1 LEU 455.A O no hydrogen 2.919 N/A LYS 459.A N GLU 456.A O no hydrogen 3.373 N/A LYS 459.A NZ THR 428.A O no hydrogen 2.909 N/A LYS 459.A NZ GLU 456.A OE1 no hydrogen 2.819 N/A LYS 459.A NZ GLU 456.A OE2 no hydrogen 3.508 N/A LEU 464.A N ILE 522.A O no hydrogen 2.862 N/A LYS 465.A N LEU 519.A O no hydrogen 3.430 N/A LYS 465.A NZ GLU 476.A OE1 no hydrogen 2.786 N/A LYS 465.A NZ GLU 476.A OE2 no hydrogen 3.082 N/A GLU 466.A N THR 463.A OG1 no hydrogen 3.145 N/A ALA 467.A N THR 463.A O no hydrogen 3.231 N/A LEU 468.A N LEU 464.A O no hydrogen 3.214 N/A LYS 469.A N LYS 465.A O no hydrogen 3.367 N/A LYS 469.A NZ GLU 476.A OE2 no hydrogen 3.302 N/A ILE 470.A N GLU 466.A O no hydrogen 3.093 N/A ALA 471.A N ALA 467.A O no hydrogen 3.011 N/A PHE 472.A N LEU 468.A O no hydrogen 3.143 N/A GLY 473.A N LYS 469.A O no hydrogen 2.968 N/A PHE 474.A N LEU 468.A O no hydrogen 3.269 N/A ASN 475.A N GLN 482.A O no hydrogen 2.959 N/A GLN 482.A N ASN 475.A O no hydrogen 2.870 N/A TYR 483.A N LYS 486.A O no hydrogen 2.931 N/A LYS 486.A N TYR 483.A O no hydrogen 3.483 N/A LYS 486.A NZ GLU 490.A OE1 no hydrogen 2.773 N/A ASP 487.A N GLU 490.A OE2 no hydrogen 3.071 N/A ILE 488.A N LEU 481.A O no hydrogen 2.972 N/A THR 489.A N ASP 487.A OD2 no hydrogen 3.369 N/A THR 489.A OG1 ASP 487.A OD2 no hydrogen 2.929 N/A GLU 490.A N ASP 487.A O no hydrogen 3.007 N/A PHE 491.A N ILE 488.A O no hydrogen 3.171 N/A ASP 492.A N ARG 533.A O no hydrogen 2.848 N/A ASN 494.A N LEU 531.A O no hydrogen 2.967 N/A ASN 494.A ND2 ASP 492.A OD1 no hydrogen 3.145 N/A ASN 494.A ND2 LEU 531.A O no hydrogen 3.199 N/A ASP 496.A N ASN 529.A O no hydrogen 3.386 N/A THR 499.A N ASP 496.A OD1 no hydrogen 2.699 N/A THR 499.A OG1 ASP 496.A OD1 no hydrogen 2.617 N/A THR 499.A OG1 ASP 496.A OD2 no hydrogen 3.414 N/A SER 500.A N ASP 496.A O no hydrogen 3.039 N/A GLN 501.A N GLN 497.A O no hydrogen 3.201 N/A GLN 501.A NE2 ASN 505.A OD1 no hydrogen 2.971 N/A ASN 502.A N GLN 498.A O no hydrogen 3.087 N/A ASN 502.A ND2 ASN 525.A OD1 no hydrogen 3.306 N/A ILE 503.A N THR 499.A O no hydrogen 2.857 N/A LYS 504.A N SER 500.A O no hydrogen 3.143 N/A ASN 505.A N GLN 501.A O no hydrogen 3.190 N/A GLN 506.A N ILE 503.A O no hydrogen 2.983 N/A GLN 506.A NE2 ASN 502.A OD1 no hydrogen 3.155 N/A GLN 506.A NE2 LYS 523.A O no hydrogen 3.172 N/A LEU 507.A N ILE 503.A O no hydrogen 2.982 N/A ALA 508.A N LYS 504.A O no hydrogen 3.099 N/A GLU 509.A N ASN 505.A O no hydrogen 3.422 N/A LEU 510.A N GLN 506.A O no hydrogen 3.051 N/A LEU 510.A N LEU 507.A O no hydrogen 2.988 N/A ASN 511.A N ALA 508.A O no hydrogen 2.953 N/A ALA 512.A N LEU 507.A O no hydrogen 2.977 N/A TYR 516.A OH PHE 491.A O no hydrogen 3.040 N/A THR 517.A N ASN 514.A O no hydrogen 3.159 N/A THR 517.A OG1 ASN 514.A O no hydrogen 2.748 N/A VAL 518.A N ILE 515.A O no hydrogen 3.051 N/A LYS 521.A N VAL 518.A O no hydrogen 2.941 N/A ILE 522.A N VAL 518.A O no hydrogen 3.133 N/A ILE 522.A N LEU 519.A O no hydrogen 3.211 N/A LYS 523.A N GLN 506.A OE1 no hydrogen 3.144 N/A LEU 524.A N MET 462.A O no hydrogen 2.868 N/A ASN 525.A ND2 LEU 524.A O no hydrogen 2.899 N/A ALA 526.A N VAL 449.A O no hydrogen 2.930 N/A LYS 527.A N THR 429.A O no hydrogen 3.207 N/A MET 528.A N ASN 525.A O no hydrogen 3.242 N/A ASN 529.A N THR 499.A OG1 no hydrogen 3.140 N/A ASN 529.A ND2 ASP 496.A OD2 no hydrogen 3.047 N/A ILE 530.A N ARG 431.A O no hydrogen 2.902 N/A LEU 531.A N ASN 494.A O no hydrogen 2.952 N/A ARG 533.A N ASP 492.A O no hydrogen 3.387 N/A ARG 533.A N ASP 492.A OD1 no hydrogen 3.227 N/A ARG 533.A NE ASP 492.A OD1 no hydrogen 3.486 N/A ASP 534.A N ASN 435.A OD1 no hydrogen 3.099 N/A LYS 535.A N GLU 490.A O no hydrogen 2.858 N/A LYS 535.A NZ THR 489.A O no hydrogen 2.991 N/A LYS 535.A NZ TYR 516.A OH no hydrogen 3.032 N/A ARG 536.A N ASP 534.A OD1 no hydrogen 3.135 N/A ARG 536.A NE ASP 534.A OD1 no hydrogen 3.282 N/A ARG 536.A NE ASP 534.A OD2 no hydrogen 3.502 N/A ARG 536.A NH1 ASP 534.A OD2 no hydrogen 3.204 N/A ARG 536.A NH1 ASP 575.A OD2 no hydrogen 3.148 N/A ARG 536.A NH2 ASP 573.A OD2 no hydrogen 2.890 N/A HIS 538.A N GLY 547.A O no hydrogen 2.767 N/A HIS 538.A ND1 GLU 645.A OE2 no hydrogen 3.166 N/A HIS 538.A NE2 ASP 549.A OD1 no hydrogen 2.963 N/A TYR 539.A OH ASP 534.A O no hydrogen 2.573 N/A ASP 540.A N ILE 544.A O no hydrogen 3.097 N/A ASN 542.A N ASP 540.A OD1 no hydrogen 2.844 N/A ASN 542.A ND2 THR 273.A OG1 no hydrogen 3.233 N/A ASN 543.A N ASP 540.A O no hydrogen 3.047 N/A ASN 543.A ND2 HIS 272.A O no hydrogen 2.821 N/A ASN 543.A ND2 SER 274.A OG no hydrogen 3.358 N/A ILE 544.A N ASP 540.A OD1 no hydrogen 3.052 N/A VAL 546.A N HIS 538.A O no hydrogen 2.911 N/A VAL 553.A N ASP 549.A O no hydrogen 3.002 N/A LYS 554.A N GLU 550.A O no hydrogen 2.821 N/A LYS 554.A NZ LEU 666.A O no hydrogen 3.090 N/A GLU 555.A N SER 551.A O no hydrogen 2.968 N/A ALA 556.A N VAL 552.A O no hydrogen 3.200 N/A HIS 557.A N LYS 554.A O no hydrogen 3.061 N/A HIS 557.A ND1 VAL 553.A O no hydrogen 2.853 N/A HIS 557.A NE2 TYR 583.A OH no hydrogen 2.947 N/A ARG 558.A N GLU 555.A O no hydrogen 3.043 N/A SER 564.A N GLY 567.A O no hydrogen 3.086 N/A GLU 566.A N SER 564.A OG no hydrogen 3.225 N/A GLY 567.A N SER 564.A O no hydrogen 3.400 N/A LEU 569.A N ASN 562.A O no hydrogen 3.105 N/A LEU 570.A N THR 615.A O no hydrogen 2.828 N/A ASN 571.A N GLU 559.A O no hydrogen 3.405 N/A ASN 571.A ND2 GLU 559.A OE1 no hydrogen 3.283 N/A ASN 571.A ND2 GLU 559.A OE2 no hydrogen 3.295 N/A ASP 575.A N ASP 573.A OD1 no hydrogen 3.178 N/A ARG 577.A N ASP 573.A O no hydrogen 3.049 N/A LYS 578.A N ASP 575.A O no hydrogen 3.187 N/A LYS 578.A NZ ASP 438.A O no hydrogen 3.142 N/A LYS 578.A NZ ASN 440.A OD1 no hydrogen 2.951 N/A ILE 579.A N ILE 576.A O no hydrogen 2.964 N/A SER 581.A N VAL 642.A O no hydrogen 2.923 N/A SER 581.A OG THR 643.A O no hydrogen 3.397 N/A SER 581.A OG THR 647.A OG1 no hydrogen 2.730 N/A TYR 583.A N LEU 604.A O no hydrogen 2.997 N/A TYR 583.A OH HIS 557.A NE2 no hydrogen 2.947 N/A ILE 584.A N TYR 640.A O no hydrogen 3.025 N/A VAL 585.A N ASN 598.A OD1 no hydrogen 3.267 N/A GLU 586.A N ASN 638.A O no hydrogen 3.001 N/A ILE 587.A N GLU 595.A O no hydrogen 2.877 N/A GLU 588.A N LYS 636.A O no hydrogen 2.797 N/A ASP 589.A N LEU 593.A O no hydrogen 2.912 N/A GLU 591.A N ASP 589.A OD1 no hydrogen 2.986 N/A GLY 592.A N ASP 589.A O no hydrogen 3.231 N/A LYS 594.A NZ GLU 588.A OE2 no hydrogen 3.164 N/A GLU 595.A N ILE 587.A O no hydrogen 3.016 N/A ILE 597.A N VAL 585.A O no hydrogen 2.899 N/A ASN 598.A ND2 TYR 583.A O no hydrogen 3.130 N/A ASN 598.A ND2 MET 603.A O no hydrogen 2.857 N/A ARG 600.A N ASN 598.A O no hydrogen 2.860 N/A ARG 600.A NE ASP 602.A OD1 no hydrogen 3.261 N/A ARG 600.A NE ASP 602.A OD2 no hydrogen 3.214 N/A ARG 600.A NH2 ASP 602.A OD1 no hydrogen 3.355 N/A ARG 600.A NH2 ASP 602.A OD2 no hydrogen 3.212 N/A TYR 601.A N THR 657.A O no hydrogen 3.065 N/A MET 603.A N ARG 600.A O no hydrogen 3.108 N/A ASN 605.A ND2 LEU 292.A O no hydrogen 3.645 N/A SER 608.A OG PHE 616.A O no hydrogen 3.405 N/A ARG 610.A N LYS 614.A O no hydrogen 2.906 N/A GLY 613.A N ARG 610.A O no hydrogen 3.089 N/A LYS 614.A N ASP 612.A OD1 no hydrogen 3.157 N/A THR 615.A N LEU 570.A O no hydrogen 2.957 N/A PHE 616.A N SER 608.A O no hydrogen 3.036 N/A ILE 617.A N LEU 568.A O no hydrogen 2.966 N/A ASP 618.A N ILE 606.A O no hydrogen 2.905 N/A PHE 619.A N GLU 566.A O no hydrogen 3.081 N/A LYS 620.A N ASP 618.A OD1 no hydrogen 2.879 N/A LYS 621.A N ASP 618.A OD1 no hydrogen 3.245 N/A LYS 621.A NZ ASN 605.A O no hydrogen 2.949 N/A TYR 622.A OH ASN 605.A OD1 no hydrogen 2.857 N/A ASN 623.A N LYS 620.A O no hydrogen 3.284 N/A ASN 623.A ND2 PRO 627.A O no hydrogen 3.055 N/A LEU 628.A N THR 565.A O no hydrogen 2.742 N/A ASN 634.A N ASN 632.A OD1 no hydrogen 3.021 N/A TYR 635.A N ASN 632.A O no hydrogen 2.833 N/A LYS 636.A N GLU 588.A O no hydrogen 2.957 N/A VAL 637.A N LYS 670.A O no hydrogen 2.877 N/A ASN 638.A N GLU 586.A O no hydrogen 2.905 N/A VAL 639.A N PHE 668.A O no hydrogen 3.088 N/A TYR 640.A N ILE 584.A O no hydrogen 2.912 N/A TYR 640.A OH GLU 586.A OE2 no hydrogen 2.349 N/A ALA 641.A N ILE 665.A O no hydrogen 2.858 N/A VAL 642.A N GLY 582.A O no hydrogen 3.092 N/A LYS 644.A N ILE 579.A O no hydrogen 2.863 N/A GLU 645.A N VAL 546.A O no hydrogen 2.841 N/A ASN 646.A N THR 643.A O no hydrogen 3.015 N/A THR 647.A N THR 643.A O no hydrogen 3.137 N/A THR 647.A N LYS 644.A O no hydrogen 3.250 N/A THR 647.A OG1 SER 581.A OG no hydrogen 2.730 N/A ASN 650.A ND2 GLU 384.A O no hydrogen 3.122 N/A SER 652.A N ASP 656.A O no hydrogen 3.120 N/A SER 652.A OG ASN 654.A OD1 no hydrogen 2.892 N/A SER 652.A OG ASP 656.A O no hydrogen 3.488 N/A GLY 655.A N SER 652.A O no hydrogen 2.890 N/A ASP 656.A N SER 652.A OG no hydrogen 2.971 N/A SER 658.A N ASP 656.A OD1 no hydrogen 3.383 N/A SER 658.A OG ASP 656.A OD1 no hydrogen 3.240 N/A SER 658.A OG ASP 656.A OD2 no hydrogen 3.112 N/A THR 659.A N ASP 599.A OD1 no hydrogen 3.094 N/A THR 659.A OG1 ASP 599.A OD1 no hydrogen 2.892 N/A ASN 660.A N SER 658.A OG no hydrogen 3.079 N/A ILE 662.A N THR 659.A O no hydrogen 3.065 N/A ILE 665.A N ALA 641.A O no hydrogen 2.977 N/A ILE 667.A N VAL 639.A O no hydrogen 3.010 N/A LYS 670.A N VAL 637.A O no hydrogen 3.487 N/A LYS 671.A N GLU 674.A OE1 no hydrogen 3.268 N/A GLY 672.A N TYR 635.A O no hydrogen 2.932 N/A TYR 673.A N PRO 633.A O no hydrogen 2.901 N/A GLU 674.A N LYS 671.A O no hydrogen 3.067 N/A ILE 675.A N GLY 672.A O no hydrogen 3.248 N/A