Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 8p2f_E.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ARG 3.A NE PHE 5.A O no hydrogen 2.645 N/A ARG 3.A NH1 ASP 283.A OD2 no hydrogen 3.113 N/A ARG 3.A NH1 SER 349.A O no hydrogen 3.566 N/A ARG 3.A NH2 SER 349.A O no hydrogen 3.082 N/A SER 6.A OG GLU 8.A OE1 no hydrogen 3.453 N/A GLU 8.A N GLU 8.A OE1 no hydrogen 2.685 N/A LYS 9.A N SER 6.A O no hydrogen 2.834 N/A THR 10.A N LEU 7.A O no hydrogen 3.436 N/A THR 10.A OG1 SER 6.A O no hydrogen 2.996 N/A ARG 11.A N ARG 54.A O no hydrogen 2.685 N/A ARG 11.A NE ILE 253.A O no hydrogen 3.523 N/A ARG 11.A NH1 GLU 8.A O no hydrogen 2.915 N/A ARG 11.A NH1 THR 10.A O no hydrogen 2.947 N/A ARG 11.A NH2 ILE 253.A O no hydrogen 3.101 N/A ASN 12.A ND2 ASP 78.A OD2 no hydrogen 3.283 N/A ASN 12.A ND2 GLY 350.A O no hydrogen 3.439 N/A ILE 13.A N ASN 56.A O no hydrogen 2.858 N/A GLY 14.A N GLY 79.A O no hydrogen 2.959 N/A ILE 15.A N ILE 58.A O no hydrogen 2.880 N/A MET 16.A N VAL 81.A O no hydrogen 2.961 N/A ALA 21.A N HIS 18.A O no hydrogen 3.182 N/A LYS 23.A NZ ALA 17.A O no hydrogen 3.407 N/A THR 24.A OG1 ASP 59.A OD2 no hydrogen 3.109 N/A THR 26.A N GLY 22.A O no hydrogen 2.872 N/A THR 26.A OG1 GLY 22.A O no hydrogen 2.781 N/A THR 27.A N LYS 23.A O no hydrogen 2.913 N/A THR 27.A OG1 LYS 23.A O no hydrogen 2.918 N/A GLU 28.A N THR 24.A O no hydrogen 2.873 N/A ARG 29.A N THR 25.A O no hydrogen 2.932 N/A ARG 29.A NE GLU 28.A OE1 no hydrogen 2.546 N/A ARG 29.A NH1 ASN 242.A OD1 no hydrogen 2.533 N/A ARG 29.A NH2 GLU 28.A OE2 no hydrogen 2.750 N/A ILE 30.A N THR 26.A O no hydrogen 2.889 N/A LEU 31.A N THR 27.A O no hydrogen 2.926 N/A TYR 32.A N GLU 28.A O no hydrogen 2.888 N/A TYR 33.A N ARG 29.A O no hydrogen 2.938 N/A THR 34.A N ILE 30.A O no hydrogen 2.930 N/A THR 34.A OG1 ILE 30.A O no hydrogen 2.826 N/A THR 34.A OG1 LEU 31.A O no hydrogen 2.922 N/A GLY 35.A N LEU 31.A O no hydrogen 2.899 N/A ARG 36.A NH1 TYR 32.A OH no hydrogen 3.313 N/A THR 42.A N THR 40.A OG1 no hydrogen 3.300 N/A THR 46.A N ILE 57.A O no hydrogen 2.962 N/A THR 46.A OG1 ILE 57.A O no hydrogen 3.319 N/A THR 47.A N MET 336.A O no hydrogen 2.929 N/A THR 47.A OG1 ASN 56.A OD1 no hydrogen 2.887 N/A ALA 48.A N VAL 55.A O no hydrogen 2.900 N/A TRP 50.A N HIS 53.A O no hydrogen 2.825 N/A TRP 50.A NE1 ASP 250.A OD1 no hydrogen 3.170 N/A HIS 53.A N TRP 50.A O no hydrogen 2.881 N/A HIS 53.A ND1 GLU 51.A O no hydrogen 2.952 N/A VAL 55.A N ALA 48.A O no hydrogen 2.886 N/A ASN 56.A N ARG 11.A O no hydrogen 2.665 N/A ASN 56.A ND2 ASN 12.A OD1 no hydrogen 2.590 N/A ILE 57.A N THR 46.A O no hydrogen 2.868 N/A ILE 58.A N ILE 13.A O no hydrogen 2.976 N/A THR 60.A N ILE 15.A O no hydrogen 2.988 N/A THR 60.A OG1 ILE 15.A O no hydrogen 2.538 N/A PHE 66.A N HIS 63.A O no hydrogen 3.047 N/A GLU 69.A N PHE 66.A O no hydrogen 3.295 N/A GLU 71.A N THR 67.A O no hydrogen 2.929 N/A ARG 72.A N VAL 68.A O no hydrogen 2.889 N/A ARG 72.A NE PHE 292.A O no hydrogen 3.174 N/A ARG 72.A NH1 GLU 69.A OE2 no hydrogen 2.872 N/A ARG 72.A NH2 PHE 292.A O no hydrogen 3.513 N/A SER 73.A N GLU 69.A O no hydrogen 2.927 N/A SER 73.A OG GLU 69.A O no hydrogen 2.995 N/A LEU 74.A N VAL 70.A O no hydrogen 2.907 N/A ARG 75.A N GLU 71.A O no hydrogen 2.972 N/A ARG 75.A NH1 ARG 75.A O no hydrogen 2.981 N/A ARG 75.A NH2 GLU 377.A O no hydrogen 2.900 N/A VAL 76.A N SER 73.A O no hydrogen 3.157 N/A ASP 78.A N ASN 12.A O no hydrogen 3.166 N/A GLY 79.A N ASN 12.A O no hydrogen 2.896 N/A ALA 80.A N PRO 107.A O no hydrogen 2.913 N/A VAL 81.A N GLY 14.A O no hydrogen 2.863 N/A THR 82.A N ILE 109.A O no hydrogen 2.909 N/A VAL 83.A N MET 16.A O no hydrogen 2.906 N/A LEU 84.A N PHE 111.A O no hydrogen 2.897 N/A GLN 87.A N ASP 85.A OD1 no hydrogen 2.841 N/A SER 88.A N ASP 85.A O no hydrogen 3.337 N/A GLY 89.A N ASP 85.A O no hydrogen 2.637 N/A GLU 91.A N THR 94.A OG1 no hydrogen 3.288 N/A GLN 93.A N HIS 18.A ND1 no hydrogen 3.358 N/A GLN 93.A NE2 GLY 62.A O no hydrogen 2.523 N/A GLU 95.A N GLU 91.A O no hydrogen 2.964 N/A THR 96.A N PRO 92.A O no hydrogen 2.975 N/A THR 96.A OG1 PRO 92.A O no hydrogen 3.248 N/A THR 96.A OG1 GLN 93.A OE1 no hydrogen 3.364 N/A VAL 97.A N GLN 93.A O no hydrogen 2.952 N/A TRP 98.A N THR 94.A O no hydrogen 2.906 N/A ARG 99.A N GLU 95.A O no hydrogen 2.921 N/A GLN 100.A N THR 96.A O no hydrogen 2.997 N/A GLN 100.A NE2 THR 67.A O no hydrogen 3.626 N/A ALA 101.A N VAL 97.A O no hydrogen 2.896 N/A THR 102.A N TRP 98.A O no hydrogen 2.887 N/A THR 102.A OG1 TRP 98.A O no hydrogen 2.926 N/A THR 103.A N ARG 99.A O no hydrogen 2.902 N/A THR 103.A OG1 ARG 99.A O no hydrogen 3.170 N/A TYR 104.A N GLN 100.A O no hydrogen 2.971 N/A GLY 105.A N THR 102.A O no hydrogen 3.094 N/A VAL 106.A N ALA 101.A O no hydrogen 2.955 N/A ARG 108.A NE VAL 106.A O no hydrogen 2.951 N/A ARG 108.A NH1 THR 102.A OG1 no hydrogen 2.716 N/A ARG 108.A NH2 THR 102.A OG1 no hydrogen 2.993 N/A ILE 109.A N ALA 80.A O no hydrogen 2.923 N/A VAL 110.A N PRO 233.A O no hydrogen 2.890 N/A PHE 111.A N THR 82.A O no hydrogen 2.849 N/A VAL 112.A N LEU 235.A O no hydrogen 2.877 N/A ASN 113.A N LEU 84.A O no hydrogen 2.876 N/A ASN 113.A ND2 ALA 21.A O no hydrogen 3.293 N/A LYS 114.A NZ ASP 20.A O no hydrogen 2.541 N/A MET 115.A N GLY 237.A O no hydrogen 3.328 N/A LYS 117.A N LYS 114.A O no hydrogen 3.232 N/A LYS 117.A NZ ASP 85.A OD1 no hydrogen 3.012 N/A LYS 117.A NZ ASP 85.A OD2 no hydrogen 2.752 N/A GLY 119.A N GLU 147.A OE2 no hydrogen 3.109 N/A ALA 120.A N LYS 117.A O no hydrogen 3.096 N/A ASN 121.A N ALA 86.A O no hydrogen 3.291 N/A GLU 123.A N GLU 123.A OE1 no hydrogen 2.401 N/A TYR 124.A N ASN 121.A OD1 no hydrogen 2.841 N/A SER 125.A N ASN 121.A O no hydrogen 2.949 N/A SER 125.A OG ASN 121.A O no hydrogen 3.072 N/A VAL 126.A N PHE 122.A O no hydrogen 2.951 N/A SER 127.A N GLU 123.A O no hydrogen 2.903 N/A SER 127.A OG GLU 123.A O no hydrogen 3.390 N/A SER 127.A OG TYR 124.A O no hydrogen 2.561 N/A THR 128.A N TYR 124.A O no hydrogen 2.890 N/A THR 128.A OG1 TYR 124.A O no hydrogen 3.141 N/A THR 128.A OG1 SER 125.A O no hydrogen 2.304 N/A LEU 129.A N SER 125.A O no hydrogen 2.939 N/A HIS 130.A N VAL 126.A O no hydrogen 2.974 N/A HIS 130.A NE2 ALA 137.A O no hydrogen 2.547 N/A ASP 131.A N SER 127.A O no hydrogen 2.898 N/A ARG 132.A N THR 128.A O no hydrogen 2.869 N/A ALA 137.A N ALA 135.A O no hydrogen 2.891 N/A ALA 138.A N TYR 232.A O no hydrogen 2.957 N/A ILE 140.A N VAL 234.A O no hydrogen 2.980 N/A LEU 142.A N ILE 154.A O no hydrogen 2.909 N/A ILE 144.A N ALA 152.A O no hydrogen 2.852 N/A GLU 147.A N MET 115.A O no hydrogen 2.999 N/A GLU 149.A N ALA 146.A O no hydrogen 3.087 N/A PHE 150.A N GLU 147.A O no hydrogen 3.039 N/A GLU 151.A N ILE 144.A O no hydrogen 2.953 N/A ALA 152.A N ILE 144.A O no hydrogen 3.038 N/A ILE 153.A N PHE 162.A O no hydrogen 2.895 N/A ILE 154.A N LEU 142.A O no hydrogen 2.835 N/A ASP 155.A N LYS 160.A O no hydrogen 2.857 N/A LEU 156.A N ILE 140.A O no hydrogen 3.070 N/A VAL 157.A N ASP 155.A OD1 no hydrogen 2.795 N/A GLU 158.A N ASP 155.A OD1 no hydrogen 3.485 N/A MET 159.A N LEU 156.A O no hydrogen 3.323 N/A LYS 160.A N ASP 155.A O no hydrogen 2.943 N/A CYS 161.A N ILE 175.A O no hydrogen 2.946 N/A PHE 162.A N ILE 153.A O no hydrogen 2.867 N/A LYS 163.A N GLU 173.A O no hydrogen 2.902 N/A TYR 164.A N GLU 151.A O no hydrogen 2.954 N/A THR 165.A OG1 GLU 171.A O no hydrogen 3.345 N/A GLU 173.A N LYS 163.A O no hydrogen 2.947 N/A ILE 175.A N CYS 161.A O no hydrogen 2.864 N/A LEU 182.A N GLU 179.A O no hydrogen 3.033 N/A ARG 184.A NH2 PRO 143.A O no hydrogen 3.539 N/A ARG 184.A NH2 HIS 181.A ND1 no hydrogen 3.423 N/A ALA 185.A N HIS 181.A O no hydrogen 2.902 N/A GLU 186.A N LEU 182.A O no hydrogen 2.894 N/A GLU 187.A N ASP 183.A O no hydrogen 2.921 N/A ALA 188.A N ARG 184.A O no hydrogen 2.909 N/A ARG 189.A N ALA 185.A O no hydrogen 2.879 N/A ARG 189.A NE LEU 156.A O no hydrogen 2.998 N/A ARG 189.A NE VAL 157.A O no hydrogen 3.537 N/A ARG 189.A NH2 VAL 157.A O no hydrogen 3.347 N/A ALA 190.A N GLU 186.A O no hydrogen 2.911 N/A SER 191.A N GLU 187.A O no hydrogen 2.939 N/A SER 191.A OG GLU 187.A O no hydrogen 3.085 N/A LEU 192.A N ALA 188.A O no hydrogen 2.886 N/A ILE 193.A N ARG 189.A O no hydrogen 2.893 N/A GLU 194.A N ALA 190.A O no hydrogen 2.918 N/A ALA 195.A N SER 191.A O no hydrogen 2.911 N/A VAL 196.A N LEU 192.A O no hydrogen 2.943 N/A ALA 197.A N ILE 193.A O no hydrogen 2.851 N/A GLU 198.A N GLU 194.A O no hydrogen 2.921 N/A THR 199.A N VAL 196.A O no hydrogen 3.029 N/A THR 199.A OG1 VAL 196.A O no hydrogen 2.598 N/A SER 200.A N VAL 196.A O no hydrogen 2.923 N/A LEU 203.A N SER 200.A OG no hydrogen 3.370 N/A MET 204.A N SER 200.A O no hydrogen 3.089 N/A GLU 205.A N ASP 201.A O no hydrogen 2.937 N/A LYS 206.A N GLU 202.A O no hydrogen 2.922 N/A LYS 206.A NZ GLU 212.A O no hydrogen 2.470 N/A TYR 207.A N LEU 203.A O no hydrogen 2.871 N/A LEU 208.A N MET 204.A O no hydrogen 2.898 N/A GLY 209.A N GLU 205.A O no hydrogen 2.914 N/A ASP 210.A N TYR 207.A O no hydrogen 2.870 N/A SER 214.A OG SER 216.A OG no hydrogen 3.149 N/A SER 216.A OG SER 214.A OG no hydrogen 3.149 N/A LEU 218.A N SER 214.A O no hydrogen 2.898 N/A LYS 219.A N VAL 215.A O no hydrogen 2.928 N/A GLU 220.A N SER 216.A O no hydrogen 2.888 N/A ALA 221.A N GLU 217.A O no hydrogen 2.923 N/A ILE 222.A N LEU 218.A O no hydrogen 2.914 N/A ARG 223.A N LYS 219.A O no hydrogen 2.886 N/A ARG 223.A NE ASP 261.A OD2 no hydrogen 3.336 N/A ARG 223.A NH1 ASP 254.A O no hydrogen 3.169 N/A ARG 223.A NH2 ASP 261.A OD2 no hydrogen 2.463 N/A GLN 224.A N GLU 220.A O no hydrogen 2.898 N/A ALA 225.A N ALA 221.A O no hydrogen 2.941 N/A THR 226.A N ILE 222.A O no hydrogen 2.876 N/A THR 226.A OG1 ILE 222.A O no hydrogen 2.653 N/A THR 227.A N ARG 223.A O no hydrogen 2.916 N/A THR 227.A OG1 ARG 223.A O no hydrogen 3.017 N/A ASN 228.A N GLN 224.A O no hydrogen 2.916 N/A VAL 229.A N THR 226.A O no hydrogen 2.775 N/A GLU 230.A N ALA 225.A O no hydrogen 2.995 N/A TYR 232.A N ASN 136.A O no hydrogen 2.924 N/A VAL 234.A N ALA 138.A O no hydrogen 2.898 N/A LEU 235.A N VAL 110.A O no hydrogen 2.883 N/A GLY 237.A N VAL 112.A O no hydrogen 2.919 N/A THR 238.A N LYS 243.A O no hydrogen 2.789 N/A THR 238.A OG1 ASP 116.A OD2 no hydrogen 2.312 N/A ALA 239.A N ASN 113.A OD1 no hydrogen 2.764 N/A ASN 242.A N ALA 239.A O no hydrogen 3.352 N/A ASN 242.A ND2 ASP 167.A O no hydrogen 2.697 N/A LYS 243.A N THR 238.A O no hydrogen 3.052 N/A LYS 243.A NZ ASP 167.A OD1 no hydrogen 3.229 N/A LYS 243.A NZ LYS 241.A O no hydrogen 3.441 N/A GLN 246.A N GLN 246.A OE1 no hydrogen 2.347 N/A GLN 246.A NE2 GLY 169.A O no hydrogen 3.462 N/A MET 248.A N GLY 244.A O no hydrogen 2.881 N/A LEU 249.A N VAL 245.A O no hydrogen 2.933 N/A ASP 250.A N GLN 246.A O no hydrogen 2.907 N/A ALA 251.A N LEU 247.A O no hydrogen 2.882 N/A VAL 252.A N MET 248.A O no hydrogen 2.894 N/A ILE 253.A N LEU 249.A O no hydrogen 2.962 N/A ASP 254.A N ASP 250.A O no hydrogen 2.867 N/A TYR 255.A N ALA 251.A O no hydrogen 2.885 N/A LEU 256.A N VAL 252.A O no hydrogen 3.205 N/A SER 258.A OG ASP 261.A OD1 no hydrogen 2.947 N/A LEU 260.A N SER 258.A OG no hydrogen 3.207 N/A ASP 261.A N SER 258.A OG no hydrogen 3.191 N/A VAL 262.A N SER 258.A O no hydrogen 2.941 N/A GLY 267.A N VAL 277.A O no hydrogen 2.885 N/A HIS 268.A N ILE 375.A O no hydrogen 2.904 N/A ALA 270.A N ASP 373.A O no hydrogen 2.904 N/A SER 271.A OG ASN 272.A OD1 no hydrogen 3.504 N/A GLU 275.A N ASN 272.A O no hydrogen 2.763 N/A VAL 277.A N GLY 267.A O no hydrogen 2.892 N/A ALA 279.A N ILE 265.A O no hydrogen 2.914 N/A ALA 285.A N ASP 282.A O no hydrogen 3.283 N/A ALA 288.A N SER 310.A O no hydrogen 2.858 N/A ALA 289.A N LEU 367.A O no hydrogen 2.895 N/A LEU 290.A N ARG 307.A O no hydrogen 2.836 N/A ALA 291.A N ASP 365.A O no hydrogen 2.918 N/A PHE 292.A N PHE 305.A O no hydrogen 2.880 N/A LYS 293.A N PHE 305.A O no hydrogen 3.022 N/A LYS 293.A NZ GLU 69.A OE1 no hydrogen 3.435 N/A MET 295.A N LEU 303.A O no hydrogen 2.963 N/A ASP 297.A N GLY 301.A O no hydrogen 2.872 N/A TYR 299.A N ASP 297.A OD1 no hydrogen 2.861 N/A GLY 301.A N ASP 297.A O no hydrogen 2.928 N/A LEU 303.A N MET 295.A O no hydrogen 2.845 N/A THR 304.A N ALA 355.A O no hydrogen 3.045 N/A PHE 305.A N LYS 293.A O no hydrogen 2.837 N/A PHE 306.A N ALA 353.A O no hydrogen 2.884 N/A ARG 307.A N LEU 290.A O no hydrogen 2.804 N/A ARG 307.A NE VAL 308.A O no hydrogen 3.105 N/A ARG 307.A NH1 ASP 78.A OD1 no hydrogen 3.354 N/A ARG 307.A NH2 ASP 78.A OD1 no hydrogen 3.511 N/A VAL 308.A N ASP 351.A O no hydrogen 2.888 N/A TYR 309.A N ALA 288.A O no hydrogen 3.188 N/A SER 310.A N ALA 288.A O no hydrogen 3.345 N/A SER 310.A OG LYS 280.A O no hydrogen 3.019 N/A SER 310.A OG GLU 286.A O no hydrogen 3.414 N/A GLY 311.A N ASP 282.A O no hydrogen 2.710 N/A MET 313.A N VAL 347.A O no hydrogen 3.043 N/A SER 315.A N ASP 345.A O no hydrogen 2.827 N/A SER 315.A OG ASP 345.A O no hydrogen 3.438 N/A SER 317.A N VAL 330.A O no hydrogen 2.936 N/A SER 317.A OG THR 314.A O no hydrogen 2.543 N/A VAL 319.A N GLU 328.A O no hydrogen 2.887 N/A LYS 320.A N CYS 368.A O no hydrogen 2.523 N/A LYS 320.A NZ GLU 370.A O no hydrogen 2.937 N/A LYS 320.A NZ ASN 372.A O no hydrogen 3.035 N/A ASN 321.A N LYS 326.A O no hydrogen 2.867 N/A SER 322.A N THR 366.A O no hydrogen 3.169 N/A SER 322.A OG THR 366.A O no hydrogen 3.500 N/A SER 322.A OG ILE 374.A O no hydrogen 2.674 N/A LYS 324.A N ASN 321.A OD1 no hydrogen 3.322 N/A LYS 324.A NZ ASP 365.A OD2 no hydrogen 3.432 N/A LYS 326.A N ASN 321.A O no hydrogen 2.944 N/A LYS 326.A NZ ASP 360.A OD2 no hydrogen 2.607 N/A GLU 328.A N VAL 319.A O no hydrogen 2.892 N/A VAL 330.A N SER 317.A O no hydrogen 2.874 N/A LEU 334.A N ALA 354.A O no hydrogen 2.898 N/A GLN 335.A N GLN 342.A O no hydrogen 2.915 N/A GLN 335.A NE2 ILE 352.A O no hydrogen 3.489 N/A HIS 337.A N SER 340.A O no hydrogen 2.753 N/A HIS 337.A ND1 THR 47.A O no hydrogen 3.220 N/A SER 340.A OG ARG 341.A O no hydrogen 3.362 N/A ARG 341.A NH1 ASP 297.A OD1 no hydrogen 2.953 N/A GLN 342.A N GLN 335.A O no hydrogen 2.903 N/A ILE 344.A N LEU 333.A O no hydrogen 2.915 N/A VAL 347.A N MET 313.A O no hydrogen 3.024 N/A SER 349.A OG ASP 282.A O no hydrogen 3.240 N/A SER 349.A OG TYR 309.A O no hydrogen 3.524 N/A SER 349.A OG GLY 311.A O no hydrogen 2.745 N/A GLY 350.A N VAL 308.A O no hydrogen 2.508 N/A ALA 353.A N PHE 306.A O no hydrogen 2.954 N/A ALA 354.A N LEU 334.A O no hydrogen 3.009 N/A ALA 355.A N THR 304.A O no hydrogen 2.860 N/A VAL 356.A N ARG 332.A O no hydrogen 2.985 N/A LYS 359.A N GLU 328.A OE1 no hydrogen 3.287 N/A THR 361.A OG1 GLU 328.A OE2 no hydrogen 2.461 N/A GLY 362.A N ASP 365.A OD2 no hydrogen 2.508 N/A THR 363.A OG1 PHE 292.A O no hydrogen 3.059 N/A GLY 364.A N ALA 291.A O no hydrogen 2.604 N/A ASP 365.A N GLY 362.A O no hydrogen 2.984 N/A THR 366.A N THR 323.A OG1 no hydrogen 3.301 N/A LEU 367.A N ALA 289.A O no hydrogen 2.884 N/A CYS 368.A N LYS 320.A O no hydrogen 2.641 N/A CYS 368.A SG LYS 320.A O no hydrogen 3.567 N/A CYS 368.A SG GLY 369.A O no hydrogen 3.601 N/A CYS 368.A SG ASN 372.A O no hydrogen 3.513 N/A CYS 368.A SG ILE 374.A O no hydrogen 3.845 N/A GLY 369.A N PHE 287.A O no hydrogen 2.901 N/A ASP 373.A N ASN 372.A OD1 no hydrogen 2.653 N/A ILE 375.A N HIS 268.A O no hydrogen 2.865 N/A LEU 376.A N THR 366.A OG1 no hydrogen 2.977 N/A VAL 385.A N GLY 430.A O no hydrogen 2.888 N/A ILE 386.A N GLY 430.A O no hydrogen 2.990 N/A LEU 388.A N ILE 428.A O no hydrogen 2.924 N/A SER 389.A N GLY 454.A O no hydrogen 2.886 N/A SER 389.A OG GLY 454.A O no hydrogen 3.073 N/A SER 389.A OG ALA 455.A O no hydrogen 3.539 N/A VAL 390.A N VAL 426.A O no hydrogen 2.971 N/A GLU 391.A N ASN 452.A O no hydrogen 2.938 N/A LYS 393.A N GLU 450.A O no hydrogen 2.875 N/A ASP 397.A N SER 394.A O no hydrogen 3.194 N/A GLN 398.A N LYS 395.A O no hydrogen 3.137 N/A LYS 400.A NZ PHE 447.A O no hydrogen 3.296 N/A MET 401.A N ASP 397.A O no hydrogen 2.814 N/A THR 402.A N GLN 398.A O no hydrogen 2.906 N/A THR 402.A OG1 GLN 398.A O no hydrogen 3.318 N/A GLN 403.A N ASP 399.A O no hydrogen 2.966 N/A GLN 403.A NE2 ASP 399.A O no hydrogen 3.043 N/A ALA 404.A N LYS 400.A O no hydrogen 2.834 N/A LEU 405.A N MET 401.A O no hydrogen 2.863 N/A VAL 406.A N THR 402.A O no hydrogen 2.926 N/A LYS 407.A N GLN 403.A O no hydrogen 2.916 N/A LEU 408.A N ALA 404.A O no hydrogen 2.831 N/A GLN 409.A N LEU 405.A O no hydrogen 2.868 N/A GLU 410.A N VAL 406.A O no hydrogen 2.927 N/A GLU 411.A N LYS 407.A O no hydrogen 2.905 N/A ASP 412.A N LEU 408.A O no hydrogen 2.866 N/A THR 414.A OG1 ASP 412.A OD1 no hydrogen 3.165 N/A THR 414.A OG1 ASP 412.A OD2 no hydrogen 3.161 N/A PHE 415.A N ASP 412.A O no hydrogen 3.311 N/A HIS 416.A N GLY 429.A O no hydrogen 2.983 N/A HIS 418.A N ILE 427.A O no hydrogen 2.978 N/A ASP 420.A N GLN 425.A O no hydrogen 2.908 N/A GLU 421.A N GLU 421.A OE1 no hydrogen 2.497 N/A THR 423.A OG1 ASP 420.A OD2 no hydrogen 2.456 N/A GLY 424.A N ASP 420.A O no hydrogen 2.440 N/A ILE 427.A N HIS 418.A O no hydrogen 2.856 N/A ILE 428.A N LEU 388.A O no hydrogen 2.874 N/A GLY 429.A N HIS 416.A O no hydrogen 2.859 N/A GLY 430.A N ILE 386.A O no hydrogen 2.901 N/A MET 431.A N HIS 435.A ND1 no hydrogen 3.218 N/A HIS 435.A N ASP 65.A OD2 no hydrogen 3.173 N/A HIS 435.A NE2 ASP 412.A OD2 no hydrogen 2.910 N/A LEU 436.A N GLY 432.A O no hydrogen 2.986 N/A ASP 437.A N GLU 433.A O no hydrogen 2.866 N/A ILE 438.A N LEU 434.A O no hydrogen 2.922 N/A LEU 439.A N HIS 435.A O no hydrogen 2.974 N/A VAL 440.A N LEU 436.A O no hydrogen 2.866 N/A ASP 441.A N ASP 437.A O no hydrogen 2.976 N/A ARG 442.A N ILE 438.A O no hydrogen 2.892 N/A MET 443.A N LEU 439.A O no hydrogen 2.874 N/A LYS 444.A N VAL 440.A O no hydrogen 2.903 N/A LYS 445.A N ASP 441.A O no hydrogen 2.962 N/A LYS 445.A NZ ASP 441.A O no hydrogen 2.947 N/A GLU 446.A N ARG 442.A O no hydrogen 2.817 N/A PHE 447.A N ARG 442.A O no hydrogen 3.414 N/A VAL 449.A N MET 443.A O no hydrogen 2.930 N/A CYS 451.A SG VAL 449.A O no hydrogen 3.554 N/A ASN 452.A N GLU 391.A O no hydrogen 2.904 N/A ASN 452.A ND2 GLU 391.A OE2 no hydrogen 2.679 N/A GLY 454.A N SER 389.A O no hydrogen 2.928 N/A MET 457.A N GLN 425.A OE1 no hydrogen 3.336 N/A ARG 461.A N LEU 579.A O no hydrogen 2.974 N/A ARG 461.A NH1 TYR 460.A O no hydrogen 2.642 N/A GLU 462.A N PRO 536.A O no hydrogen 2.821 N/A THR 463.A N VAL 577.A O no hydrogen 2.940 N/A THR 463.A OG1 ILE 538.A O no hydrogen 3.207 N/A THR 463.A OG1 ASP 539.A O no hydrogen 3.569 N/A SER 466.A N CYS 574.A O no hydrogen 3.114 N/A SER 466.A OG SER 467.A O no hydrogen 3.505 N/A SER 467.A OG PHE 491.A O no hydrogen 2.582 N/A SER 467.A OG THR 492.A OG1 no hydrogen 3.043 N/A ALA 468.A N PHE 491.A O no hydrogen 2.920 N/A VAL 470.A N ILE 489.A O no hydrogen 2.864 N/A GLN 471.A NE2 HIS 488.A NE2 no hydrogen 3.022 N/A GLY 472.A N VAL 487.A O no hydrogen 2.915 N/A LYS 473.A NZ SER 475.A OG no hydrogen 2.781 N/A PHE 474.A N GLY 485.A O no hydrogen 2.901 N/A ARG 476.A N GLN 483.A O no hydrogen 2.884 N/A GLY 482.A N ASP 553.A OD1 no hydrogen 3.322 N/A GLN 483.A N ARG 476.A O no hydrogen 2.913 N/A GLY 485.A N PHE 474.A O no hydrogen 2.896 N/A VAL 487.A N GLY 472.A O no hydrogen 2.931 N/A HIS 488.A N ASP 546.A O no hydrogen 2.820 N/A ILE 489.A N VAL 470.A O no hydrogen 2.929 N/A GLU 490.A N LYS 543.A O no hydrogen 2.872 N/A PHE 491.A N ALA 468.A O no hydrogen 2.905 N/A THR 492.A N LYS 541.A O no hydrogen 2.883 N/A THR 492.A OG1 SER 467.A OG no hydrogen 3.043 N/A ASN 494.A N ASP 539.A O no hydrogen 3.209 N/A ASN 494.A ND2 GLY 499.A O no hydrogen 2.957 N/A GLY 497.A N ASP 539.A OD2 no hydrogen 2.875 N/A ALA 498.A N GLU 495.A O no hydrogen 2.970 N/A GLY 499.A N ASP 539.A OD1 no hydrogen 2.802 N/A GLU 501.A N VAL 540.A O no hydrogen 2.950 N/A GLU 503.A N ALA 542.A O no hydrogen 2.879 N/A ALA 505.A N LEU 544.A O no hydrogen 2.894 N/A ILE 506.A N ASN 504.A OD1 no hydrogen 3.275 N/A TYR 515.A N PRO 512.A O no hydrogen 2.980 N/A SER 518.A OG TYR 515.A O no hydrogen 2.407 N/A SER 518.A OG GLU 556.A O no hydrogen 3.561 N/A VAL 519.A N TYR 515.A O no hydrogen 2.973 N/A GLU 520.A N ILE 516.A O no hydrogen 2.987 N/A ALA 521.A N PRO 517.A O no hydrogen 2.905 N/A GLY 522.A N SER 518.A O no hydrogen 2.869 N/A LEU 523.A N VAL 519.A O no hydrogen 2.947 N/A LYS 524.A N GLU 520.A O no hydrogen 2.943 N/A ASP 525.A N ALA 521.A O no hydrogen 2.893 N/A ALA 526.A N GLY 522.A O no hydrogen 2.905 N/A MET 527.A N LEU 523.A O no hydrogen 2.896 N/A GLU 528.A N LYS 524.A O no hydrogen 2.942 N/A ASN 529.A ND2 ASP 525.A O no hydrogen 2.919 N/A VAL 531.A N GLU 462.A OE1 no hydrogen 3.053 N/A LEU 532.A N GLU 462.A OE1 no hydrogen 2.811 N/A ALA 533.A N GLU 462.A OE2 no hydrogen 2.811 N/A TYR 535.A N GLU 462.A OE2 no hydrogen 2.960 N/A TYR 535.A OH ASN 668.A OD1 no hydrogen 3.351 N/A LEU 537.A N MET 527.A O no hydrogen 2.994 N/A ILE 538.A N GLU 462.A O no hydrogen 2.971 N/A LYS 541.A N THR 492.A O no hydrogen 2.916 N/A ALA 542.A N GLU 501.A O no hydrogen 2.883 N/A LYS 543.A N GLU 490.A O no hydrogen 2.893 N/A LEU 544.A N GLU 503.A O no hydrogen 2.899 N/A TYR 545.A N HIS 488.A O no hydrogen 2.920 N/A ASP 546.A N HIS 488.A O no hydrogen 3.080 N/A SER 548.A N ASP 486.A O no hydrogen 3.475 N/A SER 548.A OG ASP 486.A OD2 no hydrogen 3.145 N/A HIS 550.A N SER 554.A OG no hydrogen 2.492 N/A ASP 553.A N HIS 550.A ND1 no hydrogen 3.166 N/A SER 554.A N HIS 550.A O no hydrogen 2.507 N/A SER 554.A OG HIS 550.A O no hydrogen 2.716 N/A SER 555.A OG GLN 483.A OE1 no hydrogen 2.655 N/A GLU 556.A N GLU 556.A OE1 no hydrogen 2.822 N/A PHE 559.A N SER 555.A O no hydrogen 2.964 N/A LYS 560.A N GLU 556.A O no hydrogen 2.944 N/A ILE 561.A N MET 557.A O no hydrogen 2.902 N/A ALA 562.A N ALA 558.A O no hydrogen 2.915 N/A ALA 563.A N PHE 559.A O no hydrogen 2.893 N/A SER 564.A N LYS 560.A O no hydrogen 2.942 N/A SER 564.A OG ILE 561.A O no hydrogen 2.545 N/A LEU 565.A N ILE 561.A O no hydrogen 2.936 N/A ALA 566.A N ALA 562.A O no hydrogen 2.890 N/A LEU 567.A N ALA 563.A O no hydrogen 2.903 N/A LYS 568.A N SER 564.A O no hydrogen 2.919 N/A GLU 569.A N LEU 565.A O no hydrogen 2.978 N/A ALA 570.A N ALA 566.A O no hydrogen 2.869 N/A ALA 571.A N LEU 567.A O no hydrogen 2.849 N/A LYS 572.A N LYS 568.A O no hydrogen 3.000 N/A LYS 572.A NZ LYS 568.A O no hydrogen 3.527 N/A LYS 573.A N GLU 569.A O no hydrogen 2.948 N/A LYS 573.A N ALA 570.A O no hydrogen 3.154 N/A LYS 573.A NZ GLN 469.A O no hydrogen 3.467 N/A CYS 574.A SG ALA 570.A O no hydrogen 3.116 N/A VAL 577.A N THR 463.A O no hydrogen 2.871 N/A LEU 579.A N ARG 461.A O no hydrogen 2.769 N/A GLU 580.A N ALA 654.A O no hydrogen 2.577 N/A MET 582.A N HIS 652.A O no hydrogen 2.650 N/A MET 583.A N VAL 624.A O no hydrogen 2.853 N/A LYS 584.A N TYR 649.A O no hydrogen 2.816 N/A LYS 584.A NZ TYR 623.A OH no hydrogen 2.914 N/A VAL 585.A N ALA 622.A O no hydrogen 2.850 N/A THR 586.A N THR 647.A O no hydrogen 2.886 N/A ILE 587.A N VAL 620.A O no hydrogen 2.905 N/A GLU 588.A N THR 645.A O no hydrogen 2.826 N/A MET 589.A N GLN 618.A O no hydrogen 2.991 N/A TYR 593.A N PRO 590.A O no hydrogen 3.052 N/A TYR 593.A OH GLN 641.A OE1 no hydrogen 2.577 N/A MET 594.A N GLU 591.A O no hydrogen 3.107 N/A ILE 597.A N TYR 593.A O no hydrogen 2.974 N/A MET 598.A N MET 594.A O no hydrogen 2.930 N/A GLY 599.A N GLY 595.A O no hydrogen 2.905 N/A ASP 600.A N ASP 596.A O no hydrogen 2.924 N/A VAL 601.A N ILE 597.A O no hydrogen 2.910 N/A THR 602.A N MET 598.A O no hydrogen 2.964 N/A SER 603.A N GLY 599.A O no hydrogen 2.915 N/A SER 603.A OG GLY 599.A O no hydrogen 2.688 N/A ARG 604.A N ASP 600.A O no hydrogen 2.939 N/A ARG 604.A N VAL 601.A O no hydrogen 3.001 N/A ARG 604.A NE ASP 600.A OD1 no hydrogen 2.774 N/A ARG 604.A NH1 GLU 628.A O no hydrogen 3.144 N/A ARG 604.A NH1 PHE 630.A O no hydrogen 2.876 N/A ARG 605.A N THR 602.A O no hydrogen 3.250 N/A ARG 605.A NE GLU 628.A OE2 no hydrogen 2.981 N/A ARG 605.A NH1 GLU 580.A OE2 no hydrogen 3.148 N/A ARG 605.A NH2 GLU 580.A OE1 no hydrogen 3.280 N/A ARG 605.A NH2 GLU 580.A OE2 no hydrogen 3.366 N/A ARG 605.A NH2 GLU 628.A OE2 no hydrogen 3.500 N/A GLY 606.A N VAL 601.A O no hydrogen 3.188 N/A ARG 607.A N TYR 623.A O no hydrogen 2.876 N/A ASP 609.A N ASN 621.A O no hydrogen 2.528 N/A GLY 610.A N ASN 621.A O no hydrogen 2.967 N/A GLU 612.A N VAL 619.A O no hydrogen 2.908 N/A ARG 614.A N ALA 617.A O no hydrogen 2.892 N/A ALA 617.A N ARG 614.A O no hydrogen 2.916 N/A GLN 618.A N MET 589.A O no hydrogen 2.890 N/A VAL 619.A N GLU 612.A O no hydrogen 2.884 N/A VAL 620.A N ILE 587.A O no hydrogen 2.817 N/A ASN 621.A N GLY 610.A O no hydrogen 2.867 N/A ALA 622.A N VAL 585.A O no hydrogen 2.968 N/A TYR 623.A N ARG 607.A O no hydrogen 2.998 N/A VAL 624.A N MET 583.A O no hydrogen 3.019 N/A LEU 626.A N PRO 581.A O no hydrogen 3.257 N/A MET 629.A N LEU 626.A O no hydrogen 3.128 N/A PHE 630.A N SER 627.A O no hydrogen 3.510 N/A SER 635.A OG ASP 600.A OD2 no hydrogen 2.633 N/A LEU 636.A N TYR 632.A O no hydrogen 2.878 N/A ARG 637.A N ALA 633.A O no hydrogen 2.898 N/A ARG 637.A NH1 MET 431.A O no hydrogen 3.063 N/A ARG 637.A NH2 MET 431.A O no hydrogen 3.166 N/A SER 638.A N THR 634.A O no hydrogen 2.931 N/A SER 638.A OG THR 634.A O no hydrogen 3.248 N/A ASN 639.A N SER 635.A O no hydrogen 2.893 N/A THR 640.A N LEU 636.A O no hydrogen 2.897 N/A THR 640.A OG1 LEU 636.A O no hydrogen 2.553 N/A GLY 642.A N ARG 637.A O no hydrogen 2.782 N/A ARG 643.A N THR 640.A O no hydrogen 3.039 N/A ARG 643.A NE GLU 95.A OE1 no hydrogen 3.441 N/A ARG 643.A NE GLU 95.A OE2 no hydrogen 2.705 N/A ARG 643.A NH2 GLU 95.A OE2 no hydrogen 2.824 N/A GLY 644.A N THR 640.A OG1 no hydrogen 2.820 N/A THR 645.A N GLU 588.A O no hydrogen 2.966 N/A TYR 646.A OH VAL 385.A O no hydrogen 2.890 N/A THR 647.A N THR 586.A O no hydrogen 2.938 N/A TYR 649.A N LYS 584.A O no hydrogen 3.004 N/A ASP 651.A N MET 582.A O no hydrogen 2.910 N/A HIS 652.A N MET 582.A O no hydrogen 3.253 N/A HIS 652.A ND1 ASP 651.A OD2 no hydrogen 2.401 N/A ALA 654.A N GLU 580.A O no hydrogen 2.840 N/A VAL 656.A N ILE 578.A O no hydrogen 2.676 N/A ALA 661.A N PRO 657.A O no hydrogen 2.890 N/A GLU 662.A N LYS 658.A O no hydrogen 2.917 N/A ASP 663.A N SER 659.A O no hydrogen 2.902 N/A ILE 664.A N ILE 660.A O no hydrogen 2.904 N/A ILE 665.A N ALA 661.A O no hydrogen 2.910 N/A LYS 666.A N GLU 662.A O no hydrogen 2.909 N/A LYS 667.A N ASP 663.A O no hydrogen 2.888 N/A ASN 668.A N ILE 664.A O no hydrogen 2.917 N/A ASN 668.A ND2 TYR 535.A OH no hydrogen 3.377 N/A ASN 668.A ND2 ILE 664.A O no hydrogen 2.473 N/A LYS 669.A N ILE 665.A O no hydrogen 2.902 N/A GLY 670.A N LYS 666.A O no hydrogen 2.912 N/A