Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 8gs8_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): TYR 5.A N SER 2.A O no hydrogen 3.255 N/A TYR 5.A OH ASP 447.A OD1 no hydrogen 2.937 N/A VAL 8.A N ILE 194.A O no hydrogen 2.953 N/A HIS 10.A N ARG 196.A O no hydrogen 2.888 N/A HIS 10.A NE2 HIS 195.A ND1 no hydrogen 2.871 N/A PHE 12.A N ARG 198.A O no hydrogen 2.911 N/A ASP 13.A N ASN 36.A O no hydrogen 2.738 N/A ALA 14.A N ASN 36.A O no hydrogen 3.053 N/A VAL 15.A N ASN 201.A O no hydrogen 3.041 N/A VAL 16.A N ALA 38.A O no hydrogen 2.863 N/A VAL 17.A N VAL 203.A O no hydrogen 2.801 N/A GLY 21.A N THR 50.A OG1 no hydrogen 2.911 N/A LEU 24.A N GLY 20.A O no hydrogen 2.695 N/A ARG 25.A N GLY 21.A O no hydrogen 2.954 N/A ARG 25.A NH1 ARG 25.A O no hydrogen 2.944 N/A ALA 26.A N ALA 22.A O no hydrogen 2.965 N/A ALA 27.A N GLY 23.A O no hydrogen 2.930 N/A PHE 28.A N LEU 24.A O no hydrogen 2.873 N/A GLY 29.A N ARG 25.A O no hydrogen 2.881 N/A LEU 30.A N ALA 26.A O no hydrogen 2.942 N/A SER 31.A N ALA 27.A O no hydrogen 2.902 N/A SER 31.A OG ALA 27.A O no hydrogen 2.815 N/A SER 31.A OG PHE 28.A O no hydrogen 3.160 N/A SER 31.A OG THR 163.A OG1 no hydrogen 3.052 N/A GLU 32.A N PHE 28.A O no hydrogen 2.877 N/A ALA 33.A N GLY 29.A O no hydrogen 2.902 N/A GLY 34.A N LEU 30.A O no hydrogen 3.084 N/A ASN 36.A N ASP 13.A OD2 no hydrogen 2.799 N/A THR 37.A OG1 ALA 14.A O no hydrogen 3.445 N/A ALA 38.A N ALA 14.A O no hydrogen 2.872 N/A CYS 39.A SG VAL 16.A O no hydrogen 3.941 N/A CYS 39.A SG GLY 18.A O no hydrogen 2.949 N/A VAL 40.A N VAL 16.A O no hydrogen 2.828 N/A THR 41.A N PHE 166.A O no hydrogen 2.972 N/A THR 41.A OG1 LEU 43.A O no hydrogen 2.557 N/A LYS 42.A NZ THR 221.A O no hydrogen 3.413 N/A LYS 42.A NZ ASP 225.A OD2 no hydrogen 2.994 N/A LYS 42.A NZ GLU 517.A OE1 no hydrogen 3.061 N/A LEU 43.A N THR 41.A OG1 no hydrogen 3.319 N/A ARG 47.A N PHE 44.A O no hydrogen 2.531 N/A SER 48.A N PRO 45.A O no hydrogen 3.312 N/A SER 48.A OG ALA 19.A O no hydrogen 2.809 N/A SER 48.A OG PRO 45.A O no hydrogen 2.667 N/A VAL 51.A N SER 48.A O no hydrogen 3.089 N/A ALA 52.A N HIS 49.A O no hydrogen 3.153 N/A ALA 53.A N VAL 51.A O no hydrogen 2.792 N/A ILE 57.A N CYS 140.A O no hydrogen 2.945 N/A ASN 58.A N ALA 404.A O no hydrogen 3.152 N/A ASN 58.A ND2 GLY 403.A O no hydrogen 2.792 N/A ASN 58.A ND2 ASN 405.A OD1 no hydrogen 3.351 N/A ALA 59.A N ARG 138.A O no hydrogen 3.193 N/A ASN 63.A N LEU 61.A O no hydrogen 3.111 N/A ARG 70.A N ASN 68.A OD1 no hydrogen 3.262 N/A ARG 70.A NH1 ASP 603.A OD1 no hydrogen 2.516 N/A ARG 70.A NH2 ASN 68.A OD1 no hydrogen 3.170 N/A TRP 71.A N ASN 68.A O no hydrogen 3.220 N/A HIS 72.A NE2 ASN 405.A OD1 no hydrogen 3.184 N/A PHE 73.A N TRP 69.A O no hydrogen 2.925 N/A TYR 74.A N ARG 70.A O no hydrogen 2.918 N/A ASP 75.A N TRP 71.A O no hydrogen 2.902 N/A THR 76.A N HIS 72.A O no hydrogen 2.936 N/A THR 76.A OG1 HIS 72.A O no hydrogen 2.768 N/A VAL 77.A N PHE 73.A O no hydrogen 2.958 N/A LYS 78.A N TYR 74.A O no hydrogen 2.910 N/A GLY 79.A N ASP 75.A O no hydrogen 2.910 N/A SER 80.A N THR 76.A O no hydrogen 2.894 N/A SER 80.A OG VAL 77.A O no hydrogen 2.772 N/A ASP 81.A N LYS 78.A O no hydrogen 3.031 N/A TRP 82.A N SER 80.A OG no hydrogen 3.242 N/A TRP 82.A NE1 VAL 607.A O no hydrogen 2.942 N/A ASP 85.A N SER 395.A O no hydrogen 2.433 N/A GLN 86.A N ILE 595.A O no hydrogen 3.059 N/A GLN 86.A NE2 VAL 607.A O no hydrogen 3.209 N/A ILE 89.A N ASP 85.A O no hydrogen 2.810 N/A HIS 90.A N GLN 86.A O no hydrogen 3.047 N/A TYR 91.A N ASP 87.A O no hydrogen 2.943 N/A MET 92.A N ALA 88.A O no hydrogen 2.919 N/A THR 93.A N ILE 89.A O no hydrogen 3.029 N/A THR 93.A OG1 ILE 89.A O no hydrogen 3.005 N/A THR 93.A OG1 HIS 90.A O no hydrogen 3.304 N/A GLU 94.A N HIS 90.A O no hydrogen 2.990 N/A GLU 94.A N TYR 91.A O no hydrogen 3.215 N/A GLN 95.A N TYR 91.A O no hydrogen 2.960 N/A GLN 95.A N MET 92.A O no hydrogen 3.232 N/A ALA 99.A N GLN 95.A O no hydrogen 2.934 N/A VAL 100.A N ALA 96.A O no hydrogen 2.981 N/A VAL 101.A N PRO 97.A O no hydrogen 2.954 N/A GLU 102.A N ALA 98.A O no hydrogen 2.945 N/A LEU 103.A N ALA 99.A O no hydrogen 3.005 N/A GLU 104.A N VAL 100.A O no hydrogen 2.985 N/A ASN 105.A N VAL 101.A O no hydrogen 2.971 N/A TYR 106.A N LEU 103.A O no hydrogen 3.438 N/A GLY 107.A N GLU 104.A O no hydrogen 3.411 N/A PHE 110.A N MET 108.A O no hydrogen 2.712 N/A SER 111.A N CYS 141.A O no hydrogen 3.290 N/A ARG 112.A NH2 GLU 104.A OE1 no hydrogen 2.707 N/A THR 113.A N LYS 117.A O no hydrogen 2.759 N/A THR 113.A OG1 LYS 117.A O no hydrogen 3.496 N/A ASP 115.A N THR 113.A OG1 no hydrogen 3.412 N/A GLY 116.A N THR 113.A O no hydrogen 2.798 N/A LYS 117.A N THR 113.A OG1 no hydrogen 3.426 N/A TYR 119.A N SER 111.A O no hydrogen 2.529 N/A GLN 120.A NE2 LEU 61.A O no hydrogen 2.982 N/A GLN 120.A NE2 ARG 138.A O no hydrogen 2.969 N/A ARG 121.A N CYS 139.A O no hydrogen 2.824 N/A GLY 124.A N GLU 259.A OE2 no hydrogen 3.186 N/A SER 127.A N ASP 75.A OD2 no hydrogen 2.895 N/A SER 127.A OG GLN 126.A O no hydrogen 2.643 N/A LYS 132.A NZ LYS 129.A O no hydrogen 3.054 N/A GLY 133.A N LEU 128.A O no hydrogen 2.886 N/A GLN 135.A NE2 PHE 123.A O no hydrogen 3.072 N/A ALA 136.A N GLN 135.A OE1 no hydrogen 3.075 N/A HIS 137.A N GLU 65.A OE2 no hydrogen 2.862 N/A ARG 138.A NE ASP 67.A OD2 no hydrogen 3.224 N/A ARG 138.A NH1 ASP 75.A OD2 no hydrogen 2.798 N/A ARG 138.A NH1 GLN 126.A OE1 no hydrogen 3.047 N/A ARG 138.A NH2 ASP 67.A OD1 no hydrogen 3.044 N/A ARG 138.A NH2 ASP 67.A OD2 no hydrogen 3.196 N/A ARG 138.A NH2 SER 127.A O no hydrogen 3.356 N/A CYS 139.A N ARG 121.A O no hydrogen 3.307 N/A CYS 140.A N ILE 57.A O no hydrogen 2.809 N/A CYS 140.A SG ARG 138.A O no hydrogen 3.765 N/A CYS 141.A N TYR 119.A O no hydrogen 3.349 N/A CYS 141.A SG TYR 119.A O no hydrogen 3.342 N/A CYS 141.A SG CYS 139.A O no hydrogen 3.724 N/A VAL 142.A N THR 146.A OG1 no hydrogen 3.139 N/A ARG 145.A N VAL 142.A O no hydrogen 2.668 N/A GLY 147.A N ALA 53.A O no hydrogen 3.196 N/A SER 149.A N ARG 145.A O no hydrogen 3.121 N/A SER 149.A OG ARG 145.A O no hydrogen 3.088 N/A LEU 150.A N THR 146.A O no hydrogen 2.884 N/A LEU 151.A N GLY 147.A O no hydrogen 2.928 N/A HIS 152.A N HIS 148.A O no hydrogen 2.965 N/A HIS 152.A ND1 HIS 148.A O no hydrogen 2.997 N/A THR 153.A N SER 149.A O no hydrogen 2.906 N/A THR 153.A OG1 SER 149.A O no hydrogen 3.100 N/A LEU 154.A N LEU 150.A O no hydrogen 2.933 N/A TYR 155.A N LEU 151.A O no hydrogen 2.933 N/A GLY 156.A N HIS 152.A O no hydrogen 2.972 N/A ARG 157.A N THR 153.A O no hydrogen 2.887 N/A SER 158.A N LEU 154.A O no hydrogen 2.912 N/A SER 158.A OG LEU 154.A O no hydrogen 3.105 N/A SER 158.A OG TYR 155.A O no hydrogen 2.502 N/A SER 158.A OG TYR 165.A OH no hydrogen 2.359 N/A LEU 159.A N TYR 155.A O no hydrogen 3.063 N/A LEU 159.A N GLY 156.A O no hydrogen 3.272 N/A TYR 161.A N SER 158.A O no hydrogen 3.235 N/A TYR 161.A OH GLU 32.A OE1 no hydrogen 3.128 N/A THR 163.A N TYR 161.A O no hydrogen 2.683 N/A THR 163.A OG1 SER 31.A OG no hydrogen 3.052 N/A THR 163.A OG1 SER 158.A O no hydrogen 3.336 N/A SER 164.A OG THR 37.A O no hydrogen 3.570 N/A SER 164.A OG SER 164.A O no hydrogen 2.355 N/A TYR 165.A OH SER 158.A OG no hydrogen 2.359 N/A PHE 166.A N CYS 39.A O no hydrogen 2.778 N/A TYR 169.A N THR 41.A O no hydrogen 2.735 N/A PHE 170.A N LEU 187.A O no hydrogen 2.664 N/A LEU 172.A N ILE 185.A O no hydrogen 2.770 N/A LEU 175.A N GLY 183.A O no hydrogen 2.695 N/A GLU 177.A N GLU 180.A O no hydrogen 2.905 N/A GLU 180.A N GLU 177.A O no hydrogen 3.052 N/A CYS 181.A N PRO 383.A O no hydrogen 3.268 N/A CYS 181.A SG GLY 183.A O no hydrogen 3.775 N/A CYS 181.A SG THR 202.A OG1 no hydrogen 3.296 N/A ARG 182.A N LEU 175.A O no hydrogen 2.810 N/A VAL 184.A N ILE 197.A O no hydrogen 3.040 N/A ILE 185.A N ASP 173.A O no hydrogen 3.043 N/A ALA 186.A N HIS 195.A O no hydrogen 2.741 N/A LEU 187.A N PHE 170.A O no hydrogen 2.522 N/A CYS 188.A N SER 193.A O no hydrogen 2.888 N/A CYS 188.A SG ASP 191.A OD1 no hydrogen 2.865 N/A ILE 189.A N GLU 168.A O no hydrogen 3.159 N/A GLY 192.A N CYS 188.A O no hydrogen 2.815 N/A SER 193.A OG ASP 191.A OD2 no hydrogen 2.824 N/A HIS 195.A N ALA 186.A O no hydrogen 2.885 N/A HIS 195.A ND1 HIS 10.A NE2 no hydrogen 2.871 N/A ARG 196.A N VAL 8.A O no hydrogen 2.904 N/A ARG 196.A NE ASP 9.A OD2 no hydrogen 2.939 N/A ARG 196.A NH1 ALA 438.A O no hydrogen 2.694 N/A ARG 196.A NH2 ASP 9.A OD2 no hydrogen 2.975 N/A ILE 197.A N VAL 184.A O no hydrogen 2.856 N/A ARG 198.A N HIS 10.A O no hydrogen 2.875 N/A ARG 198.A NH2 GLU 11.A OE1 no hydrogen 2.535 N/A ALA 199.A N ARG 182.A O no hydrogen 2.875 N/A LYS 200.A N ASP 13.A O no hydrogen 3.378 N/A THR 202.A N GLY 384.A O no hydrogen 2.715 N/A VAL 203.A N VAL 15.A O no hydrogen 2.851 N/A VAL 204.A N TYR 386.A O no hydrogen 2.723 N/A ALA 205.A N VAL 17.A O no hydrogen 3.317 N/A ARG 211.A N SER 222.A O no hydrogen 2.997 N/A ARG 211.A NE ALA 219.A O no hydrogen 2.906 N/A ARG 211.A NH2 SER 218.A O no hydrogen 3.209 N/A THR 212.A N TYR 209.A O no hydrogen 3.249 N/A THR 212.A OG1 TYR 209.A O no hydrogen 3.432 N/A TYR 213.A N GLY 210.A O no hydrogen 3.272 N/A TYR 213.A OH ALA 473.A O no hydrogen 3.084 N/A SER 215.A N GLN 470.A OE1 no hydrogen 2.795 N/A CYS 216.A SG GLY 210.A O no hydrogen 3.782 N/A CYS 216.A SG SER 218.A O no hydrogen 3.920 N/A THR 217.A N VAL 356.A O no hydrogen 3.066 N/A THR 217.A OG1 HIS 357.A ND1 no hydrogen 3.398 N/A THR 223.A OG1 ASP 225.A OD2 no hydrogen 2.697 N/A GLY 224.A N GLY 208.A O no hydrogen 2.953 N/A ALA 228.A N GLY 224.A O no hydrogen 3.088 N/A MET 229.A N ASP 225.A O no hydrogen 2.911 N/A ILE 230.A N GLY 226.A O no hydrogen 2.963 N/A THR 231.A N THR 227.A O no hydrogen 2.931 N/A THR 231.A OG1 THR 227.A O no hydrogen 2.793 N/A ARG 232.A N ALA 228.A O no hydrogen 2.872 N/A ARG 232.A NE ASP 173.A OD1 no hydrogen 2.934 N/A ARG 232.A NH1 ASN 520.A OD1 no hydrogen 2.734 N/A ARG 232.A NH2 LEU 172.A O no hydrogen 2.709 N/A ARG 232.A NH2 ASP 173.A OD1 no hydrogen 3.186 N/A ALA 233.A N ILE 230.A O no hydrogen 3.292 N/A LEU 235.A N ILE 230.A O no hydrogen 3.238 N/A CYS 237.A N SER 578.A O no hydrogen 3.148 N/A CYS 237.A SG THR 227.A O no hydrogen 3.859 N/A CYS 237.A SG THR 231.A OG1 no hydrogen 3.456 N/A CYS 237.A SG GLN 527.A OE1 no hydrogen 3.674 N/A GLN 238.A NE2 CYS 393.A O no hydrogen 3.242 N/A ASP 239.A N THR 576.A O no hydrogen 3.042 N/A GLU 241.A N GLU 241.A OE1 no hydrogen 2.854 N/A PHE 242.A N ASP 239.A O no hydrogen 3.073 N/A GLN 244.A N TYR 358.A O no hydrogen 2.826 N/A GLN 244.A NE2 ARG 401.A O no hydrogen 2.923 N/A GLY 249.A N LEU 353.A O no hydrogen 3.205 N/A ILE 250.A N CYS 255.A O no hydrogen 3.003 N/A TYR 251.A N PRO 351.A O no hydrogen 3.313 N/A GLY 254.A N ILE 250.A O no hydrogen 3.150 N/A THR 258.A OG1 ASP 144.A OD1 no hydrogen 3.423 N/A CYS 261.A N THR 258.A O no hydrogen 2.878 N/A CYS 261.A SG ILE 257.A O no hydrogen 3.076 N/A CYS 261.A SG THR 258.A O no hydrogen 2.949 N/A GLY 263.A N GLU 259.A O no hydrogen 3.046 N/A GLU 264.A N GLY 260.A O no hydrogen 2.815 N/A GLU 264.A N CYS 261.A O no hydrogen 2.996 N/A GLY 265.A N CYS 261.A O no hydrogen 3.226 N/A GLY 265.A N ARG 262.A O no hydrogen 2.659 N/A GLY 266.A N CYS 261.A O no hydrogen 3.178 N/A ILE 267.A N GLN 317.A O no hydrogen 3.019 N/A ILE 269.A N TYR 315.A O no hydrogen 2.928 N/A ASN 270.A ND2 GLU 274.A OE2 no hydrogen 3.021 N/A ASN 270.A ND2 GLU 300.A OE1 no hydrogen 3.341 N/A SER 271.A N ARG 305.A O no hydrogen 2.660 N/A SER 271.A OG GLN 272.A OE1 no hydrogen 2.578 N/A SER 271.A OG ARG 305.A O no hydrogen 2.765 N/A GLY 273.A N ASN 270.A O no hydrogen 3.053 N/A GLU 274.A N ASN 270.A OD1 no hydrogen 2.963 N/A PHE 276.A N GLU 274.A O no hydrogen 2.975 N/A GLU 278.A N ARG 275.A O no hydrogen 3.209 N/A ARG 279.A NH2 GLU 300.A OE1 no hydrogen 3.391 N/A TYR 280.A OH GLU 300.A OE2 no hydrogen 2.830 N/A ALA 281.A N MET 277.A O no hydrogen 2.973 N/A LYS 285.A N ALA 281.A O no hydrogen 2.817 N/A LYS 285.A NZ GLU 278.A OE2 no hydrogen 3.037 N/A LEU 287.A N ASP 286.A OD1 no hydrogen 2.564 N/A ALA 288.A N ASP 286.A O no hydrogen 3.032 N/A SER 289.A OG ASN 400.A OD1 no hydrogen 3.569 N/A ARG 290.A NE GLU 259.A OE1 no hydrogen 2.503 N/A ARG 290.A NH1 GLU 259.A OE1 no hydrogen 2.895 N/A ARG 290.A NH2 GLN 244.A OE1 no hydrogen 3.382 N/A ARG 290.A NH2 HIS 357.A NE2 no hydrogen 3.081 N/A VAL 293.A N SER 289.A O no hydrogen 3.109 N/A SER 294.A OG ARG 290.A O no hydrogen 3.433 N/A SER 294.A OG ASP 291.A O no hydrogen 3.231 N/A ARG 295.A N ASP 291.A O no hydrogen 3.196 N/A ARG 295.A NH1 GLY 540.A O no hydrogen 2.778 N/A SER 296.A N VAL 292.A O no hydrogen 3.015 N/A MET 297.A N VAL 293.A O no hydrogen 2.911 N/A THR 298.A N SER 294.A O no hydrogen 2.902 N/A THR 298.A OG1 SER 294.A O no hydrogen 3.230 N/A LEU 299.A N ARG 295.A O no hydrogen 2.723 N/A GLU 300.A N MET 297.A O no hydrogen 3.352 N/A ARG 302.A N THR 298.A O no hydrogen 2.962 N/A GLY 304.A N ILE 301.A O no hydrogen 2.661 N/A ARG 305.A N GLU 300.A O no hydrogen 2.711 N/A CYS 307.A N HIS 313.A O no hydrogen 2.860 N/A CYS 307.A SG HIS 313.A ND1 no hydrogen 3.871 N/A CYS 307.A SG HIS 313.A O no hydrogen 3.349 N/A LYS 311.A NZ GLY 306.A O no hydrogen 3.245 N/A VAL 314.A N VAL 352.A O no hydrogen 3.051 N/A TYR 315.A N ILE 269.A O no hydrogen 2.912 N/A LEU 316.A N ILE 350.A O no hydrogen 2.835 N/A GLN 317.A N ILE 267.A O no hydrogen 2.821 N/A LEU 321.A N LEU 318.A O no hydrogen 2.937 N/A GLN 325.A NE2 GLU 264.A O no hydrogen 3.342 N/A GLN 325.A NE2 GLU 264.A OE1 no hydrogen 2.333 N/A LEU 326.A N PRO 322.A O no hydrogen 2.990 N/A ALA 327.A N PRO 323.A O no hydrogen 2.956 N/A THR 328.A N GLU 324.A O no hydrogen 2.891 N/A THR 328.A OG1 GLU 324.A O no hydrogen 2.719 N/A THR 328.A OG1 GLU 324.A OE2 no hydrogen 2.684 N/A ARG 329.A N GLN 325.A O no hydrogen 3.294 N/A GLY 332.A N ASP 144.A OD2 no hydrogen 3.076 N/A SER 334.A OG LEU 330.A O no hydrogen 2.883 N/A THR 336.A N GLY 332.A O no hydrogen 2.973 N/A THR 336.A OG1 GLY 332.A O no hydrogen 3.205 N/A ALA 337.A N ILE 333.A O no hydrogen 2.871 N/A MET 338.A N SER 334.A O no hydrogen 3.025 N/A ILE 339.A N GLU 335.A O no hydrogen 2.777 N/A PHE 340.A N THR 336.A O no hydrogen 2.913 N/A VAL 343.A N ALA 337.A O no hydrogen 3.309 N/A ASP 344.A N GLU 348.A OE2 no hydrogen 2.893 N/A THR 346.A N ASP 344.A OD1 no hydrogen 3.281 N/A THR 346.A OG1 ASP 344.A OD1 no hydrogen 3.046 N/A THR 346.A OG1 ASP 344.A OD2 no hydrogen 3.205 N/A LYS 347.A N ASP 344.A O no hydrogen 2.777 N/A GLU 348.A N ASP 344.A O no hydrogen 3.011 N/A ILE 350.A N LEU 316.A O no hydrogen 2.946 N/A VAL 352.A N VAL 314.A O no hydrogen 2.859 N/A LEU 353.A N GLY 249.A O no hydrogen 2.771 N/A THR 355.A N HIS 246.A O no hydrogen 3.206 N/A HIS 357.A N GLN 244.A O no hydrogen 2.842 N/A TYR 358.A N GLN 244.A O no hydrogen 3.088 N/A ASN 359.A N GLU 390.A OE1 no hydrogen 3.204 N/A ASN 359.A ND2 GLU 390.A OE1 no hydrogen 3.176 N/A GLY 362.A N GLN 238.A O no hydrogen 3.113 N/A ILE 363.A N ALA 391.A O no hydrogen 2.779 N/A THR 365.A N CYS 393.A O no hydrogen 3.253 N/A THR 365.A OG1 ASN 366.A O no hydrogen 3.109 N/A ASN 366.A N GLN 370.A O no hydrogen 3.151 N/A ASN 366.A ND2 GLN 370.A OE1 no hydrogen 3.173 N/A LYS 368.A N ASN 366.A OD1 no hydrogen 3.191 N/A GLY 369.A N ASN 366.A O no hydrogen 3.121 N/A GLN 370.A N ASN 366.A OD1 no hydrogen 2.941 N/A GLN 370.A NE2 TYR 386.A OH no hydrogen 3.501 N/A VAL 371.A N LEU 385.A O no hydrogen 3.121 N/A LEU 372.A N PRO 364.A O no hydrogen 2.723 N/A ARG 373.A N GLN 380.A O no hydrogen 2.475 N/A ARG 373.A NH1 GLY 179.A O no hydrogen 2.972 N/A HIS 374.A ND1 ASP 379.A OD1 no hydrogen 3.183 N/A VAL 375.A N GLN 378.A O no hydrogen 3.058 N/A GLN 378.A N VAL 375.A O no hydrogen 3.173 N/A VAL 382.A N VAL 371.A O no hydrogen 2.849 N/A TYR 386.A N THR 202.A O no hydrogen 2.644 N/A TYR 386.A OH SER 420.A OG no hydrogen 3.180 N/A ALA 387.A N GLY 369.A O no hydrogen 2.867 N/A CYS 388.A N VAL 204.A O no hydrogen 3.245 N/A CYS 388.A SG ALA 22.A O no hydrogen 3.807 N/A ALA 392.A N GLY 389.A O no hydrogen 3.252 N/A CYS 393.A N ILE 363.A O no hydrogen 2.536 N/A CYS 393.A SG GLN 238.A O no hydrogen 4.023 N/A CYS 393.A SG MET 360.A O no hydrogen 3.636 N/A CYS 393.A SG SER 395.A OG no hydrogen 3.084 N/A HIS 397.A NE2 ASP 409.A OD1 no hydrogen 3.121 N/A ALA 399.A N SER 80.A O no hydrogen 2.915 N/A ASN 400.A N HIS 397.A O no hydrogen 3.040 N/A ARG 401.A NH1 GLN 244.A OE1 no hydrogen 3.410 N/A ASN 405.A N LEU 402.A O no hydrogen 3.223 N/A ASP 409.A N ASN 405.A O no hydrogen 2.840 N/A LEU 410.A N SER 406.A O no hydrogen 3.052 N/A VAL 411.A N LEU 407.A O no hydrogen 3.101 N/A VAL 412.A N LEU 408.A O no hydrogen 2.896 N/A PHE 413.A N ASP 409.A O no hydrogen 2.967 N/A GLY 414.A N LEU 410.A O no hydrogen 2.883 N/A ARG 415.A N VAL 411.A O no hydrogen 2.974 N/A ARG 415.A NH1 GLN 95.A OE1 no hydrogen 3.526 N/A ALA 416.A N VAL 412.A O no hydrogen 2.967 N/A CYS 417.A N PHE 413.A O no hydrogen 2.945 N/A CYS 417.A SG ALA 387.A O no hydrogen 3.691 N/A CYS 417.A SG PHE 413.A O no hydrogen 3.171 N/A ALA 418.A N GLY 414.A O no hydrogen 3.019 N/A LEU 419.A N ARG 415.A O no hydrogen 2.846 N/A SER 420.A N ALA 416.A O no hydrogen 2.894 N/A SER 420.A OG TYR 386.A OH no hydrogen 3.180 N/A ILE 421.A N CYS 417.A O no hydrogen 2.942 N/A GLU 422.A N ALA 418.A O no hydrogen 2.947 N/A GLU 423.A N LEU 419.A O no hydrogen 2.979 N/A SER 424.A N SER 420.A O no hydrogen 2.931 N/A SER 424.A N ILE 421.A O no hydrogen 3.308 N/A SER 424.A OG SER 420.A O no hydrogen 3.279 N/A CYS 425.A N ILE 421.A O no hydrogen 2.919 N/A CYS 425.A SG ASN 201.A OD1 no hydrogen 4.027 N/A ARG 426.A N ASP 429.A OD2 no hydrogen 3.274 N/A ARG 426.A NE PRO 427.A O no hydrogen 3.293 N/A GLY 428.A N ASP 13.A OD1 no hydrogen 3.043 N/A SER 442.A OG ASP 173.A OD2 no hydrogen 2.468 N/A MET 444.A N GLU 440.A O no hydrogen 2.833 N/A ASN 445.A N GLU 441.A O no hydrogen 2.956 N/A ASN 445.A ND2 GLN 519.A OE1 no hydrogen 2.621 N/A LEU 446.A N SER 442.A O no hydrogen 2.919 N/A ASP 447.A N VAL 443.A O no hydrogen 2.905 N/A LYS 448.A N MET 444.A O no hydrogen 2.926 N/A LYS 448.A NZ ASN 445.A OD1 no hydrogen 3.092 N/A LEU 449.A N ASN 445.A O no hydrogen 2.962 N/A ARG 450.A N LEU 446.A O no hydrogen 2.903 N/A ARG 450.A NE TYR 5.A OH no hydrogen 2.942 N/A ARG 450.A NH2 TYR 5.A OH no hydrogen 3.418 N/A PHE 451.A N ASP 447.A O no hydrogen 2.985 N/A SER 455.A N HIS 498.A O no hydrogen 3.182 N/A ILE 456.A N HIS 498.A O no hydrogen 2.749 N/A GLU 460.A N ARG 457.A O no hydrogen 3.201 N/A LEU 461.A N ARG 457.A O no hydrogen 3.093 N/A ARG 462.A N THR 458.A O no hydrogen 3.429 N/A LEU 463.A N SER 459.A O no hydrogen 3.042 N/A SER 464.A N GLU 460.A O no hydrogen 2.934 N/A SER 464.A OG GLU 460.A O no hydrogen 2.599 N/A MET 465.A N LEU 461.A O no hydrogen 3.052 N/A GLN 466.A N ARG 462.A O no hydrogen 2.823 N/A GLN 466.A NE2 ARG 211.A O no hydrogen 2.701 N/A LYS 467.A N LEU 463.A O no hydrogen 2.934 N/A SER 468.A N SER 464.A O no hydrogen 2.963 N/A MET 469.A N MET 465.A O no hydrogen 2.827 N/A GLN 470.A N GLN 466.A O no hydrogen 2.942 N/A GLN 470.A NE2 GLN 470.A O no hydrogen 3.637 N/A ASN 471.A N LYS 467.A O no hydrogen 3.014 N/A HIS 472.A N SER 468.A O no hydrogen 2.950 N/A HIS 472.A ND1 SER 468.A O no hydrogen 2.648 N/A ALA 473.A N MET 469.A O no hydrogen 2.916 N/A ARG 477.A N ALA 543.A O no hydrogen 3.146 N/A ARG 477.A NH1 GLU 241.A O no hydrogen 3.128 N/A ARG 477.A NH1 HIS 542.A ND1 no hydrogen 2.853 N/A ARG 477.A NH2 GLU 241.A O no hydrogen 3.133 N/A GLY 479.A N ASP 546.A OD2 no hydrogen 3.301 N/A VAL 481.A N VAL 478.A O no hydrogen 2.722 N/A LEU 482.A N VAL 478.A O no hydrogen 2.725 N/A GLN 483.A N GLY 479.A O no hydrogen 2.902 N/A GLN 483.A NE2 GLU 533.A OE2 no hydrogen 3.199 N/A GLY 485.A N VAL 481.A O no hydrogen 2.923 N/A CYS 486.A N LEU 482.A O no hydrogen 2.969 N/A CYS 486.A SG LEU 482.A O no hydrogen 3.303 N/A CYS 486.A SG ILE 529.A O no hydrogen 3.393 N/A GLY 487.A N GLN 483.A O no hydrogen 2.936 N/A LYS 488.A N GLU 484.A O no hydrogen 2.921 N/A ILE 489.A N GLY 485.A O no hydrogen 2.875 N/A SER 490.A N CYS 486.A O no hydrogen 2.938 N/A SER 490.A OG CYS 486.A O no hydrogen 2.998 N/A SER 490.A OG TYR 530.A OH no hydrogen 2.804 N/A LYS 491.A N GLY 487.A O no hydrogen 2.947 N/A LEU 492.A N LYS 488.A O no hydrogen 2.910 N/A TYR 493.A N ILE 489.A O no hydrogen 2.852 N/A TYR 493.A OH VAL 582.A O no hydrogen 2.858 N/A GLY 494.A N SER 490.A O no hydrogen 2.987 N/A ASP 495.A N LYS 491.A O no hydrogen 2.989 N/A LEU 496.A N TYR 493.A O no hydrogen 2.812 N/A HIS 498.A N ASP 495.A O no hydrogen 3.453 N/A LYS 500.A N ILE 456.A O no hydrogen 2.916 N/A THR 501.A N ALA 452.A O no hydrogen 3.281 N/A THR 501.A OG1 LEU 449.A O no hydrogen 3.174 N/A PHE 502.A N ASP 511.A OD1 no hydrogen 2.933 N/A ARG 504.A NH1 THR 501.A OG1 no hydrogen 2.759 N/A GLY 505.A N ASP 503.A OD1 no hydrogen 3.250 N/A TRP 508.A N ILE 189.A O no hydrogen 2.903 N/A ASN 509.A ND2 ASP 503.A O no hydrogen 3.026 N/A ASN 509.A ND2 GLY 505.A O no hydrogen 2.804 N/A LEU 512.A N ASN 509.A O no hydrogen 3.231 N/A LEU 512.A N ASN 509.A OD1 no hydrogen 3.175 N/A VAL 513.A N ASN 509.A O no hydrogen 3.086 N/A GLU 514.A N THR 510.A O no hydrogen 2.996 N/A THR 515.A N ASP 511.A O no hydrogen 3.022 N/A THR 515.A OG1 ASP 511.A O no hydrogen 2.764 N/A LEU 516.A N LEU 512.A O no hydrogen 2.938 N/A GLU 517.A N VAL 513.A O no hydrogen 3.064 N/A LEU 518.A N GLU 514.A O no hydrogen 3.010 N/A LEU 518.A N THR 515.A O no hydrogen 3.263 N/A GLN 519.A N THR 515.A O no hydrogen 3.031 N/A ASN 520.A N LEU 516.A O no hydrogen 3.126 N/A ASN 520.A ND2 ASP 225.A OD1 no hydrogen 2.476 N/A LEU 521.A N GLU 517.A O no hydrogen 2.973 N/A MET 522.A N LEU 518.A O no hydrogen 3.006 N/A LEU 523.A N ASN 520.A O no hydrogen 3.197 N/A CYS 524.A N ASN 520.A O no hydrogen 3.065 N/A CYS 524.A SG GLY 224.A O no hydrogen 3.526 N/A CYS 524.A SG ASN 520.A O no hydrogen 3.447 N/A ALA 525.A N LEU 521.A O no hydrogen 2.983 N/A LEU 526.A N MET 522.A O no hydrogen 2.998 N/A GLN 527.A NE2 THR 231.A OG1 no hydrogen 3.182 N/A GLN 527.A NE2 LEU 523.A O no hydrogen 2.747 N/A THR 528.A N CYS 524.A O no hydrogen 3.048 N/A THR 528.A OG1 LEU 240.A O no hydrogen 2.952 N/A ILE 529.A N ALA 525.A O no hydrogen 2.921 N/A TYR 530.A N LEU 526.A O no hydrogen 2.985 N/A TYR 530.A OH SER 490.A OG no hydrogen 2.804 N/A GLY 531.A N GLN 527.A O no hydrogen 2.913 N/A ALA 532.A N THR 528.A O no hydrogen 2.993 N/A GLU 533.A N ILE 529.A O no hydrogen 3.002 N/A ALA 534.A N TYR 530.A O no hydrogen 2.921 N/A ARG 535.A N GLY 531.A O no hydrogen 3.106 N/A ARG 535.A NE GLU 241.A OE2 no hydrogen 2.759 N/A ARG 535.A NH1 GLU 537.A OE2 no hydrogen 2.643 N/A ARG 535.A NH1 TRP 572.A O no hydrogen 2.871 N/A ARG 535.A NH2 LYS 574.A O no hydrogen 2.356 N/A ARG 535.A NH2 THR 576.A OG1 no hydrogen 3.243 N/A SER 538.A N VAL 549.A O no hydrogen 2.973 N/A SER 538.A OG HIS 542.A O no hydrogen 3.546 N/A ARG 539.A N HIS 542.A O no hydrogen 2.897 N/A ARG 539.A NE GLU 537.A OE2 no hydrogen 2.613 N/A ARG 539.A NH1 ASP 81.A O no hydrogen 3.164 N/A ARG 539.A NH1 ASP 552.A OD1 no hydrogen 3.245 N/A ARG 539.A NH2 GLU 537.A OE1 no hydrogen 2.673 N/A ARG 539.A NH2 GLU 537.A OE2 no hydrogen 3.252 N/A ARG 539.A NH2 ASP 552.A OD1 no hydrogen 2.767 N/A GLY 540.A N ASP 81.A OD2 no hydrogen 2.789 N/A ALA 541.A N ALA 399.A O no hydrogen 3.207 N/A HIS 542.A N ARG 539.A O no hydrogen 2.859 N/A HIS 542.A NE2 ARG 535.A O no hydrogen 2.974 N/A GLU 545.A N ARG 477.A O no hydrogen 2.965 N/A LYS 548.A NZ GLU 545.A O no hydrogen 2.329 N/A ARG 550.A NE ASP 552.A OD2 no hydrogen 2.982 N/A ARG 550.A NH1 ALA 610.A O no hydrogen 3.047 N/A ARG 550.A NH2 ASP 552.A OD2 no hydrogen 3.187 N/A ARG 550.A NH2 ALA 610.A O no hydrogen 2.408 N/A ILE 551.A N GLU 537.A OE1 no hydrogen 3.134 N/A GLU 553.A N GLU 553.A OE2 no hydrogen 2.611 N/A ASP 555.A N GLN 563.A OE1 no hydrogen 2.628 N/A TYR 556.A OH GLU 553.A OE1 no hydrogen 2.990 N/A SER 557.A OG ASP 555.A OD2 no hydrogen 2.293 N/A LYS 558.A N ASP 555.A O no hydrogen 2.881 N/A GLN 563.A NE2 ASP 555.A O no hydrogen 2.561 N/A GLN 563.A NE2 LYS 558.A O no hydrogen 3.601 N/A GLN 563.A NE2 PRO 559.A O no hydrogen 3.282 N/A LYS 566.A N GLU 553.A O no hydrogen 2.903 N/A GLU 569.A N GLU 569.A OE1 no hydrogen 2.645 N/A GLU 570.A N PRO 567.A O no hydrogen 2.867 N/A HIS 571.A N PRO 567.A O no hydrogen 3.316 N/A ARG 573.A N HIS 571.A ND1 no hydrogen 2.936 N/A ARG 573.A NE GLU 553.A OE1 no hydrogen 3.246 N/A ARG 573.A NE GLU 553.A OE2 no hydrogen 2.975 N/A ARG 573.A NH1 TRP 82.A O no hydrogen 2.735 N/A ARG 573.A NH1 ASP 596.A OD2 no hydrogen 3.543 N/A ARG 573.A NH2 GLU 553.A OE1 no hydrogen 2.958 N/A ARG 573.A NH2 ASP 596.A OD1 no hydrogen 3.257 N/A LYS 574.A NZ PHE 568.A O no hydrogen 3.158 N/A LYS 574.A NZ GLU 569.A O no hydrogen 3.549 N/A HIS 575.A N ARG 592.A O no hydrogen 2.798 N/A HIS 575.A ND1 ASP 239.A OD2 no hydrogen 2.630 N/A HIS 575.A NE2 ASP 85.A OD1 no hydrogen 3.030 N/A THR 576.A N ASP 239.A OD1 no hydrogen 2.984 N/A THR 576.A OG1 GLU 241.A OE2 no hydrogen 2.968 N/A LEU 577.A N GLU 590.A O no hydrogen 2.871 N/A SER 578.A N CYS 237.A O no hydrogen 3.345 N/A SER 578.A OG GLN 527.A OE1 no hydrogen 3.180 N/A TYR 579.A N THR 588.A O no hydrogen 2.932 N/A ASP 581.A N LYS 586.A O no hydrogen 2.946 N/A THR 584.A OG1 ASP 581.A OD1 no hydrogen 3.464 N/A GLY 585.A N ASP 581.A O no hydrogen 2.527 N/A THR 588.A N TYR 579.A O no hydrogen 2.925 N/A GLU 590.A N LEU 577.A O no hydrogen 2.831 N/A ARG 592.A N HIS 575.A O no hydrogen 2.909 N/A ARG 592.A NE GLN 238.A OE1 no hydrogen 3.178 N/A ARG 592.A NH1 ASP 379.A OD2 no hydrogen 2.971 N/A ARG 592.A NH2 GLN 238.A OE1 no hydrogen 3.272 N/A THR 598.A OG1 CYS 604.A O no hydrogen 2.841 N/A CYS 604.A N ASN 600.A O no hydrogen 3.290 N/A THR 606.A OG1 ASP 596.A O no hydrogen 3.118 N/A VAL 607.A N GLN 86.A OE1 no hydrogen 2.964 N/A ARG 612.A NH1 ASP 291.A OD2 no hydrogen 3.511 N/A ARG 612.A NH2 ASP 291.A OD1 no hydrogen 2.539 N/A ARG 612.A NH2 ASP 291.A OD2 no hydrogen 2.754 N/A SER 613.A N ILE 611.A O no hydrogen 2.750 N/A SER 613.A OG ILE 611.A O no hydrogen 3.519 N/A