Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4q8h_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): SER 4.A OG SER 4.A O no hydrogen 2.380 N/A GLN 7.A N ASP 5.A OD1 no hydrogen 3.368 N/A GLN 7.A NE2 PRO 40.A O no hydrogen 2.379 N/A GLN 7.A NE2 ASN 43.A OD1 no hydrogen 3.236 N/A THR 8.A N ASP 5.A O no hydrogen 2.959 N/A THR 8.A OG1 ASP 5.A O no hydrogen 2.844 N/A TYR 15.A N ASN 13.A OD1 no hydrogen 2.822 N/A GLU 16.A N ASN 13.A O no hydrogen 3.377 N/A ALA 20.A N THR 8.A O no hydrogen 3.149 N/A TYR 21.A N PRO 18.A O no hydrogen 3.003 N/A TYR 21.A OH TYR 330.A OH no hydrogen 2.797 N/A SER 22.A N PRO 19.A O no hydrogen 3.231 N/A SER 22.A OG PRO 19.A O no hydrogen 2.463 N/A THR 27.A OG1 ASP 50.A OD1 no hydrogen 3.062 N/A THR 39.A N ASP 37.A OD1 no hydrogen 3.143 N/A THR 39.A OG1 ASP 37.A OD1 no hydrogen 3.008 N/A THR 39.A OG1 ASP 37.A OD2 no hydrogen 3.139 N/A PHE 41.A N PHE 38.A O no hydrogen 2.956 N/A ASN 42.A N PHE 38.A O no hydrogen 3.073 N/A ASN 42.A ND2 TYR 46.A O no hydrogen 2.492 N/A THR 44.A N ASN 42.A OD1 no hydrogen 2.733 N/A THR 44.A OG1 ASN 42.A OD1 no hydrogen 2.620 N/A TYR 46.A N THR 44.A OG1 no hydrogen 3.077 N/A SER 47.A OG MET 99.A O no hydrogen 3.198 N/A SER 47.A OG LYS 105.A O no hydrogen 2.870 N/A LEU 49.A N ASP 348.A O no hydrogen 2.833 N/A ASP 50.A N CYS 107.A O no hydrogen 2.803 N/A ASP 52.A N ASP 50.A OD1 no hydrogen 3.281 N/A VAL 53.A N PRO 51.A O no hydrogen 2.803 N/A ASN 55.A ND2 GLN 113.A OE1 no hydrogen 2.667 N/A TYR 57.A N ASN 55.A O no hydrogen 2.443 N/A ASN 59.A ND2 ASP 50.A O no hydrogen 3.393 N/A ILE 62.A N THR 58.A O no hydrogen 2.628 N/A GLN 63.A N ASN 59.A O no hydrogen 3.022 N/A GLN 63.A NE2 SER 47.A O no hydrogen 3.302 N/A LEU 64.A N ALA 60.A O no hydrogen 2.946 N/A TYR 65.A N ILE 61.A O no hydrogen 2.981 N/A TYR 65.A N ILE 62.A O no hydrogen 2.943 N/A TYR 65.A OH ASN 155.A OD1 no hydrogen 2.052 N/A ARG 66.A N ILE 62.A O no hydrogen 2.866 N/A ARG 66.A N GLN 63.A O no hydrogen 2.942 N/A ARG 66.A NH1 SER 47.A O no hydrogen 2.995 N/A ARG 66.A NH1 GLN 63.A OE1 no hydrogen 3.440 N/A ILE 68.A N TYR 65.A O no hydrogen 3.485 N/A PHE 72.A N ILE 68.A O no hydrogen 2.640 N/A ASN 73.A N PRO 69.A O no hydrogen 2.894 N/A ASN 73.A ND2 PRO 383.A O no hydrogen 3.239 N/A PHE 74.A N GLU 70.A O no hydrogen 2.918 N/A VAL 75.A N MET 71.A O no hydrogen 2.917 N/A VAL 76.A N PHE 72.A O no hydrogen 2.905 N/A CYS 78.A N PHE 74.A O no hydrogen 2.908 N/A CYS 78.A SG PHE 74.A O no hydrogen 3.220 N/A LEU 79.A N VAL 76.A O no hydrogen 3.380 N/A LYS 80.A NZ ASP 81.A OD1 no hydrogen 3.543 N/A LYS 80.A NZ ASP 81.A OD2 no hydrogen 2.510 N/A GLU 85.A N GLU 85.A OE1 no hydrogen 2.478 N/A THR 86.A OG1 ASN 83.A O no hydrogen 3.128 N/A THR 86.A OG1 THR 86.A O no hydrogen 2.463 N/A LEU 88.A N GLU 165.A OE2 no hydrogen 3.402 N/A LEU 89.A N GLU 165.A OE1 no hydrogen 2.688 N/A THR 90.A N THR 86.A O no hydrogen 3.218 N/A THR 90.A OG1 THR 86.A O no hydrogen 2.732 N/A THR 90.A OG1 THR 87.A O no hydrogen 3.026 N/A ASP 91.A N THR 87.A O no hydrogen 2.914 N/A LEU 92.A N LEU 88.A O no hydrogen 2.918 N/A GLY 93.A N LEU 89.A O no hydrogen 2.923 N/A TYR 94.A N THR 90.A O no hydrogen 2.865 N/A LEU 95.A N ASP 91.A O no hydrogen 2.928 N/A PHE 96.A N LEU 92.A O no hydrogen 2.901 N/A ASP 97.A N GLY 93.A O no hydrogen 2.895 N/A MET 98.A N TYR 94.A O no hydrogen 2.905 N/A MET 99.A N LEU 95.A O no hydrogen 2.920 N/A GLU 100.A N PHE 96.A O no hydrogen 2.914 N/A ARG 101.A N ASP 97.A O no hydrogen 2.936 N/A ARG 101.A NH2 ASP 388.A OD1 no hydrogen 3.326 N/A SER 102.A N MET 98.A O no hydrogen 2.817 N/A SER 102.A OG MET 98.A O no hydrogen 2.678 N/A GLY 104.A N SER 47.A OG no hydrogen 3.033 N/A LYS 105.A N SER 102.A O no hydrogen 3.202 N/A CYS 107.A N GLY 48.A O no hydrogen 3.299 N/A CYS 107.A SG SER 102.A OG no hydrogen 3.131 N/A CYS 107.A SG LYS 105.A O no hydrogen 3.408 N/A SER 109.A OG ASN 59.A OD1 no hydrogen 3.181 N/A SER 110.A N SER 108.A OG no hydrogen 3.376 N/A ASN 111.A ND2 ILE 540.A O no hydrogen 2.925 N/A GLN 113.A N SER 109.A O no hydrogen 3.018 N/A ALA 114.A N SER 110.A O no hydrogen 2.868 N/A SER 115.A N ASN 111.A O no hydrogen 2.911 N/A SER 115.A OG ASP 91.A OD2 no hydrogen 2.332 N/A SER 115.A OG ASN 111.A O no hydrogen 2.878 N/A LEU 116.A N PHE 112.A O no hydrogen 2.910 N/A LYS 117.A N GLN 113.A O no hydrogen 2.902 N/A SER 118.A N ALA 114.A O no hydrogen 2.903 N/A LEU 119.A N SER 115.A O no hydrogen 2.913 N/A THR 120.A N LEU 116.A O no hydrogen 2.903 N/A THR 120.A OG1 LEU 116.A O no hydrogen 3.118 N/A THR 120.A OG1 LYS 117.A O no hydrogen 3.068 N/A THR 120.A OG1 GLU 135.A OE2 no hydrogen 3.150 N/A ASP 121.A N LYS 117.A O no hydrogen 2.943 N/A LYS 122.A N LEU 119.A O no hydrogen 2.889 N/A GLU 126.A N GLU 126.A OE1 no hydrogen 2.649 N/A LEU 128.A N GLU 125.A O no hydrogen 3.388 N/A LEU 131.A N TYR 127.A O no hydrogen 2.904 N/A LEU 131.A N LEU 128.A O no hydrogen 3.095 N/A CYS 132.A N LEU 128.A O no hydrogen 2.906 N/A CYS 132.A SG LEU 128.A O no hydrogen 3.247 N/A CYS 132.A SG GLU 129.A O no hydrogen 3.469 N/A ARG 134.A N LEU 131.A O no hydrogen 3.279 N/A ARG 134.A NH2 LYS 153.A O no hydrogen 2.649 N/A GLU 135.A N GLU 135.A OE1 no hydrogen 2.469 N/A ILE 137.A N ARG 134.A O no hydrogen 2.840 N/A GLU 138.A N ARG 134.A O no hydrogen 2.419 N/A SER 142.A OG PHE 140.A O no hydrogen 3.312 N/A SER 143.A OG SER 142.A O no hydrogen 2.583 N/A SER 143.A OG GLU 144.A OE1 no hydrogen 2.885 N/A GLU 144.A N GLU 144.A OE1 no hydrogen 2.566 N/A ILE 146.A N THR 325.A OG1 no hydrogen 3.281 N/A MET 150.A N LYS 147.A O no hydrogen 3.292 N/A GLN 152.A N GLN 152.A OE1 no hydrogen 2.419 N/A GLN 152.A NE2 LEU 261.A O no hydrogen 2.692 N/A PHE 154.A N MET 150.A O no hydrogen 2.921 N/A ASN 155.A N PRO 151.A O no hydrogen 2.891 N/A ASN 155.A ND2 SER 258.A OG no hydrogen 2.792 N/A ARG 156.A N GLN 152.A O no hydrogen 2.946 N/A PHE 157.A N LYS 153.A O no hydrogen 2.895 N/A LEU 158.A N PHE 154.A O no hydrogen 2.886 N/A LEU 159.A N ASN 155.A O no hydrogen 2.950 N/A SER 160.A N ARG 156.A O no hydrogen 2.926 N/A SER 160.A OG ARG 156.A O no hydrogen 2.571 N/A GLN 161.A N PHE 157.A O no hydrogen 2.889 N/A GLN 161.A NE2 GLU 165.A OE2 no hydrogen 3.092 N/A LEU 162.A N LEU 158.A O no hydrogen 2.909 N/A ILE 163.A N LEU 159.A O no hydrogen 2.924 N/A LYS 164.A N SER 160.A O no hydrogen 2.912 N/A GLU 165.A N GLN 161.A O no hydrogen 2.914 N/A GLU 166.A N LEU 162.A O no hydrogen 2.893 N/A ALA 167.A N ILE 163.A O no hydrogen 2.933 N/A GLN 168.A N GLU 165.A O no hydrogen 3.034 N/A THR 169.A N GLU 166.A O no hydrogen 3.458 N/A THR 169.A OG1 GLU 166.A O no hydrogen 3.491 N/A THR 169.A OG1 ASN 173.A OD1 no hydrogen 3.217 N/A ASN 171.A N THR 169.A OG1 no hydrogen 3.254 N/A HIS 172.A N THR 169.A OG1 no hydrogen 2.784 N/A LEU 176.A N GLU 166.A OE2 no hydrogen 2.349 N/A ASN 177.A N GLU 166.A OE1 no hydrogen 3.178 N/A GLN 178.A N ILE 174.A O no hydrogen 2.491 N/A CYS 179.A N THR 175.A O no hydrogen 2.891 N/A CYS 179.A N LEU 176.A O no hydrogen 3.148 N/A CYS 179.A SG GLU 70.A OE1 no hydrogen 3.278 N/A CYS 179.A SG SER 255.A OG no hydrogen 3.041 N/A PHE 180.A N LEU 176.A O no hydrogen 2.906 N/A LEU 182.A N LEU 202.A O no hydrogen 2.892 N/A GLU 183.A N ASN 252.A OD1 no hydrogen 2.616 N/A THR 184.A N LYS 200.A O no hydrogen 2.904 N/A THR 184.A OG1 LEU 182.A O no hydrogen 3.134 N/A GLU 185.A N THR 249.A O no hydrogen 2.908 N/A ILE 186.A N THR 198.A O no hydrogen 2.878 N/A ARG 187.A N GLU 247.A O no hydrogen 2.880 N/A THR 188.A N ASP 196.A O no hydrogen 2.823 N/A THR 188.A OG1 GLN 246.A OE1 no hydrogen 2.952 N/A GLU 189.A N THR 245.A O no hydrogen 2.872 N/A SER 191.A N HIS 194.A O no hydrogen 3.395 N/A SER 191.A OG ASP 193.A OD1 no hydrogen 2.920 N/A HIS 194.A N SER 191.A O no hydrogen 3.155 N/A THR 197.A OG1 THR 197.A O no hydrogen 2.447 N/A THR 198.A N ILE 186.A O no hydrogen 2.902 N/A LYS 200.A N THR 184.A O no hydrogen 2.916 N/A LEU 202.A N LEU 182.A O no hydrogen 2.927 N/A SER 204.A OG GLU 260.A OE2 no hydrogen 2.800 N/A LEU 205.A N SER 258.A O no hydrogen 2.648 N/A ILE 207.A N GLU 260.A O no hydrogen 2.753 N/A ILE 217.A N TRP 277.A O no hydrogen 3.015 N/A LEU 218.A N ASN 216.A OD1 no hydrogen 2.922 N/A ILE 221.A N ILE 217.A O no hydrogen 3.189 N/A GLU 222.A N LEU 218.A O no hydrogen 2.908 N/A TYR 223.A N PRO 219.A O no hydrogen 2.895 N/A ALA 224.A N TYR 220.A O no hydrogen 2.943 N/A MET 225.A N ILE 221.A O no hydrogen 2.882 N/A MET 225.A N GLU 222.A O no hydrogen 3.175 N/A LYS 226.A N GLU 222.A O no hydrogen 3.201 N/A ASN 227.A N CYS 248.A O no hydrogen 2.951 N/A THR 229.A N GLN 246.A O no hydrogen 2.911 N/A THR 229.A OG1 GLN 230.A O no hydrogen 3.139 N/A LYS 231.A N ILE 244.A O no hydrogen 2.910 N/A GLY 239.A N CYS 235.A O no hydrogen 3.320 N/A GLN 246.A N THR 229.A O no hydrogen 2.879 N/A GLU 247.A N ARG 187.A O no hydrogen 2.902 N/A GLU 247.A N GLU 247.A OE1 no hydrogen 2.816 N/A CYS 248.A N ASN 227.A O no hydrogen 2.876 N/A THR 249.A N GLU 185.A O no hydrogen 2.919 N/A VAL 250.A N MET 225.A O no hydrogen 2.641 N/A LYS 251.A N GLU 183.A O no hydrogen 3.041 N/A LYS 251.A NZ GLU 185.A OE1 no hydrogen 3.035 N/A LYS 251.A NZ THR 249.A O no hydrogen 3.007 N/A ASN 252.A ND2 GLY 181.A O no hydrogen 2.852 N/A SER 255.A OG GLU 70.A OE1 no hydrogen 3.408 N/A SER 255.A OG GLU 70.A OE2 no hydrogen 3.026 N/A SER 255.A OG CYS 179.A O no hydrogen 3.385 N/A VAL 256.A N CYS 179.A O no hydrogen 3.271 N/A LEU 257.A N TYR 374.A O no hydrogen 2.888 N/A LEU 259.A N ILE 372.A O no hydrogen 2.867 N/A GLU 260.A N LEU 205.A O no hydrogen 2.749 N/A LEU 261.A N GLU 370.A O no hydrogen 3.054 N/A SER 262.A N ILE 207.A O no hydrogen 2.972 N/A LEU 264.A N GLU 267.A OE1 no hydrogen 2.521 N/A PHE 268.A N LEU 264.A O no hydrogen 3.008 N/A SER 269.A N ASP 265.A O no hydrogen 2.913 N/A SER 269.A OG ASP 265.A O no hydrogen 2.917 N/A ASN 270.A N THR 266.A O no hydrogen 2.906 N/A ILE 271.A N GLU 267.A O no hydrogen 2.906 N/A ARG 272.A N PHE 268.A O no hydrogen 2.905 N/A ARG 272.A NE TYR 364.A O no hydrogen 2.947 N/A ARG 272.A NE LYS 367.A O no hydrogen 3.057 N/A ARG 272.A NH2 LYS 367.A O no hydrogen 2.876 N/A SER 273.A N SER 269.A O no hydrogen 2.906 N/A SER 273.A OG SER 269.A O no hydrogen 3.568 N/A SER 273.A OG ASN 270.A O no hydrogen 2.394 N/A SER 274.A N ASN 270.A O no hydrogen 3.165 N/A SER 274.A OG LYS 275.A O no hydrogen 3.543 N/A THR 279.A OG1 ASN 216.A OD1 no hydrogen 3.546 N/A THR 279.A OG1 TRP 277.A O no hydrogen 3.543 N/A SER 280.A OG GLU 356.A OE2 no hydrogen 3.295 N/A PHE 282.A N TYR 309.A O no hydrogen 2.919 N/A TYR 283.A N ARG 294.A O no hydrogen 2.869 N/A GLY 284.A N PHE 307.A O no hydrogen 2.900 N/A SER 285.A N VAL 292.A O no hydrogen 2.921 N/A ILE 287.A N LYS 290.A O no hydrogen 2.958 N/A LYS 290.A N ILE 287.A O no hydrogen 2.880 N/A VAL 292.A N SER 285.A O no hydrogen 2.878 N/A LEU 293.A N GLU 222.A OE2 no hydrogen 2.449 N/A ARG 294.A N TYR 283.A O no hydrogen 2.911 N/A ARG 294.A NH1 GLU 222.A OE1 no hydrogen 3.387 N/A ARG 294.A NH1 LEU 293.A O no hydrogen 2.648 N/A SER 295.A N GLU 299.A OE1 no hydrogen 2.873 N/A SER 295.A OG GLU 299.A OE1 no hydrogen 3.073 N/A SER 295.A OG GLU 299.A OE2 no hydrogen 2.544 N/A GLU 299.A N THR 296.A O no hydrogen 3.339 N/A PHE 307.A N GLY 284.A O no hydrogen 2.907 N/A TYR 309.A N PHE 282.A O no hydrogen 2.881 N/A TYR 309.A OH PRO 254.A O no hydrogen 2.167 N/A GLU 310.A N CYS 375.A O no hydrogen 2.964 N/A LEU 311.A N SER 280.A O no hydrogen 2.823 N/A ASN 312.A N ILE 373.A O no hydrogen 2.857 N/A ASN 312.A ND2 PHE 67.A O no hydrogen 3.595 N/A GLY 313.A N ILE 373.A O no hydrogen 2.977 N/A TYR 314.A N TYR 330.A O no hydrogen 2.899 N/A TYR 314.A OH ALA 359.A O no hydrogen 2.329 N/A VAL 315.A N ILE 371.A O no hydrogen 2.870 N/A ALA 316.A N VAL 328.A O no hydrogen 2.882 N/A LYS 317.A N THR 368.A O no hydrogen 2.858 N/A ILE 318.A N ARG 326.A O no hydrogen 2.873 N/A THR 319.A N TRP 366.A O no hydrogen 3.171 N/A ASP 320.A N GLU 324.A O no hydrogen 2.885 N/A ASN 321.A ND2 TYR 15.A O no hydrogen 3.195 N/A ASN 323.A N ASP 320.A O no hydrogen 3.041 N/A ARG 326.A N ILE 318.A O no hydrogen 2.945 N/A ARG 326.A NH2 ASP 320.A OD2 no hydrogen 3.496 N/A VAL 328.A N ALA 316.A O no hydrogen 2.923 N/A THR 329.A N PHE 346.A O no hydrogen 2.928 N/A THR 329.A OG1 ALA 60.A O no hydrogen 2.701 N/A TYR 330.A N TYR 314.A O no hydrogen 2.912 N/A TYR 330.A OH TYR 21.A OH no hydrogen 2.797 N/A VAL 331.A N LEU 344.A O no hydrogen 2.920 N/A LYS 332.A N ASN 312.A O no hydrogen 2.974 N/A LYS 332.A NZ GLU 310.A OE2 no hydrogen 2.809 N/A LYS 333.A N LYS 342.A O no hydrogen 2.937 N/A LYS 333.A NZ TYR 46.A OH no hydrogen 3.517 N/A TYR 334.A OH ASN 339.A OD1 no hydrogen 2.522 N/A ASN 335.A N CYS 340.A O no hydrogen 2.863 N/A CYS 340.A N ASN 335.A O no hydrogen 2.947 N/A LYS 342.A N LYS 333.A O no hydrogen 2.904 N/A LYS 342.A NZ TYR 46.A OH no hydrogen 3.016 N/A TRP 343.A NE1 GLU 356.A OE1 no hydrogen 3.201 N/A LEU 344.A N VAL 331.A O no hydrogen 2.887 N/A MET 345.A N VAL 352.A O no hydrogen 2.868 N/A PHE 346.A N THR 329.A O no hydrogen 2.878 N/A ASN 347.A N LEU 350.A O no hydrogen 2.879 N/A ASN 347.A ND2 ALA 20.A O no hydrogen 3.030 N/A ASN 347.A ND2 SER 22.A O no hydrogen 3.155 N/A TYR 349.A OH PRO 25.A O no hydrogen 2.348 N/A LEU 350.A N ASN 347.A O no hydrogen 2.904 N/A VAL 352.A N MET 345.A O no hydrogen 2.962 N/A ILE 354.A N TRP 343.A O no hydrogen 2.909 N/A GLU 358.A N THR 355.A OG1 no hydrogen 3.299 N/A ALA 359.A N THR 355.A O no hydrogen 3.110 N/A LEU 360.A N GLU 356.A O no hydrogen 2.944 N/A LYS 361.A NZ GLU 358.A OE1 no hydrogen 3.196 N/A LYS 361.A NZ TYR 364.A OH no hydrogen 2.750 N/A TYR 364.A OH GLU 358.A OE2 no hydrogen 2.364 N/A TRP 366.A NE1 LYS 14.A O no hydrogen 2.641 N/A LYS 367.A N TYR 364.A O no hydrogen 3.077 N/A LYS 367.A NZ TYR 314.A OH no hydrogen 2.622 N/A LYS 367.A NZ LYS 361.A O no hydrogen 2.927 N/A THR 368.A N LYS 317.A O no hydrogen 2.923 N/A GLU 370.A N VAL 315.A O no hydrogen 2.962 N/A ILE 371.A N VAL 315.A O no hydrogen 2.934 N/A ILE 372.A N LEU 259.A O no hydrogen 2.906 N/A ILE 373.A N GLY 313.A O no hydrogen 2.857 N/A TYR 374.A N LEU 257.A O no hydrogen 2.936 N/A TYR 374.A OH THR 279.A O no hydrogen 2.519 N/A CYS 375.A N GLU 310.A O no hydrogen 2.957 N/A CYS 375.A SG SER 255.A O no hydrogen 3.858 N/A CYS 375.A SG ASP 376.A O no hydrogen 3.658 N/A ASP 376.A N SER 255.A O no hydrogen 2.651 N/A ALA 377.A N LYS 308.A O no hydrogen 2.999 N/A LEU 380.A N ASP 376.A O no hydrogen 2.890 N/A ARG 381.A N GLU 378.A O no hydrogen 3.194 N/A ARG 381.A NH1 GLU 310.A OE1 no hydrogen 3.140 N/A ARG 381.A NH1 ALA 377.A O no hydrogen 2.391 N/A ARG 381.A NH2 GLU 310.A OE1 no hydrogen 2.786 N/A LYS 382.A N GLU 379.A O no hydrogen 3.303 N/A LYS 382.A NZ GLU 379.A OE2 no hydrogen 2.429 N/A PHE 385.A N ASN 73.A OD1 no hydrogen 2.450 N/A THR 389.A N SER 386.A O no hydrogen 3.019 N/A THR 389.A OG1 SER 386.A O no hydrogen 2.595 N/A TYR 390.A N VAL 387.A O no hydrogen 2.989 N/A ASN 393.A N LYS 80.A O no hydrogen 3.121 N/A TYR 394.A OH GLN 523.A OE1 no hydrogen 3.189 N/A ASP 395.A N ASN 393.A OD1 no hydrogen 3.115 N/A LEU 397.A N TYR 394.A O no hydrogen 3.124 N/A PHE 398.A N ASP 395.A O no hydrogen 2.910 N/A ARG 399.A NH2 GLU 82.A OE2 no hydrogen 2.939 N/A THR 409.A OG1 ASP 408.A O no hydrogen 2.541 N/A THR 409.A OG1 SER 504.A O no hydrogen 2.123 N/A THR 418.A N GLU 421.A OE2 no hydrogen 3.192 N/A THR 418.A OG1 ASP 420.A OD1 no hydrogen 2.206 N/A GLU 421.A N THR 418.A O no hydrogen 2.961 N/A GLY 426.A N GLY 525.A O no hydrogen 3.406 N/A THR 427.A N LYS 424.A O no hydrogen 3.183 N/A VAL 429.A N VAL 527.A O no hydrogen 3.196 N/A ALA 430.A N ILE 461.A O no hydrogen 2.913 N/A ILE 431.A N VAL 529.A O no hydrogen 2.988 N/A ASP 432.A N SER 459.A O no hydrogen 2.935 N/A GLU 434.A N ARG 457.A O no hydrogen 2.901 N/A VAL 436.A N ALA 454.A O no hydrogen 2.823 N/A SER 437.A N ASP 486.A O no hydrogen 2.790 N/A SER 437.A OG ASP 486.A O no hydrogen 3.090 N/A LEU 438.A N ARG 452.A O no hydrogen 2.831 N/A SER 440.A OG GLN 439.A O no hydrogen 2.431 N/A GLU 441.A N LYS 451.A O no hydrogen 3.341 N/A ILE 445.A N CYS 443.A O no hydrogen 2.947 N/A ARG 452.A NE GLN 439.A OE1 no hydrogen 3.084 N/A ARG 452.A NH2 ASP 139.A OD1 no hydrogen 3.193 N/A ARG 452.A NH2 GLN 439.A OE1 no hydrogen 3.181 N/A THR 453.A OG1 VAL 436.A O no hydrogen 3.223 N/A ALA 454.A N VAL 436.A O no hydrogen 2.770 N/A ALA 456.A N GLU 434.A O no hydrogen 2.961 N/A ARG 457.A N GLU 434.A O no hydrogen 2.924 N/A ARG 457.A NE SER 459.A OG no hydrogen 3.201 N/A ARG 457.A NE ASP 475.A OD1 no hydrogen 2.852 N/A ARG 457.A NH1 ASP 583.A OD1 no hydrogen 3.461 N/A ARG 457.A NH2 ASP 475.A OD1 no hydrogen 2.658 N/A ARG 457.A NH2 ASP 583.A OD1 no hydrogen 2.960 N/A ILE 458.A N ASP 476.A O no hydrogen 2.916 N/A SER 459.A N ASP 432.A O no hydrogen 2.888 N/A SER 459.A OG ASP 475.A OD1 no hydrogen 2.302 N/A ILE 460.A N VAL 474.A O no hydrogen 2.894 N/A ILE 461.A N ALA 430.A O no hydrogen 2.872 N/A ARG 462.A N VAL 471.A O no hydrogen 3.264 N/A ARG 462.A NE VAL 471.A O no hydrogen 3.040 N/A ARG 462.A NH1 GLU 421.A OE2 no hydrogen 2.571 N/A ARG 462.A NH2 LEU 416.A O no hydrogen 3.404 N/A TYR 469.A N GLY 466.A O no hydrogen 3.192 N/A GLY 470.A N ARG 462.A O no hydrogen 3.299 N/A VAL 471.A N LEU 468.A O no hydrogen 2.978 N/A PHE 473.A N ILE 460.A O no hydrogen 3.085 N/A VAL 474.A N ILE 460.A O no hydrogen 2.935 N/A ASP 476.A N ILE 458.A O no hydrogen 2.929 N/A TYR 477.A N LYS 506.A O no hydrogen 3.404 N/A VAL 478.A N ALA 456.A O no hydrogen 2.536 N/A VAL 479.A N LEU 508.A O no hydrogen 2.686 N/A ASP 486.A N SER 437.A O no hydrogen 3.252 N/A ASP 486.A N SER 437.A OG no hydrogen 2.779 N/A LEU 488.A N ASP 486.A OD1 no hydrogen 2.671 N/A TYR 491.A N LEU 488.A O no hydrogen 2.763 N/A SER 492.A N LEU 488.A O no hydrogen 2.444 N/A SER 492.A OG TYR 487.A O no hydrogen 2.777 N/A SER 492.A OG LEU 488.A O no hydrogen 2.702 N/A GLY 493.A N THR 489.A O no hydrogen 3.039 N/A SER 504.A OG GLY 497.A O no hydrogen 2.517 N/A SER 504.A OG GLU 502.A O no hydrogen 3.225 N/A SER 504.A OG LYS 503.A O no hydrogen 2.246 N/A THR 505.A N LYS 503.A O no hydrogen 2.381 N/A LYS 506.A N THR 505.A OG1 no hydrogen 2.424 N/A ARG 507.A NH1 ASP 498.A O no hydrogen 2.056 N/A LEU 508.A N TYR 477.A O no hydrogen 2.372 N/A ARG 510.A NH1 ARG 510.A O no hydrogen 3.016 N/A ARG 510.A NH2 ASN 111.A O no hydrogen 3.406 N/A TYR 515.A OH ASN 541.A O no hydrogen 2.462 N/A ARG 516.A N ASN 512.A O no hydrogen 2.294 N/A ARG 516.A NH1 LEU 79.A O no hydrogen 2.339 N/A ARG 516.A NH2 LEU 79.A O no hydrogen 2.912 N/A ARG 516.A NH2 ASN 393.A O no hydrogen 3.098 N/A LYS 517.A N VAL 513.A O no hydrogen 2.896 N/A LYS 517.A NZ ASP 476.A OD2 no hydrogen 2.499 N/A VAL 518.A N VAL 514.A O no hydrogen 2.970 N/A TRP 519.A N TYR 515.A O no hydrogen 2.860 N/A TRP 519.A NE1 ASP 97.A OD2 no hydrogen 2.766 N/A LEU 520.A N ARG 516.A O no hydrogen 2.866 N/A LEU 521.A N LYS 517.A O no hydrogen 2.943 N/A MET 522.A N VAL 518.A O no hydrogen 2.903 N/A GLN 523.A N TRP 519.A O no hydrogen 2.890 N/A GLN 523.A NE2 ASP 388.A OD1 no hydrogen 2.512 N/A LEU 524.A N LEU 520.A O no hydrogen 2.898 N/A GLY 525.A N LEU 521.A O no hydrogen 3.157 N/A CYS 526.A N LEU 521.A O no hydrogen 3.034 N/A CYS 526.A SG LEU 521.A O no hydrogen 3.104 N/A VAL 527.A N THR 427.A O no hydrogen 3.018 N/A PHE 528.A N GLN 548.A O no hydrogen 2.681 N/A VAL 529.A N VAL 429.A O no hydrogen 2.949 N/A HIS 531.A ND1 THR 552.A OG1 no hydrogen 2.760 N/A GLY 532.A N ASP 551.A OD1 no hydrogen 2.897 N/A LEU 533.A N ASP 551.A OD2 no hydrogen 3.477 N/A PHE 537.A N LEU 533.A O no hydrogen 2.889 N/A LYS 538.A N ASN 534.A O no hydrogen 2.915 N/A HIS 539.A N ASN 535.A O no hydrogen 2.937 N/A HIS 539.A N ASP 536.A O no hydrogen 3.133 N/A ILE 540.A N ASP 536.A O no hydrogen 2.879 N/A ASN 541.A ND2 SER 108.A O no hydrogen 3.158 N/A ILE 542.A N PHE 537.A O no hydrogen 2.978 N/A ASN 543.A ND2 ILE 106.A O no hydrogen 2.870 N/A GLN 548.A N PRO 545.A O no hydrogen 3.046 N/A ILE 549.A N ARG 546.A O no hydrogen 3.349 N/A ARG 550.A N TYR 555.A OH no hydrogen 3.309 N/A THR 552.A N GLY 530.A O no hydrogen 2.948 N/A THR 552.A OG1 HIS 531.A ND1 no hydrogen 2.760 N/A ALA 553.A N ASP 551.A OD1 no hydrogen 3.186 N/A ILE 554.A N ASP 551.A O no hydrogen 2.882 N/A TYR 555.A N ASP 551.A O no hydrogen 3.217 N/A PHE 556.A N THR 552.A O no hydrogen 2.947 N/A LEU 557.A N ILE 554.A O no hydrogen 3.399 N/A GLN 558.A NE2 ASN 612.A OD1 no hydrogen 3.357 N/A TYR 567.A N SER 564.A OG no hydrogen 3.243 N/A LEU 568.A N SER 564.A O no hydrogen 3.064 N/A ALA 569.A N LEU 565.A O no hydrogen 2.902 N/A TYR 570.A N ARG 566.A O no hydrogen 2.916 N/A VAL 571.A N TYR 567.A O no hydrogen 2.900 N/A LEU 572.A N LEU 568.A O no hydrogen 2.916 N/A LEU 573.A N ALA 569.A O no hydrogen 2.253 N/A SER 584.A OG ASP 432.A O no hydrogen 2.441 N/A SER 584.A OG ASP 432.A OD2 no hydrogen 3.152 N/A GLU 586.A N ASP 583.A OD2 no hydrogen 2.472 N/A ASP 587.A N ASP 583.A O no hydrogen 3.477 N/A ALA 588.A N SER 584.A O no hydrogen 2.927 N/A HIS 589.A N ILE 585.A O no hydrogen 2.894 N/A THR 590.A N GLU 586.A O no hydrogen 2.915 N/A THR 590.A OG1 GLU 586.A O no hydrogen 3.085 N/A THR 590.A OG1 ASP 587.A O no hydrogen 3.045 N/A ALA 591.A N ASP 587.A O no hydrogen 2.908 N/A LEU 592.A N ALA 588.A O no hydrogen 2.910 N/A ILE 593.A N HIS 589.A O no hydrogen 2.934 N/A LEU 594.A N THR 590.A O no hydrogen 2.884 N/A TYR 595.A N ALA 591.A O no hydrogen 2.907 N/A LYS 596.A N LEU 592.A O no hydrogen 2.960 N/A LYS 596.A NZ TYR 469.A OH no hydrogen 2.783 N/A LYS 597.A N ILE 593.A O no hydrogen 2.891 N/A TYR 598.A N LEU 594.A O no hydrogen 2.905 N/A LEU 599.A N TYR 595.A O no hydrogen 2.913 N/A HIS 600.A N LYS 596.A O no hydrogen 2.925 N/A LEU 601.A N LYS 597.A O no hydrogen 2.917 N/A LYS 602.A N TYR 598.A O no hydrogen 2.883 N/A GLU 603.A N LEU 599.A O no hydrogen 2.904 N/A LYS 604.A N HIS 600.A O no hydrogen 3.049 N/A ALA 605.A N LYS 602.A O no hydrogen 3.026 N/A ILE 606.A N LEU 601.A O no hydrogen 3.235 N/A LYS 609.A NZ GLU 608.A OE1 no hydrogen 3.289 N/A LEU 611.A N PHE 607.A O no hydrogen 2.920 N/A ASN 612.A N GLU 608.A O no hydrogen 2.924 N/A SER 613.A OG VAL 610.A O no hydrogen 2.756 N/A VAL 614.A N VAL 610.A O no hydrogen 2.867 N/A TYR 615.A N LEU 611.A O no hydrogen 2.964 N/A TYR 615.A OH PHE 556.A O no hydrogen 2.326 N/A GLU 616.A N ASN 612.A O no hydrogen 2.910 N/A GLU 617.A N SER 613.A O no hydrogen 2.897 N/A GLY 618.A N VAL 614.A O no hydrogen 2.907 N/A ARG 619.A N TYR 615.A O no hydrogen 2.785 N/A ALA 620.A N GLU 616.A O no hydrogen 2.985 N/A HIS 621.A N GLU 617.A O no hydrogen 2.895 N/A ASN 622.A N GLY 618.A O no hydrogen 2.340 N/A