Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 5t0h_U.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLY 1.A N GLU 31.A OE2 no hydrogen 3.198 N/A SER 4.A OG GLY 1.A O no hydrogen 3.311 N/A LEU 5.A N ILE 2.A O no hydrogen 3.265 N/A LEU 6.A N ILE 3.A O no hydrogen 3.125 N/A ASP 7.A N SER 4.A O no hydrogen 3.422 N/A GLU 8.A N LEU 5.A O no hydrogen 3.399 N/A LYS 14.A N PRO 11.A O no hydrogen 2.797 N/A LYS 14.A NZ GLU 8.A O no hydrogen 2.264 N/A LYS 14.A NZ ASP 9.A O no hydrogen 2.528 N/A GLU 15.A N PRO 11.A O no hydrogen 3.013 N/A PHE 16.A N GLN 12.A O no hydrogen 3.076 N/A ALA 17.A N LEU 13.A O no hydrogen 2.896 N/A LEU 18.A N LYS 14.A O no hydrogen 2.928 N/A HIS 19.A N GLU 15.A O no hydrogen 3.014 N/A LYS 20.A N PHE 16.A O no hydrogen 3.118 N/A LEU 21.A N ALA 17.A O no hydrogen 2.879 N/A ASN 22.A N LEU 18.A O no hydrogen 3.056 N/A VAL 24.A N LYS 20.A O no hydrogen 3.481 N/A VAL 25.A N LEU 21.A O no hydrogen 3.050 N/A ASP 27.A N ASN 26.A OD1 no hydrogen 2.444 N/A GLU 31.A N PHE 28.A O no hydrogen 2.834 N/A SER 33.A N ALA 30.A O no hydrogen 3.373 N/A SER 33.A OG ALA 30.A O no hydrogen 2.550 N/A GLU 34.A N GLU 34.A OE1 no hydrogen 2.664 N/A SER 35.A N ILE 32.A O no hydrogen 3.136 N/A VAL 36.A N SER 33.A O no hydrogen 3.194 N/A LYS 38.A N SER 35.A O no hydrogen 2.797 N/A LYS 38.A NZ ASP 7.A OD1 no hydrogen 2.384 N/A ILE 39.A N SER 35.A O no hydrogen 3.062 N/A GLU 40.A N VAL 36.A O no hydrogen 2.968 N/A VAL 41.A N LYS 38.A O no hydrogen 3.176 N/A LEU 42.A N ILE 39.A O no hydrogen 2.990 N/A TYR 43.A N ILE 39.A O no hydrogen 3.011 N/A GLU 44.A N GLU 40.A O no hydrogen 2.923 N/A ASP 45.A N LEU 42.A O no hydrogen 3.396 N/A SER 50.A OG GLU 15.A OE2 no hydrogen 3.114 N/A ARG 51.A N PHE 48.A O no hydrogen 3.364 N/A GLN 52.A N GLN 52.A OE1 no hydrogen 2.542 N/A ALA 54.A N SER 50.A O no hydrogen 2.959 N/A ALA 55.A N ARG 51.A O no hydrogen 2.944 N/A LEU 56.A N GLN 52.A O no hydrogen 2.988 N/A VAL 57.A N PHE 53.A O no hydrogen 3.042 N/A ALA 58.A N ALA 54.A O no hydrogen 3.034 N/A SER 59.A N ALA 55.A O no hydrogen 2.907 N/A SER 59.A OG ALA 55.A O no hydrogen 2.661 N/A SER 59.A OG SER 71.A O no hydrogen 3.474 N/A LYS 60.A N LEU 56.A O no hydrogen 2.911 N/A LYS 60.A N VAL 57.A O no hydrogen 3.094 N/A VAL 61.A N VAL 57.A O no hydrogen 3.007 N/A PHE 62.A N ALA 58.A O no hydrogen 3.108 N/A TYR 63.A N SER 59.A O no hydrogen 2.908 N/A HIS 64.A N LYS 60.A O no hydrogen 2.993 N/A LEU 65.A N VAL 61.A O no hydrogen 2.803 N/A GLU 69.A N GLU 69.A OE1 no hydrogen 2.616 N/A SER 71.A OG SER 59.A O no hydrogen 3.534 N/A SER 71.A OG ALA 67.A O no hydrogen 2.802 N/A LEU 72.A N PHE 68.A O no hydrogen 2.920 N/A ASN 73.A N GLU 69.A O no hydrogen 2.992 N/A TYR 74.A N GLU 70.A O no hydrogen 3.029 N/A TYR 74.A OH GLU 40.A OE1 no hydrogen 2.700 N/A ALA 75.A N SER 71.A O no hydrogen 2.858 N/A LEU 76.A N LEU 72.A O no hydrogen 2.998 N/A GLY 77.A N ASN 73.A O no hydrogen 3.168 N/A ALA 78.A N ALA 75.A O no hydrogen 3.400 N/A ASN 85.A N PHE 82.A O no hydrogen 3.408 N/A SER 88.A OG ASN 87.A O no hydrogen 2.436 N/A TYR 90.A OH SER 59.A O no hydrogen 3.028 N/A THR 93.A OG1 TYR 90.A O no hydrogen 3.359 N/A ILE 95.A N VAL 91.A O no hydrogen 2.813 N/A ALA 96.A N GLU 92.A O no hydrogen 3.017 N/A LYS 97.A N THR 93.A O no hydrogen 2.848 N/A LYS 97.A NZ PHE 68.A O no hydrogen 3.263 N/A CYS 98.A N ILE 94.A O no hydrogen 2.708 N/A CYS 98.A SG LEU 124.A O no hydrogen 3.529 N/A ILE 99.A N ILE 95.A O no hydrogen 2.881 N/A ASP 100.A N ALA 96.A O no hydrogen 2.956 N/A HIS 101.A N LYS 97.A O no hydrogen 2.979 N/A TYR 102.A N CYS 98.A O no hydrogen 2.776 N/A THR 103.A N ILE 99.A O no hydrogen 2.738 N/A THR 103.A OG1 GLU 150.A O no hydrogen 2.185 N/A LYS 104.A N ASP 100.A O no hydrogen 2.946 N/A GLN 105.A N HIS 101.A O no hydrogen 2.865 N/A CYS 106.A N TYR 102.A O no hydrogen 2.781 N/A CYS 106.A SG TYR 102.A O no hydrogen 3.137 N/A VAL 107.A N THR 103.A O no hydrogen 2.877 N/A GLU 108.A N LYS 104.A O no hydrogen 2.922 N/A ASN 109.A N GLN 105.A O no hydrogen 2.876 N/A ALA 110.A N VAL 107.A O no hydrogen 3.232 N/A LYS 118.A NZ GLU 108.A OE2 no hydrogen 2.845 N/A GLN 122.A N GLN 122.A OE1 no hydrogen 2.659 N/A ARG 123.A NE LEU 76.A O no hydrogen 2.552 N/A GLU 125.A N ASP 121.A O no hydrogen 3.487 N/A ILE 127.A N ARG 123.A O no hydrogen 2.942 N/A VAL 128.A N GLU 125.A O no hydrogen 3.276 N/A LYS 130.A N GLY 126.A O no hydrogen 3.015 N/A LYS 130.A NZ ASN 83.A O no hydrogen 3.156 N/A MET 131.A N ILE 127.A O no hydrogen 3.287 N/A PHE 132.A N VAL 128.A O no hydrogen 2.945 N/A GLN 133.A N LYS 130.A O no hydrogen 3.118 N/A GLN 133.A NE2 ASN 129.A O no hydrogen 3.338 N/A ARG 134.A N MET 131.A O no hydrogen 3.139 N/A LEU 136.A N PHE 132.A O no hydrogen 2.907 N/A ASP 137.A N GLN 133.A O no hydrogen 2.729 N/A ASP 138.A N ARG 134.A O no hydrogen 3.124 N/A LYS 140.A N CYS 135.A O no hydrogen 3.481 N/A ALA 144.A N LYS 140.A O no hydrogen 3.285 N/A ILE 145.A N TYR 141.A O no hydrogen 2.934 N/A GLY 146.A N LYS 142.A O no hydrogen 3.173 N/A ILE 147.A N GLN 143.A O no hydrogen 2.976 N/A ALA 148.A N ALA 144.A O no hydrogen 2.938 N/A LEU 149.A N ILE 145.A O no hydrogen 2.991 N/A LEU 149.A N GLY 146.A O no hydrogen 3.078 N/A GLU 150.A N GLY 146.A O no hydrogen 3.088 N/A THR 151.A N ILE 147.A O no hydrogen 2.979 N/A ARG 152.A NH1 LEU 149.A O no hydrogen 2.263 N/A VAL 156.A N ASP 155.A OD1 no hydrogen 2.354 N/A GLU 158.A N LEU 154.A O no hydrogen 3.059 N/A LYS 159.A N ASP 155.A O no hydrogen 3.121 N/A THR 160.A N VAL 156.A O no hydrogen 3.002 N/A THR 160.A OG1 PHE 157.A O no hydrogen 2.408 N/A ILE 161.A N PHE 157.A O no hydrogen 3.119 N/A LEU 162.A N LYS 159.A O no hydrogen 3.165 N/A GLU 163.A N THR 160.A O no hydrogen 3.258 N/A ASN 165.A ND2 HIS 139.A NE2 no hydrogen 3.471 N/A ALA 172.A N GLY 169.A O no hydrogen 2.933 N/A SER 174.A N MET 170.A O no hydrogen 3.090 N/A LEU 175.A N LEU 171.A O no hydrogen 2.979 N/A LYS 176.A N ALA 172.A O no hydrogen 3.175 N/A LEU 177.A N TYR 173.A O no hydrogen 2.991 N/A CYS 178.A N SER 174.A O no hydrogen 2.789 N/A CYS 178.A SG SER 174.A O no hydrogen 3.172 N/A MET 179.A N LEU 175.A O no hydrogen 2.746 N/A SER 180.A N LYS 176.A O no hydrogen 3.060 N/A LEU 181.A N LEU 177.A O no hydrogen 3.122 N/A GLN 183.A NE2 ASN 540.A OD1 no hydrogen 3.487 N/A ARG 188.A NH1 PHE 216.A O no hydrogen 3.135 N/A LYS 190.A NZ GLN 186.A OE1 no hydrogen 2.897 N/A VAL 191.A N PHE 187.A O no hydrogen 2.992 N/A LEU 192.A N ARG 188.A O no hydrogen 2.901 N/A ARG 193.A N ASN 189.A O no hydrogen 2.863 N/A LEU 195.A N LEU 192.A O no hydrogen 3.125 N/A LYS 197.A NZ ARG 193.A O no hydrogen 2.657 N/A ILE 198.A N VAL 194.A O no hydrogen 3.037 N/A TYR 199.A N LEU 195.A O no hydrogen 3.110 N/A MET 200.A N VAL 196.A O no hydrogen 3.089 N/A ASN 201.A N LYS 197.A O no hydrogen 2.955 N/A ASN 201.A ND2 LYS 197.A O no hydrogen 2.382 N/A LEU 202.A N TYR 199.A O no hydrogen 3.322 N/A ILE 208.A N ASP 206.A OD1 no hydrogen 3.408 N/A CYS 211.A N PHE 207.A O no hydrogen 2.932 N/A CYS 211.A SG ASP 245.A OD1 no hydrogen 3.219 N/A CYS 211.A SG ASP 245.A OD2 no hydrogen 3.287 N/A GLN 212.A N ILE 208.A O no hydrogen 2.940 N/A GLN 212.A NE2 ALA 172.A O no hydrogen 3.419 N/A CYS 213.A N ASN 209.A O no hydrogen 3.054 N/A CYS 213.A SG VAL 210.A O no hydrogen 3.183 N/A LEU 214.A N VAL 210.A O no hydrogen 2.994 N/A ILE 215.A N CYS 211.A O no hydrogen 3.197 N/A PHE 216.A N CYS 213.A O no hydrogen 3.251 N/A ASP 218.A N CYS 213.A O no hydrogen 3.344 N/A GLN 221.A N GLN 221.A OE1 no hydrogen 2.654 N/A SER 224.A OG GLN 221.A O no hydrogen 2.430 N/A ASP 225.A N GLN 221.A O no hydrogen 2.892 N/A ILE 226.A N ALA 222.A O no hydrogen 2.892 N/A LEU 227.A N VAL 223.A O no hydrogen 3.160 N/A GLU 228.A N SER 224.A O no hydrogen 3.166 N/A LYS 229.A N ASP 225.A O no hydrogen 3.067 N/A LEU 230.A N ILE 226.A O no hydrogen 2.980 N/A VAL 231.A N LEU 227.A O no hydrogen 2.771 N/A LYS 232.A N GLU 228.A O no hydrogen 2.855 N/A GLU 233.A N LYS 229.A O no hydrogen 2.844 N/A ASP 234.A N VAL 231.A O no hydrogen 3.115 N/A ASN 235.A N LEU 230.A O no hydrogen 2.921 N/A ALA 239.A N ASN 235.A OD1 no hydrogen 3.171 N/A TYR 240.A N LEU 237.A O no hydrogen 3.283 N/A CYS 243.A N ALA 239.A O no hydrogen 2.955 N/A CYS 243.A SG ALA 239.A O no hydrogen 3.131 N/A PHE 244.A N TYR 240.A O no hydrogen 3.227 N/A ASP 245.A N GLN 241.A O no hydrogen 2.947 N/A LEU 246.A N ILE 242.A O no hydrogen 2.888 N/A TYR 247.A N CYS 243.A O no hydrogen 3.077 N/A GLU 248.A N PHE 244.A O no hydrogen 2.737 N/A SER 249.A N ASP 245.A O no hydrogen 2.955 N/A SER 249.A OG ASP 245.A OD1 no hydrogen 3.539 N/A LEU 255.A N SER 251.A O no hydrogen 3.081 N/A SER 256.A N GLN 252.A O no hydrogen 2.757 N/A SER 257.A N GLN 253.A O no hydrogen 2.771 N/A SER 257.A OG GLN 253.A O no hydrogen 3.284 N/A SER 257.A OG PHE 254.A O no hydrogen 2.693 N/A VAL 258.A N PHE 254.A O no hydrogen 3.189 N/A ILE 259.A N LEU 255.A O no hydrogen 3.095 N/A GLN 260.A N SER 256.A O no hydrogen 3.165 N/A ASN 261.A N SER 257.A O no hydrogen 3.291 N/A LEU 262.A N VAL 258.A O no hydrogen 3.093 N/A ARG 263.A N ILE 259.A O no hydrogen 3.249 N/A ARG 263.A NH1 ILE 259.A O no hydrogen 3.137 N/A THR 264.A OG1 GLN 260.A O no hydrogen 2.794 N/A GLN 266.A N GLN 266.A OE1 no hydrogen 2.773 N/A LYS 269.A N ASP 265.A O no hydrogen 2.738 N/A MET 270.A N GLN 266.A O no hydrogen 2.986 N/A LYS 272.A N LEU 268.A O no hydrogen 3.025 N/A ILE 273.A N LYS 269.A O no hydrogen 2.821 N/A LEU 274.A N MET 270.A O no hydrogen 3.075 N/A SER 275.A N ILE 271.A O no hydrogen 3.076 N/A SER 275.A OG ILE 271.A O no hydrogen 2.713 N/A SER 275.A OG LYS 272.A O no hydrogen 3.281 N/A GLY 276.A N LYS 272.A O no hydrogen 3.123 N/A ILE 280.A N GLU 277.A O no hydrogen 2.991 N/A GLU 281.A N GLU 277.A O no hydrogen 3.031 N/A LEU 282.A N MET 278.A O no hydrogen 3.007 N/A HIS 283.A N ALA 279.A O no hydrogen 3.045 N/A LEU 284.A N ILE 280.A O no hydrogen 2.838 N/A GLN 285.A N GLU 281.A O no hydrogen 2.943 N/A PHE 286.A N LEU 282.A O no hydrogen 2.794 N/A LEU 287.A N HIS 283.A O no hydrogen 2.879 N/A ILE 288.A N LEU 284.A O no hydrogen 3.012 N/A ARG 289.A N GLN 285.A O no hydrogen 3.124 N/A ARG 289.A NE GLN 285.A OE1 no hydrogen 3.081 N/A ASN 290.A N PHE 286.A O no hydrogen 3.210 N/A MET 296.A N ASP 294.A OD1 no hydrogen 3.305 N/A LYS 299.A N LEU 295.A O no hydrogen 2.879 N/A ASN 300.A N MET 296.A O no hydrogen 2.950 N/A THR 301.A N ILE 297.A O no hydrogen 3.055 N/A THR 301.A OG1 ILE 297.A O no hydrogen 3.262 N/A THR 301.A OG1 LEU 298.A O no hydrogen 2.938 N/A LYS 302.A N LEU 298.A O no hydrogen 2.950 N/A ASP 303.A N LYS 299.A O no hydrogen 3.103 N/A VAL 305.A N LYS 302.A O no hydrogen 3.278 N/A ARG 306.A NH1 SER 308.A O no hydrogen 3.274 N/A ILE 316.A N THR 312.A O no hydrogen 2.971 N/A ALA 317.A N ALA 313.A O no hydrogen 3.130 N/A ASN 318.A N THR 314.A O no hydrogen 3.016 N/A SER 319.A N VAL 315.A O no hydrogen 2.995 N/A SER 319.A OG VAL 315.A O no hydrogen 3.166 N/A SER 319.A OG ILE 316.A O no hydrogen 2.859 N/A PHE 320.A N ALA 317.A O no hydrogen 3.211 N/A MET 321.A N ALA 317.A O no hydrogen 3.449 N/A HIS 322.A N ASN 318.A O no hydrogen 3.213 N/A CYS 323.A N PHE 320.A O no hydrogen 3.122 N/A CYS 323.A SG SER 319.A O no hydrogen 3.019 N/A CYS 323.A SG PHE 320.A O no hydrogen 3.534 N/A CYS 323.A SG VAL 355.A O no hydrogen 3.357 N/A GLY 324.A N ILE 356.A O no hydrogen 2.626 N/A THR 325.A N HIS 322.A O no hydrogen 3.114 N/A THR 325.A OG1 SER 327.A OG no hydrogen 2.515 N/A SER 327.A OG THR 325.A OG1 no hydrogen 2.515 N/A GLN 329.A N GLN 329.A OE1 no hydrogen 2.571 N/A ARG 332.A N GLN 329.A O no hydrogen 2.864 N/A ARG 332.A NH1 TYR 371.A OH no hydrogen 2.538 N/A ASP 333.A N GLN 329.A O no hydrogen 2.846 N/A ASN 334.A N PHE 330.A O no hydrogen 2.850 N/A GLU 336.A N GLU 336.A OE1 no hydrogen 2.734 N/A ALA 339.A N LEU 335.A O no hydrogen 2.774 N/A ARG 340.A N GLU 336.A O no hydrogen 3.048 N/A ARG 340.A N TRP 337.A O no hydrogen 3.285 N/A ARG 340.A NH1 ASN 307.A OD1 no hydrogen 3.492 N/A ALA 341.A N LEU 338.A O no hydrogen 3.180 N/A ALA 345.A N THR 342.A O no hydrogen 3.045 N/A THR 348.A N TRP 344.A O no hydrogen 3.060 N/A ALA 349.A N ALA 345.A O no hydrogen 2.753 N/A THR 350.A N LYS 346.A O no hydrogen 3.096 N/A ALA 351.A N PHE 347.A O no hydrogen 2.755 N/A SER 352.A N THR 348.A O no hydrogen 2.805 N/A SER 352.A OG THR 348.A O no hydrogen 3.138 N/A GLY 354.A N ALA 351.A O no hydrogen 3.065 N/A VAL 355.A N ALA 351.A O no hydrogen 3.255 N/A ILE 356.A N SER 352.A O no hydrogen 2.955 N/A HIS 357.A ND1 LEU 353.A O no hydrogen 2.532 N/A LYS 358.A N VAL 355.A O no hydrogen 3.282 N/A LYS 358.A NZ LEU 393.A O no hydrogen 2.968 N/A LEU 367.A N GLU 363.A O no hydrogen 2.884 N/A ALA 369.A N GLN 366.A O no hydrogen 3.478 N/A LYS 374.A N LEU 372.A O no hydrogen 2.582 N/A LYS 374.A NZ THR 370.A O no hydrogen 2.867 N/A LYS 374.A NZ LEU 372.A O no hydrogen 3.101 N/A SER 377.A OG SER 377.A O no hydrogen 2.435 N/A SER 380.A OG SER 380.A O no hydrogen 2.595 N/A GLN 383.A N SER 380.A O no hydrogen 2.420 N/A GLY 385.A N ALA 381.A O no hydrogen 3.023 N/A GLY 386.A N TYR 382.A O no hydrogen 2.959 N/A GLY 387.A N GLN 383.A O no hydrogen 2.980 N/A TYR 389.A N GLY 385.A O no hydrogen 3.202 N/A TYR 389.A OH PRO 719.A O no hydrogen 2.401 N/A ALA 390.A N GLY 386.A O no hydrogen 2.836 N/A LEU 391.A N GLY 387.A O no hydrogen 3.065 N/A GLY 392.A N LEU 388.A O no hydrogen 3.008 N/A GLY 392.A N TYR 389.A O no hydrogen 3.073 N/A LEU 393.A N TYR 389.A O no hydrogen 3.038 N/A HIS 395.A ND1 LEU 391.A O no hydrogen 2.262 N/A ILE 403.A N GLY 400.A O no hydrogen 2.928 N/A TYR 405.A N ASP 401.A O no hydrogen 2.959 N/A LEU 406.A N ILE 402.A O no hydrogen 2.897 N/A LEU 407.A N ILE 403.A O no hydrogen 2.963 N/A ASN 408.A N ASP 404.A O no hydrogen 2.895 N/A GLN 409.A N TYR 405.A O no hydrogen 3.447 N/A LEU 410.A N LEU 406.A O no hydrogen 2.909 N/A LYS 411.A N LEU 407.A O no hydrogen 3.120 N/A ASN 412.A N GLN 409.A O no hydrogen 3.324 N/A SER 414.A OG ASN 415.A O no hydrogen 3.315 N/A ARG 419.A N ASP 416.A O no hydrogen 2.764 N/A ARG 419.A NE THR 453.A OG1 no hydrogen 2.585 N/A ARG 419.A NH1 ASN 445.A O no hydrogen 2.238 N/A ARG 419.A NH2 ASN 445.A O no hydrogen 2.956 N/A ARG 419.A NH2 THR 453.A OG1 no hydrogen 2.793 N/A GLY 422.A N VAL 418.A O no hydrogen 2.810 N/A SER 423.A N ARG 419.A O no hydrogen 3.060 N/A SER 423.A OG ARG 419.A O no hydrogen 2.231 N/A GLY 425.A N GLY 421.A O no hydrogen 2.807 N/A LEU 426.A N GLY 422.A O no hydrogen 2.770 N/A GLY 427.A N SER 423.A O no hydrogen 2.729 N/A LEU 428.A N LEU 424.A O no hydrogen 2.841 N/A ALA 429.A N GLY 425.A O no hydrogen 3.178 N/A MET 431.A N LEU 428.A O no hydrogen 3.349 N/A GLY 432.A N LEU 463.A O no hydrogen 3.219 N/A THR 433.A N ALA 430.A O no hydrogen 2.990 N/A THR 433.A OG1 ALA 430.A O no hydrogen 2.444 N/A TYR 439.A N GLN 436.A O no hydrogen 2.812 N/A TYR 439.A OH GLN 472.A O no hydrogen 3.134 N/A LEU 441.A N ASP 437.A O no hydrogen 2.917 N/A LEU 442.A N VAL 438.A O no hydrogen 3.017 N/A LYS 443.A N ASP 440.A O no hydrogen 2.683 N/A LYS 443.A NZ TYR 439.A O no hydrogen 3.458 N/A THR 444.A N ASP 440.A O no hydrogen 3.291 N/A ASN 445.A N LEU 441.A O no hydrogen 3.118 N/A LEU 446.A N LEU 442.A O no hydrogen 2.745 N/A TYR 447.A N LYS 443.A O no hydrogen 3.177 N/A GLN 448.A N ASN 445.A O no hydrogen 3.327 N/A GLN 448.A NE2 ASN 415.A OD1 no hydrogen 3.647 N/A ALA 451.A N ASP 450.A OD1 no hydrogen 2.456 N/A GLY 454.A N ALA 451.A O no hydrogen 2.589 N/A ALA 457.A N THR 453.A O no hydrogen 3.272 N/A GLY 458.A N GLY 454.A O no hydrogen 3.206 N/A LEU 459.A N GLU 455.A O no hydrogen 3.052 N/A ALA 460.A N ALA 456.A O no hydrogen 3.138 N/A LEU 461.A N ALA 457.A O no hydrogen 2.957 N/A GLY 462.A N GLY 458.A O no hydrogen 3.043 N/A LEU 463.A N LEU 459.A O no hydrogen 3.010 N/A LEU 463.A N ALA 460.A O no hydrogen 3.224 N/A VAL 464.A N ALA 460.A O no hydrogen 3.141 N/A LEU 466.A N LEU 463.A O no hydrogen 3.267 N/A GLY 467.A N VAL 500.A O no hydrogen 3.086 N/A SER 468.A N MET 465.A O no hydrogen 2.934 N/A SER 468.A OG MET 465.A O no hydrogen 2.421 N/A LYS 469.A NZ GLU 507.A OE1 no hydrogen 3.388 N/A ALA 471.A N ASN 470.A OD1 no hydrogen 2.439 N/A GLN 472.A N GLN 472.A OE1 no hydrogen 2.629 N/A GLU 475.A N ALA 471.A O no hydrogen 2.963 N/A ASP 476.A N GLN 472.A O no hydrogen 2.912 N/A MET 477.A N ALA 473.A O no hydrogen 2.988 N/A VAL 478.A N ILE 474.A O no hydrogen 2.848 N/A GLY 479.A N ASP 476.A O no hydrogen 3.227 N/A TYR 480.A N ASP 476.A O no hydrogen 2.964 N/A GLN 482.A NE2 VAL 478.A O no hydrogen 2.770 N/A GLU 483.A N GLU 483.A OE1 no hydrogen 2.554 N/A HIS 486.A N THR 484.A OG1 no hydrogen 3.413 N/A GLU 487.A N GLU 487.A OE1 no hydrogen 2.592 N/A LYS 488.A NZ GLU 487.A OE2 no hydrogen 3.109 N/A ARG 491.A N GLU 487.A O no hydrogen 3.020 N/A ARG 491.A NE GLU 455.A OE2 no hydrogen 2.778 N/A ARG 491.A NH2 GLU 455.A OE2 no hydrogen 2.571 N/A GLY 492.A N LYS 488.A O no hydrogen 2.789 N/A LEU 493.A N ILE 489.A O no hydrogen 3.018 N/A ALA 494.A N LEU 490.A O no hydrogen 2.777 N/A VAL 495.A N ARG 491.A O no hydrogen 3.010 N/A GLY 496.A N GLY 492.A O no hydrogen 2.828 N/A ILE 497.A N LEU 493.A O no hydrogen 2.832 N/A ALA 498.A N ALA 494.A O no hydrogen 2.988 N/A LEU 499.A N VAL 495.A O no hydrogen 2.682 N/A VAL 500.A N GLY 496.A O no hydrogen 3.189 N/A GLY 503.A N MET 533.A O no hydrogen 2.717 N/A MET 505.A N ALA 534.A O no hydrogen 3.053 N/A GLU 506.A N GLU 506.A OE1 no hydrogen 2.677 N/A GLU 507.A N ARG 504.A O no hydrogen 2.961 N/A ASP 509.A N GLU 506.A O no hydrogen 3.303 N/A ILE 512.A N ALA 508.A O no hydrogen 2.925 N/A GLU 513.A N ASP 509.A O no hydrogen 2.981 N/A LEU 515.A N LEU 511.A O no hydrogen 2.906 N/A CYS 516.A N ILE 512.A O no hydrogen 2.918 N/A ARG 517.A N GLU 513.A O no hydrogen 2.999 N/A ARG 517.A NE GLU 513.A OE2 no hydrogen 2.553 N/A ASP 518.A N SER 514.A O no hydrogen 3.265 N/A LYS 519.A N ASP 518.A OD1 no hydrogen 2.707 N/A LEU 523.A N ASP 520.A OD2 no hydrogen 3.273 N/A ARG 524.A N ASP 520.A O no hydrogen 2.888 N/A ARG 525.A N PRO 521.A O no hydrogen 2.929 N/A SER 526.A N ILE 522.A O no hydrogen 2.869 N/A SER 526.A OG ALA 494.A O no hydrogen 2.844 N/A GLY 527.A N LEU 523.A O no hydrogen 2.983 N/A MET 528.A N ARG 524.A O no hydrogen 2.968 N/A MET 528.A N ARG 525.A O no hydrogen 3.200 N/A TYR 529.A N ARG 525.A O no hydrogen 3.213 N/A THR 530.A N SER 526.A O no hydrogen 2.897 N/A THR 530.A OG1 SER 526.A O no hydrogen 2.269 N/A VAL 531.A N GLY 527.A O no hydrogen 2.835 N/A ALA 532.A N MET 528.A O no hydrogen 2.952 N/A MET 533.A N TYR 529.A O no hydrogen 3.062 N/A ALA 534.A N THR 530.A O no hydrogen 3.065 N/A TYR 535.A N VAL 531.A O no hydrogen 3.085 N/A TYR 535.A OH ASP 509.A OD1 no hydrogen 3.297 N/A TYR 535.A OH ASP 509.A OD2 no hydrogen 2.724 N/A CYS 536.A SG ALA 532.A O no hydrogen 3.073 N/A CYS 536.A SG PHE 569.A O no hydrogen 3.408 N/A SER 538.A N TYR 535.A O no hydrogen 2.945 N/A ASN 540.A N SER 538.A OG no hydrogen 3.328 N/A ARG 545.A N ASN 541.A O no hydrogen 3.231 N/A LEU 547.A N ALA 543.A O no hydrogen 2.947 N/A LEU 548.A N ILE 544.A O no hydrogen 3.254 N/A HIS 549.A N ARG 545.A O no hydrogen 3.127 N/A VAL 550.A N ARG 546.A O no hydrogen 2.957 N/A ALA 551.A N LEU 547.A O no hydrogen 3.259 N/A VAL 552.A N HIS 549.A O no hydrogen 2.867 N/A SER 553.A N HIS 549.A O no hydrogen 3.065 N/A SER 553.A OG HIS 549.A O no hydrogen 3.354 N/A VAL 555.A N ASP 554.A OD1 no hydrogen 2.741 N/A ASP 558.A N ASN 556.A OD1 no hydrogen 3.293 N/A ARG 560.A N ASN 556.A O no hydrogen 3.259 N/A ARG 560.A NH1 VAL 552.A O no hydrogen 2.492 N/A ARG 560.A NH1 ASP 554.A O no hydrogen 3.321 N/A ARG 561.A N ASP 557.A O no hydrogen 2.797 N/A ARG 561.A NH1 GLN 713.A OE1 no hydrogen 2.839 N/A ALA 562.A N ASP 558.A O no hydrogen 3.020 N/A ALA 563.A N VAL 559.A O no hydrogen 2.786 N/A VAL 564.A N ARG 560.A O no hydrogen 3.040 N/A GLU 565.A N ARG 561.A O no hydrogen 2.992 N/A SER 566.A OG MET 528.A O no hydrogen 3.366 N/A SER 566.A OG ALA 562.A O no hydrogen 3.235 N/A GLY 568.A N GLU 565.A O no hydrogen 3.064 N/A PHE 569.A N SER 566.A O no hydrogen 3.035 N/A ILE 570.A N SER 566.A O no hydrogen 2.970 N/A LEU 571.A N LEU 567.A O no hydrogen 3.188 N/A THR 574.A N LEU 571.A O no hydrogen 2.824 N/A CYS 578.A N PRO 575.A O no hydrogen 3.366 N/A SER 580.A N GLN 577.A O no hydrogen 3.064 N/A SER 580.A OG GLN 577.A O no hydrogen 2.439 N/A VAL 581.A N GLN 577.A O no hydrogen 3.065 N/A VAL 582.A N CYS 578.A O no hydrogen 2.886 N/A SER 586.A N SER 583.A O no hydrogen 3.485 N/A SER 586.A OG SER 583.A O no hydrogen 2.866 N/A SER 586.A OG GLU 587.A OE2 no hydrogen 3.531 N/A GLU 587.A N LEU 584.A O no hydrogen 2.644 N/A SER 588.A OG ASN 590.A O no hydrogen 3.336 N/A SER 588.A OG ASN 590.A OD1 no hydrogen 3.396 N/A ARG 594.A NH1 SER 588.A O no hydrogen 2.419 N/A ARG 594.A NH1 TYR 589.A O no hydrogen 2.719 N/A ARG 594.A NH2 ASP 623.A OD2 no hydrogen 2.966 N/A TYR 595.A N PRO 591.A O no hydrogen 2.767 N/A GLY 596.A N HIS 592.A O no hydrogen 2.980 N/A ALA 597.A N VAL 593.A O no hydrogen 2.987 N/A ALA 598.A N ARG 594.A O no hydrogen 3.136 N/A MET 599.A N TYR 595.A O no hydrogen 2.894 N/A ALA 600.A N GLY 596.A O no hydrogen 2.859 N/A LEU 601.A N ALA 597.A O no hydrogen 2.923 N/A GLY 602.A N ALA 598.A O no hydrogen 2.981 N/A ILE 603.A N MET 599.A O no hydrogen 2.942 N/A CYS 604.A N ALA 600.A O no hydrogen 3.011 N/A CYS 604.A SG LEU 571.A O no hydrogen 3.457 N/A CYS 605.A N LEU 601.A O no hydrogen 3.354 N/A CYS 605.A SG PRO 575.A O no hydrogen 3.248 N/A THR 608.A N CYS 605.A O no hydrogen 2.792 N/A THR 608.A OG1 CYS 605.A O no hydrogen 2.613 N/A GLU 612.A N ASN 610.A OD1 no hydrogen 2.842 N/A ASN 615.A N LYS 611.A O no hydrogen 2.926 N/A LEU 616.A N GLU 612.A O no hydrogen 2.988 N/A LEU 617.A N ALA 613.A O no hydrogen 2.949 N/A GLU 618.A N ASN 615.A O no hydrogen 3.302 N/A ASN 622.A N PRO 619.A O no hydrogen 3.060 N/A ASP 623.A N MET 620.A O no hydrogen 3.262 N/A VAL 625.A N ASP 623.A OD2 no hydrogen 3.026 N/A ARG 629.A NH1 ASP 623.A O no hydrogen 3.042 N/A ARG 629.A NH1 PRO 624.A O no hydrogen 2.633 N/A GLN 630.A N ASN 626.A O no hydrogen 2.980 N/A GLY 631.A N TYR 627.A O no hydrogen 2.838 N/A ALA 632.A N VAL 628.A O no hydrogen 2.964 N/A LEU 633.A N ARG 629.A O no hydrogen 2.807 N/A LEU 633.A N GLN 630.A O no hydrogen 2.846 N/A ILE 634.A N GLN 630.A O no hydrogen 2.945 N/A ALA 635.A N GLY 631.A O no hydrogen 2.951 N/A SER 636.A N ALA 632.A O no hydrogen 3.067 N/A ALA 637.A N LEU 633.A O no hydrogen 3.108 N/A LEU 638.A N ILE 634.A O no hydrogen 2.965 N/A ILE 639.A N ALA 635.A O no hydrogen 3.004 N/A GLN 642.A NE2 HIS 687.A O no hydrogen 3.644 N/A GLN 642.A NE2 THR 731.A OG1 no hydrogen 2.507 N/A GLN 643.A N MET 640.A O no hydrogen 2.816 N/A GLN 643.A NE2 THR 608.A O no hydrogen 3.034 N/A THR 647.A N THR 644.A O no hydrogen 3.024 N/A THR 647.A OG1 THR 644.A O no hydrogen 2.310 N/A CYS 648.A N THR 647.A OG1 no hydrogen 2.661 N/A VAL 651.A N CYS 648.A O no hydrogen 3.501 N/A ASN 652.A N GLU 645.A OE1 no hydrogen 3.033 N/A PHE 654.A N LYS 650.A O no hydrogen 2.907 N/A ARG 655.A N VAL 651.A O no hydrogen 2.823 N/A ARG 655.A NH1 ASP 683.A OD1 no hydrogen 3.134 N/A GLN 656.A N ASN 652.A O no hydrogen 2.912 N/A LEU 657.A N GLN 653.A O no hydrogen 3.195 N/A TYR 658.A N PHE 654.A O no hydrogen 2.869 N/A TYR 658.A N ARG 655.A O no hydrogen 3.197 N/A SER 659.A N ARG 655.A O no hydrogen 3.436 N/A LYS 660.A N GLN 656.A O no hydrogen 3.044 N/A VAL 661.A N LEU 657.A O no hydrogen 3.238 N/A ILE 662.A N TYR 658.A O no hydrogen 3.139 N/A ASN 663.A N SER 659.A O no hydrogen 3.002 N/A ASN 663.A ND2 ASN 300.A O no hydrogen 3.387 N/A HIS 666.A N ASP 664.A OD1 no hydrogen 3.306 N/A LYS 672.A N ASP 668.A O no hydrogen 3.101 N/A LYS 672.A NZ ASP 664.A O no hydrogen 2.950 N/A PHE 673.A N MET 670.A O no hydrogen 2.891 N/A ALA 675.A N LYS 672.A O no hydrogen 3.182 N/A LEU 677.A N PHE 673.A O no hydrogen 3.138 N/A ALA 678.A N GLY 674.A O no hydrogen 2.901 N/A GLN 679.A N ALA 675.A O no hydrogen 2.946 N/A GLY 680.A N ILE 676.A O no hydrogen 3.045 N/A ILE 681.A N LEU 677.A O no hydrogen 2.891 N/A LEU 682.A N ALA 678.A O no hydrogen 2.929 N/A ASP 683.A N GLN 679.A O no hydrogen 3.324 N/A ALA 684.A N ILE 681.A O no hydrogen 2.973 N/A GLY 685.A N PHE 320.A O no hydrogen 2.713 N/A HIS 687.A N ASP 683.A O no hydrogen 2.953 N/A HIS 687.A N ALA 684.A O no hydrogen 3.201 N/A ASN 688.A N GLY 685.A O no hydrogen 3.046 N/A ASN 688.A ND2 ASN 290.A O no hydrogen 3.298 N/A THR 690.A N THR 729.A O no hydrogen 3.138 N/A SER 692.A OG THR 729.A OG1 no hydrogen 2.692 N/A GLN 694.A NE2 SER 695.A O no hydrogen 3.330 N/A SER 695.A N HIS 699.A O no hydrogen 3.208 N/A SER 695.A OG THR 697.A OG1 no hydrogen 2.905 N/A SER 695.A OG HIS 699.A O no hydrogen 2.468 N/A THR 697.A OG1 SER 695.A OG no hydrogen 2.905 N/A GLY 698.A N SER 695.A O no hydrogen 3.214 N/A HIS 699.A N SER 695.A OG no hydrogen 3.233 N/A THR 700.A OG1 TYR 502.A OH no hydrogen 3.120 N/A THR 700.A OG1 LEU 693.A O no hydrogen 3.355 N/A HIS 701.A N LEU 693.A O no hydrogen 3.259 N/A SER 704.A OG SER 692.A O no hydrogen 3.426 N/A SER 704.A OG ALA 727.A O no hydrogen 3.451 N/A VAL 705.A N HIS 701.A O no hydrogen 3.272 N/A VAL 706.A N MET 702.A O no hydrogen 2.852 N/A GLY 707.A N PRO 703.A O no hydrogen 2.825 N/A VAL 708.A N SER 704.A O no hydrogen 2.960 N/A LEU 709.A N VAL 705.A O no hydrogen 2.932 N/A VAL 710.A N VAL 706.A O no hydrogen 3.238 N/A PHE 711.A N GLY 707.A O no hydrogen 3.093 N/A THR 712.A OG1 LEU 709.A O no hydrogen 2.501 N/A LEU 720.A N TRP 717.A O no hydrogen 3.318 N/A SER 721.A N PHE 718.A O no hydrogen 3.068 N/A SER 721.A OG PHE 718.A O no hydrogen 2.936 N/A HIS 722.A N PRO 719.A O no hydrogen 2.866 N/A PHE 723.A N LEU 720.A O no hydrogen 3.183 N/A SER 725.A N HIS 722.A O no hydrogen 3.171 N/A SER 725.A OG HIS 722.A O no hydrogen 2.744 N/A LEU 726.A N PHE 723.A O no hydrogen 3.252 N/A ALA 727.A N LEU 724.A O no hydrogen 2.981 N/A TYR 728.A N SER 725.A O no hydrogen 3.192 N/A THR 729.A N THR 690.A O no hydrogen 2.503 N/A THR 729.A OG1 THR 690.A O no hydrogen 3.176 N/A THR 729.A OG1 SER 692.A OG no hydrogen 2.692 N/A THR 731.A OG1 ASN 688.A O no hydrogen 2.848 N/A THR 731.A OG1 VAL 773.A O no hydrogen 3.482 N/A VAL 733.A N ALA 771.A O no hydrogen 2.991 N/A ILE 734.A N GLY 799.A O no hydrogen 2.844 N/A LYS 738.A N ASN 737.A OD1 no hydrogen 2.361 N/A LYS 738.A NZ ASP 739.A OD2 no hydrogen 2.952 N/A LYS 741.A N ASP 739.A OD1 no hydrogen 2.511 N/A LYS 741.A NZ TYR 789.A OH no hydrogen 2.840 N/A THR 755.A N LYS 752.A O no hydrogen 3.135 N/A THR 755.A OG1 LYS 752.A O no hydrogen 2.568 N/A TYR 758.A OH GLN 777.A OE1 no hydrogen 2.973 N/A LYS 765.A NZ ARG 772.A O no hydrogen 2.841 N/A GLN 777.A N MET 774.A O no hydrogen 2.929 N/A GLN 777.A NE2 THR 755.A O no hydrogen 2.747 N/A THR 782.A N LYS 748.A O no hydrogen 3.255 N/A CYS 787.A SG TYR 789.A O no hydrogen 3.828 N/A GLN 790.A N LYS 804.A O no hydrogen 2.688 N/A GLN 790.A NE2 PRO 784.A O no hydrogen 3.493 N/A GLN 790.A NE2 CYS 787.A O no hydrogen 3.513 N/A GLY 799.A N CYS 732.A O no hydrogen 2.434 N/A LEU 803.A N ASN 737.A O no hydrogen 3.529 N/A LYS 804.A N GLN 790.A O no hydrogen 2.826 N/A THR 806.A N ARG 788.A O no hydrogen 2.635 N/A THR 806.A OG1 ARG 788.A O no hydrogen 2.429 N/A