Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3bk7_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): MET 5.A N LEU 75.A O no hydrogen 2.434 N/A ILE 7.A N VAL 73.A O no hydrogen 2.918 N/A ALA 8.A N GLU 52.A OE1 no hydrogen 2.877 N/A VAL 9.A N SER 71.A O no hydrogen 3.108 N/A ILE 10.A N ASN 90.A O no hydrogen 3.143 N/A TYR 12.A OH PRO 48.A O no hydrogen 2.944 N/A LYS 14.A N ASP 11.A O no hydrogen 2.892 N/A LYS 14.A NZ ASN 68.A O no hydrogen 3.246 N/A CYS 15.A N TYR 12.A O no hydrogen 2.809 N/A LYS 19.A N ASN 16.A O no hydrogen 2.932 N/A CYS 20.A SG PRO 17.A O no hydrogen 3.559 N/A ARG 27.A NH1 HIS 22.A O no hydrogen 3.300 N/A VAL 28.A N LEU 24.A O no hydrogen 2.886 N/A CYS 29.A N CYS 25.A O no hydrogen 2.656 N/A CYS 29.A SG ASN 32.A OD1 no hydrogen 3.156 N/A ASN 32.A ND2 ILE 39.A O no hydrogen 2.699 N/A ARG 33.A N CYS 29.A O no hydrogen 2.845 N/A MET 34.A N PRO 30.A O no hydrogen 3.100 N/A MET 34.A N VAL 31.A O no hydrogen 3.171 N/A GLY 35.A N ASN 32.A O no hydrogen 3.191 N/A ALA 38.A N ASN 32.A OD1 no hydrogen 3.092 N/A ILE 39.A N ASN 32.A OD1 no hydrogen 3.244 N/A ILE 40.A N ILE 49.A O no hydrogen 2.651 N/A ASP 42.A N LYS 47.A O no hydrogen 2.863 N/A GLU 44.A N ASP 42.A O no hydrogen 2.804 N/A ASN 45.A N ASP 42.A OD2 no hydrogen 3.351 N/A ASN 45.A ND2 ASP 42.A OD1 no hydrogen 3.150 N/A TYR 46.A OH ASP 18.A OD1 no hydrogen 3.360 N/A LYS 47.A N ASP 42.A O no hydrogen 3.336 N/A ILE 49.A N ILE 40.A O no hydrogen 2.616 N/A ILE 50.A N ASN 90.A OD1 no hydrogen 3.109 N/A GLN 51.A N ALA 38.A O no hydrogen 2.639 N/A SER 54.A N GLN 51.A O no hydrogen 2.634 N/A SER 54.A OG GLU 37.A O no hydrogen 3.514 N/A CYS 58.A N THR 56.A OG1 no hydrogen 3.147 N/A HIS 63.A N GLY 59.A O no hydrogen 3.386 N/A LYS 64.A N ILE 60.A O no hydrogen 3.039 N/A CYS 65.A N CYS 61.A O no hydrogen 3.063 N/A SER 71.A N VAL 9.A O no hydrogen 3.032 N/A SER 71.A OG GLU 290.A OE2 no hydrogen 3.469 N/A VAL 73.A N ILE 7.A O no hydrogen 3.001 N/A LEU 75.A N MET 5.A O no hydrogen 2.750 N/A GLU 81.A N GLN 78.A O no hydrogen 3.026 N/A ASP 82.A N LEU 79.A O no hydrogen 2.675 N/A VAL 84.A N LEU 94.A O no hydrogen 2.908 N/A HIS 85.A N LEU 94.A O no hydrogen 3.313 N/A ARG 86.A N ASN 130.A OD1 no hydrogen 3.371 N/A ARG 86.A NE ALA 91.A O no hydrogen 3.156 N/A ARG 86.A NH1 GLU 52.A OE1 no hydrogen 2.752 N/A ARG 86.A NH1 ALA 91.A O no hydrogen 3.518 N/A TYR 87.A N PHE 92.A O no hydrogen 2.915 N/A TYR 87.A OH THR 118.A OG1 no hydrogen 2.877 N/A ASN 90.A ND2 ALA 8.A O no hydrogen 3.257 N/A ASN 90.A ND2 ILE 50.A O no hydrogen 3.279 N/A ALA 91.A N GLY 88.A O no hydrogen 2.960 N/A VAL 93.A N VAL 293.A O no hydrogen 3.038 N/A LEU 94.A N HIS 85.A O no hydrogen 2.675 N/A TYR 95.A N GLY 295.A O no hydrogen 2.766 N/A ARG 96.A N ASP 82.A O no hydrogen 3.009 N/A ARG 96.A NE ASP 82.A OD1 no hydrogen 3.001 N/A ARG 96.A NH1 ASP 82.A OD1 no hydrogen 3.460 N/A LYS 101.A NZ GLU 149.A OE1 no hydrogen 3.478 N/A MET 104.A N LYS 101.A O no hydrogen 3.166 N/A VAL 105.A N ASP 282.A OD2 no hydrogen 2.825 N/A VAL 106.A N VAL 267.A O no hydrogen 2.831 N/A GLY 107.A N VAL 283.A O no hydrogen 2.833 N/A ILE 108.A N VAL 269.A O no hydrogen 2.749 N/A VAL 109.A N HIS 285.A O no hydrogen 2.996 N/A THR 114.A OG1 PRO 111.A O no hydrogen 2.674 N/A LYS 116.A NZ PRO 111.A O no hydrogen 3.463 N/A LYS 116.A NZ ASN 112.A OD1 no hydrogen 3.071 N/A THR 117.A OG1 GLN 169.A OE1 no hydrogen 2.608 N/A THR 117.A OG1 ASP 239.A OD2 no hydrogen 2.560 N/A THR 118.A OG1 TYR 87.A OH no hydrogen 2.877 N/A ALA 119.A N GLY 115.A O no hydrogen 2.938 N/A VAL 120.A N LYS 116.A O no hydrogen 3.390 N/A LYS 121.A N THR 117.A O no hydrogen 3.248 N/A LYS 121.A NZ GLN 126.A OE1 no hydrogen 3.326 N/A ILE 122.A N THR 118.A O no hydrogen 3.384 N/A LEU 123.A N ALA 119.A O no hydrogen 3.151 N/A ALA 124.A N VAL 120.A O no hydrogen 3.027 N/A GLY 125.A N ILE 122.A O no hydrogen 3.041 N/A LEU 127.A N LYS 121.A O no hydrogen 2.926 N/A ASN 130.A ND2 ARG 86.A O no hydrogen 2.772 N/A LEU 131.A N VAL 84.A O no hydrogen 3.093 N/A GLU 133.A N ASN 130.A O no hydrogen 2.702 N/A ASN 135.A ND2 SER 137.A O no hydrogen 3.532 N/A ASN 140.A N SER 137.A OG no hydrogen 3.203 N/A ILE 142.A N TRP 138.A O no hydrogen 2.745 N/A ARG 143.A N ASP 139.A O no hydrogen 2.955 N/A ALA 144.A N ASN 140.A O no hydrogen 3.105 N/A PHE 145.A N VAL 141.A O no hydrogen 2.991 N/A ARG 146.A N ARG 143.A O no hydrogen 3.071 N/A GLY 147.A N GLN 151.A OE1 no hydrogen 2.934 N/A ASN 148.A N PHE 145.A O no hydrogen 3.046 N/A GLN 151.A N ASN 148.A O no hydrogen 3.126 N/A GLN 151.A NE2 ILE 142.A O no hydrogen 3.451 N/A TYR 153.A OH LEU 123.A O no hydrogen 2.660 N/A PHE 154.A N LEU 150.A O no hydrogen 2.940 N/A GLU 155.A N GLN 151.A O no hydrogen 3.165 N/A ARG 156.A N ASN 152.A O no hydrogen 3.009 N/A LEU 157.A N TYR 153.A O no hydrogen 2.726 N/A LYS 158.A N PHE 154.A O no hydrogen 2.992 N/A LYS 158.A NZ ASP 139.A OD1 no hydrogen 2.594 N/A ASN 159.A N GLU 155.A O no hydrogen 3.064 N/A GLY 160.A N ARG 156.A O no hydrogen 3.131 N/A GLU 161.A N ARG 156.A O no hydrogen 3.198 N/A VAL 165.A N PHE 235.A O no hydrogen 2.922 N/A LYS 167.A N PHE 237.A O no hydrogen 2.876 N/A LYS 167.A NZ PRO 168.A O no hydrogen 2.770 N/A LYS 167.A NZ GLN 221.A OE1 no hydrogen 3.151 N/A LYS 167.A NZ ASP 239.A O no hydrogen 2.867 N/A LEU 174.A N VAL 171.A O no hydrogen 3.184 N/A VAL 178.A N LEU 174.A O no hydrogen 3.345 N/A VAL 182.A N ARG 210.A O no hydrogen 3.073 N/A ARG 183.A N LEU 208.A O no hydrogen 2.908 N/A ARG 183.A NH2 ASP 209.A OD2 no hydrogen 2.878 N/A LEU 186.A N VAL 182.A O no hydrogen 3.368 N/A LYS 187.A N ARG 183.A O no hydrogen 3.280 N/A LYS 187.A N GLU 184.A O no hydrogen 2.952 N/A LYS 188.A N GLU 184.A O no hydrogen 3.201 N/A VAL 189.A N LEU 185.A O no hydrogen 3.073 N/A ASP 190.A N LYS 187.A O no hydrogen 3.049 N/A GLU 191.A N LEU 230.A O no hydrogen 2.725 N/A GLY 193.A N ASP 190.A OD1 no hydrogen 3.074 N/A LYS 194.A N ASP 190.A OD2 no hydrogen 3.247 N/A LYS 194.A NZ GLU 197.A OE2 no hydrogen 3.508 N/A VAL 198.A N LYS 194.A O no hydrogen 3.195 N/A VAL 199.A N PHE 195.A O no hydrogen 3.331 N/A LYS 200.A N GLU 196.A O no hydrogen 2.914 N/A LYS 200.A N GLU 197.A O no hydrogen 3.130 N/A GLU 201.A N GLU 197.A O no hydrogen 2.866 N/A LEU 202.A N VAL 198.A O no hydrogen 3.025 N/A GLU 203.A N LYS 200.A O no hydrogen 2.676 N/A LEU 204.A N VAL 199.A O no hydrogen 2.583 N/A GLU 205.A N GLU 205.A OE1 no hydrogen 2.548 N/A LEU 208.A N LEU 204.A O no hydrogen 3.258 N/A ARG 210.A N VAL 207.A O no hydrogen 2.679 N/A ARG 210.A NH1 GLN 214.A O no hydrogen 2.620 N/A LEU 212.A N GLY 180.A O no hydrogen 3.424 N/A GLN 214.A N GLU 211.A O no hydrogen 2.813 N/A LEU 215.A N LEU 212.A O no hydrogen 3.246 N/A SER 216.A N GLU 219.A OE1 no hydrogen 3.002 N/A GLU 219.A N SER 216.A OG no hydrogen 3.389 N/A LEU 220.A N SER 216.A O no hydrogen 2.816 N/A GLN 221.A N GLY 217.A O no hydrogen 2.788 N/A GLN 221.A NE2 GLU 240.A O no hydrogen 3.585 N/A GLN 221.A NE2 SER 243.A O no hydrogen 2.816 N/A ARG 222.A N GLY 218.A O no hydrogen 2.964 N/A ARG 222.A NE GLY 218.A O no hydrogen 3.394 N/A ARG 222.A NH1 LEU 202.A O no hydrogen 3.234 N/A VAL 223.A N GLU 219.A O no hydrogen 2.815 N/A ALA 224.A N LEU 220.A O no hydrogen 3.114 N/A ALA 224.A N GLN 221.A O no hydrogen 2.887 N/A ILE 225.A N GLN 221.A O no hydrogen 3.053 N/A ALA 226.A N ARG 222.A O no hydrogen 2.972 N/A ALA 227.A N VAL 223.A O no hydrogen 3.021 N/A ALA 228.A N ALA 224.A O no hydrogen 3.172 N/A ALA 228.A N ILE 225.A O no hydrogen 3.122 N/A LEU 229.A N ILE 225.A O no hydrogen 3.107 N/A LEU 230.A N ALA 226.A O no hydrogen 3.053 N/A ARG 231.A N ALA 228.A O no hydrogen 3.309 N/A LYS 232.A N GLU 191.A OE1 no hydrogen 2.845 N/A ALA 233.A N TYR 236.A OH no hydrogen 3.200 N/A HIS 234.A NE2 ASP 102.A OD1 no hydrogen 3.085 N/A TYR 236.A N ALA 266.A O no hydrogen 3.249 N/A TYR 236.A OH ARG 231.A O no hydrogen 2.980 N/A TYR 236.A OH ALA 233.A O no hydrogen 3.339 N/A PHE 237.A N VAL 165.A O no hydrogen 2.823 N/A PHE 238.A N LEU 268.A O no hydrogen 2.817 N/A ASP 239.A N LYS 167.A O no hydrogen 3.067 N/A GLU 240.A N VAL 270.A O no hydrogen 3.163 N/A SER 242.A N GLU 271.A OE2 no hydrogen 3.095 N/A SER 243.A N GLU 240.A O no hydrogen 3.264 N/A SER 243.A OG GLU 240.A O no hydrogen 3.347 N/A TYR 244.A OH ASP 172.A OD1 no hydrogen 2.754 N/A LEU 245.A N SER 242.A O no hydrogen 3.155 N/A ILE 247.A N HIS 516.A ND1 no hydrogen 2.941 N/A GLN 249.A N ASP 246.A OD1 no hydrogen 2.780 N/A ARG 250.A N ASP 246.A O no hydrogen 2.979 N/A ARG 250.A NE LEU 245.A O no hydrogen 3.307 N/A ARG 250.A NH1 ASP 273.A OD2 no hydrogen 2.462 N/A ARG 250.A NH2 LEU 245.A O no hydrogen 2.964 N/A LYS 252.A N ARG 248.A O no hydrogen 3.057 N/A VAL 253.A N GLN 249.A O no hydrogen 2.995 N/A ALA 254.A N ARG 250.A O no hydrogen 3.432 N/A ARG 255.A NH1 GLU 576.A OE2 no hydrogen 3.292 N/A ARG 255.A NH2 GLY 559.A O no hydrogen 3.548 N/A VAL 256.A N LYS 252.A O no hydrogen 3.264 N/A ILE 257.A N VAL 253.A O no hydrogen 2.694 N/A ARG 258.A N ALA 254.A O no hydrogen 2.699 N/A ARG 258.A NH1 ASP 282.A OD1 no hydrogen 3.011 N/A ARG 258.A NH1 ASP 282.A OD2 no hydrogen 3.020 N/A ARG 258.A NH2 ASP 282.A OD1 no hydrogen 2.538 N/A ARG 259.A NE GLU 576.A OE1 no hydrogen 2.999 N/A ARG 259.A NH2 GLU 576.A OE1 no hydrogen 3.374 N/A ARG 259.A NH2 GLU 576.A OE2 no hydrogen 2.781 N/A LEU 260.A N ILE 257.A O no hydrogen 2.784 N/A ALA 261.A N ARG 258.A O no hydrogen 2.920 N/A GLU 263.A N ARG 259.A O no hydrogen 3.395 N/A GLY 264.A N ALA 261.A O no hydrogen 2.809 N/A LYS 265.A N LEU 260.A O no hydrogen 3.086 N/A LYS 265.A NZ TYR 236.A OH no hydrogen 3.259 N/A LYS 265.A NZ GLU 263.A OE1 no hydrogen 2.524 N/A ALA 266.A N HIS 234.A O no hydrogen 3.123 N/A VAL 267.A N MET 104.A O no hydrogen 2.760 N/A LEU 268.A N TYR 236.A O no hydrogen 3.019 N/A VAL 269.A N VAL 106.A O no hydrogen 3.071 N/A VAL 270.A N PHE 238.A O no hydrogen 2.977 N/A GLU 271.A N ILE 108.A O no hydrogen 3.129 N/A HIS 272.A N GLU 271.A OE1 no hydrogen 3.134 N/A ASP 273.A N GLU 271.A OE1 no hydrogen 2.944 N/A VAL 276.A N ASP 273.A OD1 no hydrogen 3.344 N/A LEU 277.A N ASP 273.A O no hydrogen 2.776 N/A ASP 278.A N LEU 274.A O no hydrogen 2.862 N/A TYR 279.A N ALA 275.A O no hydrogen 3.152 N/A LEU 280.A N VAL 276.A O no hydrogen 3.101 N/A SER 281.A N LEU 277.A O no hydrogen 2.763 N/A SER 281.A OG LEU 277.A O no hydrogen 3.023 N/A ASP 282.A N VAL 105.A O no hydrogen 2.671 N/A VAL 283.A N VAL 105.A O no hydrogen 3.327 N/A ILE 284.A N LYS 301.A O no hydrogen 2.886 N/A HIS 285.A N GLY 107.A O no hydrogen 3.013 N/A VAL 286.A N SER 298.A OG no hydrogen 3.257 N/A VAL 287.A N VAL 109.A O no hydrogen 2.981 N/A TYR 288.A N ILE 296.A O no hydrogen 3.053 N/A GLY 292.A N GLY 113.A O no hydrogen 2.663 N/A VAL 293.A N GLU 290.A O no hydrogen 3.005 N/A TYR 294.A N GLU 290.A O no hydrogen 3.234 N/A GLY 295.A N VAL 93.A O no hydrogen 3.121 N/A ILE 296.A N TYR 288.A O no hydrogen 2.988 N/A PHE 297.A N TYR 95.A O no hydrogen 3.136 N/A SER 298.A N VAL 286.A O no hydrogen 2.929 N/A SER 298.A OG LYS 299.A O no hydrogen 2.977 N/A LYS 299.A N GLU 318.A OE2 no hydrogen 2.846 N/A LYS 301.A N ILE 284.A O no hydrogen 2.810 N/A LYS 301.A NZ GLU 318.A OE1 no hydrogen 2.823 N/A THR 303.A OG1 SER 281.A O no hydrogen 2.732 N/A ARG 304.A NE ASP 565.A OD2 no hydrogen 2.978 N/A ARG 304.A NH1 ASP 565.A OD1 no hydrogen 3.179 N/A ARG 304.A NH1 ASP 567.A OD2 no hydrogen 2.370 N/A GLY 306.A N GLY 302.A O no hydrogen 2.769 N/A ILE 307.A N THR 303.A O no hydrogen 2.959 N/A ASN 308.A N ARG 304.A O no hydrogen 3.166 N/A ASN 308.A N ASN 305.A O no hydrogen 2.961 N/A ASN 308.A ND2 ASP 565.A OD1 no hydrogen 3.355 N/A ASN 308.A ND2 ASP 565.A OD2 no hydrogen 2.801 N/A GLU 309.A N ASN 305.A O no hydrogen 3.006 N/A PHE 310.A N GLY 306.A O no hydrogen 3.116 N/A LEU 311.A N ILE 307.A O no hydrogen 3.221 N/A GLN 312.A N ASN 308.A O no hydrogen 3.105 N/A GLY 313.A N GLU 309.A O no hydrogen 3.017 N/A GLY 313.A N PHE 310.A O no hydrogen 3.079 N/A TYR 314.A N GLU 309.A O no hydrogen 3.370 N/A TYR 314.A OH ASN 319.A OD1 no hydrogen 2.707 N/A LEU 315.A N VAL 320.A O no hydrogen 2.906 N/A ASN 319.A N LEU 315.A O no hydrogen 2.526 N/A VAL 320.A N LEU 315.A O no hydrogen 3.308 N/A ARG 323.A NE GLU 491.A OE2 no hydrogen 2.593 N/A ARG 323.A NH1 LEU 311.A O no hydrogen 3.091 N/A ARG 323.A NH1 TYR 325.A O no hydrogen 2.984 N/A ARG 323.A NH2 PHE 310.A O no hydrogen 2.825 N/A ARG 323.A NH2 GLU 491.A OE2 no hydrogen 3.056 N/A ILE 327.A N LEU 311.A O no hydrogen 3.160 N/A LYS 331.A N GLU 334.A OE1 no hydrogen 3.269 N/A ARG 335.A N LEU 332.A O no hydrogen 3.186 N/A LEU 343.A N ILE 365.A O no hydrogen 2.755 N/A VAL 344.A N ILE 365.A O no hydrogen 3.403 N/A TYR 346.A N GLY 363.A O no hydrogen 2.984 N/A ARG 348.A NH1 GLU 359.A OE2 no hydrogen 2.416 N/A LEU 349.A N VAL 360.A O no hydrogen 2.966 N/A VAL 350.A N GLU 396.A O no hydrogen 2.908 N/A LYS 351.A N LEU 358.A O no hydrogen 3.042 N/A LYS 351.A NZ GLU 393.A O no hydrogen 2.729 N/A ASP 352.A N THR 395.A OG1 no hydrogen 2.751 N/A TYR 353.A N PHE 356.A O no hydrogen 2.912 N/A TYR 353.A OH GLU 392.A OE2 no hydrogen 2.926 N/A GLY 354.A N ASP 352.A OD2 no hydrogen 2.764 N/A LYS 357.A N ARG 537.A O no hydrogen 3.028 N/A LEU 358.A N LYS 351.A O no hydrogen 2.896 N/A GLU 359.A N GLY 539.A O no hydrogen 3.068 N/A VAL 360.A N LEU 349.A O no hydrogen 2.689 N/A GLU 361.A N ALA 541.A O no hydrogen 3.224 N/A GLY 363.A N TYR 346.A O no hydrogen 3.008 N/A ILE 365.A N VAL 344.A O no hydrogen 3.058 N/A ARG 366.A N GLU 369.A OE2 no hydrogen 2.590 N/A ARG 366.A NE GLU 364.A OE2 no hydrogen 2.736 N/A LYS 367.A N GLU 341.A O no hydrogen 2.847 N/A GLY 368.A N THR 510.A OG1 no hydrogen 2.713 N/A ILE 371.A N ALA 511.A O no hydrogen 3.023 N/A GLY 372.A N ARG 527.A O no hydrogen 3.033 N/A ILE 373.A N VAL 513.A O no hydrogen 2.841 N/A VAL 374.A N ILE 529.A O no hydrogen 3.050 N/A ASN 377.A N ASP 246.A OD2 no hydrogen 3.092 N/A LYS 381.A NZ GLY 375.A O no hydrogen 3.090 N/A LYS 381.A NZ PRO 376.A O no hydrogen 3.001 N/A LYS 381.A NZ ASN 377.A OD1 no hydrogen 3.237 N/A THR 382.A OG1 GLN 410.A OE1 no hydrogen 2.548 N/A THR 382.A OG1 ASP 482.A OD2 no hydrogen 2.650 N/A PHE 384.A N GLY 380.A O no hydrogen 2.993 N/A VAL 385.A N LYS 381.A O no hydrogen 3.093 N/A LYS 386.A N THR 382.A O no hydrogen 2.858 N/A MET 387.A N THR 383.A O no hydrogen 3.224 N/A MET 387.A N PHE 384.A O no hydrogen 2.853 N/A LEU 388.A N PHE 384.A O no hydrogen 3.321 N/A ALA 389.A N VAL 385.A O no hydrogen 2.854 N/A GLY 390.A N MET 387.A O no hydrogen 3.222 N/A THR 395.A N VAL 350.A O no hydrogen 2.661 N/A GLU 396.A N VAL 350.A O no hydrogen 2.916 N/A LYS 398.A NZ GLU 400.A OE1 no hydrogen 3.233 N/A THR 404.A N ASP 477.A OD2 no hydrogen 2.512 N/A THR 404.A OG1 ASP 477.A OD2 no hydrogen 2.933 N/A ALA 406.A N ILE 478.A O no hydrogen 3.037 N/A LYS 408.A N LEU 480.A O no hydrogen 2.555 N/A LYS 408.A NZ PRO 409.A O no hydrogen 2.813 N/A LYS 408.A NZ ASP 482.A O no hydrogen 3.092 N/A LYS 413.A NZ GLU 415.A OE1 no hydrogen 2.992 N/A THR 419.A N GLU 422.A OE1 no hydrogen 3.294 N/A VAL 420.A N ARG 453.A O no hydrogen 3.175 N/A TYR 421.A N TYR 451.A O no hydrogen 3.261 N/A GLU 422.A N THR 419.A OG1 no hydrogen 3.300 N/A LEU 423.A N THR 419.A O no hydrogen 3.066 N/A LEU 424.A N VAL 420.A O no hydrogen 2.936 N/A SER 425.A N TYR 421.A O no hydrogen 2.851 N/A SER 425.A OG TYR 421.A O no hydrogen 2.751 N/A SER 425.A OG GLU 422.A O no hydrogen 2.940 N/A LYS 426.A N GLU 422.A O no hydrogen 3.122 N/A ILE 427.A N LEU 424.A O no hydrogen 2.707 N/A ASP 428.A N LEU 424.A O no hydrogen 3.177 N/A SER 429.A OG SER 425.A O no hydrogen 2.608 N/A SER 430.A OG ASP 428.A OD1 no hydrogen 2.623 N/A LYS 431.A N ASP 428.A OD1 no hydrogen 3.028 N/A LYS 431.A NZ LEU 473.A O no hydrogen 3.206 N/A LEU 432.A N ASP 428.A O no hydrogen 3.418 N/A ASN 433.A N SER 430.A O no hydrogen 2.727 N/A SER 434.A N LYS 431.A O no hydrogen 2.821 N/A LYS 438.A N SER 434.A O no hydrogen 3.087 N/A THR 439.A N ASN 435.A O no hydrogen 3.248 N/A THR 439.A OG1 ASN 435.A O no hydrogen 2.440 N/A GLU 440.A N PHE 436.A O no hydrogen 2.890 N/A LEU 441.A N TYR 437.A O no hydrogen 2.969 N/A LEU 442.A N TYR 437.A O no hydrogen 2.880 N/A LYS 443.A N LYS 438.A O no hydrogen 2.845 N/A LEU 445.A N LEU 441.A O no hydrogen 3.155 N/A GLY 446.A N LYS 443.A O no hydrogen 2.953 N/A ILE 447.A N LEU 442.A O no hydrogen 3.004 N/A TYR 451.A N ILE 448.A O no hydrogen 3.124 N/A ASP 452.A N ASP 452.A OD1 no hydrogen 2.519 N/A ARG 453.A N LEU 450.A O no hydrogen 3.046 N/A ARG 453.A NH1 GLU 462.A OE2 no hydrogen 2.823 N/A ARG 453.A NH2 ASP 457.A O no hydrogen 2.760 N/A ARG 453.A NH2 GLU 462.A OE1 no hydrogen 3.169 N/A ARG 453.A NH2 GLU 462.A OE2 no hydrogen 3.541 N/A ASN 454.A ND2 ASP 457.A OD2 no hydrogen 2.925 N/A VAL 455.A N GLY 418.A O no hydrogen 2.758 N/A ASP 457.A N ASN 454.A O no hydrogen 2.925 N/A LEU 458.A N VAL 455.A O no hydrogen 3.201 N/A SER 459.A N GLU 462.A OE1 no hydrogen 2.478 N/A SER 459.A OG GLU 462.A OE1 no hydrogen 2.973 N/A LEU 463.A N SER 459.A O no hydrogen 2.766 N/A GLN 464.A N GLY 460.A O no hydrogen 3.097 N/A GLN 464.A NE2 GLN 464.A O no hydrogen 3.343 N/A ARG 465.A N GLY 461.A O no hydrogen 3.247 N/A ARG 465.A NE GLY 461.A O no hydrogen 3.485 N/A ARG 465.A NH1 LEU 445.A O no hydrogen 2.595 N/A VAL 466.A N GLU 462.A O no hydrogen 2.907 N/A ALA 467.A N LEU 463.A O no hydrogen 2.907 N/A ILE 468.A N GLN 464.A O no hydrogen 2.933 N/A ALA 469.A N ARG 465.A O no hydrogen 2.943 N/A ALA 470.A N VAL 466.A O no hydrogen 2.679 N/A THR 471.A N ALA 467.A O no hydrogen 2.761 N/A THR 471.A OG1 ALA 467.A O no hydrogen 2.955 N/A LEU 472.A N ILE 468.A O no hydrogen 2.999 N/A LEU 473.A N ALA 470.A O no hydrogen 3.140 N/A ARG 474.A N THR 471.A O no hydrogen 3.266 N/A ALA 476.A N TYR 479.A OH no hydrogen 3.174 N/A ASP 477.A N THR 404.A O no hydrogen 3.010 N/A ILE 478.A N THR 404.A O no hydrogen 3.415 N/A TYR 479.A N THR 510.A O no hydrogen 2.950 N/A TYR 479.A OH ARG 474.A O no hydrogen 2.765 N/A LEU 480.A N ALA 406.A O no hydrogen 2.606 N/A LEU 481.A N LEU 512.A O no hydrogen 3.187 N/A ASP 482.A N LYS 408.A O no hydrogen 2.912 N/A GLU 483.A N VAL 514.A O no hydrogen 3.057 N/A SER 485.A N GLU 515.A OE1 no hydrogen 2.786 N/A SER 485.A OG GLU 515.A OE1 no hydrogen 2.826 N/A SER 485.A OG GLU 515.A OE2 no hydrogen 2.900 N/A LEU 488.A N SER 485.A O no hydrogen 3.128 N/A ASP 489.A N GLN 492.A OE1 no hydrogen 2.905 N/A VAL 490.A N HIS 272.A ND1 no hydrogen 2.771 N/A GLN 492.A N ASP 489.A OD1 no hydrogen 2.700 N/A ARG 493.A N ASP 489.A O no hydrogen 3.226 N/A ARG 493.A NE LEU 488.A O no hydrogen 2.844 N/A ARG 493.A NH1 ASP 517.A OD2 no hydrogen 2.794 N/A ARG 493.A NH2 LEU 488.A O no hydrogen 3.297 N/A LEU 494.A N VAL 490.A O no hydrogen 3.306 N/A ALA 495.A N GLU 491.A O no hydrogen 3.102 N/A VAL 496.A N GLN 492.A O no hydrogen 3.068 N/A SER 497.A N ARG 493.A O no hydrogen 2.971 N/A SER 497.A OG ARG 493.A O no hydrogen 2.697 N/A ARG 498.A N LEU 494.A O no hydrogen 3.009 N/A ALA 499.A N ALA 495.A O no hydrogen 2.954 N/A ILE 500.A N VAL 496.A O no hydrogen 2.939 N/A ARG 501.A N SER 497.A O no hydrogen 3.067 N/A ARG 501.A NH1 ASP 526.A OD1 no hydrogen 3.285 N/A ARG 501.A NH1 ASP 526.A OD2 no hydrogen 3.182 N/A ARG 501.A NH2 ASP 526.A OD1 no hydrogen 2.608 N/A HIS 502.A N ARG 498.A O no hydrogen 2.845 N/A LEU 503.A N ALA 499.A O no hydrogen 2.786 N/A MET 504.A N ILE 500.A O no hydrogen 3.264 N/A GLU 505.A N ARG 501.A O no hydrogen 2.991 N/A LYS 506.A N HIS 502.A O no hydrogen 2.724 N/A ASN 507.A N LEU 503.A O no hydrogen 3.143 N/A GLU 508.A N GLU 505.A O no hydrogen 3.416 N/A LYS 509.A N MET 504.A O no hydrogen 2.942 N/A LYS 509.A NZ ASP 475.A OD1 no hydrogen 3.093 N/A LYS 509.A NZ ALA 476.A O no hydrogen 2.711 N/A THR 510.A OG1 ARG 366.A O no hydrogen 2.847 N/A ALA 511.A N GLU 369.A O no hydrogen 3.129 N/A LEU 512.A N TYR 479.A O no hydrogen 2.895 N/A VAL 513.A N ILE 371.A O no hydrogen 2.877 N/A VAL 514.A N LEU 481.A O no hydrogen 3.110 N/A GLU 515.A N ILE 373.A O no hydrogen 3.153 N/A HIS 516.A N GLU 515.A OE2 no hydrogen 2.913 N/A HIS 516.A NE2 GLU 483.A OE1 no hydrogen 2.726 N/A ASP 517.A N GLU 515.A OE2 no hydrogen 3.007 N/A MET 520.A N ASP 517.A O no hydrogen 3.202 N/A MET 520.A N ASP 517.A OD1 no hydrogen 3.103 N/A ILE 521.A N ASP 517.A O no hydrogen 3.143 N/A ASP 522.A N VAL 518.A O no hydrogen 3.019 N/A TYR 523.A N LEU 519.A O no hydrogen 2.890 N/A VAL 524.A N MET 520.A O no hydrogen 2.908 N/A SER 525.A N ILE 521.A O no hydrogen 2.997 N/A SER 525.A OG ILE 521.A O no hydrogen 2.557 N/A ASP 526.A N VAL 370.A O no hydrogen 2.670 N/A ARG 527.A N VAL 370.A O no hydrogen 3.203 N/A ARG 527.A NE GLU 369.A OE1 no hydrogen 2.682 N/A ARG 527.A NH2 GLU 364.A O no hydrogen 3.252 N/A ARG 527.A NH2 GLU 369.A OE1 no hydrogen 3.013 N/A ARG 527.A NH2 GLU 369.A OE2 no hydrogen 2.588 N/A LEU 528.A N MET 545.A O no hydrogen 2.962 N/A ILE 529.A N GLY 372.A O no hydrogen 2.907 N/A PHE 531.A N VAL 374.A O no hydrogen 3.015 N/A GLU 532.A N ARG 540.A O no hydrogen 3.278 N/A GLU 534.A N HIS 538.A O no hydrogen 2.713 N/A GLY 536.A N GLY 378.A O no hydrogen 2.645 N/A ARG 537.A N GLU 534.A O no hydrogen 2.705 N/A ARG 537.A NH2 GLU 534.A OE1 no hydrogen 2.508 N/A ARG 537.A NH2 GLU 534.A OE2 no hydrogen 3.275 N/A HIS 538.A N GLU 534.A O no hydrogen 3.030 N/A GLY 539.A N LYS 357.A O no hydrogen 2.977 N/A ARG 540.A N GLU 532.A O no hydrogen 3.009 N/A ARG 540.A NE GLU 361.A OE2 no hydrogen 3.050 N/A ARG 540.A NH1 GLU 361.A OE2 no hydrogen 2.974 N/A ALA 541.A N GLU 359.A O no hydrogen 3.187 N/A LEU 542.A N VAL 530.A O no hydrogen 2.862 N/A MET 545.A N LEU 528.A O no hydrogen 2.859 N/A GLY 550.A N GLY 546.A O no hydrogen 2.729 N/A MET 551.A N MET 547.A O no hydrogen 2.753 N/A ASN 552.A N ARG 548.A O no hydrogen 2.982 N/A ARG 553.A N GLU 549.A O no hydrogen 3.223 N/A ARG 553.A NE GLU 532.A OE1 no hydrogen 2.698 N/A ARG 553.A NH2 GLU 532.A OE2 no hydrogen 2.687 N/A PHE 554.A N GLY 550.A O no hydrogen 2.995 N/A LEU 555.A N MET 551.A O no hydrogen 2.921 N/A ALA 556.A N ASN 552.A O no hydrogen 3.419 N/A SER 557.A N PHE 554.A O no hydrogen 3.012 N/A VAL 558.A N LEU 555.A O no hydrogen 2.946 N/A GLY 559.A N LEU 555.A O no hydrogen 2.777 N/A THR 561.A OG1 ASN 574.A OD1 no hydrogen 2.884 N/A THR 561.A OG1 ASP 581.A OD1 no hydrogen 2.941 N/A PHE 562.A N TYR 590.A O no hydrogen 2.616 N/A ARG 563.A N ARG 572.A O no hydrogen 2.671 N/A ARG 564.A NH1 ASP 522.A OD1 no hydrogen 2.820 N/A ARG 564.A NH1 TYR 591.A OH no hydrogen 3.276 N/A ASP 565.A N ARG 570.A O no hydrogen 3.115 N/A ASP 567.A N ASP 565.A OD1 no hydrogen 2.956 N/A SER 568.A N ASP 565.A OD1 no hydrogen 2.888 N/A SER 568.A OG ASN 308.A OD1 no hydrogen 2.708 N/A GLY 569.A N ASP 565.A O no hydrogen 2.768 N/A ARG 570.A N SER 568.A OG no hydrogen 3.409 N/A ARG 570.A NE ASN 308.A OD1 no hydrogen 2.823 N/A ARG 570.A NH1 ASP 278.A OD2 no hydrogen 2.922 N/A ARG 572.A N ARG 563.A O no hydrogen 3.174 N/A ALA 573.A N ASP 278.A OD2 no hydrogen 3.177 N/A ASN 574.A N THR 561.A O no hydrogen 3.019 N/A LYS 575.A NZ TYR 279.A O no hydrogen 3.532 N/A LYS 575.A NZ SER 281.A O no hydrogen 2.795 N/A GLY 577.A N ASP 581.A OD2 no hydrogen 3.155 N/A SER 578.A OG LYS 575.A O no hydrogen 3.343 N/A ASP 581.A N SER 578.A OG no hydrogen 2.868 N/A ARG 582.A N SER 578.A O no hydrogen 2.946 N/A GLU 583.A N VAL 579.A O no hydrogen 3.006 N/A GLN 584.A N LYS 580.A O no hydrogen 2.883 N/A LYS 585.A N ASP 581.A O no hydrogen 3.202 N/A LYS 585.A NZ ASP 581.A OD2 no hydrogen 2.632 N/A ALA 586.A N ARG 582.A O no hydrogen 2.909 N/A ARG 587.A N GLU 583.A O no hydrogen 3.252 N/A GLY 588.A N LYS 585.A O no hydrogen 2.749 N/A GLU 589.A N GLN 584.A O no hydrogen 2.665 N/A