Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1j0j_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ARG 2.A N ASP 33.A OD2 no hydrogen 2.668 N/A ALA 5.A N ARG 2.A O no hydrogen 3.131 N/A ILE 6.A N LYS 3.A O no hydrogen 2.833 N/A TYR 7.A N ARG 28.A O no hydrogen 3.046 N/A HIS 8.A N TYR 97.A OH no hydrogen 3.032 N/A HIS 8.A ND1 ARG 26.A O no hydrogen 2.694 N/A HIS 8.A NE2 TYR 84.A OH no hydrogen 2.694 N/A ALA 11.A N ARG 9.A O no hydrogen 2.619 N/A ASN 13.A ND2 HIS 406.A O no hydrogen 2.831 N/A PHE 14.A N ALA 11.A O no hydrogen 2.798 N/A ALA 15.A N ALA 11.A O no hydrogen 3.159 N/A TYR 16.A N HIS 24.A O no hydrogen 3.246 N/A TYR 16.A OH HIS 24.A ND1 no hydrogen 2.680 N/A TYR 18.A N THR 22.A O no hydrogen 2.892 N/A TYR 18.A OH GLU 414.A OE2 no hydrogen 2.913 N/A GLU 21.A N ASP 19.A OD2 no hydrogen 2.667 N/A THR 22.A N ASP 19.A O no hydrogen 3.205 N/A THR 22.A OG1 ASP 19.A OD1 no hydrogen 2.662 N/A THR 22.A OG1 ASP 19.A OD2 no hydrogen 2.838 N/A LEU 23.A N VAL 75.A O no hydrogen 2.774 N/A HIS 24.A N TYR 16.A O no hydrogen 2.792 N/A HIS 24.A ND1 TYR 16.A OH no hydrogen 2.680 N/A LEU 25.A N ALA 73.A O no hydrogen 2.858 N/A ARG 26.A N PHE 14.A O no hydrogen 2.901 N/A ARG 26.A NH1 TYR 408.A O no hydrogen 3.196 N/A ARG 26.A NH2 ASN 410.A OD1 no hydrogen 3.074 N/A LEU 27.A N TRP 71.A O no hydrogen 3.019 N/A ARG 28.A N TYR 7.A O no hydrogen 3.259 N/A ARG 28.A NE ALA 5.A O no hydrogen 3.241 N/A ARG 28.A NH2 ALA 5.A O no hydrogen 3.040 N/A THR 29.A N ASP 69.A O no hydrogen 2.964 N/A LYS 31.A N LEU 67.A O no hydrogen 2.972 N/A LYS 31.A NZ ASP 65.A O no hydrogen 2.926 N/A ASP 32.A N ASP 69.A OD2 no hydrogen 2.513 N/A ASP 33.A N LYS 30.A O no hydrogen 2.984 N/A ASP 35.A N TYR 89.A O no hydrogen 2.790 N/A ARG 36.A N TYR 89.A O no hydrogen 3.336 N/A ARG 36.A NH2 GLU 38.A OE2 no hydrogen 3.202 N/A GLU 38.A N VAL 87.A O no hydrogen 3.089 N/A LEU 39.A N MET 57.A O no hydrogen 2.572 N/A LEU 40.A N GLY 85.A O no hydrogen 3.018 N/A HIS 41.A N GLN 55.A O no hydrogen 2.845 N/A GLY 42.A N ARG 83.A O no hydrogen 3.222 N/A TYR 45.A N ASP 43.A OD2 no hydrogen 2.914 N/A ASP 46.A N ASP 43.A O no hydrogen 3.145 N/A GLN 48.A N ALA 51.A O no hydrogen 2.880 N/A GLN 48.A NE2 ASP 46.A OD2 no hydrogen 3.181 N/A ALA 51.A N GLN 48.A O no hydrogen 2.815 N/A TRP 52.A NE1 ASP 43.A O no hydrogen 3.090 N/A GLN 53.A N ASP 46.A O no hydrogen 2.881 N/A GLN 53.A NE2 ALA 51.A O no hydrogen 2.459 N/A GLN 55.A N HIS 41.A O no hydrogen 2.659 N/A MET 57.A N LEU 39.A O no hydrogen 2.804 N/A MET 59.A N VAL 37.A O no hydrogen 2.625 N/A ARG 60.A N PHE 72.A O no hydrogen 2.844 N/A ARG 60.A NH1 GLU 507.A OE2 no hydrogen 3.069 N/A LYS 61.A NZ ASP 69.A OD1 no hydrogen 3.541 N/A LYS 61.A NZ ASP 69.A OD2 no hydrogen 3.461 N/A THR 62.A N TYR 70.A O no hydrogen 2.878 N/A THR 62.A OG1 HIS 406.A NE2 no hydrogen 2.518 N/A SER 64.A OG ASP 69.A OD1 no hydrogen 2.720 N/A ASP 65.A N PHE 68.A O no hydrogen 3.158 N/A LEU 67.A N ASP 65.A OD1 no hydrogen 3.089 N/A PHE 68.A N ASP 65.A OD1 no hydrogen 2.801 N/A ASP 69.A N THR 29.A O no hydrogen 2.691 N/A TYR 70.A N GLY 63.A O no hydrogen 2.987 N/A TYR 70.A OH ASP 65.A OD2 no hydrogen 2.888 N/A TRP 71.A N LEU 27.A O no hydrogen 2.768 N/A TRP 71.A NE1 THR 29.A OG1 no hydrogen 3.045 N/A PHE 72.A N ARG 60.A O no hydrogen 2.564 N/A VAL 75.A N LEU 23.A O no hydrogen 2.914 N/A LYS 76.A NZ THR 22.A OG1 no hydrogen 2.504 N/A ARG 80.A N PRO 77.A O no hydrogen 3.318 N/A ARG 81.A NE ASP 43.A OD1 no hydrogen 3.154 N/A ARG 81.A NH2 ASP 43.A OD1 no hydrogen 3.308 N/A LEU 82.A N PHE 117.A O no hydrogen 3.372 N/A ARG 83.A N GLY 42.A O no hydrogen 3.016 N/A ARG 83.A NH1 TYR 114.A O no hydrogen 2.688 N/A TYR 84.A N PHE 115.A O no hydrogen 2.878 N/A TYR 84.A OH HIS 8.A NE2 no hydrogen 2.694 N/A GLY 85.A N LEU 40.A O no hydrogen 2.893 N/A PHE 86.A N TYR 97.A O no hydrogen 2.930 N/A VAL 87.A N GLU 38.A O no hydrogen 3.030 N/A LEU 88.A N LEU 95.A O no hydrogen 2.579 N/A TYR 89.A N ARG 36.A O no hydrogen 2.906 N/A TYR 89.A OH GLU 38.A OE1 no hydrogen 2.946 N/A SER 90.A N GLU 93.A O no hydrogen 3.293 N/A SER 90.A OG ASP 33.A O no hydrogen 3.215 N/A GLY 91.A N ASP 35.A OD1 no hydrogen 3.381 N/A GLU 93.A N SER 90.A O no hydrogen 3.138 N/A LYS 94.A NZ GLU 105.A OE1 no hydrogen 3.039 N/A LYS 94.A NZ GLU 105.A OE2 no hydrogen 2.843 N/A LEU 95.A N LEU 88.A O no hydrogen 2.988 N/A VAL 96.A N TYR 103.A O no hydrogen 2.692 N/A TYR 97.A N PHE 86.A O no hydrogen 2.580 N/A THR 98.A N GLY 101.A O no hydrogen 2.941 N/A THR 98.A OG1 GLY 101.A O no hydrogen 2.969 N/A LYS 100.A N THR 98.A OG1 no hydrogen 3.164 N/A LYS 100.A N TYR 113.A O no hydrogen 2.999 N/A GLY 101.A N THR 98.A O no hydrogen 3.078 N/A TYR 103.A N VAL 96.A O no hydrogen 2.818 N/A ALA 112.A N ASP 110.A OD2 no hydrogen 3.023 N/A TYR 113.A OH ASP 109.A OD1 no hydrogen 2.619 N/A TYR 114.A OH PRO 107.A O no hydrogen 2.616 N/A CYS 116.A SG LEU 82.A O no hydrogen 3.770 N/A PHE 117.A N LEU 82.A O no hydrogen 2.864 N/A ASP 124.A N HIS 121.A O no hydrogen 3.232 N/A LEU 125.A N ARG 122.A O no hydrogen 3.164 N/A TRP 131.A NE1 ASP 351.A O no hydrogen 2.796 N/A VAL 132.A N PRO 129.A O no hydrogen 3.338 N/A LYS 133.A N ASP 130.A O no hydrogen 3.147 N/A LYS 133.A NZ GLU 414.A OE1 no hydrogen 3.287 N/A ASP 134.A N TRP 131.A O no hydrogen 2.927 N/A THR 135.A N VAL 132.A O no hydrogen 2.979 N/A THR 135.A OG1 TRP 131.A O no hydrogen 2.946 N/A THR 135.A OG1 VAL 132.A O no hydrogen 3.319 N/A VAL 136.A N THR 191.A OG1 no hydrogen 3.045 N/A TRP 137.A N PRO 453.A O no hydrogen 2.760 N/A TRP 137.A NE1 SER 452.A OG no hydrogen 2.691 N/A TYR 138.A N GLY 192.A O no hydrogen 2.765 N/A TYR 138.A OH GLU 460.A OE1 no hydrogen 2.475 N/A GLN 139.A N ILE 455.A O no hydrogen 2.789 N/A ILE 140.A N TYR 194.A O no hydrogen 2.946 N/A ARG 144.A N PHE 141.A O no hydrogen 2.743 N/A ARG 144.A NE GLU 143.A OE1 no hydrogen 2.666 N/A ARG 144.A NH1 ARG 472.A O no hydrogen 2.725 N/A ARG 144.A NH2 GLU 143.A OE1 no hydrogen 3.214 N/A PHE 145.A N PRO 142.A O no hydrogen 3.178 N/A GLY 148.A N ALA 146.A O no hydrogen 2.786 N/A ASN 149.A N ASP 174.A OD1 no hydrogen 3.149 N/A ASN 149.A N ASP 174.A OD2 no hydrogen 3.162 N/A SER 151.A OG ASN 149.A OD1 no hydrogen 2.332 N/A ILE 152.A N ASN 149.A OD1 no hydrogen 3.010 N/A SER 153.A OG ASN 149.A O no hydrogen 3.208 N/A SER 153.A OG GLY 172.A O no hydrogen 3.289 N/A SER 157.A N PRO 154.A O no hydrogen 3.231 N/A ARG 158.A N PHE 170.A O no hydrogen 3.143 N/A TRP 160.A NE1 MET 475.A O no hydrogen 2.880 N/A SER 162.A N PRO 159.A O no hydrogen 2.792 N/A GLU 163.A N GLU 163.A OE1 no hydrogen 2.489 N/A THR 166.A N SER 169.A OG no hydrogen 2.946 N/A SER 169.A N THR 166.A O no hydrogen 3.157 N/A SER 169.A OG THR 166.A O no hydrogen 3.430 N/A PHE 171.A N GLU 143.A OE1 no hydrogen 2.788 N/A PHE 171.A N GLU 143.A OE2 no hydrogen 2.783 N/A GLY 173.A N GLU 143.A OE2 no hydrogen 3.288 N/A ASP 174.A N ALA 146.A O no hydrogen 3.447 N/A LEU 175.A N PHE 219.A O no hydrogen 3.140 N/A GLY 177.A N ASP 174.A OD1 no hydrogen 3.204 N/A ILE 179.A N LEU 175.A O no hydrogen 3.150 N/A ASP 180.A N GLN 176.A O no hydrogen 2.583 N/A HIS 181.A N ILE 178.A O no hydrogen 3.032 N/A LEU 182.A N ILE 179.A O no hydrogen 3.358 N/A TYR 184.A N HIS 181.A O no hydrogen 2.546 N/A TYR 184.A OH GLU 460.A OE1 no hydrogen 2.694 N/A LEU 185.A N HIS 181.A O no hydrogen 3.433 N/A VAL 186.A N LEU 182.A O no hydrogen 2.850 N/A ASP 187.A N ASP 183.A O no hydrogen 3.122 N/A LEU 188.A N TYR 184.A O no hydrogen 3.061 N/A GLY 189.A N LEU 185.A O no hydrogen 2.937 N/A ILE 190.A N LEU 185.A O no hydrogen 3.084 N/A THR 191.A N VAL 136.A O no hydrogen 3.098 N/A ILE 193.A N ARG 238.A O no hydrogen 2.776 N/A TYR 194.A N TYR 138.A O no hydrogen 3.102 N/A TYR 194.A OH ASP 242.A OD1 no hydrogen 3.175 N/A LEU 195.A N MET 240.A O no hydrogen 2.872 N/A THR 196.A N ILE 140.A O no hydrogen 3.283 N/A THR 196.A OG1 ILE 140.A O no hydrogen 3.513 N/A ARG 200.A N GLU 214.A O no hydrogen 2.853 N/A SER 201.A N ASP 216.A OD1 no hydrogen 3.071 N/A SER 201.A OG SER 203.A OG no hydrogen 3.240 N/A SER 201.A OG ASP 208.A O no hydrogen 2.975 N/A SER 201.A OG ASP 208.A OD1 no hydrogen 2.531 N/A SER 203.A OG SER 201.A OG no hydrogen 3.240 N/A SER 203.A OG ASP 208.A OD1 no hydrogen 2.639 N/A ASN 204.A ND2 SER 169.A O no hydrogen 2.946 N/A LYS 206.A N SER 203.A OG no hydrogen 2.855 N/A LYS 206.A NZ SER 201.A O no hydrogen 3.004 N/A LYS 206.A NZ SER 203.A O no hydrogen 2.760 N/A LYS 206.A NZ ASP 216.A OD1 no hydrogen 3.506 N/A LYS 206.A NZ ASP 216.A OD2 no hydrogen 3.424 N/A TYR 207.A N HIS 205.A ND1 no hydrogen 3.011 N/A TYR 207.A OH ASP 242.A OD1 no hydrogen 2.793 N/A TYR 207.A OH HIS 423.A NE2 no hydrogen 2.626 N/A THR 209.A OG1 TYR 212.A OH no hydrogen 3.195 N/A ALA 210.A N ARG 200.A O no hydrogen 2.640 N/A ASP 211.A N ARG 200.A O no hydrogen 3.402 N/A TYR 212.A OH VAL 244.A O no hydrogen 2.741 N/A PHE 213.A N ASP 211.A OD2 no hydrogen 3.132 N/A GLU 214.A N ASP 211.A O no hydrogen 3.210 N/A ASP 216.A N ILE 198.A O no hydrogen 2.898 N/A HIS 218.A N ASP 216.A OD2 no hydrogen 3.183 N/A HIS 218.A ND1 ILE 152.A O no hydrogen 3.085 N/A PHE 219.A N ASP 216.A O no hydrogen 2.774 N/A GLY 220.A N ASP 216.A O no hydrogen 3.300 N/A ASP 221.A N THR 224.A OG1 no hydrogen 3.165 N/A LYS 222.A NZ PHE 213.A O no hydrogen 2.758 N/A LYS 222.A NZ TYR 315.A OH no hydrogen 2.785 N/A THR 224.A N ASP 221.A OD1 no hydrogen 2.938 N/A THR 224.A OG1 ASP 221.A OD1 no hydrogen 2.902 N/A LEU 225.A N ASP 221.A O no hydrogen 2.958 N/A LYS 226.A N LYS 222.A O no hydrogen 2.946 N/A LYS 226.A NZ ASP 230.A OD1 no hydrogen 2.827 N/A LYS 226.A NZ ASP 230.A OD2 no hydrogen 3.450 N/A THR 227.A N GLU 223.A O no hydrogen 3.169 N/A LEU 228.A N THR 224.A O no hydrogen 3.056 N/A ILE 229.A N LEU 225.A O no hydrogen 2.992 N/A ASP 230.A N LYS 226.A O no hydrogen 2.646 N/A ARG 231.A N THR 227.A O no hydrogen 2.750 N/A CYS 232.A N LEU 228.A O no hydrogen 2.745 N/A CYS 232.A SG LEU 228.A O no hydrogen 3.241 N/A HIS 233.A N ILE 229.A O no hydrogen 2.853 N/A GLU 234.A N ASP 230.A O no hydrogen 3.309 N/A LYS 235.A N ARG 231.A O no hydrogen 3.390 N/A GLY 236.A N HIS 233.A O no hydrogen 2.737 N/A ILE 237.A N CYS 232.A O no hydrogen 2.763 N/A ARG 238.A N THR 191.A O no hydrogen 3.174 N/A ARG 238.A NH1 ASP 323.A OD2 no hydrogen 3.516 N/A ARG 238.A NH1 ASP 351.A OD1 no hydrogen 3.228 N/A VAL 239.A N ASP 323.A OD1 no hydrogen 2.484 N/A MET 240.A N ILE 193.A O no hydrogen 2.723 N/A LEU 241.A N GLY 324.A O no hydrogen 3.235 N/A ALA 243.A N ARG 326.A O no hydrogen 2.698 N/A PHE 245.A N ALA 243.A O no hydrogen 3.188 N/A ASN 246.A ND2 HIS 247.A ND1 no hydrogen 3.065 N/A CYS 248.A N PRO 296.A O no hydrogen 3.212 N/A CYS 248.A SG GLY 249.A O no hydrogen 3.332 N/A CYS 248.A SG PRO 296.A O no hydrogen 3.812 N/A PHE 252.A N GLY 249.A O no hydrogen 3.072 N/A PHE 255.A N PHE 252.A O no hydrogen 2.532 N/A GLN 256.A N PHE 252.A O no hydrogen 3.082 N/A GLN 256.A NE2 TYR 250.A O no hydrogen 2.712 N/A ASP 257.A N ALA 253.A O no hydrogen 3.008 N/A VAL 258.A N PRO 254.A O no hydrogen 3.412 N/A TRP 259.A N PHE 255.A O no hydrogen 2.864 N/A LYS 260.A N GLN 256.A O no hydrogen 2.983 N/A LYS 260.A NZ GLN 256.A OE1 no hydrogen 2.731 N/A ASN 261.A N ASP 257.A O no hydrogen 2.575 N/A GLY 262.A N VAL 258.A O no hydrogen 2.896 N/A SER 264.A N ASN 261.A O no hydrogen 3.290 N/A SER 264.A OG ASN 261.A O no hydrogen 2.606 N/A SER 265.A N GLY 262.A O no hydrogen 2.999 N/A SER 265.A OG ASP 257.A OD2 no hydrogen 2.576 N/A TYR 267.A N SER 265.A OG no hydrogen 2.988 N/A LYS 268.A N SER 265.A O no hydrogen 3.367 N/A LYS 268.A NZ GLU 263.A O no hydrogen 3.344 N/A TRP 270.A N TYR 267.A O no hydrogen 2.821 N/A TRP 270.A NE1 GLU 304.A OE1 no hydrogen 3.275 N/A HIS 274.A N ASN 285.A O no hydrogen 2.999 N/A GLN 279.A N ASN 285.A OD1 no hydrogen 2.958 N/A ASN 285.A N GLN 279.A O no hydrogen 3.239 N/A ASN 285.A ND2 PRO 277.A O no hydrogen 2.877 N/A TYR 286.A OH PRO 293.A O no hydrogen 2.851 N/A ASP 287.A N HIS 272.A O no hydrogen 3.147 N/A THR 288.A OG1 PHE 289.A O no hydrogen 3.410 N/A THR 288.A OG1 ALA 290.A O no hydrogen 2.699 N/A PHE 289.A N MET 295.A O no hydrogen 2.905 N/A VAL 292.A N PHE 289.A O no hydrogen 2.986 N/A MET 295.A N VAL 292.A O no hydrogen 3.143 N/A LYS 297.A N ASP 287.A O no hydrogen 2.904 N/A LYS 297.A NZ GLU 332.A O no hydrogen 3.067 N/A LEU 298.A N ASN 246.A O no hydrogen 2.923 N/A ASN 299.A N TRP 270.A O no hydrogen 2.919 N/A ASN 299.A ND2 ASP 269.A O no hydrogen 3.215 N/A THR 300.A OG1 ASP 334.A OD1 no hydrogen 2.934 N/A ALA 301.A N ASN 299.A OD1 no hydrogen 3.316 N/A ASN 302.A N ASN 299.A O no hydrogen 2.791 N/A ASN 302.A ND2 ASP 269.A O no hydrogen 2.950 N/A ASN 302.A ND2 ASP 269.A OD2 no hydrogen 2.826 N/A GLU 304.A N ASN 302.A OD1 no hydrogen 2.712 N/A VAL 305.A N ASN 302.A OD1 no hydrogen 3.190 N/A LYS 306.A N ASN 302.A O no hydrogen 2.957 N/A LYS 306.A NZ GLU 340.A OE2 no hydrogen 2.480 N/A ARG 307.A N PRO 303.A O no hydrogen 3.045 N/A ARG 307.A NE ARG 307.A O no hydrogen 2.994 N/A ARG 307.A NE ASP 311.A OD1 no hydrogen 2.623 N/A ARG 307.A NH2 ASP 311.A OD1 no hydrogen 2.625 N/A ARG 307.A NH2 GLU 344.A OE1 no hydrogen 2.658 N/A TYR 308.A N GLU 304.A O no hydrogen 2.918 N/A LEU 309.A N VAL 305.A O no hydrogen 2.974 N/A LEU 310.A N LYS 306.A O no hydrogen 2.999 N/A ASP 311.A N ARG 307.A O no hydrogen 3.294 N/A VAL 312.A N TYR 308.A O no hydrogen 2.982 N/A ALA 313.A N LEU 309.A O no hydrogen 2.875 N/A THR 314.A N LEU 310.A O no hydrogen 2.836 N/A THR 314.A OG1 LEU 310.A O no hydrogen 3.171 N/A THR 314.A OG1 ASP 311.A O no hydrogen 3.202 N/A TYR 315.A N ASP 311.A O no hydrogen 2.684 N/A TRP 316.A NE1 TYR 212.A O no hydrogen 3.088 N/A ARG 318.A N THR 314.A O no hydrogen 2.742 N/A ARG 318.A NH1 GLU 319.A OE2 no hydrogen 3.061 N/A GLU 319.A N TYR 315.A O no hydrogen 2.770 N/A PHE 320.A N TRP 316.A O no hydrogen 3.096 N/A ASP 321.A N ILE 317.A O no hydrogen 2.780 N/A ASP 323.A N VAL 239.A O no hydrogen 2.707 N/A TRP 325.A N TYR 353.A O no hydrogen 2.930 N/A TRP 325.A NE1 ALA 313.A O no hydrogen 2.882 N/A ARG 326.A N LEU 241.A O no hydrogen 2.716 N/A ARG 326.A NH1 ASP 242.A OD2 no hydrogen 3.102 N/A ARG 326.A NH1 ASP 328.A OD1 no hydrogen 2.883 N/A LEU 327.A N LEU 355.A O no hydrogen 2.914 N/A ASP 328.A N ALA 243.A O no hydrogen 3.211 N/A VAL 329.A N GLN 357.A OE1 no hydrogen 2.773 N/A GLU 332.A N VAL 329.A O no hydrogen 3.128 N/A ILE 333.A N ALA 330.A O no hydrogen 3.328 N/A PHE 337.A N ASP 334.A OD2 no hydrogen 2.770 N/A TRP 338.A N ASP 334.A O no hydrogen 3.262 N/A TRP 338.A NE1 ALA 330.A O no hydrogen 2.703 N/A ARG 339.A N HIS 335.A O no hydrogen 2.945 N/A ARG 339.A NE ASP 369.A OD2 no hydrogen 2.566 N/A GLU 340.A N GLU 336.A O no hydrogen 3.222 N/A PHE 341.A N PHE 337.A O no hydrogen 2.816 N/A ARG 342.A N TRP 338.A O no hydrogen 3.096 N/A ARG 342.A NH1 GLN 370.A O no hydrogen 2.798 N/A ARG 342.A NH1 ASP 372.A OD1 no hydrogen 2.796 N/A ARG 342.A NH2 ASP 372.A OD1 no hydrogen 2.982 N/A GLN 343.A N ARG 339.A O no hydrogen 3.379 N/A GLU 344.A N GLU 340.A O no hydrogen 2.898 N/A VAL 345.A N PHE 341.A O no hydrogen 3.033 N/A LYS 346.A N ARG 342.A O no hydrogen 2.877 N/A LYS 346.A NZ PRO 350.A O no hydrogen 3.338 N/A LYS 346.A NZ VAL 352.A O no hydrogen 2.657 N/A LYS 346.A NZ ASP 372.A OD1 no hydrogen 3.155 N/A LYS 346.A NZ ASP 372.A OD2 no hydrogen 2.711 N/A ALA 347.A N GLN 343.A O no hydrogen 3.056 N/A LEU 348.A N GLU 344.A O no hydrogen 3.229 N/A LYS 349.A N VAL 345.A O no hydrogen 2.891 N/A LYS 349.A NZ ASP 321.A OD2 no hydrogen 2.598 N/A LYS 349.A NZ ILE 322.A O no hydrogen 3.010 N/A VAL 352.A N LYS 349.A O no hydrogen 2.933 N/A TYR 353.A N ASP 323.A O no hydrogen 2.869 N/A TYR 353.A OH ALA 415.A O no hydrogen 2.724 N/A ILE 354.A N ASP 372.A OD2 no hydrogen 2.731 N/A LEU 355.A N TRP 325.A O no hydrogen 3.043 N/A GLY 356.A N ALA 373.A O no hydrogen 2.930 N/A GLN 357.A N LEU 327.A O no hydrogen 2.886 N/A GLN 357.A NE2 TYR 377.A OH no hydrogen 3.235 N/A HIS 360.A ND1 ASP 361.A O no hydrogen 2.669 N/A ALA 362.A N TYR 408.A OH no hydrogen 3.208 N/A MET 363.A N ASP 361.A OD2 no hydrogen 3.299 N/A TRP 365.A N ALA 362.A O no hydrogen 2.780 N/A LEU 366.A N MET 363.A O no hydrogen 3.132 N/A ARG 367.A NE ASP 12.A OD1 no hydrogen 2.832 N/A ARG 367.A NH2 ASP 12.A OD1 no hydrogen 3.534 N/A ARG 367.A NH2 ASP 12.A OD2 no hydrogen 3.419 N/A GLN 370.A NE2 HIS 335.A ND1 no hydrogen 2.764 N/A PHE 371.A N TRP 365.A O no hydrogen 3.061 N/A ASP 372.A N ILE 354.A O no hydrogen 2.773 N/A ALA 373.A N ILE 354.A O no hydrogen 3.401 N/A MET 375.A N GLY 356.A O no hydrogen 2.976 N/A ASN 376.A N PHE 417.A O no hydrogen 3.033 N/A TYR 377.A N MET 375.A O no hydrogen 3.019 N/A PHE 379.A N ASN 376.A OD1 no hydrogen 3.032 N/A THR 380.A N ASN 376.A O no hydrogen 3.406 N/A THR 380.A OG1 ASN 376.A O no hydrogen 3.360 N/A THR 380.A OG1 TYR 377.A O no hydrogen 3.527 N/A THR 380.A OG1 LEU 419.A O no hydrogen 2.736 N/A ASP 381.A N TYR 377.A O no hydrogen 2.963 N/A GLY 382.A N PRO 378.A O no hydrogen 3.059 N/A VAL 383.A N PHE 379.A O no hydrogen 2.932 N/A LEU 384.A N THR 380.A O no hydrogen 2.927 N/A ARG 385.A N ASP 381.A O no hydrogen 2.991 N/A PHE 386.A N VAL 383.A O no hydrogen 3.355 N/A PHE 387.A N VAL 383.A O no hydrogen 2.980 N/A ALA 388.A N LEU 384.A O no hydrogen 3.144 N/A LYS 389.A N LEU 384.A O no hydrogen 2.711 N/A LYS 389.A NZ VAL 431.A O no hydrogen 3.155 N/A GLU 391.A N ARG 385.A O no hydrogen 2.600 N/A ILE 392.A N ARG 385.A O no hydrogen 3.420 N/A SER 393.A N GLN 396.A OE1 no hydrogen 2.518 N/A ALA 394.A N MET 517.A O no hydrogen 3.394 N/A ARG 395.A N GLU 516.A O no hydrogen 3.177 N/A GLN 396.A N SER 393.A OG no hydrogen 3.077 N/A PHE 397.A N SER 393.A O no hydrogen 2.894 N/A ALA 398.A N ALA 394.A O no hydrogen 2.893 N/A ASN 399.A N ARG 395.A O no hydrogen 2.976 N/A ASN 399.A ND2 GLU 66.A OE2 no hydrogen 2.633 N/A GLN 400.A N GLN 396.A O no hydrogen 2.825 N/A MET 401.A N PHE 397.A O no hydrogen 3.079 N/A MET 402.A N ALA 398.A O no hydrogen 2.934 N/A HIS 403.A N ASN 399.A O no hydrogen 2.828 N/A HIS 403.A ND1 ASP 65.A OD2 no hydrogen 2.742 N/A VAL 404.A N GLN 400.A O no hydrogen 3.038 N/A LEU 405.A N MET 401.A O no hydrogen 3.127 N/A HIS 406.A N MET 402.A O no hydrogen 3.000 N/A HIS 406.A ND1 MET 402.A O no hydrogen 2.727 N/A HIS 406.A NE2 THR 62.A OG1 no hydrogen 2.518 N/A SER 407.A N VAL 404.A O no hydrogen 3.115 N/A SER 407.A OG VAL 404.A O no hydrogen 2.573 N/A TYR 408.A N LEU 405.A O no hydrogen 3.381 N/A ASN 410.A N TYR 16.A OH no hydrogen 3.057 N/A VAL 412.A N PRO 409.A O no hydrogen 2.851 N/A ASN 413.A N PRO 409.A O no hydrogen 3.186 N/A ASN 413.A ND2 LEU 405.A O no hydrogen 2.833 N/A ASN 413.A ND2 TYR 408.A O no hydrogen 3.655 N/A GLU 414.A N ASN 410.A O no hydrogen 3.125 N/A ALA 415.A N VAL 412.A O no hydrogen 2.880 N/A ALA 416.A N ASN 413.A O no hydrogen 3.503 N/A ASN 418.A N ALA 416.A O no hydrogen 3.177 N/A ASN 418.A N SER 452.A O no hydrogen 3.243 N/A HIS 423.A N HIS 423.A ND1 no hydrogen 2.822 N/A HIS 423.A ND1 GLN 139.A OE1 no hydrogen 2.964 N/A ASP 424.A N SER 422.A OG no hydrogen 3.167 N/A THR 425.A N SER 422.A O no hydrogen 3.375 N/A THR 425.A OG1 SER 426.A O no hydrogen 2.914 N/A ARG 427.A N GLY 465.A O no hydrogen 2.818 N/A ARG 427.A NE CYS 471.A O no hydrogen 3.347 N/A ARG 427.A NH1 TYR 457.A O no hydrogen 2.641 N/A ARG 427.A NH1 ASP 459.A OD1 no hydrogen 2.976 N/A ARG 427.A NH2 TYR 457.A O no hydrogen 3.121 N/A ARG 427.A NH2 CYS 471.A O no hydrogen 3.140 N/A THR 430.A OG1 GLY 465.A O no hydrogen 2.995 N/A VAL 431.A N ARG 427.A O no hydrogen 2.961 N/A CYS 432.A N ILE 428.A O no hydrogen 2.903 N/A CYS 432.A SG ILE 428.A O no hydrogen 2.893 N/A GLY 433.A N THR 430.A O no hydrogen 2.741 N/A GLY 434.A N LEU 429.A O no hydrogen 2.652 N/A ASP 435.A N CYS 432.A O no hydrogen 3.180 N/A ARG 437.A NE ASP 435.A OD1 no hydrogen 3.408 N/A ARG 437.A NE ASP 435.A OD2 no hydrogen 3.477 N/A ARG 437.A NH2 ASP 435.A OD2 no hydrogen 3.040 N/A LYS 438.A N ASP 435.A OD1 no hydrogen 3.334 N/A LYS 438.A NZ ASP 435.A OD2 no hydrogen 3.379 N/A VAL 439.A N ASP 435.A O no hydrogen 3.501 N/A LYS 440.A N ILE 436.A O no hydrogen 2.981 N/A LYS 440.A NZ GLU 485.A OE1 no hydrogen 2.868 N/A LEU 441.A N ARG 437.A O no hydrogen 3.303 N/A LEU 442.A N LYS 438.A O no hydrogen 3.060 N/A PHE 443.A N VAL 439.A O no hydrogen 2.940 N/A LEU 444.A N LYS 440.A O no hydrogen 2.993 N/A PHE 445.A N LEU 441.A O no hydrogen 3.064 N/A GLN 446.A N LEU 442.A O no hydrogen 3.063 N/A LEU 447.A N PHE 443.A O no hydrogen 2.910 N/A THR 448.A N LEU 444.A O no hydrogen 2.998 N/A THR 448.A OG1 LEU 444.A O no hydrogen 2.729 N/A THR 448.A OG1 PHE 445.A O no hydrogen 3.210 N/A THR 448.A OG1 TYR 522.A OH no hydrogen 2.594 N/A PHE 449.A N GLN 446.A O no hydrogen 3.380 N/A THR 450.A OG1 GLY 506.A O no hydrogen 2.473 N/A SER 452.A N ALA 416.A O no hydrogen 2.622 N/A SER 452.A OG VAL 132.A O no hydrogen 3.049 N/A CYS 454.A N ASN 418.A O no hydrogen 2.797 N/A CYS 454.A SG ILE 455.A O no hydrogen 3.868 N/A ILE 455.A N TRP 137.A O no hydrogen 2.856 N/A TYR 456.A OH CYS 471.A O no hydrogen 2.905 N/A TYR 457.A N GLN 139.A O no hydrogen 2.984 N/A TYR 457.A OH LYS 473.A O no hydrogen 2.706 N/A GLY 458.A N TYR 138.A OH no hydrogen 3.230 N/A GLY 458.A N GLU 460.A OE1 no hydrogen 3.298 N/A ASP 459.A N TYR 456.A O no hydrogen 2.927 N/A GLU 460.A N GLU 460.A OE2 no hydrogen 2.426 N/A ILE 461.A N GLY 458.A O no hydrogen 2.732 N/A GLY 462.A N ASP 459.A O no hydrogen 3.313 N/A MET 463.A N GLY 458.A O no hydrogen 3.496 N/A GLY 465.A N THR 430.A OG1 no hydrogen 2.921 N/A ASP 468.A N ASN 467.A OD1 no hydrogen 2.798 N/A GLU 470.A N ASN 467.A O no hydrogen 3.135 N/A CYS 471.A SG SER 422.A O no hydrogen 4.015 N/A CYS 471.A SG HIS 423.A O no hydrogen 3.190 N/A ARG 472.A N PRO 469.A O no hydrogen 2.782 N/A ARG 472.A NE HIS 423.A O no hydrogen 2.966 N/A ARG 472.A NH2 HIS 423.A O no hydrogen 2.919 N/A LYS 473.A NZ THR 464.A O no hydrogen 2.614 N/A LYS 473.A NZ GLU 470.A O no hydrogen 3.237 N/A MET 475.A N ARG 144.A O no hydrogen 2.767 N/A TRP 477.A NE1 PHE 145.A O no hydrogen 2.784 N/A GLN 481.A N ASP 478.A O no hydrogen 2.936 N/A GLN 482.A N PRO 479.A O no hydrogen 3.069 N/A ASN 483.A N ILE 461.A O no hydrogen 3.030 N/A LYS 484.A NZ GLN 482.A OE1 no hydrogen 3.164 N/A LEU 486.A N ASN 483.A OD1 no hydrogen 2.863 N/A HIS 487.A N ASN 483.A O no hydrogen 3.504 N/A GLN 488.A N LYS 484.A O no hydrogen 3.137 N/A HIS 489.A N GLU 485.A O no hydrogen 3.098 N/A HIS 489.A NE2 LYS 440.A O no hydrogen 2.999 N/A VAL 490.A N LEU 486.A O no hydrogen 2.801 N/A LYS 491.A N HIS 487.A O no hydrogen 2.903 N/A LYS 491.A NZ ASP 187.A O no hydrogen 2.873 N/A LYS 491.A NZ ASP 187.A OD1 no hydrogen 3.126 N/A GLN 492.A N GLN 488.A O no hydrogen 2.654 N/A LEU 493.A N HIS 489.A O no hydrogen 3.020 N/A ILE 494.A N VAL 490.A O no hydrogen 2.892 N/A ALA 495.A N LYS 491.A O no hydrogen 3.262 N/A LEU 496.A N GLN 492.A O no hydrogen 3.051 N/A ARG 497.A N LEU 493.A O no hydrogen 2.818 N/A ARG 497.A NE LEU 447.A O no hydrogen 2.890 N/A ARG 497.A NH2 PHE 449.A O no hydrogen 2.777 N/A ARG 497.A NH2 GLY 451.A O no hydrogen 3.403 N/A ARG 497.A NH2 LEU 503.A O no hydrogen 3.477 N/A LYS 498.A N ILE 494.A O no hydrogen 3.269 N/A LYS 498.A N ALA 495.A O no hydrogen 2.730 N/A GLN 499.A N ALA 495.A O no hydrogen 3.110 N/A TYR 500.A N LEU 496.A O no hydrogen 2.950 N/A ARG 501.A NH2 ASP 526.A O no hydrogen 2.945 N/A SER 502.A N GLU 529.A OE1 no hydrogen 2.425 N/A SER 502.A OG GLU 529.A OE1 no hydrogen 2.795 N/A LEU 503.A N TYR 500.A O no hydrogen 3.046 N/A ARG 504.A N ARG 501.A O no hydrogen 2.563 N/A ARG 504.A NE ARG 497.A O no hydrogen 3.061 N/A ARG 504.A NH2 LYS 498.A O no hydrogen 2.719 N/A ARG 505.A N ARG 501.A O no hydrogen 2.892 N/A ARG 505.A NE ASP 134.A OD1 no hydrogen 2.528 N/A ARG 505.A NE ASP 134.A OD2 no hydrogen 3.420 N/A ARG 505.A NH2 ASP 130.A OD1 no hydrogen 2.739 N/A ARG 505.A NH2 ASP 130.A OD2 no hydrogen 3.294 N/A ARG 505.A NH2 ASP 134.A OD2 no hydrogen 2.787 N/A GLY 506.A N SER 502.A O no hydrogen 3.084 N/A GLU 507.A N THR 525.A O no hydrogen 2.992 N/A SER 509.A N LYS 523.A O no hydrogen 3.359 N/A LEU 511.A N ILE 521.A O no hydrogen 2.701 N/A LEU 520.A N ILE 535.A O no hydrogen 3.066 N/A TYR 522.A N VAL 533.A O no hydrogen 3.150 N/A TYR 522.A OH THR 448.A OG1 no hydrogen 2.594 N/A LYS 523.A N SER 509.A O no hydrogen 3.027 N/A LYS 524.A N VAL 531.A O no hydrogen 3.057 N/A LYS 524.A NZ THR 450.A OG1 no hydrogen 2.671 N/A LYS 524.A NZ SER 502.A O no hydrogen 3.153 N/A LYS 524.A NZ GLY 506.A O no hydrogen 2.665 N/A LYS 524.A NZ GLU 507.A O no hydrogen 3.355 N/A THR 525.A N GLU 507.A O no hydrogen 2.878 N/A ASP 528.A N ASP 526.A OD2 no hydrogen 2.501 N/A THR 530.A OG1 ASP 528.A O no hydrogen 3.416 N/A THR 530.A OG1 GLU 529.A O no hydrogen 2.604 N/A VAL 531.A N LYS 524.A O no hydrogen 3.273 N/A LEU 532.A N TYR 583.A O no hydrogen 2.615 N/A VAL 533.A N TYR 522.A O no hydrogen 2.889 N/A ILE 534.A N VAL 581.A O no hydrogen 3.120 N/A ILE 535.A N LEU 520.A O no hydrogen 2.886 N/A ASN 536.A N GLY 579.A O no hydrogen 2.846 N/A ASN 536.A ND2 GLN 540.A O no hydrogen 2.839 N/A ASN 536.A ND2 PRO 576.A O no hydrogen 3.170 N/A ARG 537.A N ASN 518.A O no hydrogen 2.823 N/A ARG 537.A NE ARG 537.A O no hydrogen 3.185 N/A ARG 537.A NH1 PHE 386.A O no hydrogen 2.763 N/A ARG 537.A NH1 ILE 392.A O no hydrogen 2.920 N/A ARG 537.A NH2 ASN 518.A OD1 no hydrogen 3.468 N/A SER 538.A N ASN 536.A O no hydrogen 3.094 N/A SER 538.A OG ASN 536.A OD1 no hydrogen 3.226 N/A SER 538.A OG GLN 540.A O no hydrogen 3.250 N/A ALA 542.A N LEU 575.A O no hydrogen 2.932 N/A ILE 544.A N THR 573.A O no hydrogen 2.761 N/A ILE 546.A N LEU 571.A O no hydrogen 3.155 N/A THR 553.A OG1 ASP 549.A O no hydrogen 2.398 N/A TRP 554.A N GLU 586.A O no hydrogen 2.745 N/A LEU 555.A N PHE 564.A O no hydrogen 3.063 N/A VAL 556.A N ALA 584.A O no hydrogen 2.879 N/A ASN 557.A N GLU 562.A O no hydrogen 3.064 N/A LEU 558.A N LEU 582.A O no hydrogen 2.772 N/A LEU 559.A N ASN 557.A OD1 no hydrogen 2.867 N/A THR 560.A N ASN 557.A OD1 no hydrogen 2.900 N/A GLY 561.A N ASN 557.A O no hydrogen 2.712 N/A GLU 562.A N THR 560.A OG1 no hydrogen 3.134 N/A PHE 564.A N LEU 555.A O no hydrogen 3.242 N/A ALA 566.A N THR 553.A O no hydrogen 3.215 N/A THR 573.A N ILE 544.A O no hydrogen 2.952 N/A THR 573.A OG1 TYR 583.A OH no hydrogen 3.044 N/A SER 574.A OG ASP 543.A OD2 no hydrogen 3.007 N/A LEU 575.A N ALA 542.A O no hydrogen 3.017 N/A TYR 578.A OH GLU 390.A OE1 no hydrogen 2.450 N/A GLY 579.A N PRO 576.A O no hydrogen 2.860 N/A TYR 583.A N LEU 532.A O no hydrogen 2.725 N/A TYR 583.A OH THR 573.A OG1 no hydrogen 3.044 N/A ALA 584.A N VAL 556.A O no hydrogen 2.958 N/A ILE 585.A N THR 530.A O no hydrogen 2.694 N/A GLU 586.A N TRP 554.A O no hydrogen 2.608 N/A TRP 588.A N GLY 552.A O no hydrogen 2.609 N/A