Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4k2r_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ALA 5.A N ASP 2.A O no hydrogen 3.428 N/A PHE 10.A N LEU 7.A O no hydrogen 3.111 N/A TYR 11.A N LEU 35.A O no hydrogen 2.995 N/A TYR 11.A OH CYS 101.A O no hydrogen 2.524 N/A SER 13.A N GLN 110.A O no hydrogen 2.800 N/A SER 15.A OG GLU 18.A OE1 no hydrogen 2.802 N/A GLU 18.A N SER 15.A OG no hydrogen 3.339 N/A ALA 19.A N SER 15.A O no hydrogen 3.326 N/A GLU 20.A N ARG 16.A O no hydrogen 2.706 N/A GLU 21.A N ALA 17.A O no hydrogen 2.588 N/A HIS 22.A N GLU 18.A O no hydrogen 2.992 N/A HIS 22.A ND1 GLU 18.A O no hydrogen 3.104 N/A LEU 23.A N ALA 19.A O no hydrogen 3.065 N/A LYS 24.A N GLU 20.A O no hydrogen 3.098 N/A LYS 24.A N GLU 21.A O no hydrogen 2.575 N/A LEU 25.A N GLU 21.A O no hydrogen 3.320 N/A GLY 27.A N LYS 24.A O no hydrogen 2.756 N/A GLY 31.A N VAL 50.A O no hydrogen 3.153 N/A LEU 32.A N ALA 29.A O no hydrogen 3.069 N/A PHE 33.A N LYS 99.A O no hydrogen 3.150 N/A LEU 34.A N SER 48.A O no hydrogen 3.113 N/A LEU 35.A N PHE 9.A O no hydrogen 3.039 N/A ARG 36.A N VAL 46.A O no hydrogen 3.184 N/A ARG 36.A NE SER 48.A OG no hydrogen 3.215 N/A ARG 36.A NH2 HIS 57.A ND1 no hydrogen 2.808 N/A GLN 37.A N GLY 12.A O no hydrogen 3.005 N/A CYS 38.A N GLY 44.A O no hydrogen 3.201 N/A ARG 40.A NH1 GLU 224.A O no hydrogen 2.674 N/A SER 41.A OG GLU 61.A OE2 no hydrogen 2.132 N/A LEU 42.A N LYS 227.A O no hydrogen 2.792 N/A TYR 45.A N ILE 60.A O no hydrogen 2.956 N/A TYR 45.A OH ASP 2.A OD1 no hydrogen 3.392 N/A VAL 46.A N ARG 36.A O no hydrogen 2.771 N/A LEU 47.A N PHE 58.A O no hydrogen 2.597 N/A SER 48.A N LEU 34.A O no hydrogen 3.212 N/A SER 48.A OG HIS 57.A ND1 no hydrogen 2.697 N/A LEU 49.A N HIS 56.A O no hydrogen 2.846 N/A VAL 50.A N LEU 32.A O no hydrogen 3.099 N/A HIS 51.A N ARG 54.A O no hydrogen 3.010 N/A ASP 52.A N ASP 30.A OD1 no hydrogen 2.541 N/A ASP 52.A N ASP 30.A OD2 no hydrogen 2.894 N/A ARG 54.A N HIS 51.A O no hydrogen 3.036 N/A HIS 56.A N LEU 49.A O no hydrogen 2.864 N/A HIS 57.A ND1 SER 48.A OG no hydrogen 2.697 N/A HIS 57.A NE2 GLU 20.A OE1 no hydrogen 2.740 N/A PHE 58.A N LEU 47.A O no hydrogen 2.480 N/A ILE 60.A N TYR 45.A O no hydrogen 2.826 N/A GLU 61.A N ALA 69.A O no hydrogen 3.160 N/A GLN 63.A N THR 67.A O no hydrogen 2.854 N/A ASN 65.A ND2 THR 67.A OG1 no hydrogen 2.822 N/A GLY 66.A N GLN 63.A O no hydrogen 3.461 N/A TYR 68.A N HIS 76.A O no hydrogen 2.764 N/A ALA 69.A N GLU 61.A O no hydrogen 3.179 N/A GLY 73.A N ILE 70.A O no hydrogen 2.658 N/A LYS 74.A NZ ASP 91.A OD1 no hydrogen 3.567 N/A LYS 74.A NZ ASP 91.A OD2 no hydrogen 2.631 N/A HIS 76.A N TYR 68.A O no hydrogen 2.854 N/A GLU 81.A N GLU 81.A OE2 no hydrogen 2.530 N/A LEU 82.A N GLY 78.A O no hydrogen 2.763 N/A CYS 83.A N PRO 79.A O no hydrogen 2.721 N/A CYS 83.A SG PRO 79.A O no hydrogen 3.802 N/A GLU 84.A N ALA 80.A O no hydrogen 2.992 N/A GLU 84.A N GLU 81.A O no hydrogen 2.950 N/A PHE 85.A N GLU 81.A O no hydrogen 2.999 N/A TYR 86.A N LEU 82.A O no hydrogen 3.355 N/A SER 87.A N GLU 84.A O no hydrogen 3.067 N/A SER 87.A OG CYS 83.A O no hydrogen 2.408 N/A ARG 88.A N PHE 85.A O no hydrogen 3.100 N/A LEU 93.A N PRO 90.A O no hydrogen 3.116 N/A CYS 95.A SG HIS 51.A ND1 no hydrogen 3.522 N/A CYS 95.A SG ASN 96.A O no hydrogen 3.841 N/A ASN 96.A ND2 SER 87.A O no hydrogen 2.965 N/A LEU 97.A N TYR 86.A O no hydrogen 2.874 N/A ARG 98.A N GLY 31.A O no hydrogen 2.649 N/A ARG 98.A NE ASN 96.A OD1 no hydrogen 2.266 N/A LYS 99.A N GLY 31.A O no hydrogen 2.753 N/A LYS 99.A NZ PRO 100.A O no hydrogen 2.190 N/A CYS 101.A N PHE 33.A O no hydrogen 2.698 N/A CYS 101.A SG TYR 11.A OH no hydrogen 3.470 N/A CYS 101.A SG HIS 22.A O no hydrogen 3.788 N/A ARG 103.A N PRO 8.A O no hydrogen 2.581 N/A ARG 103.A NE LEU 107.A O no hydrogen 3.162 N/A ARG 103.A NH1 LEU 107.A O no hydrogen 3.309 N/A ARG 103.A NH2 PHE 10.A O no hydrogen 2.856 N/A LEU 107.A N PRO 104.A O no hydrogen 3.234 N/A GLN 110.A N TYR 11.A O no hydrogen 3.167 N/A GLY 112.A N ASP 115.A OD2 no hydrogen 2.373 N/A CYS 116.A N GLY 112.A O no hydrogen 3.274 N/A CYS 116.A SG GLY 112.A O no hydrogen 3.579 N/A LEU 117.A N VAL 113.A O no hydrogen 2.788 N/A ARG 118.A N PHE 114.A O no hydrogen 2.676 N/A ARG 118.A NH1 ASP 115.A OD1 no hydrogen 2.947 N/A ARG 118.A NH2 ASP 115.A OD1 no hydrogen 3.314 N/A ASP 119.A N ASP 115.A O no hydrogen 2.864 N/A ALA 120.A N CYS 116.A O no hydrogen 2.872 N/A MET 121.A N LEU 117.A O no hydrogen 2.995 N/A VAL 122.A N ARG 118.A O no hydrogen 2.926 N/A ARG 123.A N ASP 119.A O no hydrogen 3.117 N/A ASP 124.A N ALA 120.A O no hydrogen 3.103 N/A TYR 125.A N MET 121.A O no hydrogen 2.840 N/A TYR 125.A N VAL 122.A O no hydrogen 2.848 N/A VAL 126.A N VAL 122.A O no hydrogen 3.261 N/A ARG 127.A N ARG 123.A O no hydrogen 3.082 N/A GLN 128.A N ASP 124.A O no hydrogen 3.141 N/A GLN 128.A N TYR 125.A O no hydrogen 3.261 N/A THR 129.A N TYR 125.A O no hydrogen 2.750 N/A THR 129.A OG1 TYR 125.A O no hydrogen 2.380 N/A TRP 130.A N VAL 126.A O no hydrogen 2.922 N/A TRP 130.A NE1 ASP 265.A OD1 no hydrogen 3.137 N/A GLU 138.A N GLY 134.A O no hydrogen 3.188 N/A GLN 139.A N GLU 135.A O no hydrogen 2.646 N/A ALA 140.A N ALA 136.A O no hydrogen 3.137 N/A ILE 141.A N LEU 137.A O no hydrogen 3.075 N/A ILE 142.A N GLU 138.A O no hydrogen 3.121 N/A SER 143.A N GLN 139.A O no hydrogen 3.523 N/A GLN 144.A N ALA 140.A O no hydrogen 3.200 N/A GLN 144.A NE2 SER 143.A O no hydrogen 2.961 N/A GLN 144.A NE2 SER 143.A OG no hydrogen 2.975 N/A GLN 144.A NE2 GLU 394.A OE1 no hydrogen 2.880 N/A ALA 145.A N ILE 141.A O no hydrogen 2.737 N/A VAL 148.A N GLN 144.A O no hydrogen 3.048 N/A GLU 149.A N ALA 145.A O no hydrogen 3.107 N/A LYS 150.A NZ ALA 538.A O no hydrogen 3.376 N/A LYS 150.A NZ LYS 540.A O no hydrogen 3.035 N/A LEU 151.A N GLN 147.A O no hydrogen 2.988 N/A ILE 152.A N VAL 148.A O no hydrogen 2.668 N/A ALA 153.A N GLU 149.A O no hydrogen 3.200 N/A THR 154.A N LEU 151.A O no hydrogen 3.021 N/A THR 154.A OG1 LYS 150.A O no hydrogen 3.078 N/A THR 154.A OG1 LEU 151.A O no hydrogen 2.656 N/A THR 155.A N ILE 152.A O no hydrogen 3.114 N/A THR 155.A OG1 LEU 151.A O no hydrogen 2.975 N/A GLU 158.A N GLU 158.A OE2 no hydrogen 2.706 N/A ARG 159.A N ALA 156.A O no hydrogen 3.237 N/A MET 160.A N HIS 157.A O no hydrogen 2.749 N/A TYR 163.A N MET 160.A O no hydrogen 3.440 N/A HIS 164.A N LEU 188.A O no hydrogen 2.882 N/A HIS 164.A NE2 CYS 253.A O no hydrogen 2.803 N/A THR 168.A N GLU 171.A OE1 no hydrogen 2.601 N/A ALA 172.A N THR 168.A O no hydrogen 2.584 N/A GLU 173.A N ARG 169.A O no hydrogen 2.759 N/A ARG 174.A N GLU 170.A O no hydrogen 2.355 N/A LYS 175.A N GLU 171.A O no hydrogen 2.678 N/A LEU 176.A N ALA 172.A O no hydrogen 3.067 N/A TYR 177.A N GLU 173.A O no hydrogen 3.283 N/A SER 178.A N LYS 175.A O no hydrogen 2.771 N/A GLN 181.A NE2 TYR 177.A O no hydrogen 2.814 N/A THR 182.A OG1 ASP 183.A O no hydrogen 3.071 N/A GLY 184.A N ILE 202.A O no hydrogen 2.887 N/A LYS 185.A NZ LEU 176.A O no hydrogen 3.153 N/A LYS 185.A NZ ALA 180.A O no hydrogen 2.935 N/A LEU 187.A N SER 200.A O no hydrogen 2.937 N/A LEU 188.A N TRP 162.A O no hydrogen 2.935 N/A ARG 189.A N ALA 198.A O no hydrogen 2.949 N/A ARG 189.A NE SER 200.A OG no hydrogen 3.261 N/A ARG 189.A NH2 HIS 209.A ND1 no hydrogen 2.780 N/A ARG 191.A N THR 196.A O no hydrogen 2.833 N/A THR 196.A N GLU 193.A O no hydrogen 2.930 N/A THR 196.A OG1 GLU 193.A O no hydrogen 1.919 N/A TYR 197.A N ILE 212.A O no hydrogen 3.208 N/A ALA 198.A N ARG 189.A O no hydrogen 2.873 N/A LEU 199.A N TYR 210.A O no hydrogen 2.780 N/A SER 200.A N LEU 187.A O no hydrogen 2.924 N/A SER 200.A OG HIS 209.A ND1 no hydrogen 3.077 N/A LEU 201.A N TYR 208.A O no hydrogen 2.882 N/A ILE 202.A N LYS 185.A O no hydrogen 2.852 N/A TYR 203.A N THR 206.A O no hydrogen 2.821 N/A GLY 204.A N ASP 183.A OD1 no hydrogen 3.062 N/A THR 206.A N TYR 203.A O no hydrogen 2.554 N/A THR 206.A OG1 TYR 203.A O no hydrogen 3.495 N/A THR 206.A OG1 GLY 204.A O no hydrogen 2.941 N/A VAL 207.A N TYR 177.A OH no hydrogen 3.105 N/A TYR 208.A N LEU 201.A O no hydrogen 2.661 N/A HIS 209.A ND1 SER 200.A OG no hydrogen 3.077 N/A HIS 209.A NE2 GLU 173.A OE1 no hydrogen 3.286 N/A TYR 210.A N LEU 199.A O no hydrogen 3.011 N/A ILE 212.A N TYR 197.A O no hydrogen 2.772 N/A SER 213.A N CYS 221.A O no hydrogen 3.345 N/A GLN 214.A NE2 GLY 218.A O no hydrogen 3.421 N/A ASP 215.A N LYS 219.A O no hydrogen 3.097 N/A LYS 219.A NZ SER 41.A OG no hydrogen 3.078 N/A LYS 219.A NZ LEU 42.A O no hydrogen 3.425 N/A LYS 219.A NZ GLU 61.A OE2 no hydrogen 2.778 N/A TYR 220.A N PHE 228.A O no hydrogen 2.655 N/A CYS 221.A SG ILE 222.A O no hydrogen 3.707 N/A CYS 221.A SG GLY 225.A O no hydrogen 3.453 N/A CYS 221.A SG THR 226.A O no hydrogen 3.975 N/A GLY 225.A N ILE 222.A O no hydrogen 2.194 N/A THR 226.A N GLU 224.A OE1 no hydrogen 2.979 N/A THR 226.A OG1 GLU 224.A OE1 no hydrogen 2.600 N/A THR 226.A OG1 GLU 224.A OE2 no hydrogen 3.033 N/A LYS 227.A N ARG 40.A O no hydrogen 3.202 N/A LYS 227.A NZ GLY 225.A O no hydrogen 2.754 N/A PHE 228.A N TYR 220.A O no hydrogen 2.876 N/A THR 230.A OG1 GLN 233.A OE1 no hydrogen 2.622 N/A LEU 234.A N THR 230.A O no hydrogen 3.198 N/A VAL 235.A N LEU 231.A O no hydrogen 2.732 N/A GLU 236.A N TRP 232.A O no hydrogen 2.832 N/A TYR 237.A N GLN 233.A O no hydrogen 2.728 N/A TYR 237.A N LEU 234.A O no hydrogen 2.967 N/A LEU 238.A N LEU 234.A O no hydrogen 2.928 N/A LEU 238.A N VAL 235.A O no hydrogen 3.073 N/A LYS 239.A NZ GLU 236.A OE1 no hydrogen 3.092 N/A LEU 240.A N TYR 237.A O no hydrogen 3.210 N/A LYS 241.A N TYR 237.A O no hydrogen 3.000 N/A LEU 245.A N ALA 242.A O no hydrogen 3.007 N/A ILE 246.A N TYR 210.A OH no hydrogen 2.970 N/A LEU 249.A N LEU 238.A O no hydrogen 3.301 N/A LYS 250.A N GLY 184.A O no hydrogen 3.201 N/A LYS 250.A NZ TYR 247.A OH no hydrogen 2.829 N/A CYS 253.A N PHE 186.A O no hydrogen 2.766 N/A SER 256.A N ASN 255.A OD1 no hydrogen 2.262 N/A LYS 258.A NZ ASP 265.A OD1 no hydrogen 3.505 N/A ARG 260.A NH1 GLN 144.A OE1 no hydrogen 2.993 N/A ARG 260.A NH1 PRO 261.A O no hydrogen 2.956 N/A ARG 260.A NH2 GLU 394.A OE1 no hydrogen 3.138 N/A MET 262.A N ASP 265.A OD2 no hydrogen 2.922 N/A ASP 265.A N MET 262.A O no hydrogen 3.414 N/A THR 266.A N PRO 263.A O no hydrogen 3.443 N/A THR 266.A OG1 PRO 263.A O no hydrogen 2.647 N/A TYR 269.A OH ALA 136.A O no hydrogen 2.813 N/A TYR 273.A N SER 271.A OG no hydrogen 3.328 N/A TYR 273.A OH ILE 356.A O no hydrogen 2.888 N/A SER 274.A OG SER 271.A O no hydrogen 2.350 N/A LEU 279.A N ASP 275.A O no hydrogen 2.779 N/A LYS 280.A N GLU 277.A O no hydrogen 3.042 N/A LYS 282.A NZ HIS 345.A O no hydrogen 3.130 N/A LEU 286.A N VAL 358.A O no hydrogen 2.639 N/A ARG 288.A NH1 ARG 288.A O no hydrogen 2.952 N/A ARG 288.A NH1 LEU 291.A O no hydrogen 3.003 N/A LEU 291.A N ARG 288.A O no hydrogen 3.351 N/A LEU 292.A N VAL 310.A O no hydrogen 2.905 N/A ALA 294.A N GLN 308.A O no hydrogen 3.026 N/A LEU 298.A N VAL 306.A O no hydrogen 2.757 N/A CYS 300.A SG GLU 297.A OE2 no hydrogen 3.839 N/A GLY 301.A N GLY 304.A O no hydrogen 3.236 N/A VAL 306.A N GLY 299.A O no hydrogen 3.111 N/A ARG 307.A N ILE 322.A O no hydrogen 2.845 N/A GLY 309.A N VAL 320.A O no hydrogen 2.975 N/A VAL 310.A N LEU 292.A O no hydrogen 3.136 N/A TYR 311.A N ILE 318.A O no hydrogen 2.742 N/A ARG 312.A N ASN 290.A O no hydrogen 2.791 N/A MET 313.A N LYS 316.A O no hydrogen 2.652 N/A LYS 315.A N GLU 278.A OE2 no hydrogen 2.694 N/A LYS 315.A NZ GLU 278.A OE1 no hydrogen 3.103 N/A ILE 318.A N TYR 311.A O no hydrogen 2.794 N/A VAL 320.A N GLY 309.A O no hydrogen 3.180 N/A ALA 321.A N MET 368.A O no hydrogen 2.793 N/A ILE 322.A N ARG 307.A O no hydrogen 2.912 N/A LYS 323.A N LEU 366.A O no hydrogen 2.938 N/A VAL 324.A N SER 305.A O no hydrogen 2.896 N/A LYS 326.A N PHE 303.A O no hydrogen 2.731 N/A LYS 331.A N THR 329.A O no hydrogen 2.450 N/A ASP 333.A N LYS 331.A O no hydrogen 2.227 N/A MET 337.A N ASP 333.A O no hydrogen 3.173 N/A MET 338.A N THR 334.A O no hydrogen 3.065 N/A ARG 339.A N GLU 335.A O no hydrogen 2.491 N/A ARG 339.A NE GLU 336.A OE2 no hydrogen 3.084 N/A GLU 340.A N GLU 336.A O no hydrogen 3.052 N/A ALA 341.A N MET 337.A O no hydrogen 2.871 N/A GLN 342.A N MET 338.A O no hydrogen 2.916 N/A GLN 342.A NE2 GLN 342.A O no hydrogen 2.217 N/A ILE 343.A N GLU 340.A O no hydrogen 2.214 N/A MET 344.A N GLU 340.A O no hydrogen 3.070 N/A HIS 345.A N ALA 341.A O no hydrogen 2.670 N/A HIS 345.A NE2 ILE 356.A O no hydrogen 2.634 N/A GLN 346.A N ILE 343.A O no hydrogen 3.271 N/A ASP 348.A N TYR 405.A OH no hydrogen 2.479 N/A ASN 349.A ND2 GLN 139.A OE1 no hydrogen 3.143 N/A TYR 351.A N ASN 349.A OD1 no hydrogen 2.800 N/A ILE 352.A N ASN 349.A O no hydrogen 3.417 N/A VAL 353.A N ILE 431.A O no hydrogen 2.719 N/A ARG 354.A N GLU 369.A OE1 no hydrogen 3.146 N/A ARG 354.A NE ASP 348.A OD1 no hydrogen 2.988 N/A ARG 354.A NH1 VAL 268.A O no hydrogen 3.177 N/A ARG 354.A NH1 GLU 369.A OE2 no hydrogen 2.640 N/A ARG 354.A NH2 TYR 269.A O no hydrogen 3.241 N/A ARG 354.A NH2 ASP 348.A OD1 no hydrogen 3.046 N/A ILE 356.A N VAL 367.A O no hydrogen 2.802 N/A GLY 357.A N VAL 367.A O no hydrogen 3.321 N/A VAL 358.A N LEU 284.A O no hydrogen 2.834 N/A CYS 359.A N MET 365.A O no hydrogen 3.259 N/A CYS 359.A SG LEU 286.A O no hydrogen 3.907 N/A ALA 361.A N ALA 363.A O no hydrogen 3.000 N/A GLU 362.A N GLU 362.A OE1 no hydrogen 2.772 N/A MET 365.A N CYS 359.A O no hydrogen 2.923 N/A LEU 366.A N LYS 323.A O no hydrogen 2.785 N/A VAL 367.A N GLY 357.A O no hydrogen 3.069 N/A MET 368.A N ALA 321.A O no hydrogen 2.943 N/A GLU 369.A N ARG 354.A O no hydrogen 3.031 N/A LEU 376.A N VAL 421.A O no hydrogen 2.689 N/A PHE 379.A N PRO 375.A O no hydrogen 3.073 N/A LEU 380.A N LEU 376.A O no hydrogen 3.120 N/A LEU 380.A N HIS 377.A O no hydrogen 3.256 N/A VAL 381.A N LYS 378.A O no hydrogen 3.034 N/A LYS 383.A N LEU 380.A O no hydrogen 3.049 N/A LYS 383.A NZ PHE 379.A O no hydrogen 3.360 N/A ARG 384.A NH2 PRO 499.A O no hydrogen 2.503 N/A ILE 387.A N LYS 383.A O no hydrogen 2.942 N/A ASN 391.A ND2 ASN 391.A O no hydrogen 2.350 N/A ASN 391.A ND2 ARG 426.A O no hydrogen 3.024 N/A VAL 392.A N PRO 388.A O no hydrogen 3.323 N/A ALA 393.A N VAL 389.A O no hydrogen 2.978 N/A GLU 394.A N SER 390.A O no hydrogen 2.810 N/A LEU 395.A N VAL 392.A O no hydrogen 3.008 N/A LEU 396.A N VAL 392.A O no hydrogen 2.921 N/A HIS 397.A N ALA 393.A O no hydrogen 3.012 N/A GLN 398.A N GLU 394.A O no hydrogen 3.280 N/A GLN 398.A NE2 SER 143.A OG no hydrogen 3.390 N/A GLN 398.A NE2 HIS 427.A O no hydrogen 2.666 N/A VAL 399.A N LEU 395.A O no hydrogen 3.146 N/A SER 400.A N LEU 396.A O no hydrogen 3.032 N/A SER 400.A OG LEU 396.A O no hydrogen 3.323 N/A SER 400.A OG HIS 397.A O no hydrogen 2.197 N/A MET 401.A N HIS 397.A O no hydrogen 2.916 N/A GLY 402.A N GLN 398.A O no hydrogen 3.176 N/A GLY 402.A N VAL 399.A O no hydrogen 3.015 N/A MET 403.A N VAL 399.A O no hydrogen 2.932 N/A LYS 404.A N SER 400.A O no hydrogen 2.606 N/A TYR 405.A N MET 401.A O no hydrogen 3.264 N/A LEU 406.A N GLY 402.A O no hydrogen 2.859 N/A GLU 407.A N MET 403.A O no hydrogen 2.709 N/A GLU 408.A N LYS 404.A O no hydrogen 2.988 N/A LYS 409.A N TYR 405.A O no hydrogen 3.259 N/A LYS 409.A N LEU 406.A O no hydrogen 3.325 N/A ASN 410.A N GLU 407.A O no hydrogen 2.998 N/A PHE 411.A N LEU 406.A O no hydrogen 3.061 N/A HIS 413.A N ASP 458.A OD2 no hydrogen 3.238 N/A HIS 413.A NE2 SER 432.A O no hydrogen 2.796 N/A ARG 414.A N PHE 434.A O no hydrogen 3.321 N/A ASN 415.A N HIS 413.A ND1 no hydrogen 2.948 N/A ALA 418.A N GLU 468.A OE1 no hydrogen 3.294 N/A ASN 420.A N ALA 417.A O no hydrogen 2.933 N/A ASN 420.A ND2 ASN 415.A O no hydrogen 2.079 N/A VAL 421.A N ALA 418.A O no hydrogen 2.778 N/A LEU 422.A N LYS 430.A O no hydrogen 2.761 N/A LEU 423.A N GLY 374.A O no hydrogen 3.146 N/A VAL 424.A N TYR 428.A O no hydrogen 2.663 N/A ASN 425.A N TYR 428.A O no hydrogen 3.407 N/A ASN 425.A ND2 MET 262.A O no hydrogen 3.445 N/A ARG 426.A NE ASN 391.A OD1 no hydrogen 3.256 N/A ARG 426.A NH2 ASN 391.A OD1 no hydrogen 3.197 N/A HIS 427.A N ASN 425.A OD1 no hydrogen 2.548 N/A HIS 427.A ND1 GLU 394.A OE2 no hydrogen 2.492 N/A HIS 427.A NE2 GLU 548.A OE2 no hydrogen 2.998 N/A TYR 428.A N ASN 425.A O no hydrogen 3.320 N/A TYR 428.A OH PRO 350.A O no hydrogen 2.346 N/A ALA 429.A N GLN 398.A OE1 no hydrogen 2.724 N/A LYS 430.A N LEU 422.A O no hydrogen 3.113 N/A LYS 430.A NZ VAL 268.A O no hydrogen 3.292 N/A LYS 430.A NZ PRO 350.A O no hydrogen 2.564 N/A LYS 430.A NZ GLU 369.A OE1 no hydrogen 3.090 N/A ILE 431.A N TYR 351.A O no hydrogen 2.759 N/A SER 432.A N ASN 420.A O no hydrogen 2.909 N/A SER 432.A OG ASN 420.A O no hydrogen 3.279 N/A SER 437.A OG GLY 435.A O no hydrogen 3.551 N/A LYS 441.A N TRP 438.A O no hydrogen 3.042 N/A LYS 441.A NZ PRO 476.A O no hydrogen 2.594 N/A LYS 441.A NZ TYR 477.A O no hydrogen 2.169 N/A TRP 442.A NE1 GLU 468.A OE1 no hydrogen 2.491 N/A TYR 443.A OH ASN 415.A OD1 no hydrogen 3.011 N/A GLU 446.A N GLU 446.A OE1 no hydrogen 2.708 N/A CYS 447.A N ALA 444.A O no hydrogen 3.327 N/A CYS 447.A SG ALA 444.A O no hydrogen 3.700 N/A CYS 447.A SG LYS 452.A O no hydrogen 3.666 N/A ASN 449.A N PRO 445.A O no hydrogen 2.770 N/A PHE 450.A N GLU 446.A O no hydrogen 2.959 N/A LYS 452.A N GLU 446.A O no hydrogen 2.896 N/A ARG 456.A NH1 GLU 518.A O no hydrogen 2.987 N/A SER 457.A N SER 454.A O no hydrogen 2.926 N/A SER 457.A OG SER 454.A O no hydrogen 2.534 N/A ASP 458.A N SER 454.A O no hydrogen 3.251 N/A VAL 459.A N SER 455.A O no hydrogen 2.855 N/A TRP 460.A N SER 457.A O no hydrogen 3.045 N/A SER 461.A N SER 457.A O no hydrogen 3.494 N/A SER 461.A OG ASP 458.A O no hydrogen 2.896 N/A TYR 462.A N ASP 458.A O no hydrogen 2.978 N/A TYR 462.A OH LEU 396.A O no hydrogen 2.544 N/A GLY 463.A N VAL 459.A O no hydrogen 3.369 N/A VAL 464.A N TRP 460.A O no hydrogen 3.047 N/A THR 465.A N SER 461.A O no hydrogen 2.642 N/A THR 465.A OG1 SER 461.A O no hydrogen 2.430 N/A MET 466.A N TYR 462.A O no hydrogen 2.599 N/A TRP 467.A N GLY 463.A O no hydrogen 3.095 N/A TRP 467.A NE1 GLU 496.A O no hydrogen 2.311 N/A GLU 468.A N VAL 464.A O no hydrogen 3.200 N/A ALA 469.A N THR 465.A O no hydrogen 3.011 N/A LEU 470.A N MET 466.A O no hydrogen 2.807 N/A SER 471.A OG TRP 467.A O no hydrogen 2.211 N/A TYR 472.A N ALA 469.A O no hydrogen 2.907 N/A TYR 472.A OH ILE 387.A O no hydrogen 2.863 N/A GLY 473.A N GLU 468.A O no hydrogen 2.836 N/A GLN 474.A N SER 471.A O no hydrogen 3.344 N/A GLU 484.A N LYS 481.A O no hydrogen 2.726 N/A VAL 485.A N GLY 482.A O no hydrogen 3.031 N/A ALA 487.A N PRO 483.A O no hydrogen 2.937 N/A PHE 488.A N GLU 484.A O no hydrogen 3.016 N/A ILE 489.A N VAL 485.A O no hydrogen 2.527 N/A GLU 490.A N MET 486.A O no hydrogen 3.054 N/A GLY 492.A N ILE 489.A O no hydrogen 2.937 N/A ARG 494.A NE TRP 513.A O no hydrogen 3.189 N/A ARG 494.A NH2 TRP 513.A O no hydrogen 2.804 N/A CYS 497.A SG PRO 498.A O no hydrogen 3.693 N/A CYS 497.A SG CYS 501.A O no hydrogen 3.577 N/A CYS 501.A SG PRO 502.A O no hydrogen 3.584 N/A TYR 506.A N PRO 502.A O no hydrogen 3.245 N/A TYR 506.A OH MET 495.A O no hydrogen 2.891 N/A ALA 507.A N PRO 503.A O no hydrogen 2.827 N/A LEU 508.A N LEU 505.A O no hydrogen 3.336 N/A MET 509.A N LEU 505.A O no hydrogen 3.108 N/A SER 510.A N TYR 506.A O no hydrogen 2.704 N/A SER 510.A OG TYR 506.A O no hydrogen 2.675 N/A ASP 511.A N ALA 507.A O no hydrogen 3.400 N/A CYS 512.A N LEU 508.A O no hydrogen 2.980 N/A CYS 512.A SG VAL 459.A O no hydrogen 3.460 N/A CYS 512.A SG LEU 508.A O no hydrogen 3.470 N/A TRP 513.A N SER 510.A O no hydrogen 2.754 N/A TYR 515.A OH GLU 490.A OE2 no hydrogen 2.370 N/A ARG 520.A N LYS 516.A O no hydrogen 3.240 N/A ARG 520.A NH1 TYR 515.A O no hydrogen 3.276 N/A ARG 520.A NH2 GLU 446.A OE2 no hydrogen 3.405 N/A ARG 520.A NH2 ARG 456.A O no hydrogen 2.452 N/A PHE 523.A N GLU 407.A OE2 no hydrogen 2.373 N/A THR 525.A N ASP 522.A OD1 no hydrogen 3.021 N/A THR 525.A OG1 ASP 522.A OD1 no hydrogen 3.114 N/A VAL 526.A N ASP 522.A O no hydrogen 3.153 N/A GLU 527.A N PHE 523.A O no hydrogen 2.802 N/A GLN 528.A N LEU 524.A O no hydrogen 3.109 N/A ARG 529.A N THR 525.A O no hydrogen 2.770 N/A ARG 529.A NH1 ASP 511.A OD2 no hydrogen 3.247 N/A MET 530.A N VAL 526.A O no hydrogen 2.442 N/A ARG 531.A N GLU 527.A O no hydrogen 2.934 N/A ARG 531.A N GLN 528.A O no hydrogen 3.080 N/A ARG 531.A NH2 GLU 527.A OE1 no hydrogen 2.960 N/A ALA 532.A N GLN 528.A O no hydrogen 3.443 N/A CYS 533.A N ARG 529.A O no hydrogen 3.364 N/A CYS 533.A SG ARG 529.A O no hydrogen 3.575 N/A TYR 534.A N MET 530.A O no hydrogen 3.000 N/A TYR 535.A N ARG 531.A O no hydrogen 2.682 N/A TYR 535.A OH ILE 142.A O no hydrogen 2.386 N/A SER 536.A N ALA 532.A O no hydrogen 2.949 N/A SER 536.A OG ALA 532.A O no hydrogen 3.387 N/A SER 536.A OG CYS 533.A O no hydrogen 2.708 N/A LEU 537.A N CYS 533.A O no hydrogen 3.225 N/A ALA 538.A N TYR 534.A O no hydrogen 2.900 N/A SER 539.A N TYR 535.A O no hydrogen 2.985 N/A SER 539.A OG TYR 535.A O no hydrogen 2.475 N/A SER 545.A N GLU 386.A O no hydrogen 3.209 N/A LEU 550.A N LEU 547.A O no hydrogen 3.015 N/A