Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 2rkw_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ILE 6.A N VAL 44.A O no hydrogen 2.727 N/A VAL 8.A N VAL 42.A O no hydrogen 2.684 N/A ASN 17.A N VAL 34.A O no hydrogen 3.160 N/A VAL 20.A N GLY 32.A O no hydrogen 2.780 N/A GLY 25.A N ASP 85.A OD1 no hydrogen 2.969 N/A THR 28.A OG1 ASP 26.A O no hydrogen 2.655 N/A ARG 30.A NE VAL 29.A O no hydrogen 2.689 N/A VAL 34.A N GLU 18.A O no hydrogen 2.868 N/A LEU 35.A N VAL 43.A O no hydrogen 2.788 N/A ASP 36.A N VAL 43.A O no hydrogen 3.247 N/A SER 38.A OG ASP 36.A OD2 no hydrogen 2.926 N/A VAL 42.A N VAL 8.A O no hydrogen 2.791 N/A VAL 43.A N ASP 36.A O no hydrogen 2.834 N/A VAL 44.A N ILE 6.A O no hydrogen 2.867 N/A GLN 45.A N GLN 33.A O no hydrogen 3.175 N/A THR 48.A OG1 PHE 47.A O no hydrogen 2.596 N/A THR 51.A OG1 PHE 7.A O no hydrogen 3.482 N/A THR 51.A OG1 ASP 85.A OD2 no hydrogen 3.242 N/A LEU 52.A N PHE 7.A O no hydrogen 3.037 N/A LEU 54.A N LEU 84.A O no hydrogen 3.002 N/A ALA 56.A N GLN 82.A O no hydrogen 3.029 N/A SER 57.A OG PRO 55.A O no hydrogen 3.484 N/A SER 57.A OG VAL 79.A O no hydrogen 2.682 N/A VAL 58.A N ASP 81.A OD2 no hydrogen 3.204 N/A LEU 60.A N SER 57.A O no hydrogen 3.137 N/A GLY 62.A N ALA 182.A O no hydrogen 2.969 N/A ARG 63.A N LEU 60.A O no hydrogen 3.306 N/A ARG 63.A NH1 ASP 73.A OD1 no hydrogen 2.868 N/A ARG 63.A NH2 PRO 76.A O no hydrogen 3.185 N/A ILE 64.A N ASP 73.A OD2 no hydrogen 3.400 N/A LEU 65.A N VAL 184.A O no hydrogen 2.641 N/A SER 66.A N GLU 70.A OE2 no hydrogen 3.275 N/A SER 66.A OG GLU 70.A O no hydrogen 2.639 N/A GLY 67.A N GLU 70.A OE2 no hydrogen 2.763 N/A ARG 72.A N ILE 64.A O no hydrogen 3.134 N/A ARG 72.A NE LEU 186.A O no hydrogen 3.194 N/A ARG 72.A NH2 LEU 186.A O no hydrogen 2.923 N/A ARG 72.A NH2 ASP 191.A OD1 no hydrogen 2.370 N/A ASP 81.A N ALA 56.A O no hydrogen 3.035 N/A GLN 82.A N ALA 56.A O no hydrogen 3.333 N/A LEU 84.A N LEU 54.A O no hydrogen 3.177 N/A ASN 87.A N ASN 87.A OD1 no hydrogen 2.574 N/A ALA 95.A N ILE 254.A O no hydrogen 2.910 N/A LEU 97.A N ALA 95.A O no hydrogen 2.829 N/A LYS 100.A N ARG 118.A O no hydrogen 3.267 N/A ILE 103.A N LEU 116.A O no hydrogen 2.587 N/A GLN 104.A N SER 144.A O no hydrogen 2.769 N/A THR 105.A N ASP 111.A OD1 no hydrogen 3.043 N/A THR 105.A N ASP 111.A OD2 no hydrogen 3.138 N/A THR 105.A OG1 ASP 111.A OD1 no hydrogen 2.660 N/A GLY 106.A N ASP 111.A OD2 no hydrogen 2.961 N/A SER 108.A OG THR 390.A OG1 no hydrogen 2.965 N/A ILE 110.A N ILE 107.A O no hydrogen 3.272 N/A ASP 111.A N ILE 107.A O no hydrogen 2.793 N/A GLY 112.A N SER 108.A O no hydrogen 2.520 N/A THR 113.A OG1 THR 109.A O no hydrogen 2.887 N/A THR 113.A OG1 ASN 114.A OD1 no hydrogen 2.925 N/A ASN 114.A N ILE 110.A O no hydrogen 2.712 N/A THR 115.A OG1 ASP 111.A O no hydrogen 3.268 N/A VAL 117.A N GLN 120.A OE1 no hydrogen 2.805 N/A ARG 118.A NE PHE 102.A O no hydrogen 2.799 N/A ARG 118.A NH2 PHE 102.A O no hydrogen 2.753 N/A GLY 119.A N THR 263.A OG1 no hydrogen 2.901 N/A GLN 120.A N VAL 117.A O no hydrogen 2.983 N/A LYS 121.A N GLU 288.A OE1 no hydrogen 3.044 N/A LYS 121.A NZ TYR 249.A O no hydrogen 3.020 N/A LEU 122.A N GLN 264.A O no hydrogen 3.272 N/A ILE 124.A N PRO 266.A O no hydrogen 2.804 N/A SER 126.A N LEU 268.A O no hydrogen 3.186 N/A ALA 127.A N SER 126.A OG no hydrogen 2.764 N/A SER 128.A N MET 270.A O no hydrogen 2.800 N/A HIS 132.A N LEU 130.A O no hydrogen 2.870 N/A GLU 134.A N GLU 134.A OE1 no hydrogen 2.680 N/A ILE 135.A N PRO 131.A O no hydrogen 3.227 N/A ALA 136.A N HIS 132.A O no hydrogen 2.649 N/A LEU 137.A N ASN 133.A O no hydrogen 3.069 N/A GLN 138.A N GLU 134.A O no hydrogen 3.336 N/A GLN 138.A NE2 GLY 380.A O no hydrogen 2.912 N/A GLN 138.A NE2 GLU 383.A O no hydrogen 3.532 N/A ILE 139.A N ILE 135.A O no hydrogen 3.220 N/A ARG 141.A N LEU 137.A O no hydrogen 2.693 N/A ARG 141.A NH2 TRP 381.A O no hydrogen 2.497 N/A GLN 142.A N GLN 138.A O no hydrogen 2.818 N/A GLN 142.A NE2 GLU 383.A O no hydrogen 2.699 N/A ALA 143.A N ILE 139.A O no hydrogen 3.040 N/A SER 144.A N GLN 104.A O no hydrogen 2.943 N/A SER 150.A OG LYS 259.A O no hydrogen 3.494 N/A VAL 154.A N ARG 181.A O no hydrogen 2.882 N/A VAL 155.A N LEU 219.A O no hydrogen 2.880 N/A PHE 156.A N VAL 183.A O no hydrogen 2.794 N/A ALA 157.A N ILE 221.A O no hydrogen 3.032 N/A ALA 158.A N PHE 185.A O no hydrogen 2.832 N/A MET 159.A N THR 223.A O no hydrogen 2.679 N/A THR 162.A N GLU 165.A OE2 no hydrogen 2.959 N/A THR 162.A OG1 GLU 165.A OE2 no hydrogen 3.458 N/A GLU 165.A N THR 162.A OG1 no hydrogen 3.167 N/A ALA 166.A N THR 162.A O no hydrogen 2.824 N/A GLN 167.A N ASN 163.A O no hydrogen 2.680 N/A TYR 168.A N GLU 164.A O no hydrogen 3.068 N/A PHE 169.A N GLU 165.A O no hydrogen 3.068 N/A MET 170.A N ALA 166.A O no hydrogen 3.382 N/A SER 171.A N GLN 167.A O no hydrogen 3.373 N/A SER 171.A OG GLN 167.A O no hydrogen 2.924 N/A PHE 173.A N PHE 169.A O no hydrogen 3.264 N/A LYS 175.A N SER 171.A O no hydrogen 3.232 N/A THR 176.A OG1 ASP 172.A O no hydrogen 2.502 N/A LEU 179.A N PHE 173.A O no hydrogen 3.109 N/A ARG 181.A N ALA 178.A O no hydrogen 3.036 N/A ARG 181.A NH1 ALA 140.A O no hydrogen 3.055 N/A ARG 181.A NH1 ARG 141.A O no hydrogen 2.638 N/A ALA 182.A N LEU 179.A O no hydrogen 3.403 N/A VAL 183.A N VAL 154.A O no hydrogen 2.778 N/A VAL 184.A N ARG 63.A O no hydrogen 3.284 N/A PHE 185.A N PHE 156.A O no hydrogen 2.742 N/A LEU 186.A N LEU 65.A O no hydrogen 3.406 N/A ASN 187.A N ALA 158.A O no hydrogen 2.865 N/A LEU 188.A N ASP 191.A OD1 no hydrogen 2.655 N/A ALA 189.A N ILE 161.A O no hydrogen 2.677 N/A ASP 191.A N LEU 188.A O no hydrogen 2.936 N/A ARG 196.A N ALA 193.A O no hydrogen 3.227 N/A VAL 198.A N VAL 194.A O no hydrogen 3.044 N/A THR 199.A N ARG 196.A O no hydrogen 3.100 N/A THR 199.A OG1 GLU 195.A O no hydrogen 2.520 N/A ARG 201.A NH1 ILE 197.A O no hydrogen 2.821 N/A ARG 201.A NH1 TYR 228.A OH no hydrogen 2.724 N/A ARG 201.A NH2 TYR 228.A OH no hydrogen 2.991 N/A ARG 201.A NH2 THR 247.A OG1 no hydrogen 2.735 N/A MET 202.A N VAL 198.A O no hydrogen 3.005 N/A MET 202.A N THR 199.A O no hydrogen 3.157 N/A ALA 203.A N THR 199.A O no hydrogen 3.175 N/A LEU 204.A N PRO 200.A O no hydrogen 2.940 N/A THR 205.A N ARG 201.A O no hydrogen 3.261 N/A THR 205.A OG1 ILE 86.A O no hydrogen 2.524 N/A THR 205.A OG1 ARG 201.A O no hydrogen 2.372 N/A ALA 206.A N MET 202.A O no hydrogen 2.963 N/A ALA 207.A N ALA 203.A O no hydrogen 2.778 N/A GLU 208.A N LEU 204.A O no hydrogen 2.715 N/A TYR 209.A N THR 205.A O no hydrogen 2.788 N/A TYR 209.A OH ASP 81.A OD1 no hydrogen 2.426 N/A LEU 210.A N ALA 206.A O no hydrogen 3.102 N/A ALA 211.A N ALA 207.A O no hydrogen 2.692 N/A TYR 212.A N GLU 208.A O no hydrogen 2.881 N/A HIS 214.A ND1 TYR 209.A O no hydrogen 3.392 N/A HIS 217.A N ALA 151.A O no hydrogen 3.005 N/A HIS 217.A ND1 SER 261.A OG no hydrogen 2.622 N/A VAL 218.A N SER 261.A O no hydrogen 2.875 N/A LEU 219.A N ALA 153.A O no hydrogen 3.149 N/A VAL 220.A N THR 263.A O no hydrogen 2.725 N/A ILE 221.A N VAL 155.A O no hydrogen 3.043 N/A LEU 222.A N ILE 265.A O no hydrogen 3.317 N/A THR 223.A N ALA 157.A O no hydrogen 2.798 N/A THR 223.A OG1 ASN 133.A OD1 no hydrogen 2.503 N/A ILE 225.A N ILE 267.A O no hydrogen 2.810 N/A THR 226.A OG1 ASP 224.A OD1 no hydrogen 2.669 N/A THR 226.A OG1 SER 269.A O no hydrogen 3.416 N/A ASN 227.A N ASP 224.A OD1 no hydrogen 3.200 N/A ASN 227.A ND2 GLY 160.A O no hydrogen 3.497 N/A TYR 228.A OH ASP 244.A OD1 no hydrogen 2.925 N/A TYR 228.A OH ASP 244.A OD2 no hydrogen 2.896 N/A ALA 229.A N ILE 225.A O no hydrogen 2.767 N/A GLU 230.A N THR 226.A O no hydrogen 2.633 N/A ALA 231.A N ALA 229.A O no hydrogen 2.559 N/A LEU 232.A N TYR 228.A O no hydrogen 2.922 N/A ARG 233.A N ALA 229.A O no hydrogen 3.283 N/A ARG 233.A NE GLU 230.A OE1 no hydrogen 2.588 N/A GLN 234.A N ALA 231.A O no hydrogen 3.238 N/A MET 235.A N ALA 231.A O no hydrogen 3.151 N/A ASP 244.A N TYR 242.A O no hydrogen 2.710 N/A LEU 245.A N MET 241.A O no hydrogen 3.290 N/A THR 247.A N THR 243.A O no hydrogen 2.593 N/A THR 247.A N ASP 244.A O no hydrogen 3.254 N/A THR 247.A OG1 ASP 244.A O no hydrogen 2.292 N/A LEU 248.A N LEU 245.A O no hydrogen 2.959 N/A TYR 249.A N LEU 245.A O no hydrogen 3.223 N/A GLU 250.A N ALA 246.A O no hydrogen 3.002 N/A ARG 251.A N LEU 248.A O no hydrogen 3.166 N/A ARG 251.A NE GLU 208.A OE2 no hydrogen 2.720 N/A ARG 251.A NH1 ILE 86.A O no hydrogen 3.337 N/A ARG 251.A NH2 ILE 86.A O no hydrogen 3.415 N/A ARG 251.A NH2 THR 205.A OG1 no hydrogen 3.013 N/A ARG 251.A NH2 GLU 208.A OE1 no hydrogen 2.590 N/A ALA 252.A N GLU 250.A O no hydrogen 2.542 N/A GLY 253.A N VAL 262.A O no hydrogen 2.951 N/A VAL 255.A N GLY 260.A O no hydrogen 3.383 N/A LYS 256.A N PRO 93.A O no hydrogen 2.763 N/A ALA 258.A N VAL 255.A O no hydrogen 3.056 N/A SER 261.A N MET 216.A O no hydrogen 3.351 N/A SER 261.A OG HIS 217.A ND1 no hydrogen 2.622 N/A VAL 262.A N GLY 253.A O no hydrogen 2.948 N/A THR 263.A N VAL 218.A O no hydrogen 3.061 N/A GLN 264.A N GLN 120.A O no hydrogen 2.937 N/A ILE 265.A N VAL 220.A O no hydrogen 2.880 N/A ILE 267.A N LEU 222.A O no hydrogen 2.986 N/A LEU 268.A N ILE 124.A O no hydrogen 3.031 N/A SER 269.A N THR 226.A OG1 no hydrogen 3.066 N/A SER 269.A OG ASP 224.A OD2 no hydrogen 3.355 N/A MET 270.A N SER 126.A O no hydrogen 2.918 N/A SER 283.A N ASP 281.A OD2 no hydrogen 3.360 N/A SER 283.A OG ASP 281.A OD2 no hydrogen 2.597 N/A TYR 285.A N LEU 282.A O no hydrogen 3.303 N/A ILE 286.A N SER 283.A O no hydrogen 3.046 N/A GLN 290.A N LEU 312.A O no hydrogen 2.822 N/A ILE 291.A N PRO 123.A O no hydrogen 3.218 N/A VAL 293.A N PHE 125.A O no hydrogen 2.818 N/A ALA 294.A N PRO 305.A O no hydrogen 3.175 N/A ARG 295.A NH1 SER 128.A O no hydrogen 3.328 N/A ARG 295.A NH2 SER 128.A O no hydrogen 3.506 N/A HIS 298.A N ALA 294.A O no hydrogen 3.293 N/A ARG 299.A N ARG 295.A O no hydrogen 3.019 N/A LYS 300.A N LEU 297.A O no hydrogen 3.200 N/A GLY 301.A N HIS 298.A O no hydrogen 2.761 N/A ILE 302.A N LEU 297.A O no hydrogen 3.198 N/A TYR 303.A OH GLN 138.A OE1 no hydrogen 2.744 N/A ASN 307.A N VAL 292.A O no hydrogen 2.909 N/A SER 311.A OG ASN 307.A O no hydrogen 2.632 N/A LEU 312.A N GLN 290.A O no hydrogen 2.714 N/A SER 313.A OG THR 115.A O no hydrogen 2.636 N/A SER 313.A OG GLN 120.A OE1 no hydrogen 3.446 N/A ARG 314.A N GLU 288.A O no hydrogen 3.053 N/A MET 316.A N SER 313.A O no hydrogen 2.708 N/A GLY 319.A N MET 316.A O no hydrogen 2.968 N/A ILE 320.A N MET 316.A O no hydrogen 3.301 N/A LYS 324.A NZ SER 318.A O no hydrogen 3.180 N/A THR 325.A N GLY 321.A O no hydrogen 2.783 N/A THR 325.A OG1 GLY 321.A O no hydrogen 3.124 N/A THR 325.A OG1 HIS 329.A ND1 no hydrogen 3.041 N/A ARG 326.A NE ASP 328.A OD1 no hydrogen 2.841 N/A ARG 326.A NH2 ASP 328.A OD2 no hydrogen 3.249 N/A HIS 329.A N ARG 326.A O no hydrogen 3.385 N/A HIS 329.A ND1 THR 325.A OG1 no hydrogen 3.041 N/A HIS 329.A NE2 GLY 112.A O no hydrogen 3.034 N/A LYS 330.A NZ ASP 334.A OD2 no hydrogen 3.249 N/A VAL 332.A N ASP 328.A O no hydrogen 2.966 N/A SER 333.A N HIS 329.A O no hydrogen 3.021 N/A SER 333.A OG GLY 112.A O no hydrogen 2.516 N/A SER 333.A OG HIS 329.A O no hydrogen 3.033 N/A ASP 334.A N LYS 330.A O no hydrogen 2.803 N/A GLN 335.A N ALA 331.A O no hydrogen 3.123 N/A GLN 335.A N VAL 332.A O no hydrogen 3.105 N/A MET 336.A N VAL 332.A O no hydrogen 2.854 N/A TYR 337.A N SER 333.A O no hydrogen 3.099 N/A TYR 337.A OH LEU 309.A O no hydrogen 2.787 N/A ALA 338.A N ASP 334.A O no hydrogen 3.152 N/A GLY 339.A N GLN 335.A O no hydrogen 2.868 N/A TYR 340.A N MET 336.A O no hydrogen 2.637 N/A TYR 340.A OH GLU 373.A OE2 no hydrogen 2.691 N/A ALA 341.A N TYR 337.A O no hydrogen 2.794 N/A GLU 342.A N ALA 338.A O no hydrogen 3.085 N/A GLY 343.A N GLY 339.A O no hydrogen 3.137 N/A ARG 344.A N TYR 340.A O no hydrogen 3.124 N/A ARG 344.A NH1 GLU 296.A OE2 no hydrogen 2.809 N/A ARG 344.A NH2 GLU 296.A OE1 no hydrogen 3.166 N/A ARG 344.A NH2 GLU 296.A OE2 no hydrogen 3.415 N/A ASP 345.A N ALA 341.A O no hydrogen 3.473 N/A LEU 346.A N GLU 342.A O no hydrogen 3.067 N/A ARG 347.A N GLY 343.A O no hydrogen 3.237 N/A ARG 347.A NH1 GLU 373.A OE1 no hydrogen 3.099 N/A ARG 347.A NH1 GLU 373.A OE2 no hydrogen 3.189 N/A ARG 347.A NH2 ASP 370.A OD1 no hydrogen 2.934 N/A ARG 347.A NH2 GLU 373.A OE1 no hydrogen 2.586 N/A LEU 349.A N ASP 345.A O no hydrogen 3.136 N/A VAL 350.A N LEU 346.A O no hydrogen 2.529 N/A ALA 351.A N ARG 347.A O no hydrogen 3.217 N/A ILE 352.A N GLY 348.A O no hydrogen 3.197 N/A VAL 353.A N LEU 349.A O no hydrogen 2.979 N/A ALA 357.A N GLY 354.A O no hydrogen 2.749 N/A ARG 361.A N SER 359.A OG no hydrogen 3.153 N/A ARG 361.A NE GLN 405.A OE1 no hydrogen 3.472 N/A THR 363.A N SER 359.A O no hydrogen 2.787 N/A THR 363.A OG1 SER 359.A O no hydrogen 2.725 N/A LYS 364.A N GLU 360.A O no hydrogen 3.439 N/A PHE 365.A N ASP 362.A O no hydrogen 3.238 N/A LEU 366.A N ASP 362.A O no hydrogen 2.803 N/A GLU 367.A N THR 363.A O no hydrogen 2.918 N/A ALA 369.A N PHE 365.A O no hydrogen 3.382 N/A LEU 371.A N GLU 367.A O no hydrogen 2.895 N/A PHE 372.A N PHE 368.A O no hydrogen 2.537 N/A GLU 373.A N ALA 369.A O no hydrogen 3.025 N/A ASP 374.A N ASP 370.A O no hydrogen 2.837 N/A LYS 375.A N LEU 371.A O no hydrogen 2.679 N/A PHE 376.A N PHE 372.A O no hydrogen 2.912 N/A VAL 377.A N PHE 372.A O no hydrogen 2.892 N/A ARG 378.A N GLU 373.A O no hydrogen 3.107 N/A GLN 379.A N TYR 303.A O no hydrogen 2.766 N/A GLN 379.A NE2 GLY 106.A O no hydrogen 3.224 N/A GLY 380.A N GLU 383.A OE2 no hydrogen 2.489 N/A TRP 381.A NE1 GLU 134.A O no hydrogen 3.103 N/A GLU 383.A N GLY 380.A O no hydrogen 3.446 N/A ASN 384.A ND2 GLN 142.A O no hydrogen 3.599 N/A ARG 385.A N GLY 106.A O no hydrogen 3.367 N/A ARG 385.A NH1 SER 108.A OG no hydrogen 3.294 N/A ARG 385.A NH1 PHE 376.A O no hydrogen 2.990 N/A ARG 385.A NH2 LYS 375.A O no hydrogen 3.450 N/A THR 386.A N ASP 389.A OD2 no hydrogen 2.803 N/A THR 386.A OG1 ASP 389.A OD2 no hydrogen 2.713 N/A THR 390.A N THR 386.A O no hydrogen 2.902 N/A THR 390.A OG1 SER 108.A OG no hydrogen 2.965 N/A THR 390.A OG1 THR 386.A O no hydrogen 3.462 N/A LEU 391.A N ILE 387.A O no hydrogen 2.682 N/A GLU 392.A N GLU 388.A O no hydrogen 2.794 N/A ILE 393.A N ASP 389.A O no hydrogen 3.147 N/A GLY 394.A N THR 390.A O no hydrogen 2.902 N/A TRP 395.A N LEU 391.A O no hydrogen 2.713 N/A TRP 395.A NE1 ASP 328.A OD2 no hydrogen 2.698 N/A GLN 396.A N GLU 392.A O no hydrogen 3.204 N/A GLN 396.A NE2 GLU 392.A OE1 no hydrogen 3.522 N/A ILE 397.A N ILE 393.A O no hydrogen 3.191 N/A THR 399.A N GLN 396.A O no hydrogen 2.835 N/A THR 399.A OG1 GLN 396.A O no hydrogen 2.992 N/A HIS 400.A NE2 GLU 367.A OE1 no hydrogen 3.125 N/A LEU 401.A N LEU 398.A O no hydrogen 2.847 N/A GLN 405.A N PRO 402.A O no hydrogen 3.248 N/A LEU 406.A N PRO 402.A O no hydrogen 3.189 N/A ILE 414.A N ASP 410.A O no hydrogen 3.414 N/A LYS 416.A N LYS 412.A O no hydrogen 3.251 N/A LYS 416.A NZ GLU 327.A OE2 no hydrogen 2.642 N/A TYR 417.A N TYR 413.A O no hydrogen 3.040 N/A TYR 417.A OH GLU 327.A OE2 no hydrogen 2.655 N/A