Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1pxt_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LEU 1.A N GLU 3.A OE1 no hydrogen 2.917 N/A LEU 1.A N GLU 3.A OE2 no hydrogen 3.151 N/A GLU 3.A N LEU 1.A O no hydrogen 2.586 N/A ARG 5.A N ASP 8.A OD2 no hydrogen 2.876 N/A ARG 5.A NE ASP 8.A OD1 no hydrogen 2.965 N/A ARG 5.A NE ASP 8.A OD2 no hydrogen 3.462 N/A ARG 5.A NH1 LEU 1.A O no hydrogen 3.075 N/A ARG 5.A NH2 LEU 1.A O no hydrogen 3.415 N/A ARG 5.A NH2 ASP 8.A OD2 no hydrogen 2.982 N/A ASP 8.A N ARG 5.A O no hydrogen 3.057 N/A VAL 10.A N ALA 212.A O no hydrogen 2.691 N/A ILE 11.A N GLY 226.A O no hydrogen 3.056 N/A VAL 12.A N LEU 210.A O no hydrogen 3.014 N/A ASN 15.A ND2 ASP 179.A O no hydrogen 3.164 N/A ASN 15.A ND2 GLU 180.A O no hydrogen 2.906 N/A ARG 16.A N GLU 180.A O no hydrogen 3.046 N/A ARG 16.A NE SER 17.A O no hydrogen 3.194 N/A ARG 16.A NH1 THR 313.A OG1 no hydrogen 3.038 N/A SER 17.A OG ALA 18.A O no hydrogen 2.990 N/A ILE 19.A N ASP 195.A OD1 no hydrogen 2.917 N/A GLY 20.A N ASP 204.A O no hydrogen 2.933 N/A LYS 21.A N GLU 196.A OE2 no hydrogen 3.098 N/A GLY 22.A N VAL 202.A O no hydrogen 2.994 N/A ALA 26.A N GLU 196.A OE2 no hydrogen 2.657 N/A LYS 28.A N GLY 25.A O no hydrogen 3.017 N/A LYS 28.A NZ ASP 29.A OD2 no hydrogen 2.754 N/A ASN 31.A ND2 ASN 131.A OD1 no hydrogen 2.807 N/A THR 32.A OG1 HIS 76.A NE2 no hydrogen 2.927 N/A TYR 34.A N ASN 31.A O no hydrogen 2.846 N/A TYR 34.A OH LYS 185.A O no hydrogen 3.181 N/A LEU 35.A N ASN 31.A O no hydrogen 3.294 N/A LEU 36.A N THR 32.A O no hydrogen 2.745 N/A TYR 37.A N ASP 33.A O no hydrogen 2.920 N/A ASN 38.A N TYR 34.A O no hydrogen 2.980 N/A ASN 38.A ND2 TYR 34.A O no hydrogen 2.648 N/A PHE 39.A N LEU 35.A O no hydrogen 2.815 N/A LEU 40.A N LEU 36.A O no hydrogen 2.858 N/A ASN 41.A N TYR 37.A O no hydrogen 3.023 N/A GLU 42.A N ASN 38.A O no hydrogen 3.110 N/A PHE 43.A N PHE 39.A O no hydrogen 2.763 N/A ILE 44.A N LEU 40.A O no hydrogen 2.785 N/A GLY 45.A N GLU 42.A O no hydrogen 2.546 N/A ARG 46.A N GLU 42.A O no hydrogen 3.110 N/A ARG 46.A NH2 ASP 179.A OD1 no hydrogen 3.001 N/A ARG 52.A N PRO 48.A O no hydrogen 3.314 N/A ARG 52.A NE PHE 47.A O no hydrogen 2.710 N/A ALA 53.A N GLU 49.A O no hydrogen 2.820 N/A ASP 54.A N PRO 50.A O no hydrogen 3.032 N/A ASN 56.A ND2 ASP 54.A OD1 no hydrogen 2.849 N/A GLU 59.A N ILE 119.A O no hydrogen 3.092 N/A VAL 61.A N PRO 90.A O no hydrogen 3.262 N/A ALA 62.A N LEU 121.A O no hydrogen 3.141 N/A CYS 63.A N VAL 92.A O no hydrogen 2.861 N/A CYS 63.A SG GLY 64.A O no hydrogen 3.686 N/A CYS 63.A SG HIS 76.A ND1 no hydrogen 4.016 N/A GLY 64.A N LEU 123.A O no hydrogen 3.019 N/A ASN 65.A N LEU 94.A O no hydrogen 3.057 N/A VAL 66.A N GLU 126.A OE1 no hydrogen 3.302 N/A LEU 67.A N GLU 126.A OE2 no hydrogen 3.269 N/A ASN 68.A N ASN 65.A OD1 no hydrogen 3.178 N/A ASN 68.A ND2 THR 32.A OG1 no hydrogen 3.256 N/A ASN 68.A ND2 GLU 75.A OE2 no hydrogen 2.565 N/A ALA 71.A N ASN 68.A O no hydrogen 2.813 N/A GLY 72.A N VAL 69.A O no hydrogen 3.253 N/A ALA 73.A N GLY 70.A O no hydrogen 3.190 N/A GLU 75.A N GLU 75.A OE1 no hydrogen 3.135 N/A HIS 76.A N GLY 72.A O no hydrogen 3.085 N/A HIS 76.A NE2 THR 32.A OG1 no hydrogen 2.927 N/A ARG 77.A N ALA 73.A O no hydrogen 3.353 N/A ARG 77.A N THR 74.A O no hydrogen 3.077 N/A ARG 77.A NH1 TYR 87.A O no hydrogen 3.184 N/A ARG 77.A NH1 THR 89.A O no hydrogen 2.574 N/A ARG 77.A NH2 TYR 87.A O no hydrogen 3.009 N/A ALA 78.A N THR 74.A O no hydrogen 3.094 N/A ALA 79.A N GLU 75.A O no hydrogen 3.087 N/A CYS 80.A N HIS 76.A O no hydrogen 3.066 N/A CYS 80.A SG HIS 76.A O no hydrogen 3.086 N/A LEU 81.A N ARG 77.A O no hydrogen 2.752 N/A ALA 82.A N ALA 78.A O no hydrogen 2.540 N/A SER 83.A N ALA 79.A O no hydrogen 2.762 N/A SER 83.A OG CYS 80.A O no hydrogen 3.373 N/A ILE 85.A N CYS 80.A O no hydrogen 2.958 N/A THR 89.A N PRO 86.A O no hydrogen 3.072 N/A THR 89.A OG1 ILE 58.A O no hydrogen 2.705 N/A VAL 92.A N VAL 61.A O no hydrogen 2.792 N/A ARG 96.A N SER 100.A OG no hydrogen 2.799 N/A GLN 97.A N ASN 95.A OD1 no hydrogen 2.635 N/A GLN 97.A NE2 ASN 95.A OD1 no hydrogen 2.789 N/A SER 99.A OG ARG 96.A O no hydrogen 3.334 N/A SER 100.A N GLN 97.A O no hydrogen 2.877 N/A SER 100.A OG ASN 95.A OD1 no hydrogen 3.475 N/A SER 100.A OG GLN 97.A O no hydrogen 2.420 N/A LEU 102.A N SER 99.A O no hydrogen 2.624 N/A THR 103.A N SER 99.A O no hydrogen 2.940 N/A THR 103.A OG1 SER 100.A O no hydrogen 3.525 N/A ALA 104.A N SER 100.A O no hydrogen 2.911 N/A VAL 105.A N LEU 102.A O no hydrogen 2.599 N/A ASN 106.A N LEU 102.A O no hydrogen 2.758 N/A ASP 107.A N THR 103.A O no hydrogen 2.664 N/A ILE 108.A N ALA 104.A O no hydrogen 3.341 N/A ALA 109.A N VAL 105.A O no hydrogen 2.901 N/A ASN 110.A N ASN 106.A O no hydrogen 3.038 N/A LYS 111.A N ASP 107.A O no hydrogen 3.272 N/A LYS 111.A NZ GLU 60.A OE2 no hydrogen 2.750 N/A LYS 111.A NZ ASP 107.A OD1 no hydrogen 2.761 N/A LYS 111.A NZ ASP 107.A OD2 no hydrogen 2.958 N/A ILE 112.A N ILE 108.A O no hydrogen 3.105 N/A LYS 113.A N ALA 109.A O no hydrogen 2.884 N/A VAL 114.A N ASN 110.A O no hydrogen 2.830 N/A GLY 115.A N ILE 112.A O no hydrogen 3.344 N/A ILE 117.A N LYS 111.A O no hydrogen 3.106 N/A ASP 118.A N GLU 59.A OE2 no hydrogen 2.648 N/A GLY 120.A N LEU 211.A O no hydrogen 3.079 N/A LEU 121.A N GLU 60.A O no hydrogen 2.992 N/A ALA 122.A N VAL 209.A O no hydrogen 2.751 N/A GLY 124.A N ALA 207.A O no hydrogen 2.905 N/A GLU 126.A N GLY 205.A O no hydrogen 2.917 N/A SER 127.A OG VAL 30.A O no hydrogen 3.259 N/A SER 127.A OG THR 129.A OG1 no hydrogen 3.057 N/A THR 129.A N ASP 204.A OD1 no hydrogen 2.990 N/A THR 129.A OG1 SER 127.A OG no hydrogen 3.057 N/A THR 129.A OG1 ASP 204.A OD2 no hydrogen 2.792 N/A ASN 131.A N SER 127.A O no hydrogen 3.161 N/A TYR 132.A N MET 128.A O no hydrogen 3.121 N/A LYS 133.A NZ ASN 130.A O no hydrogen 3.010 N/A ASN 134.A N ASN 131.A O no hydrogen 3.028 N/A ASN 134.A ND2 LEU 67.A O no hydrogen 2.768 N/A ASN 137.A N GLN 135.A O no hydrogen 2.675 N/A GLU 139.A N ASN 137.A O no hydrogen 2.676 N/A ALA 140.A N ASN 137.A OD1 no hydrogen 2.978 N/A LYS 141.A N ASN 137.A O no hydrogen 3.416 N/A CYS 143.A N ALA 140.A O no hydrogen 2.868 N/A CYS 143.A SG THR 332.A O no hydrogen 3.734 N/A THR 150.A N PRO 146.A O no hydrogen 3.026 N/A THR 150.A OG1 MET 147.A O no hydrogen 2.364 N/A ASN 151.A N MET 147.A O no hydrogen 3.027 N/A ASN 151.A N GLY 148.A O no hydrogen 2.827 N/A GLU 152.A N GLY 148.A O no hydrogen 2.893 N/A ASN 153.A N ILE 149.A O no hydrogen 2.936 N/A ASN 153.A N THR 150.A O no hydrogen 3.022 N/A ARG 154.A NE ASP 158.A OD1 no hydrogen 3.508 N/A ARG 154.A NE ASP 158.A OD2 no hydrogen 2.817 N/A GLN 157.A N ARG 154.A O no hydrogen 2.729 N/A ASP 158.A N ARG 154.A O no hydrogen 2.741 N/A GLU 159.A N LYS 155.A O no hydrogen 2.645 N/A PHE 160.A N ASP 156.A O no hydrogen 2.943 N/A ALA 161.A N GLN 157.A O no hydrogen 2.575 N/A ALA 162.A N ASP 158.A O no hydrogen 2.784 N/A ASN 163.A N GLU 159.A O no hydrogen 3.306 N/A SER 164.A OG GLU 270.A OE1 no hydrogen 2.622 N/A TYR 165.A N ALA 161.A O no hydrogen 3.365 N/A GLN 166.A N ALA 162.A O no hydrogen 2.904 N/A LYS 167.A N ASN 163.A O no hydrogen 2.691 N/A LYS 167.A NZ VAL 290.A O no hydrogen 3.347 N/A LYS 167.A NZ ASN 291.A O no hydrogen 2.746 N/A ALA 168.A N SER 164.A O no hydrogen 2.900 N/A TYR 169.A N TYR 165.A O no hydrogen 2.922 N/A TYR 169.A OH ASN 173.A OD1 no hydrogen 3.018 N/A LYS 170.A N GLN 166.A O no hydrogen 2.823 N/A LYS 170.A NZ GLN 166.A OE1 no hydrogen 3.238 N/A ALA 171.A N LYS 167.A O no hydrogen 2.970 N/A LYS 172.A N ALA 168.A O no hydrogen 2.639 N/A LYS 172.A NZ ASP 195.A O no hydrogen 3.259 N/A LYS 172.A NZ PRO 198.A O no hydrogen 3.516 N/A ASN 173.A N TYR 169.A O no hydrogen 2.651 N/A GLU 174.A N LYS 170.A O no hydrogen 2.746 N/A GLY 175.A N LYS 172.A O no hydrogen 2.769 N/A LEU 176.A N ALA 171.A O no hydrogen 2.630 N/A GLU 178.A N GLY 175.A O no hydrogen 3.345 N/A LEU 182.A N ARG 16.A O no hydrogen 2.782 N/A ILE 184.A N CYS 192.A O no hydrogen 2.738 N/A LYS 185.A NZ GLU 42.A OE2 no hydrogen 3.172 N/A LYS 185.A NZ PRO 183.A O no hydrogen 2.814 N/A SER 190.A N ASP 188.A O no hydrogen 2.571 N/A SER 190.A N ASP 188.A OD1 no hydrogen 3.386 N/A SER 190.A OG ASP 188.A O no hydrogen 3.201 N/A SER 190.A OG ASP 188.A OD1 no hydrogen 2.388 N/A CYS 192.A N ILE 184.A O no hydrogen 2.692 N/A GLN 201.A NE2 ILE 297.A O no hydrogen 2.778 N/A SER 203.A OG GLN 201.A O no hydrogen 2.691 N/A GLY 205.A N GLU 126.A O no hydrogen 3.007 N/A VAL 206.A N SER 17.A OG no hydrogen 3.358 N/A ALA 207.A N GLY 124.A O no hydrogen 2.897 N/A GLY 208.A N ASN 15.A O no hydrogen 3.062 N/A VAL 209.A N ALA 122.A O no hydrogen 2.847 N/A LEU 210.A N ALA 13.A O no hydrogen 2.895 N/A ALA 212.A N VAL 10.A O no hydrogen 2.925 N/A ARG 213.A N ASP 118.A O no hydrogen 3.014 N/A ARG 213.A NE ILE 112.A O no hydrogen 3.361 N/A ARG 213.A NH1 ASP 118.A OD1 no hydrogen 2.666 N/A ARG 213.A NH2 ILE 112.A O no hydrogen 2.963 N/A ARG 213.A NH2 ASP 118.A OD1 no hydrogen 3.009 N/A ARG 214.A N ASP 8.A O no hydrogen 2.535 N/A ARG 214.A NE ARG 5.A O no hydrogen 3.095 N/A ARG 214.A NE ASP 8.A OD2 no hydrogen 3.274 N/A ARG 214.A NH1 GLU 343.A O no hydrogen 3.546 N/A ARG 214.A NH2 ASP 8.A OD2 no hydrogen 3.368 N/A ARG 214.A NH2 GLU 343.A O no hydrogen 3.349 N/A SER 215.A N PRO 6.A O no hydrogen 2.906 N/A ALA 217.A N ARG 213.A O no hydrogen 2.953 N/A ASN 218.A N ARG 214.A O no hydrogen 3.070 N/A GLN 219.A N VAL 216.A O no hydrogen 3.028 N/A LEU 220.A N VAL 216.A O no hydrogen 3.143 N/A LEU 220.A N ALA 217.A O no hydrogen 3.197 N/A LEU 222.A N ALA 217.A O no hydrogen 3.061 N/A LEU 225.A N ILE 11.A O no hydrogen 2.906 N/A ARG 227.A N ILE 341.A O no hydrogen 2.805 N/A TYR 228.A N VAL 9.A O no hydrogen 2.984 N/A ILE 229.A N ILE 339.A O no hydrogen 2.777 N/A GLN 232.A N ALA 337.A O no hydrogen 2.988 N/A GLN 232.A NE2 ASP 230.A OD2 no hydrogen 3.298 N/A VAL 234.A N GLY 335.A O no hydrogen 2.919 N/A VAL 236.A N GLY 333.A O no hydrogen 3.025 N/A ILE 240.A N PRO 237.A O no hydrogen 3.117 N/A VAL 243.A N ILE 240.A O no hydrogen 2.848 N/A GLY 244.A N MET 241.A O no hydrogen 3.102 N/A ALA 246.A N VAL 243.A O no hydrogen 3.055 N/A ALA 248.A N GLY 244.A O no hydrogen 3.092 N/A ILE 249.A N PRO 245.A O no hydrogen 3.124 N/A LYS 251.A N TYR 247.A O no hydrogen 3.380 N/A LYS 251.A NZ THR 233.A O no hydrogen 2.970 N/A VAL 252.A N ALA 248.A O no hydrogen 3.007 N/A LEU 253.A N ILE 249.A O no hydrogen 2.822 N/A GLU 254.A N PRO 250.A O no hydrogen 2.589 N/A ALA 255.A N LYS 251.A O no hydrogen 2.895 N/A THR 256.A N LEU 253.A O no hydrogen 2.588 N/A THR 256.A OG1 VAL 252.A O no hydrogen 2.735 N/A THR 256.A OG1 LEU 253.A O no hydrogen 2.496 N/A GLY 257.A N LEU 253.A O no hydrogen 2.623 N/A GLY 257.A N GLU 254.A O no hydrogen 3.109 N/A GLN 259.A NE2 ASP 262.A OD1 no hydrogen 2.942 N/A GLN 261.A NE2 GLN 261.A O no hydrogen 3.289 N/A ASP 262.A N GLN 259.A O no hydrogen 2.878 N/A ILE 263.A N VAL 260.A O no hydrogen 2.922 N/A ASP 264.A N ILE 323.A O no hydrogen 2.815 N/A PHE 266.A N LYS 289.A O no hydrogen 2.902 N/A GLU 267.A N VAL 325.A O no hydrogen 2.849 N/A ILE 268.A N PHE 266.A O no hydrogen 2.773 N/A ASN 269.A N SER 327.A O no hydrogen 2.904 N/A ALA 271.A N GLN 275.A OE1 no hydrogen 3.110 N/A PHE 272.A N GLN 275.A OE1 no hydrogen 3.000 N/A GLN 275.A NE2 ASN 269.A O no hydrogen 3.572 N/A ALA 276.A N PHE 272.A O no hydrogen 3.041 N/A LEU 277.A N ALA 273.A O no hydrogen 3.100 N/A TYR 278.A N ALA 274.A O no hydrogen 3.470 N/A CYS 279.A N GLN 275.A O no hydrogen 3.424 N/A CYS 279.A SG GLY 242.A O no hydrogen 3.828 N/A ILE 280.A N ALA 276.A O no hydrogen 3.106 N/A HIS 281.A N LEU 277.A O no hydrogen 2.794 N/A LYS 282.A N TYR 278.A O no hydrogen 2.712 N/A LEU 283.A N CYS 279.A O no hydrogen 2.840 N/A GLY 284.A N HIS 281.A O no hydrogen 2.801 N/A ILE 285.A N ILE 280.A O no hydrogen 3.213 N/A ASN 288.A N ASP 286.A OD1 no hydrogen 3.321 N/A LYS 289.A N ASP 286.A O no hydrogen 2.782 N/A LYS 289.A NZ ASP 286.A OD2 no hydrogen 2.977 N/A VAL 290.A N LEU 287.A O no hydrogen 3.015 N/A ASN 291.A N PHE 266.A O no hydrogen 3.406 N/A ASN 291.A ND2 ILE 268.A O no hydrogen 2.982 N/A GLY 294.A N ASN 291.A O no hydrogen 3.008 N/A GLY 295.A N SER 164.A OG no hydrogen 2.765 N/A ILE 297.A N GLU 270.A OE1 no hydrogen 3.307 N/A ALA 298.A N GLY 295.A O no hydrogen 3.408 N/A LEU 299.A N GLY 295.A O no hydrogen 2.827 N/A GLY 300.A N ALA 296.A O no hydrogen 2.752 N/A HIS 301.A N GLN 201.A O no hydrogen 2.806 N/A HIS 301.A ND1 THR 306.A OG1 no hydrogen 2.387 N/A LEU 303.A N HIS 301.A O no hydrogen 2.663 N/A GLY 304.A N GLU 126.A OE1 no hydrogen 3.111 N/A CYS 305.A N PRO 302.A O no hydrogen 2.699 N/A THR 306.A OG1 HIS 301.A ND1 no hydrogen 2.387 N/A ARG 309.A N CYS 305.A O no hydrogen 2.978 N/A ARG 309.A N THR 306.A O no hydrogen 2.729 N/A ARG 309.A NE THR 313.A OG1 no hydrogen 3.003 N/A ARG 309.A NH2 THR 313.A OG1 no hydrogen 3.010 N/A GLN 310.A N THR 306.A O no hydrogen 2.810 N/A THR 313.A N ARG 309.A O no hydrogen 2.937 N/A THR 313.A OG1 GLU 180.A OE2 no hydrogen 3.107 N/A ILE 314.A N GLN 310.A O no hydrogen 2.939 N/A LEU 315.A N VAL 311.A O no hydrogen 2.939 N/A ARG 316.A N THR 313.A O no hydrogen 2.906 N/A ARG 316.A NH1 ALA 14.A O no hydrogen 2.830 N/A ARG 316.A NH1 ALA 312.A O no hydrogen 3.002 N/A ARG 316.A NH2 ALA 14.A O no hydrogen 3.360 N/A GLU 317.A N THR 313.A O no hydrogen 3.238 N/A LYS 319.A N GLN 322.A OE1 no hydrogen 2.649 N/A LYS 320.A NZ ASP 321.A OD2 no hydrogen 3.281 N/A ASP 321.A N LYS 342.A O no hydrogen 2.677 N/A GLN 322.A N LYS 319.A O no hydrogen 2.767 N/A ILE 323.A N ASP 264.A OD2 no hydrogen 2.859 N/A GLY 324.A N PHE 340.A O no hydrogen 3.194 N/A VAL 325.A N ILE 265.A O no hydrogen 2.929 N/A VAL 326.A N ALA 338.A O no hydrogen 2.953 N/A SER 327.A N GLU 267.A O no hydrogen 3.361 N/A SER 327.A OG ALA 336.A O no hydrogen 3.031 N/A MET 328.A N ALA 336.A O no hydrogen 3.451 N/A ILE 330.A N MET 334.A O no hydrogen 2.845 N/A GLY 333.A N ILE 330.A O no hydrogen 3.145 N/A MET 334.A N ILE 330.A O no hydrogen 3.134 N/A ALA 336.A N MET 328.A O no hydrogen 3.308 N/A ALA 337.A N GLN 232.A O no hydrogen 3.143 N/A ALA 338.A N VAL 326.A O no hydrogen 2.981 N/A ILE 339.A N ASP 230.A O no hydrogen 3.318 N/A PHE 340.A N GLY 324.A O no hydrogen 3.012 N/A ILE 341.A N ARG 227.A O no hydrogen 2.955 N/A LYS 342.A N GLN 322.A O no hydrogen 3.017 N/A LYS 342.A NZ LEU 225.A O no hydrogen 3.410 N/A