Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3ukr_C.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ALA 1.A N ILE 333.A O no hydrogen 3.425 N/A TYR 2.A OH ASP 328.A OD2 no hydrogen 3.031 N/A HIS 3.A N MET 331.A O no hydrogen 3.130 N/A SER 4.A OG LEU 6.A O no hydrogen 3.090 N/A PHE 5.A N GLY 329.A O no hydrogen 3.026 N/A ILE 10.A N GLY 326.A O no hydrogen 3.118 N/A SER 11.A N CYS 25.A O no hydrogen 2.805 N/A CYS 12.A SG VAL 54.A O no hydrogen 3.955 N/A HIS 13.A ND1 THR 325.A OG1 no hydrogen 2.851 N/A HIS 13.A NE2 SER 310.A OG no hydrogen 3.024 N/A ALA 14.A N ALA 23.A O no hydrogen 3.023 N/A ASN 16.A N GLN 21.A O no hydrogen 3.172 N/A LYS 17.A NZ ASP 62.A OD1 no hydrogen 2.714 N/A ARG 19.A N ASN 16.A O no hydrogen 3.221 N/A ARG 19.A NE LEU 312.A O no hydrogen 2.700 N/A ARG 19.A NH1 ASN 16.A O no hydrogen 2.875 N/A THR 20.A N ASN 16.A OD1 no hydrogen 2.846 N/A GLN 21.A N ASN 16.A OD1 no hydrogen 3.289 N/A ILE 22.A N TYR 34.A O no hydrogen 2.972 N/A ALA 23.A N ALA 14.A O no hydrogen 2.827 N/A ILE 24.A N HIS 32.A O no hydrogen 2.886 N/A CYS 25.A N CYS 12.A O no hydrogen 3.112 N/A CYS 25.A SG ASN 28.A O no hydrogen 3.155 N/A CYS 25.A SG GLU 30.A O no hydrogen 3.381 N/A CYS 25.A SG VAL 54.A O no hydrogen 3.443 N/A ASN 27.A N CYS 25.A O no hydrogen 2.812 N/A ASN 27.A ND2 GLU 8.A OE2 no hydrogen 3.417 N/A ASN 28.A ND2 GLU 30.A OE1 no hydrogen 3.144 N/A GLU 30.A N ASN 28.A OD1 no hydrogen 2.897 N/A HIS 32.A N ILE 24.A O no hydrogen 2.816 N/A ILE 33.A N HIS 45.A O no hydrogen 3.031 N/A TYR 34.A N ILE 22.A O no hydrogen 2.875 N/A GLU 35.A N VAL 42.A O no hydrogen 2.797 N/A SER 37.A N LYS 40.A O no hydrogen 2.819 N/A LYS 40.A N SER 37.A O no hydrogen 2.972 N/A VAL 42.A N GLU 35.A O no hydrogen 2.811 N/A GLN 43.A NE2 HIS 45.A O no hydrogen 3.609 N/A VAL 44.A N ILE 33.A O no hydrogen 2.835 N/A HIS 45.A N ILE 33.A O no hydrogen 3.385 N/A LEU 47.A N VAL 31.A O no hydrogen 2.861 N/A LYS 48.A NZ GLU 46.A OE1 no hydrogen 2.496 N/A HIS 50.A ND1 ASP 72.A OD1 no hydrogen 3.141 N/A HIS 50.A ND1 ASP 72.A OD2 no hydrogen 3.243 N/A HIS 50.A NE2 THR 68.A OG1 no hydrogen 2.638 N/A ASN 51.A N ASP 72.A OD2 no hydrogen 2.827 N/A GLN 53.A N THR 71.A OG1 no hydrogen 3.082 N/A VAL 54.A N ASN 28.A O no hydrogen 3.172 N/A THR 55.A N CYS 69.A O no hydrogen 3.052 N/A THR 55.A OG1 CYS 69.A O no hydrogen 3.443 N/A THR 55.A OG1 ALA 98.A O no hydrogen 2.621 N/A GLY 56.A N CYS 69.A O no hydrogen 3.420 N/A ASP 58.A N VAL 67.A O no hydrogen 3.009 N/A ALA 60.A N ARG 65.A O no hydrogen 2.792 N/A ASP 62.A N GLU 107.A OE2 no hydrogen 2.941 N/A SER 63.A N GLU 107.A OE1 no hydrogen 2.680 N/A SER 63.A OG GLU 107.A OE1 no hydrogen 2.805 N/A ARG 65.A NE SER 63.A OG no hydrogen 2.891 N/A ARG 65.A NH2 SER 63.A OG no hydrogen 3.403 N/A ILE 66.A N TRP 78.A O no hydrogen 3.081 N/A VAL 67.A N ASP 58.A O no hydrogen 2.852 N/A THR 68.A N TYR 76.A O no hydrogen 2.924 N/A THR 68.A OG1 HIS 50.A NE2 no hydrogen 2.638 N/A CYS 69.A N GLY 56.A O no hydrogen 3.237 N/A CYS 69.A SG THR 55.A OG1 no hydrogen 3.716 N/A GLY 70.A N ASN 74.A O no hydrogen 3.194 N/A THR 71.A N GLN 53.A O no hydrogen 2.911 N/A ARG 73.A N GLY 70.A O no hydrogen 3.007 N/A ASN 74.A N ASP 72.A OD1 no hydrogen 3.333 N/A ASN 74.A ND2 ASP 72.A OD2 no hydrogen 3.179 N/A TYR 76.A N THR 68.A O no hydrogen 2.756 N/A VAL 77.A N THR 88.A O no hydrogen 3.173 N/A TRP 78.A N ILE 66.A O no hydrogen 2.525 N/A TRP 78.A NE1 THR 68.A OG1 no hydrogen 3.076 N/A THR 79.A N LYS 86.A O no hydrogen 2.921 N/A LYS 81.A N THR 84.A O no hydrogen 3.112 N/A THR 84.A N LYS 81.A O no hydrogen 3.482 N/A LYS 86.A N THR 79.A O no hydrogen 2.815 N/A VAL 90.A N ALA 75.A O no hydrogen 3.272 N/A ARG 93.A NH2 CYS 133.A O no hydrogen 2.851 N/A ASN 95.A N SER 116.A OG no hydrogen 3.160 N/A ARG 96.A NH1 ASN 95.A O no hydrogen 2.572 N/A ALA 98.A N GLY 70.A O no hydrogen 3.072 N/A ARG 99.A N GLY 113.A O no hydrogen 2.804 N/A ARG 99.A NH1 ARG 99.A O no hydrogen 3.004 N/A CYS 100.A N GLY 113.A O no hydrogen 3.256 N/A CYS 100.A SG VAL 144.A O no hydrogen 3.597 N/A ARG 102.A N ALA 111.A O no hydrogen 2.886 N/A ARG 102.A NH1 VAL 101.A O no hydrogen 2.661 N/A TRP 103.A N ASP 58.A OD2 no hydrogen 2.478 N/A ALA 104.A N LYS 109.A O no hydrogen 2.709 N/A ASN 106.A N SER 153.A OG no hydrogen 2.925 N/A GLU 107.A N ALA 104.A O no hydrogen 2.791 N/A LYS 108.A NZ VAL 175.A O no hydrogen 2.751 N/A LYS 109.A NZ SER 153.A O no hydrogen 2.624 N/A LYS 109.A NZ ALA 170.A O no hydrogen 2.799 N/A LYS 109.A NZ GLU 176.A OE1 no hydrogen 2.778 N/A LYS 109.A NZ GLU 176.A OE2 no hydrogen 3.560 N/A PHE 110.A N CYS 122.A O no hydrogen 3.156 N/A ALA 111.A N ARG 102.A O no hydrogen 2.738 N/A VAL 112.A N SER 120.A O no hydrogen 2.940 N/A GLY 113.A N CYS 100.A O no hydrogen 2.759 N/A SER 114.A N VAL 118.A O no hydrogen 3.346 N/A GLY 115.A N ALA 97.A O no hydrogen 2.845 N/A SER 116.A N SER 114.A OG no hydrogen 2.965 N/A SER 116.A OG ASN 95.A OD1 no hydrogen 3.148 N/A ARG 117.A N SER 114.A O no hydrogen 3.418 N/A ARG 117.A NE ARG 141.A O no hydrogen 2.808 N/A ILE 119.A N ILE 136.A O no hydrogen 3.178 N/A SER 120.A N VAL 112.A O no hydrogen 2.931 N/A SER 120.A OG LEU 92.A O no hydrogen 3.319 N/A SER 120.A OG HIS 135.A NE2 no hydrogen 3.382 N/A ILE 121.A N LYS 134.A O no hydrogen 2.889 N/A CYS 122.A N PHE 110.A O no hydrogen 2.904 N/A CYS 122.A SG SER 120.A O no hydrogen 4.022 N/A TYR 123.A N VAL 132.A O no hydrogen 3.035 N/A TYR 123.A OH GLU 174.A OE1 no hydrogen 2.889 N/A GLU 125.A N TRP 130.A O no hydrogen 2.937 N/A GLN 126.A NE2 GLN 126.A O no hydrogen 3.286 N/A ASN 128.A ND2 GLU 125.A OE2 no hydrogen 2.900 N/A ASP 129.A N GLN 126.A O no hydrogen 3.320 N/A TRP 130.A N GLU 125.A O no hydrogen 3.304 N/A VAL 132.A N TYR 123.A O no hydrogen 2.930 N/A CYS 133.A SG ILE 91.A O no hydrogen 3.871 N/A CYS 133.A SG LEU 92.A O no hydrogen 3.610 N/A CYS 133.A SG HIS 135.A NE2 no hydrogen 3.717 N/A LYS 134.A N ILE 121.A O no hydrogen 2.908 N/A HIS 135.A NE2 LEU 92.A O no hydrogen 2.954 N/A ILE 136.A N ILE 119.A O no hydrogen 3.031 N/A LYS 137.A NZ ARG 117.A O no hydrogen 2.792 N/A ILE 140.A N LYS 137.A O no hydrogen 2.964 N/A ARG 141.A N ASP 162.A OD2 no hydrogen 2.827 N/A THR 143.A N SER 142.A OG no hydrogen 2.675 N/A VAL 144.A N SER 114.A O no hydrogen 3.096 N/A LEU 145.A N GLY 159.A O no hydrogen 2.757 N/A SER 146.A N GLY 159.A O no hydrogen 3.018 N/A SER 146.A OG VAL 204.A O no hydrogen 3.258 N/A ASP 148.A N ALA 157.A O no hydrogen 3.076 N/A TRP 149.A NE1 ARG 102.A O no hydrogen 2.990 N/A HIS 150.A N LEU 155.A O no hydrogen 2.852 N/A ASN 152.A N HIS 150.A ND1 no hydrogen 2.925 N/A SER 153.A N HIS 150.A O no hydrogen 2.934 N/A VAL 154.A N ASN 152.A OD1 no hydrogen 2.566 N/A LEU 155.A N ASN 152.A OD1 no hydrogen 3.069 N/A LEU 156.A N PHE 168.A O no hydrogen 2.780 N/A ALA 157.A N ASP 148.A O no hydrogen 2.806 N/A ALA 158.A N ARG 166.A O no hydrogen 2.710 N/A GLY 159.A N SER 146.A O no hydrogen 2.844 N/A SER 160.A N LYS 164.A O no hydrogen 3.247 N/A SER 160.A OG ASP 162.A OD1 no hydrogen 2.431 N/A CYS 161.A N THR 143.A O no hydrogen 2.754 N/A CYS 161.A SG THR 143.A O no hydrogen 3.905 N/A LYS 164.A N ASP 162.A OD1 no hydrogen 3.261 N/A LYS 164.A NZ SER 197.A O no hydrogen 2.958 N/A LYS 164.A NZ SER 199.A O no hydrogen 3.171 N/A CYS 165.A N SER 197.A OG no hydrogen 2.844 N/A ARG 166.A N ALA 158.A O no hydrogen 2.801 N/A ARG 166.A NE GLU 196.A OE2 no hydrogen 2.768 N/A ARG 166.A NH1 SER 160.A OG no hydrogen 3.402 N/A ARG 166.A NH1 ASP 162.A OD1 no hydrogen 3.332 N/A ARG 166.A NH1 ASP 162.A OD2 no hydrogen 3.303 N/A ARG 166.A NH2 ASP 162.A OD2 no hydrogen 3.393 N/A ARG 166.A NH2 GLU 196.A OE2 no hydrogen 3.400 N/A ILE 167.A N PHE 195.A O no hydrogen 3.062 N/A PHE 168.A N LEU 156.A O no hydrogen 2.736 N/A SER 169.A N GLU 192.A O no hydrogen 3.082 N/A SER 169.A OG MET 188.A O no hydrogen 2.641 N/A SER 169.A OG PRO 189.A O no hydrogen 3.037 N/A ALA 170.A N VAL 154.A O no hydrogen 2.676 N/A TYR 171.A N SER 169.A OG no hydrogen 3.381 N/A ILE 172.A N GLU 176.A OE1 no hydrogen 3.164 N/A VAL 175.A N ILE 172.A O no hydrogen 3.059 N/A THR 182.A N GLY 185.A O no hydrogen 3.273 N/A TRP 184.A NE1 GLY 213.A O no hydrogen 2.843 N/A GLY 185.A N THR 182.A O no hydrogen 2.797 N/A GLY 191.A N SER 169.A O no hydrogen 2.684 N/A GLU 192.A N PRO 189.A O no hydrogen 3.087 N/A MET 194.A N ILE 167.A O no hydrogen 2.842 N/A PHE 195.A N ILE 167.A O no hydrogen 3.372 N/A SER 197.A N CYS 165.A O no hydrogen 3.019 N/A SER 197.A OG CYS 165.A O no hydrogen 3.439 N/A SER 199.A OG CYS 201.A O no hydrogen 2.978 N/A VAL 204.A N SER 160.A O no hydrogen 3.398 N/A HIS 205.A N VAL 219.A O no hydrogen 3.121 N/A HIS 205.A NE2 HIS 221.A ND1 no hydrogen 2.839 N/A CYS 208.A N ALA 217.A O no hydrogen 2.776 N/A CYS 208.A SG ASP 148.A OD2 no hydrogen 3.864 N/A CYS 208.A SG PHE 209.A O no hydrogen 3.537 N/A CYS 208.A SG THR 250.A OG1 no hydrogen 3.764 N/A PHE 209.A N ASP 148.A OD2 no hydrogen 2.652 N/A SER 210.A N ARG 215.A O no hydrogen 2.821 N/A SER 210.A OG ARG 215.A O no hydrogen 3.098 N/A SER 210.A OG GLU 254.A OE1 no hydrogen 3.385 N/A ASN 212.A N GLU 254.A OE2 no hydrogen 2.677 N/A GLY 213.A N SER 210.A O no hydrogen 2.926 N/A SER 214.A N ASN 212.A OD1 no hydrogen 2.635 N/A SER 214.A OG ASN 212.A OD1 no hydrogen 2.474 N/A SER 214.A OG ASP 231.A OD2 no hydrogen 3.523 N/A ARG 215.A N SER 210.A OG no hydrogen 3.091 N/A ARG 215.A NH1 GLU 254.A O no hydrogen 2.530 N/A ARG 215.A NH1 SER 255.A OG no hydrogen 2.783 N/A VAL 216.A N ALA 228.A O no hydrogen 3.190 N/A ALA 217.A N CYS 208.A O no hydrogen 2.852 N/A TRP 218.A N CYS 226.A O no hydrogen 2.943 N/A VAL 219.A N GLY 206.A O no hydrogen 2.905 N/A SER 220.A N THR 224.A O no hydrogen 3.269 N/A HIS 221.A N TRP 203.A O no hydrogen 2.731 N/A HIS 221.A ND1 HIS 205.A NE2 no hydrogen 2.839 N/A SER 223.A N SER 220.A O no hydrogen 3.254 N/A SER 223.A OG THR 243.A O no hydrogen 2.627 N/A THR 224.A OG1 ASP 222.A OD1 no hydrogen 2.725 N/A THR 224.A OG1 ASP 222.A OD2 no hydrogen 3.019 N/A VAL 225.A N LEU 239.A O no hydrogen 3.152 N/A CYS 226.A N TRP 218.A O no hydrogen 2.879 N/A CYS 226.A SG THR 238.A OG1 no hydrogen 3.399 N/A LEU 227.A N ALA 237.A O no hydrogen 3.050 N/A ALA 228.A N VAL 216.A O no hydrogen 2.839 N/A ASP 229.A N ALA 235.A O no hydrogen 2.891 N/A ALA 230.A N SER 214.A O no hydrogen 2.884 N/A ASP 231.A N ASP 229.A OD1 no hydrogen 3.119 N/A LYS 232.A N ASP 229.A O no hydrogen 3.160 N/A LYS 232.A NZ SER 273.A O no hydrogen 2.955 N/A LYS 232.A NZ ALA 274.A O no hydrogen 3.415 N/A ALA 235.A N LYS 232.A O no hydrogen 3.328 N/A ALA 237.A N LEU 227.A O no hydrogen 2.920 N/A LEU 239.A N VAL 225.A O no hydrogen 3.046 N/A SER 241.A N SER 223.A O no hydrogen 2.753 N/A SER 241.A OG THR 243.A OG1 no hydrogen 3.106 N/A THR 243.A N SER 241.A OG no hydrogen 3.176 N/A THR 243.A OG1 SER 241.A OG no hydrogen 3.106 N/A THR 243.A OG1 ASP 263.A OD2 no hydrogen 3.026 N/A LEU 244.A N ASP 263.A OD1 no hydrogen 3.183 N/A LEU 247.A N ALA 260.A O no hydrogen 2.844 N/A ALA 248.A N ALA 260.A O no hydrogen 3.146 N/A THR 250.A N VAL 258.A O no hydrogen 3.065 N/A THR 250.A OG1 PHE 251.A O no hydrogen 3.504 N/A ILE 252.A N SER 256.A O no hydrogen 2.866 N/A SER 255.A N THR 253.A OG1 no hydrogen 3.126 N/A SER 256.A N THR 253.A O no hydrogen 3.436 N/A LEU 257.A N PHE 269.A O no hydrogen 2.776 N/A VAL 258.A N THR 250.A O no hydrogen 2.919 N/A ALA 259.A N VAL 267.A O no hydrogen 2.907 N/A ALA 260.A N ALA 248.A O no hydrogen 3.180 N/A HIS 262.A N PRO 245.A O no hydrogen 2.920 N/A HIS 262.A ND1 SER 305.A OG no hydrogen 2.552 N/A CYS 264.A N GLY 261.A O no hydrogen 3.176 N/A CYS 264.A SG HIS 262.A O no hydrogen 3.776 N/A VAL 267.A N ALA 259.A O no hydrogen 2.717 N/A LEU 268.A N GLY 282.A O no hydrogen 3.067 N/A PHE 269.A N LEU 257.A O no hydrogen 2.777 N/A THR 270.A N SER 279.A O no hydrogen 2.973 N/A TYR 271.A N SER 255.A O no hydrogen 2.765 N/A TYR 271.A OH ASP 229.A OD2 no hydrogen 2.851 N/A ASP 272.A N LYS 277.A O no hydrogen 2.852 N/A ALA 275.A N ASP 272.A OD1 no hydrogen 2.800 N/A GLY 276.A N ASP 272.A O no hydrogen 2.623 N/A LYS 277.A N ASP 272.A O no hydrogen 3.348 N/A SER 279.A N THR 270.A O no hydrogen 2.894 N/A GLY 281.A N LEU 268.A O no hydrogen 2.604 N/A ARG 283.A NH1 ASP 285.A O no hydrogen 2.549 N/A ARG 283.A NH2 ASP 299.A OD1 no hydrogen 3.053 N/A LEU 284.A N PRO 266.A O no hydrogen 2.847 N/A ARG 292.A N THR 288.A O no hydrogen 3.443 N/A ARG 292.A NE THR 288.A O no hydrogen 2.663 N/A PHE 293.A N ALA 289.A O no hydrogen 3.325 N/A GLN 294.A N ARG 290.A O no hydrogen 2.973 N/A ASN 295.A N GLU 291.A O no hydrogen 2.908 N/A SER 300.A OG HIS 302.A O no hydrogen 2.728 N/A LEU 301.A N ASP 285.A OD2 no hydrogen 2.791 N/A HIS 302.A ND1 ASP 328.A OD1 no hydrogen 3.294 N/A HIS 302.A NE2 THR 324.A OG1 no hydrogen 2.950 N/A LYS 303.A N ASP 328.A OD2 no hydrogen 2.809 N/A LYS 303.A NZ SER 300.A O no hydrogen 3.342 N/A LYS 303.A NZ LEU 301.A O no hydrogen 3.246 N/A SER 305.A N ASN 304.A OD1 no hydrogen 2.751 N/A SER 305.A OG HIS 262.A ND1 no hydrogen 2.552 N/A VAL 306.A N GLY 261.A O no hydrogen 3.035 N/A SER 307.A N THR 325.A O no hydrogen 3.122 N/A GLN 308.A N THR 325.A O no hydrogen 3.422 N/A SER 310.A N CYS 323.A O no hydrogen 3.091 N/A SER 310.A OG HIS 13.A NE2 no hydrogen 3.024 N/A LEU 312.A N GLN 321.A O no hydrogen 2.768 N/A SER 313.A N GLN 321.A O no hydrogen 3.407 N/A SER 313.A OG SER 320.A OG no hydrogen 3.000 N/A LYS 316.A NZ PHE 209.A O no hydrogen 2.468 N/A LYS 318.A N GLY 314.A O no hydrogen 3.219 N/A CYS 319.A N ILE 252.A O no hydrogen 2.779 N/A CYS 319.A SG SER 313.A O no hydrogen 4.025 N/A CYS 319.A SG GLN 321.A O no hydrogen 3.415 N/A SER 320.A N SER 313.A O no hydrogen 2.979 N/A SER 320.A OG SER 313.A O no hydrogen 3.330 N/A SER 320.A OG SER 313.A OG no hydrogen 3.000 N/A GLN 321.A NE2 ASP 335.A OD2 no hydrogen 2.850 N/A PHE 322.A N TRP 334.A O no hydrogen 2.994 N/A CYS 323.A N SER 310.A O no hydrogen 2.784 N/A CYS 323.A SG HIS 13.A NE2 no hydrogen 3.652 N/A CYS 323.A SG SER 332.A O no hydrogen 3.905 N/A THR 324.A N SER 332.A O no hydrogen 2.876 N/A THR 324.A OG1 HIS 302.A NE2 no hydrogen 2.950 N/A THR 324.A OG1 SER 332.A O no hydrogen 3.531 N/A THR 325.A N GLN 308.A O no hydrogen 3.209 N/A THR 325.A OG1 HIS 13.A ND1 no hydrogen 2.851 N/A GLY 326.A N GLY 330.A O no hydrogen 3.080 N/A MET 327.A N SER 305.A O no hydrogen 2.831 N/A GLY 329.A N GLY 326.A O no hydrogen 3.007 N/A GLY 330.A N ASP 328.A OD1 no hydrogen 3.114 N/A MET 331.A N HIS 3.A O no hydrogen 2.900 N/A SER 332.A N THR 324.A O no hydrogen 2.703 N/A SER 332.A OG HIS 302.A NE2 no hydrogen 3.040 N/A ILE 333.A N ALA 1.A O no hydrogen 2.904 N/A TRP 334.A N PHE 322.A O no hydrogen 2.804 N/A TRP 334.A NE1 THR 324.A OG1 no hydrogen 2.692 N/A VAL 336.A N SER 320.A O no hydrogen 2.794 N/A ARG 337.A N ASP 335.A OD1 no hydrogen 3.374 N/A LEU 339.A N ASP 335.A O no hydrogen 3.095 N/A GLU 340.A N ARG 337.A O no hydrogen 3.065 N/A SER 341.A N ARG 337.A O no hydrogen 3.161 N/A SER 341.A OG ARG 337.A O no hydrogen 3.320 N/A ALA 342.A N SER 338.A O no hydrogen 2.981 N/A LEU 346.A N LEU 343.A O no hydrogen 2.763 N/A LYS 347.A NZ GLY 281.A O no hydrogen 2.882 N/A VAL 349.A N SER 256.A OG no hydrogen 2.508 N/A