Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4eku_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLU 18.A N GLU 18.A OE1 no hydrogen 2.456 N/A ASP 19.A N GLU 16.A O no hydrogen 2.932 N/A ARG 21.A N CYS 43.A O no hydrogen 2.646 N/A ARG 21.A NE VAL 20.A O no hydrogen 2.607 N/A ARG 21.A NH1 GLN 97.A OE1 no hydrogen 2.982 N/A ARG 21.A NH2 VAL 20.A O no hydrogen 3.473 N/A LEU 23.A N VAL 41.A O no hydrogen 2.893 N/A VAL 25.A N LYS 39.A O no hydrogen 3.012 N/A CYS 26.A N TYR 111.A O no hydrogen 2.941 N/A PHE 27.A N ASN 37.A O no hydrogen 3.049 N/A TYR 28.A N TYR 135.A OH no hydrogen 3.294 N/A SER 31.A N SER 29.A O no hydrogen 2.552 N/A LYS 36.A N ASN 33.A O no hydrogen 2.807 N/A LYS 39.A N VAL 25.A O no hydrogen 2.847 N/A VAL 41.A N LEU 23.A O no hydrogen 2.732 N/A CYS 43.A N ARG 21.A O no hydrogen 2.674 N/A CYS 43.A SG ARG 21.A O no hydrogen 3.597 N/A CYS 43.A SG THR 44.A O no hydrogen 4.036 N/A VAL 45.A N ASP 19.A O no hydrogen 2.725 N/A THR 47.A N THR 44.A O no hydrogen 2.843 N/A THR 47.A OG1 THR 44.A O no hydrogen 2.814 N/A GLU 48.A N GLU 51.A OE1 no hydrogen 2.935 N/A ILE 49.A N MET 91.A O no hydrogen 3.022 N/A ARG 50.A N PRO 89.A O no hydrogen 2.752 N/A ARG 50.A NH2 GLU 48.A OE1 no hydrogen 2.359 N/A ILE 53.A N ILE 49.A O no hydrogen 3.057 N/A THR 54.A N ARG 50.A O no hydrogen 2.704 N/A THR 54.A OG1 ARG 50.A O no hydrogen 2.768 N/A SER 55.A N GLU 51.A O no hydrogen 2.821 N/A SER 55.A OG GLU 51.A O no hydrogen 2.558 N/A ILE 56.A N ILE 52.A O no hydrogen 2.839 N/A ILE 56.A N ILE 53.A O no hydrogen 3.036 N/A LEU 57.A N ILE 53.A O no hydrogen 2.886 N/A LEU 58.A N THR 54.A O no hydrogen 2.844 N/A SER 59.A N SER 55.A O no hydrogen 3.180 N/A SER 59.A OG ILE 56.A O no hydrogen 2.875 N/A GLY 60.A N LEU 57.A O no hydrogen 3.261 N/A ARG 61.A N SER 59.A OG no hydrogen 2.846 N/A GLY 63.A N GLY 60.A O no hydrogen 3.355 N/A ARG 67.A N ASP 129.A OD2 no hydrogen 2.505 N/A ALA 69.A N ARG 67.A O no hydrogen 2.752 N/A GLU 70.A N GLU 70.A OE1 no hydrogen 2.773 N/A CYS 71.A N LEU 68.A O no hydrogen 3.326 N/A CYS 71.A SG TYR 117.A O no hydrogen 3.274 N/A TYR 72.A N ALA 69.A O no hydrogen 3.385 N/A TYR 72.A OH THR 132.A OG1 no hydrogen 2.951 N/A GLY 73.A N GLN 114.A O no hydrogen 2.601 N/A ARG 75.A N ASP 112.A O no hydrogen 2.839 N/A ARG 75.A NH2 ASP 112.A OD2 no hydrogen 3.225 N/A LEU 76.A N HIS 85.A O no hydrogen 2.842 N/A LYS 77.A N ARG 110.A O no hydrogen 2.862 N/A LYS 77.A NZ ASP 82.A OD2 no hydrogen 3.495 N/A HIS 78.A N GLU 83.A O no hydrogen 3.169 N/A HIS 78.A ND1 SER 81.A O no hydrogen 3.318 N/A MET 79.A N GLU 108.A O no hydrogen 2.725 N/A SER 81.A OG HIS 78.A ND1 no hydrogen 2.955 N/A HIS 85.A N LEU 76.A O no hydrogen 2.754 N/A HIS 85.A NE2 GLU 83.A OE1 no hydrogen 2.924 N/A TRP 86.A N ASN 325.A OD1 no hydrogen 2.956 N/A LEU 87.A N LEU 74.A O no hydrogen 3.119 N/A HIS 88.A NE2 ASP 331.A OD2 no hydrogen 3.138 N/A GLN 90.A N HIS 88.A ND1 no hydrogen 2.913 N/A MET 91.A N HIS 88.A O no hydrogen 2.892 N/A THR 92.A N GLU 95.A OE1 no hydrogen 2.993 N/A VAL 93.A N THR 47.A O no hydrogen 2.848 N/A GLY 94.A N VAL 45.A O no hydrogen 2.756 N/A GLU 95.A N THR 92.A OG1 no hydrogen 2.954 N/A VAL 96.A N THR 92.A O no hydrogen 3.062 N/A GLN 97.A N VAL 93.A O no hydrogen 2.972 N/A GLN 97.A N GLY 94.A O no hydrogen 3.018 N/A ASP 98.A N GLY 94.A O no hydrogen 3.050 N/A LYS 99.A N GLU 95.A O no hydrogen 2.639 N/A LYS 99.A NZ TYR 100.A OH no hydrogen 3.342 N/A TYR 100.A N VAL 96.A O no hydrogen 2.817 N/A LEU 103.A N TYR 100.A O no hydrogen 2.181 N/A VAL 105.A N GLU 108.A OE1 no hydrogen 2.763 N/A GLU 108.A N VAL 105.A O no hydrogen 3.014 N/A TRP 109.A N GLU 106.A O no hydrogen 3.204 N/A TRP 109.A NE1 HIS 104.A O no hydrogen 2.743 N/A ARG 110.A N LYS 77.A O no hydrogen 3.114 N/A ARG 110.A NH1 GLY 35.A O no hydrogen 2.778 N/A ARG 110.A NH2 GLY 35.A O no hydrogen 3.546 N/A TYR 111.A OH GLU 101.A OE2 no hydrogen 2.928 N/A ASP 112.A N ARG 75.A O no hydrogen 2.918 N/A LEU 113.A N CYS 26.A O no hydrogen 2.886 N/A GLN 114.A N GLY 73.A O no hydrogen 2.782 N/A ILE 115.A N GLN 139.A OE1 no hydrogen 2.853 N/A ARG 116.A N CYS 71.A O no hydrogen 2.969 N/A ARG 116.A NH1 ASN 325.A O no hydrogen 3.138 N/A ARG 116.A NH1 ASP 328.A OD2 no hydrogen 2.729 N/A ARG 116.A NH2 GLU 245.A OE1 no hydrogen 3.085 N/A ARG 116.A NH2 ASN 325.A O no hydrogen 3.385 N/A TYR 117.A N CYS 71.A O no hydrogen 3.195 N/A TYR 117.A OH ASP 328.A OD1 no hydrogen 2.943 N/A TYR 117.A OH ASP 328.A OD2 no hydrogen 2.885 N/A LEU 118.A N TYR 333.A OH no hydrogen 3.215 N/A PHE 122.A N PRO 119.A O no hydrogen 2.804 N/A GLU 124.A N ASP 121.A O no hydrogen 3.262 N/A SER 125.A N PHE 122.A O no hydrogen 2.940 N/A SER 125.A OG PHE 122.A O no hydrogen 3.403 N/A LEU 126.A N PHE 122.A O no hydrogen 3.114 N/A LYS 127.A N MET 123.A O no hydrogen 3.508 N/A GLU 128.A N SER 125.A O no hydrogen 2.957 N/A ASP 129.A N LEU 126.A O no hydrogen 2.884 N/A THR 132.A N ASP 129.A OD1 no hydrogen 2.820 N/A THR 132.A OG1 TYR 72.A OH no hydrogen 2.951 N/A THR 132.A OG1 ASP 129.A OD1 no hydrogen 2.951 N/A THR 132.A OG1 ASP 129.A OD2 no hydrogen 3.097 N/A LEU 133.A N ASP 129.A O no hydrogen 3.200 N/A LEU 134.A N ARG 130.A O no hydrogen 2.876 N/A TYR 135.A N THR 131.A O no hydrogen 2.803 N/A TYR 135.A OH LEU 113.A O no hydrogen 2.701 N/A PHE 136.A N THR 132.A O no hydrogen 2.717 N/A TYR 137.A N LEU 133.A O no hydrogen 2.808 N/A TYR 137.A OH GLU 164.A OE1 no hydrogen 2.297 N/A GLN 138.A N LEU 134.A O no hydrogen 2.627 N/A GLN 139.A N PHE 136.A O no hydrogen 3.127 N/A GLN 139.A NE2 ILE 115.A O no hydrogen 3.598 N/A LEU 140.A N PHE 136.A O no hydrogen 3.013 N/A ARG 141.A N TYR 137.A O no hydrogen 2.838 N/A ARG 141.A NH1 LEU 160.A O no hydrogen 3.218 N/A ARG 141.A NH2 LEU 194.A O no hydrogen 3.505 N/A ARG 141.A NH2 PHE 195.A O no hydrogen 3.065 N/A ASN 142.A N GLN 138.A O no hydrogen 2.869 N/A ASP 143.A N GLN 139.A O no hydrogen 3.305 N/A TYR 144.A N LEU 140.A O no hydrogen 2.847 N/A MET 145.A N ARG 141.A O no hydrogen 2.999 N/A GLN 146.A N ASN 142.A O no hydrogen 2.907 N/A ARG 147.A N TYR 144.A O no hydrogen 3.219 N/A ARG 147.A NE ASP 143.A OD1 no hydrogen 2.965 N/A ARG 147.A NE ASP 143.A OD2 no hydrogen 3.281 N/A ARG 147.A NH2 ASP 143.A OD2 no hydrogen 3.059 N/A TYR 148.A N TYR 144.A O no hydrogen 2.907 N/A ALA 149.A N TYR 144.A O no hydrogen 2.959 N/A LYS 151.A N TYR 148.A O no hydrogen 2.707 N/A VAL 152.A N TYR 148.A O no hydrogen 2.938 N/A MET 156.A N SER 153.A OG no hydrogen 3.148 N/A ALA 157.A N SER 153.A O no hydrogen 3.120 N/A LEU 158.A N GLU 154.A O no hydrogen 2.923 N/A GLN 159.A N GLY 155.A O no hydrogen 3.233 N/A LEU 160.A N MET 156.A O no hydrogen 3.133 N/A LEU 160.A N ALA 157.A O no hydrogen 2.877 N/A GLY 161.A N ALA 157.A O no hydrogen 2.938 N/A CYS 162.A N LEU 158.A O no hydrogen 3.178 N/A CYS 162.A SG LEU 158.A O no hydrogen 3.234 N/A LEU 163.A N GLN 159.A O no hydrogen 2.869 N/A GLU 164.A N LEU 160.A O no hydrogen 2.902 N/A LEU 165.A N GLY 161.A O no hydrogen 2.808 N/A ARG 166.A N CYS 162.A O no hydrogen 2.907 N/A ARG 166.A NE ALA 221.A O no hydrogen 2.938 N/A ARG 166.A NH1 ARG 166.A O no hydrogen 3.502 N/A ARG 166.A NH1 MET 172.A O no hydrogen 3.490 N/A ARG 166.A NH2 MET 172.A O no hydrogen 2.888 N/A ARG 166.A NH2 ALA 221.A O no hydrogen 3.455 N/A ARG 167.A N LEU 163.A O no hydrogen 2.968 N/A ARG 167.A NE TYR 137.A OH no hydrogen 3.498 N/A ARG 167.A NE GLU 164.A OE1 no hydrogen 2.582 N/A ARG 167.A NH1 GLU 225.A OE1 no hydrogen 2.907 N/A PHE 168.A N GLU 164.A O no hydrogen 2.466 N/A PHE 169.A N LEU 165.A O no hydrogen 2.874 N/A MET 172.A N PHE 169.A O no hydrogen 3.076 N/A ALA 176.A N PRO 173.A O no hydrogen 3.047 N/A LYS 179.A N ALA 176.A O no hydrogen 3.060 N/A ASN 182.A ND2 ALA 176.A O no hydrogen 3.259 N/A PHE 183.A N LYS 179.A O no hydrogen 3.285 N/A GLU 184.A N LYS 180.A O no hydrogen 2.958 N/A LEU 185.A N SER 181.A O no hydrogen 3.221 N/A LEU 186.A N ASN 182.A O no hydrogen 3.186 N/A GLU 187.A N GLU 187.A OE1 no hydrogen 2.709 N/A LYS 188.A N GLU 184.A O no hydrogen 3.220 N/A GLU 189.A N LEU 185.A O no hydrogen 2.685 N/A VAL 190.A N LEU 186.A O no hydrogen 2.822 N/A GLY 191.A N LEU 186.A O no hydrogen 2.586 N/A PHE 195.A N LEU 192.A O no hydrogen 2.647 N/A PHE 196.A N LEU 192.A O no hydrogen 2.896 N/A MET 200.A N PRO 197.A O no hydrogen 3.295 N/A GLU 202.A N LYS 198.A O no hydrogen 3.250 N/A ASN 203.A N MET 200.A O no hydrogen 2.883 N/A PHE 209.A N LYS 205.A O no hydrogen 2.990 N/A ARG 210.A N PRO 206.A O no hydrogen 2.930 N/A LYS 211.A N LYS 207.A O no hydrogen 3.023 N/A MET 212.A N GLN 208.A O no hydrogen 3.046 N/A ILE 213.A N PHE 209.A O no hydrogen 2.927 N/A GLN 214.A N ARG 210.A O no hydrogen 2.749 N/A GLN 214.A NE2 LEU 177.A O no hydrogen 3.531 N/A GLN 214.A NE2 ASP 178.A O no hydrogen 3.184 N/A GLN 215.A N LYS 211.A O no hydrogen 3.037 N/A THR 216.A N MET 212.A O no hydrogen 3.103 N/A THR 216.A OG1 MET 212.A O no hydrogen 2.751 N/A PHE 217.A N ILE 213.A O no hydrogen 2.786 N/A GLN 219.A N THR 216.A O no hydrogen 2.928 N/A GLN 219.A NE2 GLN 159.A OE1 no hydrogen 3.470 N/A TYR 220.A N PHE 217.A O no hydrogen 2.466 N/A ALA 221.A N GLN 218.A O no hydrogen 3.397 N/A LEU 223.A N TYR 220.A O no hydrogen 2.912 N/A ARG 224.A N GLU 227.A OE1 no hydrogen 2.662 N/A CYS 228.A N ARG 224.A O no hydrogen 2.921 N/A CYS 228.A SG LEU 163.A O no hydrogen 3.495 N/A CYS 228.A SG ARG 224.A O no hydrogen 3.802 N/A VAL 229.A N GLU 225.A O no hydrogen 2.924 N/A MET 230.A N GLU 226.A O no hydrogen 2.902 N/A LYS 231.A N GLU 227.A O no hydrogen 2.806 N/A PHE 232.A N CYS 228.A O no hydrogen 2.767 N/A PHE 233.A N VAL 229.A O no hydrogen 2.864 N/A ASN 234.A N MET 230.A O no hydrogen 2.963 N/A THR 235.A N LYS 231.A O no hydrogen 2.840 N/A THR 235.A OG1 LYS 231.A O no hydrogen 2.977 N/A LEU 236.A N PHE 232.A O no hydrogen 2.951 N/A ALA 237.A N PHE 233.A O no hydrogen 2.859 N/A GLY 238.A N THR 235.A O no hydrogen 3.059 N/A GLU 245.A N ILE 263.A O no hydrogen 2.700 N/A THR 246.A OG1 LEU 261.A O no hydrogen 3.494 N/A TYR 247.A N LEU 261.A O no hydrogen 2.831 N/A TYR 247.A OH GLU 245.A OE1 no hydrogen 3.105 N/A ARG 248.A NE ASP 260.A OD1 no hydrogen 3.346 N/A ARG 248.A NE ASP 260.A OD2 no hydrogen 2.695 N/A ARG 248.A NH2 ASP 260.A OD1 no hydrogen 2.723 N/A CYS 249.A N VAL 259.A O no hydrogen 3.051 N/A CYS 249.A SG TYR 247.A O no hydrogen 3.334 N/A CYS 249.A SG VAL 259.A O no hydrogen 3.761 N/A ILE 252.A N SER 314.A O no hydrogen 2.759 N/A ILE 257.A N LEU 251.A O no hydrogen 3.417 N/A VAL 259.A N CYS 249.A O no hydrogen 2.867 N/A LEU 261.A N TYR 247.A O no hydrogen 2.762 N/A VAL 262.A N ARG 269.A O no hydrogen 2.805 N/A ILE 263.A N GLU 245.A O no hydrogen 2.855 N/A GLY 264.A N GLY 267.A O no hydrogen 3.254 N/A GLY 267.A N GLY 264.A O no hydrogen 2.823 N/A ILE 268.A N ALA 282.A O no hydrogen 3.220 N/A ARG 269.A N VAL 262.A O no hydrogen 3.032 N/A ARG 269.A NH1 GLN 244.A OE1 no hydrogen 3.053 N/A LEU 271.A N ASP 260.A O no hydrogen 3.149 N/A CYS 280.A SG ILE 268.A O no hydrogen 3.721 N/A CYS 280.A SG ALA 282.A O no hydrogen 3.642 N/A CYS 280.A SG GLU 283.A OE2 no hydrogen 3.406 N/A LEU 281.A N ILE 268.A O no hydrogen 3.102 N/A ALA 282.A N ILE 268.A O no hydrogen 2.879 N/A GLN 286.A N GLU 283.A O no hydrogen 2.742 N/A ILE 287.A N GLU 283.A O no hydrogen 3.168 N/A ILE 287.A N PHE 284.A O no hydrogen 2.792 N/A ARG 288.A N GLY 305.A O no hydrogen 2.849 N/A ARG 288.A NE ILE 287.A O no hydrogen 2.669 N/A ARG 288.A NH2 LYS 285.A O no hydrogen 2.562 N/A ILE 290.A N LEU 344.A O no hydrogen 3.234 N/A LEU 293.A N VAL 301.A O no hydrogen 3.009 N/A LEU 295.A N GLN 299.A O no hydrogen 2.748 N/A ALA 300.A N THR 317.A O no hydrogen 3.203 N/A VAL 301.A N LEU 293.A O no hydrogen 2.663 N/A GLN 303.A N ARG 291.A O no hydrogen 3.068 N/A LEU 304.A N LEU 313.A O no hydrogen 3.047 N/A GLU 307.A N GLN 286.A O no hydrogen 3.448 N/A ALA 309.A N ILE 306.A O no hydrogen 2.985 N/A LEU 313.A N LEU 304.A O no hydrogen 3.367 N/A THR 317.A N ALA 300.A O no hydrogen 2.764 N/A THR 317.A OG1 ALA 300.A O no hydrogen 3.156 N/A THR 317.A OG1 SER 319.A O no hydrogen 2.907 N/A SER 318.A N GLU 322.A OE2 no hydrogen 3.248 N/A SER 318.A OG GLU 322.A OE2 no hydrogen 3.349 N/A GLU 322.A N SER 319.A OG no hydrogen 2.883 N/A ALA 323.A N SER 319.A O no hydrogen 2.996 N/A GLU 324.A N LEU 320.A O no hydrogen 2.968 N/A ASN 325.A N ALA 321.A O no hydrogen 2.875 N/A ASN 325.A ND2 ILE 84.A O no hydrogen 3.275 N/A MET 326.A N GLU 322.A O no hydrogen 3.057 N/A MET 326.A N ALA 323.A O no hydrogen 3.245 N/A ALA 327.A N ALA 323.A O no hydrogen 2.949 N/A ASP 328.A N GLU 324.A O no hydrogen 2.794 N/A LEU 329.A N ASN 325.A O no hydrogen 3.072 N/A ILE 330.A N MET 326.A O no hydrogen 2.916 N/A ASP 331.A N ALA 327.A O no hydrogen 2.850 N/A GLY 332.A N ASP 328.A O no hydrogen 2.715 N/A TYR 333.A N LEU 329.A O no hydrogen 2.938 N/A CYS 334.A N ILE 330.A O no hydrogen 2.803 N/A CYS 334.A SG ILE 330.A O no hydrogen 3.427 N/A ARG 335.A N ASP 331.A O no hydrogen 2.643 N/A LEU 336.A N GLY 332.A O no hydrogen 2.858 N/A GLN 337.A N TYR 333.A O no hydrogen 2.810 N/A GLY 338.A N CYS 334.A O no hydrogen 2.660 N/A LEU 344.A N ASP 331.A OD1 no hydrogen 2.779 N/A