Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 2xcu_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LYS 8.A NZ GLU 5.A OE2 no hydrogen 2.433 N/A ARG 9.A N GLU 5.A O no hydrogen 2.990 N/A ARG 9.A NE PHE 4.A O no hydrogen 2.799 N/A ARG 9.A NH1 PHE 54.A O no hydrogen 3.254 N/A ARG 9.A NH2 PHE 54.A O no hydrogen 2.799 N/A PHE 10.A N VAL 6.A O no hydrogen 2.877 N/A PHE 11.A N LEU 7.A O no hydrogen 2.725 N/A LYS 13.A N HIS 73.A NE2 no hydrogen 3.149 N/A LEU 16.A N LYS 13.A O no hydrogen 3.100 N/A LYS 17.A N GLU 14.A O no hydrogen 3.086 N/A LYS 17.A NZ GLU 14.A OE2 no hydrogen 3.372 N/A ASN 18.A N SER 15.A O no hydrogen 2.795 N/A CYS 19.A N LEU 16.A O no hydrogen 2.770 N/A LYS 20.A NZ GLU 88.A O no hydrogen 3.492 N/A LYS 20.A NZ LEU 89.A O no hydrogen 2.865 N/A GLY 21.A N SER 90.A O no hydrogen 3.118 N/A GLY 21.A N LYS 91.A O no hydrogen 3.022 N/A ALA 22.A N CYS 19.A O no hydrogen 3.224 N/A LEU 23.A N ARG 48.A O no hydrogen 2.813 N/A TRP 24.A N ALA 94.A O no hydrogen 2.882 N/A TRP 24.A NE1 THR 52.A OG1 no hydrogen 2.747 N/A VAL 25.A N LEU 50.A O no hydrogen 2.846 N/A HIS 26.A N ILE 96.A O no hydrogen 2.807 N/A HIS 26.A ND1 THR 52.A OG1 no hydrogen 2.924 N/A HIS 26.A NE2 GLU 101.A OE1 no hydrogen 2.804 N/A THR 27.A N THR 52.A O no hydrogen 3.045 N/A THR 27.A OG1 THR 52.A O no hydrogen 3.477 N/A GLU 32.A N GLU 32.A OE2 no hydrogen 2.784 N/A PHE 33.A N SER 29.A O no hydrogen 3.127 N/A ASN 34.A N ILE 30.A O no hydrogen 2.965 N/A THR 35.A N GLY 31.A O no hydrogen 2.908 N/A THR 35.A OG1 GLY 31.A O no hydrogen 2.888 N/A PHE 36.A N GLU 32.A O no hydrogen 3.014 N/A LEU 37.A N ASN 34.A O no hydrogen 3.261 N/A ILE 39.A N PHE 36.A O no hydrogen 2.823 N/A LEU 40.A N PHE 36.A O no hydrogen 3.014 N/A LYS 41.A N LEU 37.A O no hydrogen 2.884 N/A LEU 43.A N ILE 39.A O no hydrogen 2.882 N/A LYS 44.A N LEU 40.A O no hydrogen 2.683 N/A ARG 45.A N GLU 42.A O no hydrogen 3.237 N/A GLU 46.A N LEU 43.A O no hydrogen 2.977 N/A ARG 48.A NH1 LYS 20.A O no hydrogen 2.864 N/A ARG 48.A NH2 LYS 20.A O no hydrogen 2.900 N/A ILE 49.A N ASP 70.A OD2 no hydrogen 2.682 N/A LEU 50.A N LEU 23.A O no hydrogen 2.806 N/A LEU 51.A N CYS 71.A O no hydrogen 2.773 N/A THR 52.A N VAL 25.A O no hydrogen 2.940 N/A THR 52.A OG1 HIS 26.A ND1 no hydrogen 2.924 N/A TYR 53.A OH GLU 5.A OE1 no hydrogen 2.293 N/A PHE 54.A N ALA 28.A O no hydrogen 2.751 N/A SER 55.A N ALA 28.A O no hydrogen 2.819 N/A ARG 57.A N SER 55.A OG no hydrogen 3.313 N/A ALA 58.A N SER 55.A O no hydrogen 2.824 N/A ARG 59.A N PRO 56.A O no hydrogen 3.362 N/A TYR 61.A OH ASN 34.A OD1 no hydrogen 2.610 N/A LEU 62.A N ALA 58.A O no hydrogen 2.943 N/A LYS 63.A N ARG 59.A O no hydrogen 2.966 N/A LYS 63.A N GLU 60.A O no hydrogen 3.140 N/A THR 64.A N TYR 61.A O no hydrogen 2.943 N/A THR 64.A OG1 TYR 61.A O no hydrogen 2.633 N/A LYS 65.A N LEU 62.A O no hydrogen 2.991 N/A SER 66.A OG LYS 63.A O no hydrogen 3.558 N/A PHE 68.A N LYS 65.A O no hydrogen 2.753 N/A TYR 69.A OH LEU 62.A O no hydrogen 2.668 N/A ASP 70.A N ILE 49.A O no hydrogen 2.885 N/A CYS 71.A N ILE 49.A O no hydrogen 2.922 N/A HIS 73.A N LEU 51.A O no hydrogen 2.915 N/A HIS 73.A ND1 PRO 74.A O no hydrogen 2.671 N/A LEU 75.A N TYR 53.A O no hydrogen 3.042 N/A LEU 77.A N ARG 9.A O no hydrogen 2.856 N/A ASN 79.A N LEU 77.A O no hydrogen 2.832 N/A ASN 79.A ND2 SER 82.A OG no hydrogen 2.811 N/A SER 82.A N ASN 79.A OD1 no hydrogen 3.025 N/A SER 82.A OG PHE 10.A O no hydrogen 2.683 N/A VAL 83.A N ASN 79.A O no hydrogen 3.051 N/A LYS 84.A N PRO 80.A O no hydrogen 2.989 N/A LYS 84.A NZ GLU 87.A OE1 no hydrogen 2.527 N/A LYS 84.A NZ PHE 109.A O no hydrogen 3.401 N/A ARG 85.A N PHE 81.A O no hydrogen 2.914 N/A ARG 85.A NE PRO 12.A O no hydrogen 2.681 N/A ARG 85.A NH1 GLU 14.A OE1 no hydrogen 3.222 N/A ARG 85.A NH2 PRO 12.A O no hydrogen 2.858 N/A ARG 85.A NH2 GLU 14.A OE1 no hydrogen 2.837 N/A PHE 86.A N SER 82.A O no hydrogen 3.169 N/A GLU 87.A N VAL 83.A O no hydrogen 3.076 N/A GLU 88.A N LYS 84.A O no hydrogen 2.856 N/A LEU 89.A N ARG 85.A O no hydrogen 3.007 N/A SER 90.A N PHE 86.A O no hydrogen 3.156 N/A SER 90.A OG PHE 86.A O no hydrogen 2.903 N/A LYS 91.A N GLU 87.A O no hydrogen 2.857 N/A LYS 93.A N ALA 22.A O no hydrogen 3.002 N/A LYS 93.A NZ HIS 47.A ND1 no hydrogen 2.754 N/A LEU 95.A N PRO 113.A O no hydrogen 2.935 N/A ILE 96.A N TRP 24.A O no hydrogen 2.763 N/A VAL 97.A N ILE 115.A O no hydrogen 2.689 N/A VAL 98.A N HIS 26.A O no hydrogen 3.118 N/A GLU 99.A N VAL 117.A O no hydrogen 2.751 N/A ARG 100.A N VAL 98.A O no hydrogen 3.205 N/A ARG 100.A NH1 TYR 120.A O no hydrogen 3.240 N/A ARG 100.A NH1 GLU 127.A OE1 no hydrogen 2.921 N/A ARG 100.A NH2 GLU 127.A OE1 no hydrogen 2.555 N/A TRP 103.A N GLU 101.A O no hydrogen 2.762 N/A TRP 103.A NE1 GLU 101.A OE1 no hydrogen 2.779 N/A SER 105.A N ASP 78.A OD2 no hydrogen 2.811 N/A SER 105.A OG ASP 78.A O no hydrogen 3.376 N/A LEU 106.A N ASP 78.A OD1 no hydrogen 2.782 N/A ILE 107.A N TRP 103.A O no hydrogen 2.841 N/A ILE 108.A N PRO 104.A O no hydrogen 2.732 N/A PHE 109.A N SER 105.A O no hydrogen 2.889 N/A THR 110.A OG1 LEU 106.A O no hydrogen 2.757 N/A LYS 111.A N GLU 87.A OE1 no hydrogen 3.026 N/A LYS 111.A N GLU 87.A OE2 no hydrogen 2.762 N/A VAL 112.A N GLU 87.A OE2 no hydrogen 2.747 N/A LYS 114.A N ASP 135.A OD2 no hydrogen 2.895 N/A LYS 114.A NZ THR 110.A O no hydrogen 3.125 N/A LYS 114.A NZ VAL 112.A O no hydrogen 2.603 N/A ILE 115.A N LEU 95.A O no hydrogen 2.664 N/A LEU 116.A N LEU 136.A O no hydrogen 2.878 N/A VAL 117.A N VAL 97.A O no hydrogen 2.994 N/A ASN 118.A ND2 GLU 99.A OE2 no hydrogen 2.525 N/A ASN 118.A ND2 ASN 161.A OD1 no hydrogen 3.094 N/A ALA 119.A N ILE 138.A O no hydrogen 3.168 N/A ALA 121.A N ASP 144.A OD1 no hydrogen 2.688 N/A LYS 122.A N GLU 127.A OE1 no hydrogen 2.645 N/A LYS 122.A N GLU 127.A OE2 no hydrogen 3.159 N/A GLY 123.A N GLU 127.A OE2 no hydrogen 2.838 N/A LYS 128.A N SER 124.A O no hydrogen 3.151 N/A ILE 129.A N LEU 125.A O no hydrogen 3.033 N/A LEU 130.A N ILE 126.A O no hydrogen 2.943 N/A SER 131.A N GLU 127.A O no hydrogen 3.065 N/A SER 131.A OG GLU 127.A O no hydrogen 2.718 N/A LYS 133.A N LEU 130.A O no hydrogen 2.876 N/A PHE 134.A N SER 131.A O no hydrogen 3.147 N/A ASP 135.A N LYS 114.A O no hydrogen 2.890 N/A LEU 136.A N LYS 114.A O no hydrogen 3.410 N/A ILE 137.A N ARG 155.A O no hydrogen 2.813 N/A ILE 138.A N LEU 116.A O no hydrogen 2.777 N/A MET 139.A N PHE 157.A O no hydrogen 2.800 N/A ARG 140.A N ALA 119.A O no hydrogen 2.892 N/A ARG 140.A NE ASN 118.A O no hydrogen 2.855 N/A ARG 140.A NH2 GLU 99.A OE2 no hydrogen 3.042 N/A ARG 140.A NH2 ASN 118.A O no hydrogen 3.540 N/A THR 141.A OG1 ASP 144.A OD2 no hydrogen 2.827 N/A ASP 144.A N THR 141.A OG1 no hydrogen 3.097 N/A VAL 145.A N THR 141.A O no hydrogen 3.111 N/A GLU 146.A N GLN 142.A O no hydrogen 2.886 N/A LYS 147.A N GLU 143.A O no hydrogen 3.191 N/A PHE 148.A N ASP 144.A O no hydrogen 3.216 N/A LYS 149.A N VAL 145.A O no hydrogen 2.958 N/A THR 150.A N GLU 146.A O no hydrogen 3.274 N/A THR 150.A OG1 LYS 147.A O no hydrogen 2.937 N/A PHE 151.A N PHE 148.A O no hydrogen 2.963 N/A GLY 152.A N LYS 149.A O no hydrogen 2.792 N/A ALA 153.A N PHE 148.A O no hydrogen 3.212 N/A PHE 157.A N ILE 137.A O no hydrogen 2.974 N/A SER 158.A OG ARG 140.A O no hydrogen 3.447 N/A CYS 159.A N MET 139.A O no hydrogen 3.101 N/A LEU 162.A N ASN 118.A OD1 no hydrogen 2.626 N/A LYS 163.A N ASN 161.A OD1 no hydrogen 2.886 N/A LYS 163.A NZ GLU 99.A OE1 no hydrogen 3.541 N/A PHE 164.A N ASN 161.A O no hydrogen 3.028 N/A ILE 165.A N LEU 162.A O no hydrogen 3.068 N/A CYS 166.A N SER 336.A OG no hydrogen 2.899 N/A LYS 168.A NZ CYS 280.A O no hydrogen 3.229 N/A LYS 168.A NZ GLU 333.A OE1 no hydrogen 2.790 N/A LYS 168.A NZ GLU 333.A OE2 no hydrogen 2.867 N/A LYS 170.A N GLU 253.A OE1 no hydrogen 3.240 N/A GLY 171.A N GLU 253.A OE1 no hydrogen 3.317 N/A ILE 172.A N GLU 253.A O no hydrogen 2.808 N/A ILE 179.A N LYS 207.A O no hydrogen 3.011 N/A VAL 180.A N ILE 260.A O no hydrogen 2.916 N/A ALA 181.A N ILE 209.A O no hydrogen 2.863 N/A GLY 182.A N ILE 262.A O no hydrogen 2.662 N/A ILE 184.A N VAL 211.A O no hydrogen 3.102 N/A HIS 185.A N GLU 188.A OE2 no hydrogen 2.720 N/A HIS 185.A NE2 HIS 273.A NE2 no hydrogen 2.824 N/A GLU 188.A N HIS 185.A O no hydrogen 2.948 N/A VAL 189.A N THR 186.A O no hydrogen 3.399 N/A ILE 192.A N GLU 188.A O no hydrogen 3.328 N/A LEU 193.A N VAL 189.A O no hydrogen 2.959 N/A LYS 194.A N GLU 190.A O no hydrogen 2.781 N/A ALA 195.A N ILE 191.A O no hydrogen 3.007 N/A PHE 196.A N ILE 192.A O no hydrogen 2.880 N/A LYS 197.A N LEU 193.A O no hydrogen 2.901 N/A LYS 197.A NZ PHE 228.A O no hydrogen 2.791 N/A GLU 198.A N LYS 194.A O no hydrogen 3.184 N/A ILE 199.A N ALA 195.A O no hydrogen 2.912 N/A LYS 200.A N PHE 196.A O no hydrogen 2.896 N/A LYS 200.A NZ SER 204.A O no hydrogen 3.310 N/A LYS 201.A NZ GLU 198.A OE2 no hydrogen 3.360 N/A THR 202.A N ILE 199.A O no hydrogen 3.124 N/A TYR 203.A N ILE 199.A O no hydrogen 3.018 N/A LYS 207.A N GLU 177.A O no hydrogen 2.823 N/A LYS 207.A NZ LEU 238.A O no hydrogen 2.812 N/A LYS 207.A NZ GLY 240.A O no hydrogen 2.871 N/A LEU 208.A N ASP 241.A O no hydrogen 2.824 N/A ILE 209.A N ILE 179.A O no hydrogen 3.061 N/A LEU 210.A N ILE 243.A O no hydrogen 2.841 N/A VAL 211.A N ALA 181.A O no hydrogen 2.779 N/A ARG 213.A N ILE 184.A O no hydrogen 2.745 N/A ARG 213.A NE SER 183.A OG no hydrogen 3.204 N/A ARG 213.A NH1 SER 183.A OG no hydrogen 2.924 N/A GLU 216.A N GLU 216.A OE2 no hydrogen 2.724 N/A ASN 217.A N HIS 214.A O no hydrogen 2.836 N/A ALA 218.A N ILE 215.A O no hydrogen 2.957 N/A PHE 221.A N ASN 217.A O no hydrogen 2.870 N/A GLU 222.A N ALA 218.A O no hydrogen 2.807 N/A LYS 223.A N LYS 219.A O no hydrogen 3.049 N/A LYS 224.A N ILE 220.A O no hydrogen 3.026 N/A ALA 225.A N PHE 221.A O no hydrogen 2.914 N/A ARG 226.A N GLU 222.A O no hydrogen 3.024 N/A ARG 226.A NE GLU 222.A OE2 no hydrogen 2.841 N/A ARG 226.A NH2 GLU 222.A OE1 no hydrogen 2.953 N/A ASP 227.A N LYS 223.A O no hydrogen 2.938 N/A PHE 228.A N ALA 225.A O no hydrogen 3.037 N/A GLY 229.A N ARG 226.A O no hydrogen 2.917 N/A PHE 230.A N ALA 225.A O no hydrogen 3.344 N/A THR 232.A OG1 GLU 222.A OE2 no hydrogen 2.474 N/A SER 233.A N VAL 242.A O no hydrogen 3.269 N/A SER 233.A OG ASN 237.A O no hydrogen 2.903 N/A PHE 235.A N LEU 244.A O no hydrogen 2.676 N/A ASN 237.A N PHE 234.A O no hydrogen 3.176 N/A GLU 239.A N ASN 237.A OD1 no hydrogen 3.061 N/A GLY 240.A N SER 233.A OG no hydrogen 2.857 N/A ASP 241.A N LYS 231.A O no hydrogen 2.880 N/A VAL 242.A N LYS 231.A O no hydrogen 3.213 N/A ILE 243.A N LEU 208.A O no hydrogen 2.652 N/A LEU 244.A N SER 233.A O no hydrogen 2.855 N/A VAL 245.A N LEU 210.A O no hydrogen 3.135 N/A LYS 252.A NZ GLN 167.A O no hydrogen 2.490 N/A LEU 254.A N LEU 251.A O no hydrogen 3.059 N/A TYR 255.A N LEU 251.A O no hydrogen 3.328 N/A VAL 257.A N LEU 254.A O no hydrogen 2.939 N/A GLY 258.A N TYR 255.A O no hydrogen 2.831 N/A LYS 259.A N PHE 178.A O no hydrogen 2.905 N/A ALA 261.A N PRO 284.A O no hydrogen 2.979 N/A ILE 262.A N VAL 180.A O no hydrogen 2.708 N/A VAL 263.A N ILE 286.A O no hydrogen 3.010 N/A GLY 264.A N GLY 182.A O no hydrogen 2.777 N/A GLY 265.A N GLU 188.A OE2 no hydrogen 2.790 N/A THR 266.A N GLU 188.A OE1 no hydrogen 2.994 N/A THR 266.A OG1 VAL 263.A O no hydrogen 2.790 N/A PHE 267.A N GLU 188.A OE1 no hydrogen 2.808 N/A ILE 270.A N VAL 268.A O no hydrogen 2.754 N/A HIS 273.A NE2 HIS 185.A NE2 no hydrogen 2.824 N/A GLU 277.A N ASN 274.A OD1 no hydrogen 3.312 N/A THR 279.A OG1 LEU 276.A O no hydrogen 2.821 N/A CYS 280.A N LEU 276.A O no hydrogen 3.340 N/A CYS 280.A SG LEU 276.A O no hydrogen 3.760 N/A TRP 281.A N PRO 278.A O no hydrogen 2.753 N/A GLY 282.A N THR 279.A O no hydrogen 2.820 N/A VAL 285.A N ALA 306.A O no hydrogen 3.029 N/A ILE 286.A N ALA 261.A O no hydrogen 2.795 N/A TYR 287.A N PHE 308.A O no hydrogen 3.178 N/A TYR 287.A OH GLU 302.A OE2 no hydrogen 2.789 N/A GLY 288.A N THR 266.A OG1 no hydrogen 2.903 N/A TYR 290.A N THR 266.A O no hydrogen 2.854 N/A HIS 292.A NE2 ASN 269.A OD1 no hydrogen 2.989 N/A LYS 293.A N GLY 271.A O no hydrogen 3.222 N/A VAL 294.A N THR 291.A O no hydrogen 2.798 N/A ASN 295.A ND2 GLU 299.A OE2 no hydrogen 3.414 N/A LYS 298.A N VAL 294.A O no hydrogen 2.840 N/A LYS 298.A NZ GLU 302.A OE1 no hydrogen 3.521 N/A GLU 299.A N ASN 295.A O no hydrogen 2.971 N/A PHE 300.A N ASP 296.A O no hydrogen 2.958 N/A LEU 301.A N LEU 297.A O no hydrogen 3.011 N/A GLU 302.A N LYS 298.A O no hydrogen 3.006 N/A LYS 303.A N GLU 299.A O no hydrogen 2.973 N/A GLU 304.A N PHE 300.A O no hydrogen 2.900 N/A GLY 305.A N GLU 302.A O no hydrogen 2.856 N/A ALA 306.A N LEU 301.A O no hydrogen 2.787 N/A GLY 307.A N LEU 301.A O no hydrogen 3.075 N/A PHE 308.A N VAL 285.A O no hydrogen 3.018 N/A VAL 310.A N TYR 287.A O no hydrogen 2.922 N/A LYS 311.A N GLU 315.A OE1 no hydrogen 2.815 N/A GLU 315.A N ASN 312.A OD1 no hydrogen 3.007 N/A LEU 316.A N ASN 312.A O no hydrogen 2.940 N/A VAL 317.A N GLU 313.A O no hydrogen 3.024 N/A THR 318.A N THR 314.A O no hydrogen 2.998 N/A THR 318.A OG1 THR 314.A O no hydrogen 3.003 N/A LYS 319.A N GLU 315.A O no hydrogen 2.944 N/A LYS 319.A NZ GLU 322.A OE1 no hydrogen 3.147 N/A LEU 320.A N LEU 316.A O no hydrogen 2.812 N/A THR 321.A N VAL 317.A O no hydrogen 2.903 N/A THR 321.A OG1 VAL 317.A O no hydrogen 2.655 N/A GLU 322.A N THR 318.A O no hydrogen 2.996 N/A LEU 323.A N LYS 319.A O no hydrogen 3.187 N/A LEU 324.A N LEU 320.A O no hydrogen 2.877 N/A LEU 324.A N THR 321.A O no hydrogen 3.170 N/A SER 325.A N THR 321.A O no hydrogen 2.998 N/A SER 325.A OG GLU 322.A O no hydrogen 3.360 N/A VAL 326.A N GLU 322.A O no hydrogen 3.086 N/A LYS 328.A NZ GLY 305.A O no hydrogen 3.159 N/A LYS 328.A NZ GLU 329.A O no hydrogen 3.220 N/A LYS 335.A N LYS 331.A O no hydrogen 3.001 N/A SER 336.A N VAL 332.A O no hydrogen 2.660 N/A ARG 337.A N GLU 333.A O no hydrogen 3.068 N/A GLU 338.A N GLU 334.A O no hydrogen 3.210 N/A ILE 339.A N LYS 335.A O no hydrogen 2.916 N/A LYS 340.A N SER 336.A O no hydrogen 2.988 N/A GLY 341.A N ARG 337.A O no hydrogen 3.005 N/A CYS 342.A N GLU 338.A O no hydrogen 2.984 N/A CYS 342.A SG SER 158.A O no hydrogen 3.961 N/A TYR 343.A N ILE 339.A O no hydrogen 3.162 N/A TYR 343.A OH GLY 160.A O no hydrogen 2.823 N/A LEU 344.A N LYS 340.A O no hydrogen 2.927 N/A GLU 345.A N GLY 341.A O no hydrogen 3.019 N/A LYS 346.A N CYS 342.A O no hydrogen 3.252 N/A LEU 347.A N TYR 343.A O no hydrogen 3.035 N/A ARG 348.A N LEU 344.A O no hydrogen 2.903 N/A ARG 348.A NH1 GLU 46.A OE1 no hydrogen 2.923 N/A GLU 349.A N GLU 345.A O no hydrogen 2.855 N/A PHE 350.A N LYS 346.A O no hydrogen 2.980 N/A LEU 351.A N LEU 347.A O no hydrogen 2.879 N/A ARG 352.A N ARG 348.A O no hydrogen 2.908 N/A ARG 352.A N GLU 349.A O no hydrogen 3.185 N/A