Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1xuu_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ASN 4.A N ASN 2.A OD1 no hydrogen 2.728 N/A PHE 6.A N VAL 13.A O no hydrogen 3.280 N/A ILE 8.A N ARG 11.A O no hydrogen 2.900 N/A ARG 11.A N ILE 8.A O no hydrogen 3.143 N/A ARG 11.A NE GLU 49.A OE2 no hydrogen 2.958 N/A ARG 11.A NH1 GLU 18.A O no hydrogen 3.186 N/A ARG 11.A NH1 PRO 19.A O no hydrogen 3.268 N/A ARG 11.A NH1 GLU 49.A OE1 no hydrogen 2.961 N/A ARG 11.A NH2 SER 12.A O no hydrogen 2.802 N/A ARG 11.A NH2 GLU 18.A O no hydrogen 2.725 N/A VAL 13.A N PHE 6.A O no hydrogen 2.953 N/A ASN 16.A ND2 ASN 3.A OD1 no hydrogen 2.758 N/A HIS 17.A N GLY 14.A O no hydrogen 2.931 N/A LEU 20.A N SER 230.A O no hydrogen 2.890 N/A ILE 22.A N LEU 232.A O no hydrogen 2.736 N/A CYS 23.A N VAL 50.A O no hydrogen 3.042 N/A GLU 24.A N ARG 234.A O no hydrogen 3.056 N/A ILE 25.A N LYS 52.A O no hydrogen 2.931 N/A GLY 26.A N LYS 52.A O no hydrogen 3.232 N/A ASN 28.A N ILE 25.A O no hydrogen 2.778 N/A ASN 28.A ND2 PHE 236.A O no hydrogen 2.854 N/A ASN 28.A ND2 SER 250.A OG no hydrogen 3.125 N/A HIS 29.A NE2 CYS 85.A O no hydrogen 3.138 N/A GLU 30.A N ILE 27.A O no hydrogen 3.017 N/A SER 32.A N HIS 29.A O no hydrogen 2.947 N/A SER 32.A OG THR 35.A OG1 no hydrogen 3.323 N/A LYS 34.A NZ GLU 38.A OE2 no hydrogen 3.388 N/A THR 35.A N SER 32.A OG no hydrogen 3.230 N/A THR 35.A OG1 SER 32.A OG no hydrogen 3.323 N/A ALA 36.A N SER 32.A O no hydrogen 2.971 N/A PHE 37.A N LEU 33.A O no hydrogen 2.862 N/A GLU 38.A N LYS 34.A O no hydrogen 3.070 N/A MET 39.A N THR 35.A O no hydrogen 2.967 N/A VAL 40.A N ALA 36.A O no hydrogen 2.877 N/A ASP 41.A N PHE 37.A O no hydrogen 2.822 N/A ALA 42.A N GLU 38.A O no hydrogen 3.078 N/A ALA 43.A N MET 39.A O no hydrogen 3.006 N/A TYR 44.A N VAL 40.A O no hydrogen 2.944 N/A ASN 45.A N ASP 41.A O no hydrogen 2.940 N/A ALA 46.A N ALA 42.A O no hydrogen 3.090 N/A ALA 46.A N ALA 43.A O no hydrogen 3.132 N/A GLY 47.A N TYR 44.A O no hydrogen 3.001 N/A ALA 48.A N ALA 43.A O no hydrogen 2.958 N/A VAL 51.A N ILE 105.A O no hydrogen 3.022 N/A LYS 52.A N CYS 23.A O no hydrogen 2.799 N/A LYS 52.A NZ GLU 24.A OE1 no hydrogen 2.981 N/A HIS 53.A N ILE 107.A O no hydrogen 2.985 N/A THR 55.A N THR 109.A O no hydrogen 2.782 N/A THR 55.A OG1 GLU 92.A OE1 no hydrogen 2.538 N/A THR 55.A OG1 SER 108.A OG no hydrogen 2.818 N/A ASP 60.A N ILE 57.A O no hydrogen 3.050 N/A GLU 61.A N ILE 57.A O no hydrogen 2.995 N/A GLU 61.A N VAL 58.A O no hydrogen 3.274 N/A MET 62.A N VAL 58.A O no hydrogen 3.081 N/A SER 63.A OG GLU 65.A OE1 no hydrogen 2.756 N/A GLU 65.A N GLU 65.A OE1 no hydrogen 2.825 N/A ALA 66.A N SER 63.A O no hydrogen 2.945 N/A LYS 67.A N ASP 64.A O no hydrogen 2.995 N/A GLN 68.A N GLU 65.A O no hydrogen 3.048 N/A ALA 74.A N PRO 71.A O no hydrogen 3.252 N/A ILE 78.A N VAL 69.A O no hydrogen 3.024 N/A GLU 80.A N SER 77.A OG no hydrogen 3.105 N/A ILE 81.A N SER 77.A O no hydrogen 3.182 N/A MET 82.A N ILE 78.A O no hydrogen 3.047 N/A GLU 83.A N TYR 79.A O no hydrogen 3.021 N/A ARG 84.A N GLU 80.A O no hydrogen 3.020 N/A ARG 84.A NH2 GLU 30.A OE1 no hydrogen 2.965 N/A ARG 84.A NH2 GLU 30.A OE2 no hydrogen 3.351 N/A CYS 85.A N ILE 81.A O no hydrogen 2.950 N/A CYS 85.A SG ILE 27.A O no hydrogen 3.761 N/A CYS 85.A SG ILE 81.A O no hydrogen 3.495 N/A ALA 86.A N MET 82.A O no hydrogen 2.796 N/A GLU 92.A N ASN 88.A O no hydrogen 3.033 N/A ILE 93.A N GLU 89.A O no hydrogen 3.002 N/A LYS 94.A N GLU 90.A O no hydrogen 3.211 N/A LYS 94.A NZ GLU 90.A OE1 no hydrogen 3.560 N/A LEU 95.A N ASP 91.A O no hydrogen 2.887 N/A LYS 96.A N GLU 92.A O no hydrogen 2.974 N/A LYS 96.A NZ GLU 100.A OE1 no hydrogen 2.516 N/A GLU 97.A N ILE 93.A O no hydrogen 3.097 N/A TYR 98.A N LYS 94.A O no hydrogen 2.968 N/A TYR 98.A OH ASP 41.A OD1 no hydrogen 3.209 N/A TYR 98.A OH ASP 41.A OD2 no hydrogen 2.603 N/A VAL 99.A N LEU 95.A O no hydrogen 2.956 N/A GLU 100.A N LYS 96.A O no hydrogen 2.998 N/A SER 101.A N GLU 97.A O no hydrogen 2.742 N/A SER 101.A OG TYR 98.A O no hydrogen 2.568 N/A LYS 102.A N VAL 99.A O no hydrogen 3.066 N/A GLY 103.A N GLU 100.A O no hydrogen 2.824 N/A MET 104.A N VAL 99.A O no hydrogen 3.252 N/A ILE 105.A N GLU 49.A O no hydrogen 2.900 N/A ILE 107.A N VAL 51.A O no hydrogen 3.363 N/A SER 108.A OG THR 55.A OG1 no hydrogen 2.818 N/A THR 109.A N HIS 53.A O no hydrogen 2.866 N/A ARG 113.A NE ASP 60.A OD1 no hydrogen 3.407 N/A ARG 113.A NH2 ASP 60.A OD2 no hydrogen 2.958 N/A ALA 114.A N ASP 60.A OD1 no hydrogen 2.730 N/A ALA 115.A N SER 112.A OG no hydrogen 3.246 N/A ALA 116.A N SER 112.A O no hydrogen 3.046 N/A LEU 117.A N ARG 113.A O no hydrogen 3.035 N/A ARG 118.A N ALA 114.A O no hydrogen 3.047 N/A ARG 118.A NH2 LEU 87.A O no hydrogen 3.370 N/A ARG 118.A NH2 GLU 92.A OE2 no hydrogen 2.967 N/A LEU 119.A N ALA 115.A O no hydrogen 2.987 N/A GLN 120.A N ALA 116.A O no hydrogen 2.988 N/A ARG 121.A N LEU 117.A O no hydrogen 3.199 N/A ARG 121.A NH1 GLU 89.A OE1 no hydrogen 2.790 N/A MET 122.A N ARG 118.A O no hydrogen 3.109 N/A ASP 123.A N GLN 120.A O no hydrogen 2.983 N/A ILE 124.A N LEU 119.A O no hydrogen 3.455 N/A TYR 127.A N PRO 149.A O no hydrogen 3.102 N/A LYS 128.A NZ SER 153.A OG no hydrogen 2.712 N/A LYS 128.A NZ GLU 233.A OE2 no hydrogen 2.595 N/A ILE 129.A N ILE 151.A O no hydrogen 2.855 N/A GLU 133.A N GLY 130.A O no hydrogen 2.961 N/A CYS 134.A N SER 131.A O no hydrogen 3.452 N/A CYS 134.A SG SER 153.A O no hydrogen 3.545 N/A ASN 136.A N GLU 133.A O no hydrogen 3.045 N/A TYR 137.A OH SER 161.A O no hydrogen 2.788 N/A ILE 140.A N ASN 136.A O no hydrogen 3.016 N/A LYS 141.A N TYR 137.A O no hydrogen 2.920 N/A LEU 142.A N PRO 138.A O no hydrogen 3.226 N/A VAL 143.A N LEU 139.A O no hydrogen 3.045 N/A ALA 144.A N ILE 140.A O no hydrogen 2.939 N/A SER 145.A N LYS 141.A O no hydrogen 3.272 N/A SER 145.A N LEU 142.A O no hydrogen 3.240 N/A SER 145.A OG LEU 142.A O no hydrogen 2.560 N/A PHE 146.A N VAL 143.A O no hydrogen 3.005 N/A GLY 147.A N ALA 144.A O no hydrogen 3.364 N/A ILE 150.A N PRO 175.A O no hydrogen 3.086 N/A ILE 151.A N TYR 127.A O no hydrogen 2.876 N/A LEU 152.A N ALA 177.A O no hydrogen 2.832 N/A SER 153.A N ILE 129.A O no hydrogen 2.994 N/A THR 154.A N LEU 179.A O no hydrogen 2.914 N/A THR 154.A OG1 LEU 179.A O no hydrogen 3.062 N/A GLY 155.A N SER 131.A OG no hydrogen 2.836 N/A ASN 157.A ND2 GLY 155.A O no hydrogen 3.097 N/A SER 161.A N SER 158.A OG no hydrogen 3.305 N/A SER 161.A OG ASN 157.A OD1 no hydrogen 3.098 N/A SER 161.A OG SER 158.A O no hydrogen 2.882 N/A ILE 162.A N SER 158.A O no hydrogen 3.030 N/A LYS 163.A N ILE 159.A O no hydrogen 2.956 N/A LYS 164.A NZ GLU 160.A O no hydrogen 2.672 N/A SER 165.A N ILE 162.A O no hydrogen 2.919 N/A SER 165.A OG CYS 134.A O no hydrogen 2.567 N/A VAL 166.A N ILE 162.A O no hydrogen 3.027 N/A GLU 167.A N LYS 163.A O no hydrogen 2.994 N/A ILE 168.A N LYS 164.A O no hydrogen 3.333 N/A ILE 169.A N SER 165.A O no hydrogen 3.007 N/A ARG 170.A N VAL 166.A O no hydrogen 2.865 N/A ARG 170.A NE ASP 206.A OD1 no hydrogen 2.953 N/A ARG 170.A NH1 ASP 206.A OD1 no hydrogen 3.508 N/A ARG 170.A NH1 ASP 206.A OD2 no hydrogen 2.824 N/A GLU 171.A N GLU 167.A O no hydrogen 2.947 N/A ALA 172.A N ILE 168.A O no hydrogen 3.161 N/A GLY 173.A N ILE 169.A O no hydrogen 3.181 N/A GLY 173.A N ARG 170.A O no hydrogen 2.684 N/A TYR 176.A OH ASP 206.A OD2 no hydrogen 2.710 N/A ALA 177.A N ILE 150.A O no hydrogen 2.878 N/A LEU 178.A N ILE 208.A O no hydrogen 2.782 N/A LEU 179.A N LEU 152.A O no hydrogen 2.780 N/A HIS 180.A N GLY 210.A O no hydrogen 2.901 N/A CYS 181.A SG SER 131.A OG no hydrogen 3.612 N/A THR 182.A OG1 ASP 191.A O no hydrogen 3.184 N/A ILE 184.A N THR 182.A O no hydrogen 3.304 N/A THR 187.A N HIS 214.A O no hydrogen 2.752 N/A THR 187.A OG1 THR 182.A O no hydrogen 3.356 N/A THR 187.A OG1 ILE 184.A O no hydrogen 2.703 N/A TYR 189.A OH ASP 217.A OD2 no hydrogen 2.529 N/A ASP 191.A N PRO 188.A O no hydrogen 3.153 N/A VAL 192.A N TYR 189.A O no hydrogen 3.103 N/A ARG 193.A NE ASP 191.A O no hydrogen 2.892 N/A ARG 193.A NH1 THR 182.A OG1 no hydrogen 2.984 N/A GLY 196.A N ARG 193.A O no hydrogen 2.843 N/A MET 197.A N LEU 194.A O no hydrogen 2.978 N/A ASN 198.A ND2 GLY 195.A O no hydrogen 3.532 N/A ASP 199.A N GLY 195.A O no hydrogen 3.219 N/A LEU 200.A N GLY 196.A O no hydrogen 3.038 N/A SER 201.A N MET 197.A O no hydrogen 3.032 N/A SER 201.A OG MET 197.A O no hydrogen 3.498 N/A SER 201.A OG ASN 198.A O no hydrogen 2.854 N/A GLU 202.A N ASN 198.A O no hydrogen 2.857 N/A ALA 203.A N ASP 199.A O no hydrogen 3.055 N/A PHE 204.A N LEU 200.A O no hydrogen 2.800 N/A ALA 207.A N PHE 204.A O no hydrogen 3.082 N/A ILE 208.A N TYR 176.A O no hydrogen 3.226 N/A GLY 210.A N LEU 178.A O no hydrogen 3.107 N/A LEU 211.A N ILE 231.A O no hydrogen 2.875 N/A SER 212.A N HIS 180.A O no hydrogen 2.836 N/A SER 212.A OG GLU 233.A OE2 no hydrogen 3.163 N/A ASP 213.A N GLU 233.A O no hydrogen 2.858 N/A THR 215.A N ASP 213.A OD2 no hydrogen 3.000 N/A THR 215.A OG1 ASP 213.A OD2 no hydrogen 2.636 N/A THR 215.A OG1 ASP 217.A O no hydrogen 3.025 N/A TYR 219.A N ASP 217.A OD1 no hydrogen 3.058 N/A LEU 222.A N ASN 218.A O no hydrogen 2.941 N/A GLY 223.A N TYR 219.A O no hydrogen 2.948 N/A ALA 224.A N ALA 220.A O no hydrogen 2.952 N/A VAL 225.A N CYS 221.A O no hydrogen 3.011 N/A ALA 226.A N LEU 222.A O no hydrogen 3.152 N/A LEU 227.A N GLY 223.A O no hydrogen 3.073 N/A GLY 228.A N VAL 225.A O no hydrogen 2.924 N/A GLY 229.A N ALA 224.A O no hydrogen 2.787 N/A SER 230.A N ILE 209.A O no hydrogen 2.814 N/A LEU 232.A N LEU 20.A O no hydrogen 2.767 N/A GLU 233.A N LEU 211.A O no hydrogen 3.028 N/A ARG 234.A N ILE 22.A O no hydrogen 3.450 N/A ARG 234.A NH2 CYS 249.A O no hydrogen 3.017 N/A PHE 236.A N GLU 24.A O no hydrogen 2.763 N/A THR 237.A N MET 251.A O no hydrogen 3.028 N/A THR 237.A OG1 ASP 238.A OD2 no hydrogen 3.419 N/A THR 237.A OG1 ARG 239.A O no hydrogen 2.970 N/A ARG 242.A NE ASP 238.A OD2 no hydrogen 2.965 N/A ARG 242.A NH1 GLU 38.A OE1 no hydrogen 2.894 N/A ARG 242.A NH1 ASP 238.A OD1 no hydrogen 2.774 N/A CYS 249.A SG ASP 246.A O no hydrogen 3.727 N/A SER 250.A N ILE 247.A O no hydrogen 3.057 N/A SER 250.A OG ASP 246.A O no hydrogen 3.042 N/A MET 251.A N HIS 235.A O no hydrogen 2.787 N/A ASN 252.A N THR 255.A OG1 no hydrogen 2.604 N/A THR 255.A OG1 ASN 252.A O no hydrogen 3.068 N/A PHE 256.A N ASN 252.A O no hydrogen 2.749 N/A LYS 257.A N PRO 253.A O no hydrogen 3.013 N/A GLU 258.A N ASP 254.A O no hydrogen 3.198 N/A LEU 259.A N THR 255.A O no hydrogen 3.035 N/A LYS 260.A N PHE 256.A O no hydrogen 2.826 N/A LYS 260.A NZ GLY 47.A O no hydrogen 2.889 N/A GLN 261.A N LYS 257.A O no hydrogen 2.996 N/A GLY 262.A N GLU 258.A O no hydrogen 2.893 N/A ALA 263.A N LEU 259.A O no hydrogen 2.820 N/A HIS 264.A N LYS 260.A O no hydrogen 3.090 N/A HIS 264.A ND1 GLU 18.A OE1 no hydrogen 3.035 N/A HIS 264.A ND1 GLU 18.A OE2 no hydrogen 3.161 N/A ALA 265.A N GLN 261.A O no hydrogen 3.072 N/A LEU 266.A N GLY 262.A O no hydrogen 2.866 N/A LYS 267.A N ALA 263.A O no hydrogen 2.823 N/A LEU 268.A N HIS 264.A O no hydrogen 3.197 N/A ALA 269.A N ALA 265.A O no hydrogen 3.040 N/A ARG 270.A N LEU 266.A O no hydrogen 2.945 N/A ARG 270.A NH1 TYR 15.A O no hydrogen 2.923 N/A ARG 270.A NH2 VAL 225.A O no hydrogen 2.934 N/A ARG 270.A NH2 GLY 229.A O no hydrogen 2.765 N/A THR 276.A N LYS 273.A O no hydrogen 3.341 N/A THR 276.A OG1 LYS 273.A O no hydrogen 3.329 N/A GLU 281.A N ILE 278.A O no hydrogen 2.968 N/A LYS 282.A N ALA 279.A O no hydrogen 3.031 N/A LYS 282.A NZ ASP 286.A OD2 no hydrogen 3.109 N/A THR 284.A N GLU 281.A O no hydrogen 2.938 N/A LYS 285.A N GLU 281.A O no hydrogen 2.977 N/A ASP 286.A N LYS 282.A O no hydrogen 2.974 N/A PHE 287.A N THR 284.A O no hydrogen 3.226 N/A ALA 288.A N THR 284.A O no hydrogen 2.776 N/A PHE 289.A N LYS 285.A O no hydrogen 3.296 N/A SER 291.A N LYS 312.A O no hydrogen 2.744 N/A SER 291.A OG PRO 314.A O no hydrogen 2.787 N/A VAL 292.A N PHE 319.A O no hydrogen 2.746 N/A VAL 293.A N TRP 310.A O no hydrogen 2.881 N/A ALA 294.A N ALA 340.A O no hydrogen 2.795 N/A ASP 295.A N ASN 308.A O no hydrogen 2.791 N/A ILE 298.A N ILE 336.A O no hydrogen 2.766 N/A LYS 299.A N GLU 302.A OE2 no hydrogen 3.091 N/A LYS 300.A N ASN 335.A OD1 no hydrogen 3.096 N/A GLY 301.A N ALA 332.A O no hydrogen 2.883 N/A GLU 302.A N LYS 299.A O no hydrogen 3.030 N/A LEU 304.A N LYS 330.A O no hydrogen 2.792 N/A ASP 307.A N SER 305.A OG no hydrogen 3.151 N/A ASN 308.A N SER 305.A O no hydrogen 3.148 N/A TRP 310.A N VAL 293.A O no hydrogen 2.975 N/A LYS 312.A N SER 291.A O no hydrogen 2.888 N/A ARG 313.A NE ALA 288.A O no hydrogen 3.103 N/A GLY 315.A N ASP 286.A O no hydrogen 3.061 N/A GLY 317.A N SER 291.A OG no hydrogen 2.974 N/A SER 320.A N GLU 323.A OE2 no hydrogen 2.891 N/A SER 320.A OG GLU 323.A OE2 no hydrogen 3.184 N/A VAL 321.A N ALA 290.A O no hydrogen 3.114 N/A GLU 323.A N SER 320.A O no hydrogen 2.868 N/A TYR 324.A N VAL 321.A O no hydrogen 3.266 N/A TYR 324.A OH LEU 309.A O no hydrogen 2.694 N/A THR 326.A N GLU 323.A O no hydrogen 2.921 N/A THR 326.A OG1 GLU 323.A O no hydrogen 2.647 N/A LEU 327.A N TYR 324.A O no hydrogen 3.243 N/A PHE 328.A N GLU 325.A O no hydrogen 3.208 N/A GLY 329.A N LEU 304.A O no hydrogen 2.928 N/A LYS 330.A N LEU 327.A O no hydrogen 3.166 N/A ALA 332.A N GLU 302.A O no hydrogen 2.915 N/A ALA 333.A N ASP 346.A O no hydrogen 2.778 N/A CYS 334.A SG ASN 335.A O no hydrogen 3.832 N/A CYS 334.A SG ASP 346.A OD2 no hydrogen 3.754 N/A ILE 336.A N ILE 298.A O no hydrogen 2.664 N/A LYS 338.A N ASP 297.A OD1 no hydrogen 3.203 N/A LYS 338.A NZ ASP 295.A O no hydrogen 2.600 N/A GLY 339.A N ALA 294.A O no hydrogen 2.739 N/A ALA 340.A N ARG 337.A O no hydrogen 3.072 N/A ILE 342.A N VAL 292.A O no hydrogen 2.955 N/A LYS 343.A N ASP 346.A OD1 no hydrogen 2.960 N/A LYS 344.A N ASP 318.A OD1 no hydrogen 2.902 N/A ASP 346.A N LYS 343.A O no hydrogen 2.684 N/A GLU 348.A N VAL 331.A O no hydrogen 2.896 N/A