Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4ux9_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): TYR 4.A N VAL 15.A O no hydrogen 3.078 N/A TYR 4.A OH TYR 19.A O no hydrogen 2.463 N/A SER 5.A OG THR 14.A OG1 no hydrogen 2.835 N/A VAL 6.A N PHE 13.A O no hydrogen 3.080 N/A ILE 8.A N SER 11.A O no hydrogen 3.013 N/A THR 12.A OG1 GLU 7.A OE1 no hydrogen 2.955 N/A THR 12.A OG1 GLU 7.A OE2 no hydrogen 2.960 N/A PHE 13.A N VAL 6.A O no hydrogen 2.878 N/A THR 14.A N TYR 96.A OH no hydrogen 2.814 N/A THR 14.A OG1 SER 5.A OG no hydrogen 2.835 N/A VAL 15.A N TYR 4.A O no hydrogen 3.153 N/A LYS 17.A N ASN 2.A O no hydrogen 2.959 N/A ARG 18.A NE ASP 37.A OD1 no hydrogen 2.878 N/A ARG 18.A NH2 ASP 37.A OD1 no hydrogen 3.230 N/A ARG 18.A NH2 ASP 37.A OD2 no hydrogen 3.012 N/A TYR 19.A N LEU 16.A O no hydrogen 3.104 N/A GLN 20.A N TYR 36.A O no hydrogen 2.941 N/A LYS 23.A N ALA 34.A O no hydrogen 2.971 N/A ILE 25.A N VAL 32.A O no hydrogen 2.969 N/A GLY 26.A N VAL 32.A O no hydrogen 3.350 N/A VAL 32.A N GLY 26.A O no hydrogen 3.043 N/A CYS 33.A N ILE 46.A O no hydrogen 2.824 N/A ALA 34.A N LYS 23.A O no hydrogen 2.775 N/A ALA 35.A N VAL 44.A O no hydrogen 2.777 N/A TYR 36.A N GLN 20.A O no hydrogen 2.859 N/A ASP 37.A N ARG 42.A O no hydrogen 2.750 N/A ALA 38.A N ARG 18.A O no hydrogen 2.726 N/A ILE 39.A N ASP 37.A OD1 no hydrogen 3.167 N/A LEU 40.A N ASP 37.A OD1 no hydrogen 3.216 N/A GLU 41.A N ASP 37.A O no hydrogen 2.761 N/A ARG 42.A N ASP 37.A O no hydrogen 3.382 N/A VAL 44.A N ALA 35.A O no hydrogen 2.746 N/A ALA 45.A N MET 99.A O no hydrogen 2.833 N/A ILE 46.A N CYS 33.A O no hydrogen 2.705 N/A LYS 47.A N ILE 97.A O no hydrogen 2.883 N/A LYS 48.A N ILE 31.A O no hydrogen 3.054 N/A LYS 48.A NZ SER 11.A OG no hydrogen 3.099 N/A LYS 48.A NZ THR 12.A O no hydrogen 2.803 N/A LEU 49.A N VAL 95.A O no hydrogen 2.889 N/A GLN 55.A NE2 GLU 326.A OE2 no hydrogen 2.818 N/A HIS 57.A N ASN 54.A OD1 no hydrogen 2.971 N/A HIS 57.A ND1 ASN 54.A OD1 no hydrogen 2.794 N/A ALA 58.A N ASN 54.A O no hydrogen 3.170 N/A LYS 59.A N GLN 55.A O no hydrogen 3.313 N/A ARG 60.A N THR 56.A O no hydrogen 3.132 N/A ALA 61.A N HIS 57.A O no hydrogen 2.793 N/A TYR 62.A N ALA 58.A O no hydrogen 2.964 N/A ARG 63.A N LYS 59.A O no hydrogen 2.963 N/A ARG 63.A NE GLY 162.A O no hydrogen 3.254 N/A ARG 63.A NH2 GLY 162.A O no hydrogen 3.290 N/A GLU 64.A N ARG 60.A O no hydrogen 3.124 N/A LEU 65.A N ALA 61.A O no hydrogen 3.063 N/A VAL 66.A N TYR 62.A O no hydrogen 2.994 N/A LEU 67.A N ARG 63.A O no hydrogen 2.874 N/A MET 68.A N GLU 64.A O no hydrogen 2.979 N/A LYS 69.A N LEU 65.A O no hydrogen 3.356 N/A CYS 70.A N VAL 66.A O no hydrogen 3.242 N/A CYS 70.A SG VAL 66.A O no hydrogen 3.303 N/A CYS 70.A SG LYS 322.A O no hydrogen 3.341 N/A VAL 71.A N LEU 67.A O no hydrogen 3.046 N/A HIS 73.A NE2 GLU 315.A O no hydrogen 2.869 N/A ASN 75.A N HIS 73.A ND1 no hydrogen 2.969 N/A ASN 75.A ND2 GLN 125.A OE1 no hydrogen 3.560 N/A ASN 75.A ND2 LEU 156.A O no hydrogen 2.953 N/A ILE 76.A N HIS 73.A O no hydrogen 3.184 N/A ILE 77.A N ILE 158.A O no hydrogen 2.962 N/A GLY 78.A N GLU 100.A OE1 no hydrogen 2.772 N/A LEU 80.A N VAL 98.A O no hydrogen 2.770 N/A ASN 81.A N VAL 98.A O no hydrogen 3.248 N/A ASN 81.A ND2 TYR 19.A OH no hydrogen 2.797 N/A PHE 83.A N TYR 96.A O no hydrogen 3.060 N/A THR 84.A OG1 ASP 94.A O no hydrogen 2.863 N/A GLU 91.A N SER 88.A OG no hydrogen 3.136 N/A PHE 92.A N SER 88.A O no hydrogen 2.860 N/A GLN 93.A N GLN 86.A OE1 no hydrogen 3.005 N/A ASP 94.A N GLN 86.A OE1 no hydrogen 2.938 N/A TYR 96.A N PHE 83.A O no hydrogen 3.016 N/A ILE 97.A N LYS 47.A O no hydrogen 2.854 N/A VAL 98.A N ASN 81.A O no hydrogen 2.717 N/A MET 99.A N ALA 45.A O no hydrogen 2.850 N/A ASP 103.A N VAL 150.A O no hydrogen 3.056 N/A ALA 104.A N VAL 150.A O no hydrogen 3.085 N/A LEU 106.A N PRO 145.A O no hydrogen 2.967 N/A ILE 110.A N LEU 106.A O no hydrogen 2.982 N/A GLN 111.A N CYS 107.A O no hydrogen 3.321 N/A MET 112.A N VAL 109.A O no hydrogen 3.030 N/A HIS 116.A ND1 TYR 306.A OH no hydrogen 2.787 N/A HIS 116.A NE2 ASP 269.A OD1 no hydrogen 3.148 N/A ARG 118.A N ASP 115.A OD1 no hydrogen 3.332 N/A ARG 118.A NE ASP 115.A OD1 no hydrogen 2.810 N/A MET 119.A N ASP 115.A O no hydrogen 3.236 N/A SER 120.A N HIS 116.A O no hydrogen 2.905 N/A SER 120.A OG TYR 306.A O no hydrogen 2.507 N/A TYR 121.A N GLU 117.A O no hydrogen 3.038 N/A LEU 122.A N ARG 118.A O no hydrogen 2.974 N/A LEU 123.A N MET 119.A O no hydrogen 3.008 N/A TYR 124.A N SER 120.A O no hydrogen 2.767 N/A TYR 124.A OH GLU 315.A OE1 no hydrogen 3.007 N/A GLN 125.A N TYR 121.A O no hydrogen 3.070 N/A GLN 125.A NE2 TYR 121.A O no hydrogen 3.044 N/A GLN 125.A NE2 CYS 154.A O no hydrogen 3.121 N/A MET 126.A N LEU 122.A O no hydrogen 3.114 N/A LEU 127.A N LEU 123.A O no hydrogen 2.965 N/A CYS 128.A N TYR 124.A O no hydrogen 2.983 N/A CYS 128.A SG TYR 124.A O no hydrogen 3.463 N/A GLY 129.A N GLN 125.A O no hydrogen 2.965 N/A ILE 130.A N MET 126.A O no hydrogen 3.017 N/A LYS 131.A N LEU 127.A O no hydrogen 2.788 N/A LYS 131.A NZ ASP 299.A OD1 no hydrogen 2.909 N/A HIS 132.A N CYS 128.A O no hydrogen 3.039 N/A LEU 133.A N GLY 129.A O no hydrogen 3.220 N/A HIS 134.A N ILE 130.A O no hydrogen 2.954 N/A HIS 134.A NE2 ASP 193.A OD2 no hydrogen 2.647 N/A SER 135.A N LYS 131.A O no hydrogen 2.885 N/A SER 135.A N HIS 132.A O no hydrogen 3.244 N/A SER 135.A OG HIS 132.A O no hydrogen 2.597 N/A ALA 136.A N LEU 133.A O no hydrogen 3.312 N/A GLY 137.A N HIS 134.A O no hydrogen 2.820 N/A ILE 138.A N LEU 133.A O no hydrogen 2.859 N/A ILE 139.A N ARG 165.A O no hydrogen 2.694 N/A HIS 140.A N ASP 193.A OD2 no hydrogen 3.059 N/A ARG 141.A N ASP 193.A OD1 no hydrogen 3.139 N/A ARG 141.A NE LEU 163.A O no hydrogen 2.760 N/A ARG 141.A NH2 LEU 163.A O no hydrogen 2.981 N/A ASP 142.A N HIS 140.A ND1 no hydrogen 3.155 N/A LYS 144.A NZ THR 174.A OG1 no hydrogen 3.069 N/A ASN 147.A N LYS 144.A O no hydrogen 3.021 N/A ASN 147.A ND2 ASP 142.A O no hydrogen 2.600 N/A ILE 148.A N PRO 145.A O no hydrogen 3.442 N/A VAL 149.A N LYS 157.A O no hydrogen 3.054 N/A VAL 150.A N ALA 104.A O no hydrogen 2.717 N/A LYS 151.A N THR 155.A O no hydrogen 2.947 N/A LYS 151.A NZ LEU 101.A O no hydrogen 3.186 N/A SER 152.A N ASP 103.A OD2 no hydrogen 2.893 N/A SER 152.A OG ASP 103.A OD2 no hydrogen 3.070 N/A CYS 154.A N LYS 151.A O no hydrogen 2.851 N/A THR 155.A OG1 ASP 153.A OD1 no hydrogen 2.596 N/A LEU 156.A N GLN 125.A OE1 no hydrogen 2.912 N/A LYS 157.A N VAL 149.A O no hydrogen 2.967 N/A LYS 157.A NZ LYS 74.A O no hydrogen 3.204 N/A ILE 158.A N ASN 75.A O no hydrogen 2.774 N/A LEU 159.A N ASN 147.A O no hydrogen 2.893 N/A PHE 161.A N GLU 64.A OE2 no hydrogen 3.188 N/A ARG 165.A N ILE 139.A O no hydrogen 3.019 N/A ARG 165.A NE THR 166.A O no hydrogen 3.089 N/A THR 174.A N ASP 142.A OD1 no hydrogen 3.263 N/A THR 174.A OG1 ASP 142.A OD1 no hydrogen 3.185 N/A ARG 175.A NE GLY 213.A O no hydrogen 3.029 N/A ARG 175.A NH2 GLY 213.A O no hydrogen 2.815 N/A TYR 177.A N THR 174.A O no hydrogen 3.157 N/A TYR 177.A OH GLU 203.A OE1 no hydrogen 2.500 N/A TYR 177.A OH GLU 203.A OE2 no hydrogen 3.410 N/A ARG 178.A N ARG 175.A O no hydrogen 3.095 N/A ARG 178.A NH1 VAL 173.A O no hydrogen 2.684 N/A GLU 181.A N GLU 181.A OE1 no hydrogen 2.905 N/A VAL 182.A N ALA 179.A O no hydrogen 2.856 N/A ILE 183.A N ALA 179.A O no hydrogen 2.872 N/A LEU 184.A N PRO 180.A O no hydrogen 2.767 N/A GLY 185.A N VAL 182.A O no hydrogen 3.452 N/A TYR 188.A N GLY 168.A O no hydrogen 3.033 N/A GLU 190.A N GLU 190.A OE1 no hydrogen 3.154 N/A ASN 191.A ND2 ALA 292.A O no hydrogen 2.640 N/A ASN 191.A ND2 ARG 295.A O no hydrogen 3.252 N/A VAL 192.A N LYS 189.A O no hydrogen 3.245 N/A ASP 193.A N GLU 190.A O no hydrogen 3.186 N/A LEU 194.A N ASN 191.A O no hydrogen 3.051 N/A SER 196.A OG TYR 177.A O no hydrogen 3.442 N/A VAL 197.A N ASP 193.A O no hydrogen 3.186 N/A GLY 198.A N LEU 194.A O no hydrogen 2.969 N/A CYS 199.A N TRP 195.A O no hydrogen 3.043 N/A CYS 199.A SG TYR 176.A O no hydrogen 3.812 N/A CYS 199.A SG TRP 195.A O no hydrogen 3.561 N/A ILE 200.A N SER 196.A O no hydrogen 2.935 N/A MET 201.A N VAL 197.A O no hydrogen 2.704 N/A GLY 202.A N GLY 198.A O no hydrogen 2.925 N/A GLU 203.A N CYS 199.A O no hydrogen 3.083 N/A MET 204.A N ILE 200.A O no hydrogen 2.984 N/A VAL 205.A N MET 201.A O no hydrogen 3.251 N/A CYS 206.A N GLY 202.A O no hydrogen 2.911 N/A HIS 207.A N GLU 203.A O no hydrogen 2.626 N/A HIS 207.A ND1 ILE 110.A O no hydrogen 2.731 N/A GLY 213.A N PHE 211.A O no hydrogen 2.987 N/A GLY 213.A N GLN 219.A OE1 no hydrogen 2.916 N/A ARG 214.A N ASP 218.A OD2 no hydrogen 2.941 N/A ILE 217.A N ASP 215.A OD1 no hydrogen 3.087 N/A ASP 218.A N ASP 215.A OD1 no hydrogen 2.734 N/A GLN 219.A N ASP 215.A O no hydrogen 3.102 N/A GLN 219.A NE2 PHE 211.A O no hydrogen 3.095 N/A TRP 220.A N ILE 217.A O no hydrogen 3.065 N/A ASN 221.A ND2 ASP 218.A OD1 no hydrogen 3.092 N/A LYS 222.A N ASP 218.A O no hydrogen 3.118 N/A LYS 222.A NZ ASP 218.A OD2 no hydrogen 3.322 N/A VAL 223.A N GLN 219.A O no hydrogen 3.324 N/A ILE 224.A N TRP 220.A O no hydrogen 3.053 N/A GLU 225.A N ASN 221.A O no hydrogen 3.115 N/A LEU 227.A N VAL 223.A O no hydrogen 2.874 N/A GLY 228.A N ILE 224.A O no hydrogen 2.756 N/A THR 229.A N TYR 252.A O no hydrogen 2.937 N/A PHE 234.A N CYS 231.A O no hydrogen 3.004 N/A LYS 236.A N PRO 232.A O no hydrogen 3.275 N/A LYS 237.A N PHE 234.A O no hydrogen 3.150 N/A LYS 237.A NZ ASP 291.A OD1 no hydrogen 2.894 N/A LYS 237.A NZ ASP 291.A OD2 no hydrogen 3.372 N/A LEU 238.A N MET 235.A O no hydrogen 3.004 N/A ARG 243.A N GLN 239.A O no hydrogen 2.899 N/A ARG 243.A NE GLU 247.A OE2 no hydrogen 3.237 N/A THR 244.A N PRO 240.A O no hydrogen 3.080 N/A THR 244.A OG1 PRO 240.A O no hydrogen 2.883 N/A VAL 246.A N VAL 242.A O no hydrogen 3.035 N/A GLU 247.A N ARG 243.A O no hydrogen 2.851 N/A ASN 248.A N THR 244.A O no hydrogen 3.091 N/A ASN 248.A N TYR 245.A O no hydrogen 3.207 N/A ARG 249.A N VAL 246.A O no hydrogen 3.447 N/A ARG 249.A NE ASN 221.A OD1 no hydrogen 3.157 N/A ARG 249.A NH2 ASN 221.A OD1 no hydrogen 3.016 N/A TYR 252.A N THR 229.A OG1 no hydrogen 2.934 N/A TYR 255.A N GLN 226.A O no hydrogen 2.952 N/A SER 256.A OG GLU 258.A OE1 no hydrogen 3.550 N/A LYS 259.A N SER 256.A OG no hydrogen 3.417 N/A LEU 260.A N SER 256.A O no hydrogen 2.840 N/A PHE 261.A N PHE 257.A O no hydrogen 2.692 N/A LEU 265.A N PRO 262.A O no hydrogen 2.848 N/A PHE 266.A N ASP 263.A O no hydrogen 2.989 N/A HIS 272.A N SER 270.A OG no hydrogen 3.328 N/A LEU 275.A N ASN 273.A OD1 no hydrogen 3.078 N/A LYS 276.A N GLN 279.A OE1 no hydrogen 2.915 N/A ALA 277.A N ASP 269.A OD1 no hydrogen 2.972 N/A GLN 279.A N LYS 276.A O no hydrogen 3.008 N/A ALA 280.A N LYS 276.A O no hydrogen 3.224 N/A ARG 281.A N ALA 277.A O no hydrogen 2.955 N/A ARG 281.A NE PHE 261.A O no hydrogen 2.939 N/A ARG 281.A NH1 ASP 263.A OD1 no hydrogen 3.525 N/A ARG 281.A NH2 PHE 261.A O no hydrogen 2.785 N/A ARG 281.A NH2 ASP 263.A OD1 no hydrogen 2.859 N/A ASP 282.A N SER 278.A O no hydrogen 3.083 N/A LEU 283.A N GLN 279.A O no hydrogen 2.927 N/A LEU 284.A N ALA 280.A O no hydrogen 2.937 N/A SER 285.A N ARG 281.A O no hydrogen 2.917 N/A SER 285.A OG ASP 282.A O no hydrogen 2.709 N/A LYS 286.A N LEU 283.A O no hydrogen 3.162 N/A LYS 286.A NZ ASP 282.A OD1 no hydrogen 3.373 N/A LYS 286.A NZ ASP 282.A OD2 no hydrogen 2.765 N/A MET 287.A N LEU 283.A O no hydrogen 3.207 N/A LEU 288.A N LEU 284.A O no hydrogen 2.934 N/A SER 293.A N ASP 291.A OD1 no hydrogen 3.173 N/A SER 293.A OG ASP 291.A OD1 no hydrogen 2.799 N/A LYS 294.A N ASP 291.A O no hydrogen 2.869 N/A LYS 294.A NZ GLU 233.A OE1 no hydrogen 3.556 N/A LYS 294.A NZ GLU 233.A OE2 no hydrogen 2.655 N/A ARG 295.A N ASP 291.A O no hydrogen 3.168 N/A ARG 295.A NE VAL 289.A O no hydrogen 2.821 N/A ARG 295.A NH1 GLU 181.A OE2 no hydrogen 3.013 N/A ARG 295.A NH1 ASN 191.A O no hydrogen 3.018 N/A ARG 295.A NH2 GLU 181.A OE1 no hydrogen 2.939 N/A ARG 295.A NH2 VAL 289.A O no hydrogen 3.106 N/A ARG 295.A NH2 ILE 290.A O no hydrogen 3.109 N/A ILE 296.A N LYS 286.A O no hydrogen 3.209 N/A SER 297.A N GLU 300.A OE1 no hydrogen 3.071 N/A SER 297.A OG GLU 300.A OE1 no hydrogen 2.859 N/A GLU 300.A N SER 297.A OG no hydrogen 3.405 N/A ALA 301.A N SER 297.A O no hydrogen 2.983 N/A LEU 302.A N VAL 298.A O no hydrogen 2.866 N/A GLN 303.A N ASP 299.A O no hydrogen 2.930 N/A HIS 304.A N ALA 301.A O no hydrogen 3.246 N/A HIS 304.A NE2 ASP 282.A OD2 no hydrogen 2.762 N/A TYR 306.A N HIS 304.A ND1 no hydrogen 3.031 N/A TYR 306.A OH HIS 116.A ND1 no hydrogen 2.787 N/A ILE 307.A N HIS 304.A O no hydrogen 2.662 N/A ASN 308.A N HIS 304.A O no hydrogen 2.798 N/A ASN 308.A ND2 LEU 302.A O no hydrogen 2.968 N/A TRP 310.A N ILE 307.A O no hydrogen 3.302 N/A TRP 310.A NE1 SER 120.A OG no hydrogen 2.760 N/A TYR 311.A N ASN 308.A O no hydrogen 2.879 N/A TYR 311.A OH GLU 317.A OE2 no hydrogen 2.642 N/A ASP 312.A N TYR 124.A OH no hydrogen 3.008 N/A SER 314.A N ASP 312.A OD1 no hydrogen 3.130 N/A SER 314.A OG ASP 312.A OD1 no hydrogen 2.613 N/A GLU 315.A N ASP 312.A O no hydrogen 3.063 N/A ALA 316.A N ASP 312.A O no hydrogen 2.799 N/A GLU 317.A N PRO 313.A O no hydrogen 2.723 N/A THR 328.A N GLU 331.A OE2 no hydrogen 3.290 N/A THR 328.A OG1 GLU 331.A OE2 no hydrogen 2.653 N/A TRP 332.A N THR 328.A O no hydrogen 2.822 N/A LYS 333.A N ILE 329.A O no hydrogen 2.776 N/A LYS 333.A NZ LEU 89.A O no hydrogen 3.227 N/A LYS 333.A NZ GLU 90.A O no hydrogen 3.385 N/A GLU 334.A N GLU 330.A O no hydrogen 3.333 N/A LEU 335.A N GLU 331.A O no hydrogen 3.138 N/A ILE 336.A N TRP 332.A O no hydrogen 2.810 N/A TYR 337.A N LYS 333.A O no hydrogen 3.131 N/A LYS 338.A N GLU 334.A O no hydrogen 3.089 N/A GLU 339.A N LEU 335.A O no hydrogen 3.371 N/A VAL 340.A N ILE 336.A O no hydrogen 2.902 N/A MET 341.A N TYR 337.A O no hydrogen 2.984 N/A ASP 342.A N LYS 338.A O no hydrogen 3.189 N/A