Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3uwp_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LEU 4.A N TYR 17.A O no hydrogen 2.844 N/A ARG 5.A NE GLU 3.A OE2 no hydrogen 2.831 N/A ARG 5.A NH1 GLU 3.A OE2 no hydrogen 3.275 N/A LEU 6.A N ALA 15.A O no hydrogen 2.860 N/A LYS 7.A N ASN 76.A OD1 no hydrogen 2.766 N/A LYS 7.A NZ ASP 80.A OD1 no hydrogen 2.702 N/A LYS 7.A NZ ASP 80.A OD2 no hydrogen 3.343 N/A SER 8.A OG TRP 205.A O no hydrogen 2.619 N/A VAL 10.A N SER 8.A OG no hydrogen 3.048 N/A GLY 11.A N SER 8.A O no hydrogen 3.235 N/A ALA 12.A N SER 8.A OG no hydrogen 3.228 N/A ALA 15.A N LEU 6.A O no hydrogen 2.902 N/A TYR 17.A N LEU 4.A O no hydrogen 2.772 N/A TYR 17.A OH GLU 33.A OE2 no hydrogen 2.640 N/A TRP 19.A N LEU 2.A O no hydrogen 3.097 N/A TYR 24.A N HIS 28.A O no hydrogen 2.965 N/A ASP 25.A N HIS 28.A O no hydrogen 3.140 N/A HIS 27.A N ASP 25.A OD1 no hydrogen 2.915 N/A HIS 28.A N ASP 25.A O no hydrogen 3.381 N/A HIS 28.A ND1 ASP 25.A OD1 no hydrogen 3.044 N/A ALA 30.A N PRO 22.A O no hydrogen 2.919 N/A HIS 32.A N ASP 29.A OD1 no hydrogen 2.992 N/A HIS 32.A ND1.A ASP 29.A OD1 no hydrogen 2.661 N/A HIS 32.A ND1.A ASP 29.A OD2 no hydrogen 3.168 N/A GLU 33.A N ASP 29.A O no hydrogen 3.099 N/A ILE 34.A N ALA 30.A O no hydrogen 2.842 N/A ILE 35.A N ALA 31.A O no hydrogen 3.105 N/A GLU 36.A N HIS 32.A O no hydrogen 2.870 N/A THR 37.A N GLU 33.A O no hydrogen 2.818 N/A THR 37.A OG1 GLU 33.A O no hydrogen 2.699 N/A THR 37.A OG1 HIS 106.A NE2 no hydrogen 3.051 N/A ILE 38.A N ILE 34.A O no hydrogen 3.059 N/A ARG 39.A N ILE 35.A O no hydrogen 3.032 N/A TRP 40.A N GLU 36.A O no hydrogen 2.950 N/A VAL 41.A N THR 37.A O no hydrogen 2.858 N/A CYS 42.A N ILE 38.A O no hydrogen 3.033 N/A CYS 42.A SG ILE 38.A O no hydrogen 3.298 N/A GLU 43.A N ARG 39.A O no hydrogen 3.160 N/A GLU 44.A N TRP 40.A O no hydrogen 3.161 N/A ILE 45.A N VAL 41.A O no hydrogen 2.912 N/A LYS 49.A N ILE 45.A O no hydrogen 3.120 N/A LYS 49.A NZ GLU 43.A OE1 no hydrogen 3.547 N/A LYS 49.A NZ GLU 43.A OE2 no hydrogen 2.651 N/A LEU 50.A N PRO 46.A O no hydrogen 2.969 N/A ALA 51.A N ASP 47.A O no hydrogen 3.043 N/A MET 52.A N LEU 48.A O no hydrogen 2.958 N/A ASN 54.A ND2 LYS 49.A O no hydrogen 2.986 N/A VAL 56.A N GLU 53.A O no hydrogen 3.320 N/A ASP 59.A N VAL 56.A O no hydrogen 2.787 N/A ASP 61.A N SER 67.A OG no hydrogen 2.833 N/A LYS 63.A N ASP 61.A OD1 no hydrogen 3.104 N/A SER 64.A N ASP 61.A O no hydrogen 3.057 N/A SER 67.A N SER 64.A OG no hydrogen 3.072 N/A SER 67.A OG ASP 61.A O no hydrogen 3.561 N/A MET 68.A N SER 64.A O no hydrogen 3.007 N/A GLN 69.A N PHE 65.A O no hydrogen 2.835 N/A ARG 70.A N GLU 66.A O no hydrogen 3.155 N/A LEU 71.A N SER 67.A O no hydrogen 3.203 N/A CYS 72.A N MET 68.A O no hydrogen 3.020 N/A CYS 72.A SG MET 68.A O no hydrogen 3.458 N/A ASP 73.A N GLN 69.A O no hydrogen 2.846 N/A LYS 74.A N ARG 70.A O no hydrogen 2.973 N/A TYR 75.A N LEU 71.A O no hydrogen 2.991 N/A TYR 75.A OH LYS 7.A O no hydrogen 2.817 N/A ASN 76.A N CYS 72.A O no hydrogen 2.854 N/A ASN 76.A ND2 ARG 5.A O no hydrogen 2.931 N/A ARG 77.A N ASP 73.A O no hydrogen 2.971 N/A ALA 78.A N LYS 74.A O no hydrogen 3.142 N/A ILE 79.A N TYR 75.A O no hydrogen 2.861 N/A ASP 80.A N ASN 76.A O no hydrogen 3.029 N/A SER 81.A N ARG 77.A O no hydrogen 3.089 N/A SER 81.A OG ALA 78.A O no hydrogen 2.884 N/A ILE 82.A N ALA 78.A O no hydrogen 2.953 N/A HIS 83.A N ILE 79.A O no hydrogen 2.934 N/A HIS 83.A NE2 PRO 9.A O no hydrogen 2.794 N/A GLN 84.A N ASP 80.A O no hydrogen 3.048 N/A LEU 85.A N SER 81.A O no hydrogen 2.902 N/A TRP 86.A N ILE 82.A O no hydrogen 2.987 N/A LYS 87.A N HIS 83.A O no hydrogen 3.305 N/A LYS 87.A N GLN 84.A O no hydrogen 3.004 N/A GLY 88.A N LEU 85.A O no hydrogen 3.055 N/A ARG 98.A NH1 THR 174.A O no hydrogen 2.828 N/A ARG 98.A NH2 THR 174.A O no hydrogen 3.283 N/A LEU 103.A N SER 100.A OG no hydrogen 3.315 N/A LEU 104.A N SER 100.A O no hydrogen 2.918 N/A ARG 105.A N THR 101.A O no hydrogen 2.964 N/A ARG 105.A NE GLY 134.A O no hydrogen 3.036 N/A ARG 105.A NH2 ASP 139.A OD1 no hydrogen 2.647 N/A HIS 106.A N GLY 102.A O no hydrogen 3.195 N/A HIS 106.A NE2 THR 37.A OG1 no hydrogen 3.051 N/A ILE 107.A N LEU 103.A O no hydrogen 2.836 N/A LEU 108.A N LEU 104.A O no hydrogen 2.923 N/A GLN 109.A N ARG 105.A O no hydrogen 2.982 N/A GLN 109.A NE2 ASN 113.A OD1 no hydrogen 3.070 N/A GLN 110.A N HIS 106.A O no hydrogen 2.959 N/A GLN 110.A NE2 GLU 33.A OE2 no hydrogen 2.977 N/A GLN 110.A NE2 THR 37.A OG1 no hydrogen 3.201 N/A VAL 111.A N ILE 107.A O no hydrogen 2.809 N/A TYR 112.A N LEU 108.A O no hydrogen 2.924 N/A ASN 113.A N GLN 109.A O no hydrogen 2.701 N/A ASN 113.A ND2 GLU 33.A OE1 no hydrogen 2.899 N/A HIS 114.A N GLN 110.A O no hydrogen 3.112 N/A HIS 114.A NE2 GLU 33.A OE2 no hydrogen 2.761 N/A SER 115.A N TYR 112.A O no hydrogen 3.107 N/A SER 115.A OG VAL 111.A O no hydrogen 2.698 N/A VAL 116.A N TYR 112.A O no hydrogen 3.018 N/A THR 117.A OG1 TYR 191.A OH no hydrogen 3.065 N/A ASP 118.A N TYR 191.A OH no hydrogen 2.774 N/A GLU 120.A N GLU 120.A OE1 no hydrogen 3.047 N/A LYS 121.A N ASP 118.A O no hydrogen 3.198 N/A LEU 122.A N PRO 119.A O no hydrogen 3.268 N/A TYR 125.A N ASN 123.A O no hydrogen 2.789 N/A VAL 132.A N SER 129.A O no hydrogen 3.029 N/A TYR 133.A N PRO 130.A O no hydrogen 3.188 N/A TYR 133.A OH GLN 169.A OE1 no hydrogen 2.621 N/A GLU 135.A N VAL 132.A O no hydrogen 3.130 N/A THR 136.A N TYR 133.A O no hydrogen 3.151 N/A THR 136.A OG1 VAL 132.A O no hydrogen 2.716 N/A SER 137.A N THR 136.A OG1 no hydrogen 2.734 N/A PHE 138.A N TYR 133.A O no hydrogen 2.767 N/A ASP 139.A N THR 136.A O no hydrogen 3.013 N/A LEU 140.A N THR 136.A O no hydrogen 3.268 N/A VAL 141.A N SER 137.A O no hydrogen 2.802 N/A ALA 142.A N PHE 138.A O no hydrogen 2.826 N/A GLN 143.A N ASP 139.A O no hydrogen 2.967 N/A MET 144.A N LEU 140.A O no hydrogen 3.001 N/A ILE 145.A N VAL 141.A O no hydrogen 2.862 N/A ASP 146.A N ALA 142.A O no hydrogen 3.153 N/A GLU 147.A N GLN 143.A O no hydrogen 3.012 N/A ILE 148.A N MET 144.A O no hydrogen 2.870 N/A LYS 149.A N ILE 145.A O no hydrogen 3.108 N/A THR 151.A N ASP 154.A OD2 no hydrogen 2.811 N/A THR 151.A OG1 ASP 154.A OD2 no hydrogen 3.471 N/A ASP 153.A N THR 151.A OG1 no hydrogen 3.258 N/A ASP 154.A N THR 151.A O no hydrogen 3.107 N/A LEU 155.A N SER 233.A OG no hydrogen 2.903 N/A PHE 156.A N HIS 178.A O no hydrogen 2.961 N/A VAL 157.A N VAL 234.A O no hydrogen 2.955 N/A ASP 158.A N TYR 180.A O no hydrogen 2.821 N/A LEU 159.A N PHE 236.A O no hydrogen 2.926 N/A GLY 160.A N VAL 182.A O no hydrogen 2.822 N/A SER 161.A N VAL 182.A O no hydrogen 2.940 N/A GLY 162.A N GLU 183.A OE1 no hydrogen 2.745 N/A GLY 164.A N SER 161.A O no hydrogen 2.877 N/A GLN 165.A NE2 PRO 130.A O no hydrogen 3.245 N/A LEU 168.A N GLY 164.A O no hydrogen 3.130 N/A GLN 169.A N GLN 165.A O no hydrogen 3.070 N/A GLN 169.A NE2 PHE 138.A O no hydrogen 3.011 N/A VAL 170.A N VAL 166.A O no hydrogen 2.956 N/A ALA 171.A N VAL 167.A O no hydrogen 2.922 N/A ALA 172.A N LEU 168.A O no hydrogen 3.128 N/A ALA 173.A N VAL 170.A O no hydrogen 3.106 N/A THR 174.A OG1 VAL 170.A O no hydrogen 2.995 N/A CYS 176.A SG ASP 154.A O no hydrogen 3.475 N/A CYS 176.A SG HIS 178.A O no hydrogen 3.324 N/A HIS 179.A ND1 GLU 212.A O no hydrogen 3.008 N/A HIS 179.A NE2 THR 174.A OG1 no hydrogen 3.213 N/A TYR 180.A N PHE 156.A O no hydrogen 2.887 N/A GLY 181.A N THR 214.A O no hydrogen 2.973 N/A VAL 182.A N ASP 158.A O no hydrogen 3.130 N/A GLU 183.A N GLU 216.A O no hydrogen 3.128 N/A ALA 185.A N GLU 183.A OE2 no hydrogen 2.837 N/A ALA 189.A N ALA 185.A O no hydrogen 3.139 N/A LYS 190.A N ASP 186.A O no hydrogen 2.883 N/A TYR 191.A N ILE 187.A O no hydrogen 2.981 N/A TYR 191.A OH THR 117.A OG1 no hydrogen 3.065 N/A ALA 192.A N PRO 188.A O no hydrogen 2.702 N/A GLU 193.A N ALA 189.A O no hydrogen 3.284 N/A GLU 193.A N LYS 190.A O no hydrogen 3.157 N/A MET 195.A N TYR 191.A O no hydrogen 2.949 N/A ASP 196.A N ALA 192.A O no hydrogen 2.977 N/A ARG 197.A N GLU 193.A O no hydrogen 3.343 N/A GLU 198.A N THR 194.A O no hydrogen 2.922 N/A PHE 199.A N MET 195.A O no hydrogen 2.915 N/A ARG 200.A N ASP 196.A O no hydrogen 3.178 N/A ARG 200.A NE ASP 196.A OD1 no hydrogen 2.656 N/A ARG 200.A NH2 TYR 213.A O no hydrogen 3.153 N/A LYS 201.A N ARG 197.A O no hydrogen 3.109 N/A LYS 201.A NZ GLU 198.A OE1 no hydrogen 2.673 N/A LYS 201.A NZ GLU 198.A OE2 no hydrogen 3.273 N/A TRP 202.A N GLU 198.A O no hydrogen 2.881 N/A TRP 202.A NE1 GLU 198.A OE1 no hydrogen 3.085 N/A MET 203.A N PHE 199.A O no hydrogen 2.852 N/A LYS 204.A N ARG 200.A O no hydrogen 3.172 N/A TRP 205.A N LYS 201.A O no hydrogen 2.975 N/A TYR 206.A N TRP 202.A O no hydrogen 3.036 N/A TYR 206.A OH GLN 110.A OE1 no hydrogen 2.600 N/A GLY 207.A N LYS 204.A O no hydrogen 3.066 N/A LYS 208.A N MET 203.A O no hydrogen 2.899 N/A LYS 208.A NZ THR 97.A OG1 no hydrogen 3.129 N/A LYS 209.A N THR 97.A O no hydrogen 2.896 N/A HIS 210.A ND1 ALA 211.A O no hydrogen 2.747 N/A ALA 211.A N ALA 171.A O no hydrogen 2.772 N/A TYR 213.A OH ASP 196.A OD1 no hydrogen 2.591 N/A THR 214.A N HIS 179.A O no hydrogen 2.875 N/A GLU 216.A N GLY 181.A O no hydrogen 2.839 N/A GLY 218.A N GLU 183.A O no hydrogen 2.894 N/A LEU 221.A N ASP 219.A OD1 no hydrogen 2.867 N/A SER 222.A N ASP 219.A O no hydrogen 3.110 N/A SER 222.A OG ASP 219.A O no hydrogen 2.986 N/A ARG 226.A N SER 222.A O no hydrogen 3.153 N/A ARG 226.A N GLU 223.A O no hydrogen 3.135 N/A ARG 226.A NE GLU 223.A OE2 no hydrogen 3.153 N/A ARG 226.A NH1 GLU 252.A OE2.B no hydrogen 2.912 N/A ARG 226.A NH2 GLU 252.A OE2.B no hydrogen 2.658 N/A ARG 228.A N GLU 224.A O no hydrogen 3.389 N/A ARG 228.A NH1 GLU 216.A OE2 no hydrogen 3.181 N/A ARG 228.A NH2 GLU 216.A OE1 no hydrogen 3.025 N/A ARG 228.A NH2 GLU 216.A OE2 no hydrogen 3.462 N/A ILE 229.A N TRP 225.A O no hydrogen 2.867 N/A ALA 230.A N ARG 226.A O no hydrogen 3.059 N/A ASN 231.A N GLU 227.A O no hydrogen 3.264 N/A ASN 231.A N ARG 228.A O no hydrogen 3.088 N/A THR 232.A N ILE 229.A O no hydrogen 3.141 N/A THR 232.A OG1 ARG 228.A O no hydrogen 2.848 N/A SER 233.A N LEU 155.A O no hydrogen 3.061 N/A SER 233.A OG ASP 154.A OD1 no hydrogen 2.684 N/A SER 233.A OG LEU 155.A O no hydrogen 3.374 N/A VAL 234.A N LEU 155.A O no hydrogen 3.019 N/A ILE 235.A N ARG 262.A O no hydrogen 2.890 N/A PHE 236.A N VAL 157.A O no hydrogen 2.885 N/A VAL 237.A N VAL 264.A O no hydrogen 2.980 N/A ASN 239.A ND2 ASP 247.A OD1 no hydrogen 3.295 N/A ASN 239.A ND2 ASP 247.A OD2 no hydrogen 3.465 N/A ASN 239.A ND2 LYS 267.A O no hydrogen 2.997 N/A PHE 240.A N SER 266.A OG no hydrogen 2.976 N/A PHE 242.A N ASN 239.A O no hydrogen 2.904 N/A ASP 247.A N GLY 243.A O no hydrogen 3.083 N/A HIS 248.A N PRO 244.A O no hydrogen 2.909 N/A GLN 249.A N GLU 245.A O no hydrogen 3.013 N/A LEU 250.A N VAL 246.A O no hydrogen 2.966 N/A LYS 251.A N ASP 247.A O no hydrogen 3.012 N/A GLU 252.A N.A HIS 248.A O no hydrogen 3.167 N/A GLU 252.A N.B HIS 248.A O no hydrogen 3.159 N/A ARG 253.A N GLN 249.A O no hydrogen 3.210 N/A ARG 253.A NH1 GLN 249.A O no hydrogen 3.013 N/A ARG 253.A NH1 GLN 249.A OE1 no hydrogen 2.677 N/A ARG 253.A NH2 LEU 221.A O no hydrogen 2.885 N/A PHE 254.A N LEU 250.A O no hydrogen 2.873 N/A ALA 255.A N LYS 251.A O no hydrogen 3.099 N/A ASN 256.A N ARG 253.A O no hydrogen 3.309 N/A MET 257.A N PHE 254.A O no hydrogen 2.957 N/A GLY 260.A N ILE 314.A O no hydrogen 2.987 N/A GLY 261.A N LYS 258.A O no hydrogen 2.914 N/A ARG 262.A N SER 233.A O no hydrogen 2.883 N/A ARG 262.A NH2 ILE 148.A O no hydrogen 2.847 N/A ILE 263.A N HIS 312.A O no hydrogen 2.789 N/A VAL 264.A N ILE 235.A O no hydrogen 2.808 N/A SER 265.A N TYR 310.A O no hydrogen 2.918 N/A SER 265.A OG LYS 267.A O no hydrogen 2.718 N/A SER 266.A N ASN 239.A OD1 no hydrogen 3.160 N/A SER 266.A OG ASN 238.A OD1 no hydrogen 2.666 N/A SER 266.A OG ASN 239.A OD1 no hydrogen 3.523 N/A LYS 267.A N ASN 239.A OD1 no hydrogen 2.896 N/A PHE 269.A N HIS 312.A NE2 no hydrogen 3.007 N/A ASN 277.A N ASN 280.A OD1 no hydrogen 2.780 N/A ARG 279.A N ASN 277.A OD1 no hydrogen 2.956 N/A ASN 280.A ND2 ARG 275.A O no hydrogen 2.903 N/A ASP 283.A N ASN 280.A O no hydrogen 3.122 N/A THR 286.A N ASP 283.A O no hydrogen 3.116 N/A THR 286.A OG1 ASP 283.A O no hydrogen 2.747 N/A ILE 287.A N ILE 284.A O no hydrogen 3.001 N/A ARG 289.A N THR 313.A O no hydrogen 2.956 N/A ARG 289.A NH2 ASP 315.A OD2 no hydrogen 2.860 N/A VAL 291.A N LEU 311.A O no hydrogen 2.950 N/A LEU 293.A N TYR 309.A O no hydrogen 2.922 N/A LEU 296.A N VAL 307.A O no hydrogen 3.051 N/A SER 301.A N LYS 305.A O no hydrogen 3.106 N/A TRP 302.A NE1 GLU 126.A O no hydrogen 2.838 N/A THR 303.A N SER 301.A OG no hydrogen 3.266 N/A THR 303.A OG1 SER 301.A OG no hydrogen 2.793 N/A GLY 304.A N SER 301.A O no hydrogen 2.789 N/A LYS 305.A N THR 303.A OG1 no hydrogen 3.177 N/A SER 308.A OG GLU 292.A OE2 no hydrogen 2.782 N/A TYR 310.A N SER 265.A O no hydrogen 2.784 N/A LEU 311.A N VAL 291.A O no hydrogen 2.904 N/A HIS 312.A N ILE 263.A O no hydrogen 2.753 N/A HIS 312.A ND1 ILE 263.A O no hydrogen 2.850 N/A THR 313.A N ARG 289.A O no hydrogen 2.859 N/A ILE 314.A N GLY 261.A O no hydrogen 2.769 N/A ASP 315.A N ILE 287.A O no hydrogen 2.746 N/A ARG 316.A N GLU 259.A OE1 no hydrogen 3.084 N/A ARG 316.A N GLU 259.A OE2 no hydrogen 3.199 N/A ARG 316.A NH1 MET 257.A O no hydrogen 3.020 N/A ARG 316.A NH2 MET 257.A O no hydrogen 3.009 N/A THR 317.A N ASP 315.A OD1 no hydrogen 3.102 N/A THR 317.A OG1 ASP 315.A OD1 no hydrogen 2.541 N/A GLU 320.A N ARG 316.A O no hydrogen 2.905 N/A ASN 321.A N THR 317.A O no hydrogen 2.881 N/A TYR 322.A N ILE 318.A O no hydrogen 3.225 N/A PHE 323.A N LEU 319.A O no hydrogen 3.092 N/A SER 324.A N GLU 320.A O no hydrogen 3.004 N/A SER 324.A OG GLU 320.A O no hydrogen 3.263 N/A SER 325.A N ASN 321.A O no hydrogen 3.075 N/A SER 325.A OG.A TYR 322.A O no hydrogen 2.601 N/A SER 325.A OG.A GLN 335.A OE1 no hydrogen 2.455 N/A SER 325.A OG.B ASN 321.A O no hydrogen 3.171 N/A LEU 326.A N TYR 322.A O no hydrogen 3.004 N/A LYS 327.A N PHE 323.A O no hydrogen 3.168 N/A ASN 328.A N SER 325.A O no hydrogen 3.123 N/A LYS 330.A N ASN 328.A OD1 no hydrogen 2.948 N/A ARG 332.A N ASN 328.A O no hydrogen 2.775 N/A GLU 333.A N PRO 329.A O no hydrogen 2.903 N/A GLU 334.A N LYS 330.A O no hydrogen 3.067 N/A GLN 335.A N LEU 331.A O no hydrogen 2.933 N/A GLU 336.A N ARG 332.A O no hydrogen 3.089 N/A ALA 337.A N GLU 333.A O no hydrogen 2.972 N/A ALA 338.A N GLU 334.A O no hydrogen 2.946 N/A ARG 339.A N GLN 335.A O no hydrogen 3.064 N/A ARG 340.A N GLU 336.A O no hydrogen 3.257 N/A ARG 341.A N ALA 338.A O no hydrogen 3.060 N/A