Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3wi7_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ALA 4.A N HIS 2.A ND1 no hydrogen 3.101 N/A PHE 5.A N HIS 2.A O no hydrogen 3.156 N/A GLY 6.A N SER 3.A O no hydrogen 2.703 N/A LYS 10.A N GLU 25.A O no hydrogen 2.895 N/A TYR 12.A N THR 23.A O no hydrogen 2.999 N/A TYR 12.A OH GLU 25.A OE1 no hydrogen 2.764 N/A VAL 14.A N ILE 21.A O no hydrogen 2.777 N/A ALA 16.A N LEU 19.A O no hydrogen 2.880 N/A LEU 19.A N ALA 16.A O no hydrogen 2.671 N/A GLN 20.A N SER 70.A OG no hydrogen 2.909 N/A ILE 21.A N VAL 14.A O no hydrogen 2.850 N/A HIS 22.A N SER 69.A OG no hydrogen 2.756 N/A HIS 22.A ND1 ASP 13.A OD1 no hydrogen 2.775 N/A THR 23.A N TYR 12.A O no hydrogen 2.820 N/A THR 23.A OG1 ILE 21.A O no hydrogen 3.183 N/A VAL 24.A N ALA 60.A O no hydrogen 2.814 N/A GLU 25.A N LYS 10.A O no hydrogen 2.759 N/A HIS 26.A N LEU 58.A O no hydrogen 2.932 N/A ILE 32.A N ARG 57.A O no hydrogen 2.839 N/A VAL 33.A N THR 98.A O no hydrogen 2.825 N/A PHE 34.A N LEU 59.A O no hydrogen 2.794 N/A LEU 35.A N VAL 100.A O no hydrogen 3.064 N/A HIS 36.A ND1 GLY 37.A O no hydrogen 2.731 N/A ASN 38.A N ASP 103.A OD2 no hydrogen 2.825 N/A ASN 38.A ND2 ILE 199.A O no hydrogen 3.163 N/A THR 40.A N GLY 37.A O no hydrogen 3.046 N/A THR 40.A OG1 GLY 37.A O no hydrogen 3.119 N/A SER 42.A N ASP 62.A OD1 no hydrogen 2.688 N/A SER 42.A OG ASP 62.A OD1 no hydrogen 2.626 N/A TYR 43.A N SER 41.A OG no hydrogen 3.134 N/A TYR 43.A OH ASP 182.A OD1 no hydrogen 2.703 N/A LEU 44.A N SER 41.A O no hydrogen 3.127 N/A TRP 45.A N SER 42.A O no hydrogen 2.878 N/A ARG 46.A N TYR 43.A O no hydrogen 3.201 N/A ARG 46.A NH1 TYR 43.A O no hydrogen 2.858 N/A ARG 46.A NH1 GLU 273.A OE2 no hydrogen 2.835 N/A ARG 46.A NH2 GLU 273.A OE1 no hydrogen 3.236 N/A ARG 46.A NH2 GLU 273.A OE2 no hydrogen 3.033 N/A PHE 49.A N TRP 45.A O no hydrogen 2.778 N/A ARG 50.A N ARG 46.A O no hydrogen 2.857 N/A ARG 50.A NH1 ALA 4.A O no hydrogen 2.806 N/A ARG 51.A N HIS 47.A O no hydrogen 3.249 N/A LEU 52.A N PHE 49.A O no hydrogen 3.000 N/A HIS 53.A N ARG 50.A O no hydrogen 3.261 N/A HIS 53.A NE2 PHE 5.A O no hydrogen 3.093 N/A HIS 55.A N LEU 52.A O no hydrogen 3.216 N/A HIS 55.A NE2 ASP 284.A OD1 no hydrogen 2.505 N/A ARG 57.A N ALA 30.A O no hydrogen 2.989 N/A ARG 57.A NE GLU 25.A OE1 no hydrogen 3.389 N/A ARG 57.A NE GLU 25.A OE2 no hydrogen 3.205 N/A ARG 57.A NH2 GLU 25.A OE1 no hydrogen 2.864 N/A LEU 58.A N HIS 26.A O no hydrogen 2.760 N/A LEU 59.A N ILE 32.A O no hydrogen 2.862 N/A ALA 60.A N VAL 24.A O no hydrogen 2.873 N/A VAL 61.A N PHE 34.A O no hydrogen 3.508 N/A ASP 62.A N HIS 22.A O no hydrogen 2.944 N/A LEU 63.A N HIS 36.A NE2 no hydrogen 3.058 N/A GLY 65.A N SER 70.A O no hydrogen 2.896 N/A TYR 66.A N LEU 63.A O no hydrogen 3.087 N/A TYR 66.A OH ASN 38.A OD1 no hydrogen 2.735 N/A GLN 68.A N ASP 62.A OD2 no hydrogen 2.863 N/A SER 69.A N TYR 66.A O no hydrogen 3.001 N/A SER 69.A OG ASP 62.A O no hydrogen 2.637 N/A SER 70.A N GLN 20.A O no hydrogen 2.992 N/A SER 70.A OG GLN 20.A O no hydrogen 3.476 N/A LYS 71.A NZ GLY 67.A O no hydrogen 2.760 N/A LYS 71.A NZ SER 69.A O no hydrogen 2.952 N/A TYR 76.A OH PRO 72.A O no hydrogen 3.219 N/A ASN 80.A N THR 77.A OG1 no hydrogen 2.966 N/A ASN 80.A ND2 GLU 75.A O no hydrogen 2.986 N/A GLN 81.A N THR 77.A O no hydrogen 3.036 N/A GLN 81.A NE2 TYR 76.A O no hydrogen 3.044 N/A GLN 81.A NE2 THR 77.A O no hydrogen 3.480 N/A GLN 82.A N LEU 78.A O no hydrogen 2.890 N/A GLN 82.A NE2 GLN 82.A O no hydrogen 3.643 N/A GLN 82.A NE2 ASP 86.A OD1 no hydrogen 3.060 N/A GLN 82.A NE2 PHE 108.A O no hydrogen 3.111 N/A ARG 83.A N GLU 79.A O no hydrogen 3.214 N/A ARG 83.A NH2 ASN 80.A OD1 no hydrogen 3.046 N/A VAL 85.A N GLN 81.A O no hydrogen 3.186 N/A ASP 86.A N GLN 82.A O no hydrogen 2.819 N/A ALA 87.A N ARG 83.A O no hydrogen 2.878 N/A TRP 88.A N TYR 84.A O no hydrogen 3.043 N/A TRP 88.A N VAL 85.A O no hydrogen 3.020 N/A TRP 88.A NE1 THR 23.A OG1 no hydrogen 3.030 N/A PHE 89.A N VAL 85.A O no hydrogen 3.115 N/A ASP 90.A N ASP 86.A O no hydrogen 2.988 N/A ALA 91.A N ALA 87.A O no hydrogen 3.036 N/A LEU 92.A N TRP 88.A O no hydrogen 3.298 N/A ASP 93.A N ASP 90.A O no hydrogen 3.086 N/A ARG 95.A NH2 ASP 118.A O no hydrogen 3.558 N/A VAL 97.A N ARG 119.A O no hydrogen 2.906 N/A THR 98.A N PRO 31.A O no hydrogen 2.892 N/A LEU 99.A N ALA 122.A O no hydrogen 2.951 N/A VAL 100.A N VAL 33.A O no hydrogen 2.824 N/A LEU 101.A N ALA 124.A O no hydrogen 2.928 N/A GLN 102.A N LEU 35.A O no hydrogen 3.226 N/A GLN 102.A NE2 HIS 269.A O no hydrogen 3.125 N/A ASP 103.A N GLU 127.A O no hydrogen 2.779 N/A TYR 104.A OH GLY 202.A O no hydrogen 2.688 N/A ALA 106.A N ASP 103.A O no hydrogen 2.920 N/A PHE 108.A N TYR 104.A O no hydrogen 2.951 N/A GLY 109.A N GLY 105.A O no hydrogen 2.841 N/A LEU 110.A N ALA 106.A O no hydrogen 2.870 N/A ASN 111.A N ALA 107.A O no hydrogen 3.055 N/A TRP 112.A N PHE 108.A O no hydrogen 2.974 N/A ALA 113.A N GLY 109.A O no hydrogen 2.883 N/A SER 114.A N LEU 110.A O no hydrogen 3.019 N/A SER 114.A OG ASN 111.A O no hydrogen 2.753 N/A ARG 115.A N TRP 112.A O no hydrogen 3.042 N/A ARG 115.A NE ASN 111.A OD1 no hydrogen 2.955 N/A ARG 115.A NH2 ASP 86.A OD1 no hydrogen 2.823 N/A ARG 115.A NH2 ASN 111.A OD1 no hydrogen 2.918 N/A ASN 116.A N ALA 113.A O no hydrogen 2.949 N/A ASN 116.A ND2 TRP 112.A O no hydrogen 2.903 N/A ARG 119.A N ASN 116.A O no hydrogen 2.778 N/A ARG 119.A NE ASN 116.A OD1 no hydrogen 3.562 N/A ARG 119.A NH1 ASP 93.A OD1 no hydrogen 3.202 N/A VAL 120.A N PRO 117.A O no hydrogen 3.415 N/A ARG 121.A N VAL 97.A O no hydrogen 2.828 N/A ALA 122.A N VAL 97.A O no hydrogen 3.371 N/A VAL 123.A N PRO 232.A O no hydrogen 3.072 N/A ALA 124.A N LEU 99.A O no hydrogen 2.854 N/A PHE 125.A N LEU 234.A O no hydrogen 2.792 N/A PHE 126.A N LEU 101.A O no hydrogen 3.033 N/A VAL 129.A N ASP 103.A O no hydrogen 3.061 N/A ARG 131.A NH1 GLU 220.A OE1 no hydrogen 3.311 N/A ILE 133.A N PRO 207.A O no hydrogen 2.959 N/A SER 135.A N ASP 209.A OD1 no hydrogen 2.853 N/A SER 135.A OG ASP 209.A OD1 no hydrogen 3.273 N/A SER 135.A OG ASP 209.A OD2 no hydrogen 2.403 N/A ASP 137.A N ASP 134.A O no hydrogen 2.867 N/A LEU 138.A N SER 135.A O no hydrogen 3.178 N/A SER 139.A OG GLU 141.A OE1 no hydrogen 2.479 N/A VAL 143.A N SER 139.A O no hydrogen 3.036 N/A THR 144.A N PRO 140.A O no hydrogen 2.954 N/A THR 144.A OG1 PRO 140.A O no hydrogen 3.141 N/A ARG 145.A N GLU 141.A O no hydrogen 2.982 N/A ARG 146.A N PHE 142.A O no hydrogen 2.818 N/A ARG 146.A NE PRO 203.A O no hydrogen 2.902 N/A ARG 146.A NH2 LEU 206.A O no hydrogen 2.730 N/A ALA 147.A N VAL 143.A O no hydrogen 2.965 N/A LYS 148.A N THR 144.A O no hydrogen 3.120 N/A LEU 149.A N ARG 145.A O no hydrogen 2.745 N/A ARG 150.A N ARG 146.A O no hydrogen 2.943 N/A ARG 150.A NH1 GLU 211.A OE1 no hydrogen 2.937 N/A ARG 150.A NH2 GLU 211.A OE1 no hydrogen 3.480 N/A GLN 151.A N LYS 148.A O no hydrogen 3.120 N/A GLY 153.A N GLU 156.A OE1 no hydrogen 2.868 N/A GLY 155.A N GLN 151.A O no hydrogen 3.306 N/A GLU 156.A N GLU 156.A OE1 no hydrogen 2.821 N/A ILE 157.A N GLY 153.A O no hydrogen 2.911 N/A PHE 158.A N GLU 154.A O no hydrogen 3.081 N/A VAL 159.A N GLY 155.A O no hydrogen 2.950 N/A GLN 160.A N GLU 156.A O no hydrogen 2.772 N/A GLN 160.A NE2 PRO 193.A O no hydrogen 2.932 N/A GLN 161.A N GLU 156.A O no hydrogen 3.043 N/A GLU 162.A N ILE 157.A O no hydrogen 2.829 N/A ARG 164.A N PHE 158.A O no hydrogen 2.951 N/A ARG 164.A NE GLU 168.A OE1 no hydrogen 2.849 N/A ARG 164.A NH1 GLU 162.A OE1 no hydrogen 3.269 N/A ARG 164.A NH2 GLU 168.A OE1 no hydrogen 3.334 N/A THR 167.A N ASN 163.A O no hydrogen 2.985 N/A THR 167.A OG1 ASN 163.A O no hydrogen 3.120 N/A GLU 168.A N ARG 164.A O no hydrogen 3.029 N/A LEU 169.A N ARG 164.A O no hydrogen 3.034 N/A PHE 170.A N PHE 165.A O no hydrogen 2.828 N/A TRP 172.A N GLU 168.A O no hydrogen 3.249 N/A PHE 173.A N PHE 170.A O no hydrogen 3.244 N/A LEU 175.A N GLU 274.A OE2 no hydrogen 2.727 N/A LEU 183.A N ALA 179.A O no hydrogen 3.002 N/A ARG 184.A N PRO 180.A O no hydrogen 2.899 N/A GLN 185.A N GLU 181.A O no hydrogen 3.124 N/A GLN 185.A NE2 GLU 181.A OE1 no hydrogen 3.445 N/A TYR 186.A N ASP 182.A O no hydrogen 3.082 N/A TYR 186.A OH GLU 273.A OE2 no hydrogen 2.588 N/A GLN 187.A N LEU 183.A O no hydrogen 3.135 N/A GLN 187.A N ARG 184.A O no hydrogen 3.108 N/A GLN 187.A NE2 LEU 166.A O no hydrogen 3.172 N/A THR 188.A N ARG 184.A O no hydrogen 2.966 N/A THR 188.A OG1 GLN 185.A O no hydrogen 3.129 N/A PHE 190.A N GLN 187.A O no hydrogen 3.004 N/A THR 192.A N SER 195.A OG no hydrogen 3.144 N/A THR 192.A OG1 SER 195.A OG no hydrogen 3.230 N/A SER 195.A N THR 192.A OG1 no hydrogen 2.967 N/A SER 195.A OG THR 192.A O no hydrogen 2.629 N/A SER 195.A OG THR 192.A OG1 no hydrogen 3.230 N/A ARG 196.A N PRO 193.A O no hydrogen 3.094 N/A ARG 196.A NE PHE 190.A O no hydrogen 3.041 N/A ARG 196.A NH1 GLN 160.A O no hydrogen 2.744 N/A ARG 196.A NH2 PHE 190.A O no hydrogen 3.028 N/A LYS 197.A N HIS 194.A O no hydrogen 3.258 N/A LYS 197.A NZ ASP 73.A OD1 no hydrogen 3.228 N/A LYS 197.A NZ ILE 74.A O no hydrogen 2.660 N/A ILE 199.A N ARG 196.A O no hydrogen 3.059 N/A ALA 201.A N LYS 197.A O no hydrogen 3.427 N/A GLY 202.A N ALA 198.A O no hydrogen 3.264 N/A ARG 204.A NE LEU 149.A O no hydrogen 2.757 N/A ARG 204.A NH1 GLU 156.A OE2 no hydrogen 2.990 N/A ARG 204.A NH2 LEU 149.A O no hydrogen 2.918 N/A ARG 204.A NH2 GLN 151.A O no hydrogen 3.206 N/A ARG 204.A NH2 GLU 156.A OE1 no hydrogen 3.060 N/A ARG 204.A NH2 GLU 156.A OE2 no hydrogen 3.489 N/A ASN 205.A N ALA 201.A O no hydrogen 2.884 N/A ASN 205.A N GLY 202.A O no hydrogen 3.103 N/A ASN 205.A ND2 TYR 76.A O no hydrogen 3.061 N/A LEU 206.A N PRO 203.A O no hydrogen 3.361 N/A VAL 208.A N GLU 211.A O no hydrogen 2.965 N/A ASP 209.A N ILE 133.A O no hydrogen 2.809 N/A GLY 210.A N ASN 132.A OD1 no hydrogen 2.815 N/A GLU 211.A N VAL 208.A O no hydrogen 3.064 N/A THR 215.A N PRO 212.A O no hydrogen 2.885 N/A THR 215.A OG1 ASN 205.A O no hydrogen 2.623 N/A VAL 216.A N PRO 212.A O no hydrogen 3.382 N/A ALA 217.A N ALA 213.A O no hydrogen 2.908 N/A PHE 218.A N SER 214.A O no hydrogen 2.967 N/A LEU 219.A N THR 215.A O no hydrogen 2.870 N/A GLU 220.A N VAL 216.A O no hydrogen 2.883 N/A GLN 221.A N PHE 218.A O no hydrogen 3.253 N/A GLN 221.A NE2 PHE 218.A O no hydrogen 3.194 N/A ALA 222.A N LEU 219.A O no hydrogen 3.483 N/A VAL 223.A N GLU 220.A O no hydrogen 3.139 N/A LEU 226.A N ALA 222.A O no hydrogen 2.943 N/A ASN 227.A N VAL 223.A O no hydrogen 2.884 N/A ASN 227.A N ASN 224.A O no hydrogen 3.126 N/A THR 228.A N ASN 224.A O no hydrogen 2.881 N/A THR 228.A N TRP 225.A O no hydrogen 3.357 N/A THR 228.A OG1 ASN 224.A O no hydrogen 2.552 N/A SER 229.A N TRP 225.A O no hydrogen 2.833 N/A SER 229.A OG TRP 225.A O no hydrogen 2.675 N/A LYS 233.A N ASN 258.A O no hydrogen 3.018 N/A LYS 233.A NZ SER 229.A O no hydrogen 3.063 N/A LYS 233.A NZ SER 229.A OG no hydrogen 2.856 N/A LYS 233.A NZ THR 231.A O no hydrogen 2.799 N/A LYS 233.A NZ ARG 257.A O no hydrogen 2.647 N/A LEU 234.A N VAL 123.A O no hydrogen 2.786 N/A LEU 235.A N GLU 260.A O no hydrogen 2.847 N/A LEU 236.A N PHE 125.A O no hydrogen 3.186 N/A THR 237.A N GLU 262.A O no hydrogen 2.914 N/A LYS 239.A N GLY 265.A O no hydrogen 3.044 N/A GLY 241.A N GLY 267.A O no hydrogen 2.977 N/A PHE 242.A N GLU 127.A OE2 no hydrogen 2.840 N/A LEU 243.A N GLU 127.A OE1 no hydrogen 2.761 N/A LEU 244.A N GLU 127.A OE2 no hydrogen 3.279 N/A THR 245.A N LEU 243.A O no hydrogen 3.050 N/A ILE 248.A N THR 245.A OG1 no hydrogen 3.160 N/A LEU 249.A N THR 245.A O no hydrogen 2.859 N/A LYS 250.A N ASP 246.A O no hydrogen 2.803 N/A TRP 251.A N ALA 247.A O no hydrogen 2.878 N/A SER 252.A N ILE 248.A O no hydrogen 2.930 N/A SER 252.A OG ILE 248.A O no hydrogen 2.908 N/A GLN 253.A N LEU 249.A O no hydrogen 3.039 N/A GLN 253.A NE2 LEU 249.A O no hydrogen 3.155 N/A VAL 254.A N LYS 250.A O no hydrogen 2.996 N/A THR 255.A N TRP 251.A O no hydrogen 2.817 N/A THR 255.A OG1 TRP 251.A O no hydrogen 2.646 N/A ILE 256.A N SER 252.A O no hydrogen 2.981 N/A ARG 257.A N LEU 226.A O no hydrogen 2.823 N/A ARG 257.A NE ASP 230.A OD1 no hydrogen 2.567 N/A ARG 257.A NH2 ASP 230.A OD1 no hydrogen 2.395 N/A ASN 258.A ND2 ASP 230.A O no hydrogen 3.000 N/A GLU 260.A N LYS 233.A O no hydrogen 2.935 N/A GLU 262.A N LEU 235.A O no hydrogen 3.037 N/A ALA 264.A N THR 237.A O no hydrogen 2.796 N/A GLY 267.A N LYS 239.A O no hydrogen 2.862 N/A ILE 268.A N GLU 274.A OE1 no hydrogen 2.757 N/A HIS 269.A ND1 GLU 127.A OE1 no hydrogen 2.854 N/A GLN 272.A N GLN 272.A OE1 no hydrogen 2.813 N/A GLN 272.A NE2 GLN 102.A OE1 no hydrogen 3.124 N/A GLU 273.A N PHE 270.A O no hydrogen 2.982 N/A GLN 275.A N VAL 271.A O no hydrogen 2.781 N/A GLN 275.A NE2 ALA 266.A O no hydrogen 2.792 N/A ILE 279.A N GLN 275.A O no hydrogen 2.904 N/A ALA 280.A N PRO 276.A O no hydrogen 2.965 N/A ARG 281.A N GLU 277.A O no hydrogen 3.032 N/A LEU 282.A N THR 278.A O no hydrogen 2.860 N/A LEU 283.A N ILE 279.A O no hydrogen 2.798 N/A ASP 284.A N ALA 280.A O no hydrogen 2.755 N/A ALA 285.A N ARG 281.A O no hydrogen 2.961 N/A TRP 286.A N LEU 282.A O no hydrogen 2.992 N/A LEU 287.A N LEU 283.A O no hydrogen 2.778 N/A THR 288.A N ASP 284.A O no hydrogen 3.131 N/A THR 288.A OG1 ASP 284.A O no hydrogen 3.237 N/A ARG 289.A N ALA 285.A O no hydrogen 2.919 N/A ARG 289.A NH2 GLU 260.A OE1 no hydrogen 2.803 N/A ARG 289.A NH2 GLU 262.A OE2 no hydrogen 3.024 N/A ILE 290.A N TRP 286.A O no hydrogen 2.901 N/A ALA 291.A N LEU 287.A O no hydrogen 2.801 N/A