Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 7ddq_M.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): TYR 2.A N GLU 1.A OE1 no hydrogen 2.858 N/A TYR 2.A OH ASN 4.A OD1 no hydrogen 3.408 N/A TYR 2.A OH PHE 6.A O no hydrogen 2.272 N/A GLN 3.A NE2 GLU 1.A O no hydrogen 3.395 N/A ILE 5.A N GLN 3.A O no hydrogen 2.505 N/A THR 7.A N TRP 40.A O no hydrogen 2.884 N/A THR 7.A OG1 GLY 39.A O no hydrogen 3.375 N/A THR 7.A OG1 TRP 40.A O no hydrogen 3.414 N/A GLN 10.A NE2 PRO 36.A O no hydrogen 2.703 N/A GLU 16.A N GLN 45.A OE1 no hydrogen 3.247 N/A GLY 18.A N GLU 16.A OE2 no hydrogen 3.369 N/A ASN 24.A ND2 GLU 26.A OE2 no hydrogen 3.528 N/A ASN 27.A N ASN 24.A O no hydrogen 3.030 N/A ARG 28.A N LEU 25.A O no hydrogen 2.955 N/A ARG 28.A NH1 MET 19.A O no hydrogen 3.339 N/A ARG 28.A NH2 MET 19.A O no hydrogen 3.332 N/A THR 29.A N ILE 49.A O no hydrogen 2.952 N/A THR 29.A OG1 ILE 49.A O no hydrogen 3.567 N/A THR 33.A N LEU 46.A O no hydrogen 3.310 N/A TRP 35.A N ALA 44.A O no hydrogen 2.797 N/A LEU 38.A N TRP 35.A O no hydrogen 3.115 N/A PHE 41.A N LEU 38.A O no hydrogen 3.049 N/A GLY 42.A N LEU 38.A O no hydrogen 2.790 N/A GLN 45.A NE2 GLU 16.A O no hydrogen 2.566 N/A LEU 46.A N THR 33.A O no hydrogen 2.754 N/A ILE 49.A N THR 29.A OG1 no hydrogen 3.189 N/A LEU 51.A N ASN 27.A O no hydrogen 2.694 N/A THR 56.A N GLY 52.A O no hydrogen 3.126 N/A THR 56.A OG1 GLY 52.A O no hydrogen 2.720 N/A MET 57.A N THR 53.A O no hydrogen 2.934 N/A SER 58.A N LEU 54.A O no hydrogen 2.866 N/A SER 58.A OG SER 124.A O no hydrogen 2.925 N/A LEU 59.A N GLY 55.A O no hydrogen 2.874 N/A ILE 60.A N THR 56.A O no hydrogen 2.917 N/A PHE 61.A N MET 57.A O no hydrogen 2.975 N/A GLY 62.A N SER 58.A O no hydrogen 2.902 N/A ALA 63.A N LEU 59.A O no hydrogen 2.823 N/A PHE 64.A N ILE 60.A O no hydrogen 2.930 N/A TRP 65.A N PHE 61.A O no hydrogen 2.977 N/A PHE 66.A N GLY 62.A O no hydrogen 2.923 N/A PHE 67.A N ALA 63.A O no hydrogen 2.840 N/A LEU 68.A N PHE 64.A O no hydrogen 2.903 N/A VAL 69.A N TRP 65.A O no hydrogen 2.979 N/A GLY 70.A N PHE 66.A O no hydrogen 2.952 N/A VAL 71.A N PHE 67.A O no hydrogen 2.872 N/A SER 72.A N LEU 68.A O no hydrogen 3.128 N/A SER 72.A OG GLN 76.A OE1 no hydrogen 3.265 N/A PHE 73.A N VAL 69.A O no hydrogen 3.127 N/A ILE 74.A N GLY 70.A O no hydrogen 2.961 N/A ILE 75.A N VAL 71.A O no hydrogen 2.938 N/A GLN 76.A N SER 72.A O no hydrogen 2.909 N/A GLN 76.A NE2 GLY 92.A O no hydrogen 3.638 N/A ALA 77.A N PHE 73.A O no hydrogen 2.921 N/A ASP 78.A N ILE 75.A O no hydrogen 3.105 N/A TYR 79.A N ILE 74.A O no hydrogen 3.157 N/A SER 80.A N ALA 77.A O no hydrogen 3.261 N/A ALA 82.A N SER 80.A OG no hydrogen 3.227 N/A LEU 83.A N SER 80.A OG no hydrogen 3.321 N/A PHE 84.A N SER 80.A O no hydrogen 2.910 N/A LEU 85.A N PRO 81.A O no hydrogen 3.210 N/A ARG 86.A N ALA 82.A O no hydrogen 2.878 N/A ARG 86.A NE GLU 87.A OE2 no hydrogen 2.823 N/A ARG 86.A NH1 GLU 87.A OE2 no hydrogen 3.111 N/A GLU 87.A N LEU 83.A O no hydrogen 2.897 N/A LEU 88.A N LEU 85.A O no hydrogen 3.459 N/A ARG 90.A NE GLU 87.A OE1 no hydrogen 2.872 N/A ARG 90.A NH2 GLU 87.A OE2 no hydrogen 2.784 N/A ALA 91.A N GLU 87.A O no hydrogen 2.933 N/A GLU 99.A N GLU 99.A OE2 no hydrogen 2.898 N/A TYR 100.A N ALA 97.A O no hydrogen 3.266 N/A GLY 101.A N PRO 98.A O no hydrogen 2.977 N/A SER 103.A N TYR 100.A O no hydrogen 2.986 N/A SER 103.A OG TYR 100.A O no hydrogen 2.773 N/A SER 103.A OG SER 105.A OG no hydrogen 3.387 N/A SER 105.A OG SER 103.A OG no hydrogen 3.387 N/A SER 105.A OG SER 105.A O no hydrogen 2.276 N/A GLU 110.A N PRO 107.A O no hydrogen 2.906 N/A GLY 112.A N PRO 107.A O no hydrogen 3.028 N/A LEU 113.A N LEU 108.A O no hydrogen 2.833 N/A LEU 115.A N GLY 111.A O no hydrogen 2.791 N/A ILE 116.A N GLY 112.A O no hydrogen 2.988 N/A ALA 117.A N LEU 113.A O no hydrogen 2.924 N/A SER 118.A N TRP 114.A O no hydrogen 2.848 N/A SER 118.A OG TRP 114.A O no hydrogen 2.617 N/A SER 118.A OG TYR 176.A OH no hydrogen 2.846 N/A PHE 119.A N LEU 115.A O no hydrogen 2.925 N/A PHE 120.A N ILE 116.A O no hydrogen 3.109 N/A LEU 121.A N ALA 117.A O no hydrogen 2.861 N/A MET 122.A N SER 118.A O no hydrogen 2.856 N/A LEU 123.A N PHE 119.A O no hydrogen 2.989 N/A SER 124.A N PHE 120.A O no hydrogen 3.091 N/A SER 124.A OG PHE 120.A O no hydrogen 3.427 N/A SER 124.A OG LEU 121.A O no hydrogen 3.024 N/A VAL 125.A N LEU 121.A O no hydrogen 3.171 N/A LEU 126.A N MET 122.A O no hydrogen 3.319 N/A LEU 127.A N LEU 123.A O no hydrogen 3.063 N/A TRP 128.A N SER 124.A O no hydrogen 2.793 N/A TRP 129.A N VAL 125.A O no hydrogen 2.838 N/A TRP 129.A NE1 ALA 146.A O no hydrogen 2.792 N/A ALA 130.A N LEU 126.A O no hydrogen 2.967 N/A ARG 131.A N LEU 127.A O no hydrogen 2.930 N/A ARG 131.A NH1 TYR 50.A O no hydrogen 3.171 N/A ARG 131.A NH2 TYR 50.A O no hydrogen 2.758 N/A THR 132.A N TRP 128.A O no hydrogen 2.900 N/A THR 132.A OG1 TRP 129.A O no hydrogen 2.611 N/A TYR 133.A N TRP 129.A O no hydrogen 3.062 N/A LYS 134.A N ALA 130.A O no hydrogen 2.879 N/A LYS 134.A NZ ASP 138.A OD1 no hydrogen 3.195 N/A LYS 134.A NZ ASP 138.A OD2 no hydrogen 3.431 N/A ARG 135.A N ARG 131.A O no hydrogen 2.843 N/A ALA 136.A N THR 132.A O no hydrogen 3.503 N/A ALA 137.A N TYR 133.A O no hydrogen 2.953 N/A ASP 138.A N LYS 134.A O no hydrogen 2.876 N/A LEU 139.A N ALA 136.A O no hydrogen 3.202 N/A GLY 140.A N ALA 137.A O no hydrogen 3.240 N/A MET 141.A N ALA 136.A O no hydrogen 2.940 N/A LYS 143.A NZ MET 141.A O no hydrogen 2.864 N/A TRP 147.A N LYS 143.A O no hydrogen 3.207 N/A ALA 148.A N HIS 144.A O no hydrogen 2.977 N/A PHE 149.A N THR 145.A O no hydrogen 2.907 N/A ALA 150.A N ALA 146.A O no hydrogen 2.870 N/A GLY 151.A N TRP 147.A O no hydrogen 3.114 N/A ALA 152.A N ALA 148.A O no hydrogen 3.422 N/A LEU 153.A N PHE 149.A O no hydrogen 2.895 N/A TRP 154.A N ALA 150.A O no hydrogen 2.839 N/A LEU 155.A N GLY 151.A O no hydrogen 3.189 N/A MET 156.A N ALA 152.A O no hydrogen 3.031 N/A PHE 157.A N LEU 153.A O no hydrogen 2.860 N/A VAL 158.A N TRP 154.A O no hydrogen 2.953 N/A LEU 159.A N LEU 155.A O no hydrogen 2.952 N/A SER 160.A N MET 156.A O no hydrogen 3.096 N/A PHE 161.A N PHE 157.A O no hydrogen 2.705 N/A PHE 162.A N PHE 157.A O no hydrogen 2.773 N/A ARG 163.A N VAL 158.A O no hydrogen 3.224 N/A ARG 163.A NE SER 286.A O no hydrogen 2.954 N/A ARG 163.A NH2 SER 286.A O no hydrogen 3.186 N/A ILE 165.A N PHE 161.A O no hydrogen 3.245 N/A LEU 166.A N PHE 162.A O no hydrogen 2.972 N/A MET 167.A N ARG 163.A O no hydrogen 2.873 N/A GLY 168.A N ILE 165.A O no hydrogen 3.031 N/A SER 169.A N PRO 164.A O no hydrogen 3.016 N/A SER 169.A OG SER 171.A OG no hydrogen 2.652 N/A TRP 170.A N GLY 101.A O no hydrogen 2.870 N/A TRP 170.A NE1 LEU 102.A O no hydrogen 3.047 N/A SER 171.A N SER 169.A OG no hydrogen 3.284 N/A SER 171.A OG SER 169.A OG no hydrogen 2.652 N/A ALA 173.A N TRP 170.A O no hydrogen 2.886 N/A TYR 176.A N LEU 93.A O no hydrogen 3.036 N/A TYR 176.A OH SER 118.A OG no hydrogen 2.846 N/A PHE 179.A N PHE 89.A O no hydrogen 2.794 N/A HIS 181.A N GLY 177.A O no hydrogen 3.050 N/A HIS 181.A ND1 GLY 177.A O no hydrogen 2.905 N/A ASP 183.A N PHE 179.A O no hydrogen 2.959 N/A TRP 184.A N PRO 180.A O no hydrogen 2.859 N/A THR 185.A N HIS 181.A O no hydrogen 2.942 N/A THR 185.A OG1 HIS 181.A O no hydrogen 3.057 N/A ASN 186.A N LEU 182.A O no hydrogen 2.983 N/A ASN 187.A N ASP 183.A O no hydrogen 2.881 N/A PHE 188.A N TRP 184.A O no hydrogen 2.854 N/A SER 189.A N THR 185.A O no hydrogen 3.075 N/A LEU 190.A N ASN 186.A O no hydrogen 2.975 N/A THR 191.A N ASN 187.A O no hydrogen 2.892 N/A THR 191.A OG1 ASN 187.A O no hydrogen 3.135 N/A THR 191.A OG1 PHE 188.A O no hydrogen 3.276 N/A HIS 192.A N PHE 188.A O no hydrogen 3.313 N/A HIS 192.A ND1 PHE 188.A O no hydrogen 3.018 N/A LEU 195.A N SER 189.A OG no hydrogen 3.220 N/A PHE 196.A N ASN 194.A OD1 no hydrogen 2.804 N/A TYR 197.A N ASN 194.A O no hydrogen 3.196 N/A ASN 198.A N LEU 195.A O no hydrogen 3.247 N/A ASN 198.A ND2 GLY 282.A O no hydrogen 2.961 N/A PHE 200.A N ASN 198.A OD1 no hydrogen 2.999 N/A HIS 201.A N ASN 198.A OD1 no hydrogen 3.270 N/A GLY 202.A N ASN 198.A O no hydrogen 2.921 N/A LEU 203.A N PRO 199.A O no hydrogen 2.924 N/A SER 204.A N PHE 200.A O no hydrogen 2.880 N/A SER 204.A OG THR 275.A O no hydrogen 2.708 N/A ILE 205.A N HIS 201.A O no hydrogen 3.037 N/A ALA 206.A N GLY 202.A O no hydrogen 2.974 N/A PHE 207.A N LEU 203.A O no hydrogen 3.024 N/A LEU 208.A N SER 204.A O no hydrogen 2.876 N/A TYR 209.A N ILE 205.A O no hydrogen 2.870 N/A GLY 210.A N ALA 206.A O no hydrogen 2.863 N/A SER 211.A N PHE 207.A O no hydrogen 2.850 N/A SER 211.A OG PHE 207.A O no hydrogen 2.922 N/A SER 211.A OG LEU 208.A O no hydrogen 2.805 N/A THR 212.A N LEU 208.A O no hydrogen 2.981 N/A THR 212.A OG1 LEU 208.A O no hydrogen 3.012 N/A MET 213.A N TYR 209.A O no hydrogen 2.796 N/A LEU 214.A N GLY 210.A O no hydrogen 2.725 N/A PHE 215.A N SER 211.A O no hydrogen 3.154 N/A PHE 215.A N THR 212.A O no hydrogen 3.196 N/A ALA 216.A N THR 212.A O no hydrogen 2.960 N/A MET 217.A N MET 213.A O no hydrogen 2.926 N/A HIS 218.A N LEU 214.A O no hydrogen 2.865 N/A GLY 219.A N PHE 215.A O no hydrogen 2.889 N/A ALA 220.A N ALA 216.A O no hydrogen 2.932 N/A THR 221.A N MET 217.A O no hydrogen 2.859 N/A THR 221.A OG1 MET 217.A O no hydrogen 2.499 N/A ILE 222.A N HIS 218.A O no hydrogen 2.912 N/A LEU 223.A N GLY 219.A O no hydrogen 2.957 N/A ALA 224.A N ALA 220.A O no hydrogen 2.863 N/A VAL 225.A N THR 221.A O no hydrogen 3.026 N/A SER 226.A N LEU 223.A O no hydrogen 3.213 N/A SER 226.A OG ILE 222.A O no hydrogen 2.884 N/A SER 226.A OG LEU 223.A O no hydrogen 3.440 N/A SER 226.A OG GLU 231.A OE1 no hydrogen 3.383 N/A LEU 228.A N VAL 225.A O no hydrogen 3.170 N/A GLY 230.A N LEU 228.A O no hydrogen 2.254 N/A GLU 231.A N GLU 231.A OE1 no hydrogen 2.524 N/A GLU 233.A N GLU 231.A O no hydrogen 2.673 N/A GLN 236.A N GLU 233.A O no hydrogen 2.950 N/A ILE 237.A N GLU 233.A O no hydrogen 3.098 N/A ASP 239.A N GLU 235.A O no hydrogen 3.189 N/A ARG 240.A NE GLU 245.A OE2 no hydrogen 3.250 N/A ARG 240.A NH2 GLU 245.A OE2 no hydrogen 3.473 N/A GLU 245.A N GLY 241.A O no hydrogen 3.201 N/A ARG 246.A N THR 242.A O no hydrogen 2.820 N/A ALA 247.A N ALA 243.A O no hydrogen 2.923 N/A ALA 248.A N ALA 244.A O no hydrogen 2.934 N/A LEU 249.A N GLU 245.A O no hydrogen 2.765 N/A PHE 250.A N ARG 246.A O no hydrogen 2.890 N/A TRP 251.A NE1 THR 221.A OG1 no hydrogen 3.007 N/A ARG 252.A N ALA 248.A O no hydrogen 2.926 N/A ARG 252.A NH1 ASN 258.A OD1 no hydrogen 3.078 N/A TRP 253.A N LEU 249.A O no hydrogen 2.938 N/A THR 254.A N PHE 250.A O no hydrogen 3.013 N/A THR 254.A OG1 PHE 250.A O no hydrogen 2.392 N/A MET 255.A N TRP 251.A O no hydrogen 2.850 N/A GLY 256.A N ARG 252.A O no hydrogen 2.844 N/A ASN 258.A ND2 ALA 259.A O no hydrogen 2.999 N/A ILE 264.A N THR 260.A O no hydrogen 3.031 N/A HIS 265.A NE2 GLU 233.A OE2 no hydrogen 2.862 N/A ARG 266.A NE GLU 262.A OE1 no hydrogen 3.385 N/A TRP 267.A N GLY 263.A O no hydrogen 3.176 N/A GLY 268.A N ILE 264.A O no hydrogen 3.011 N/A TRP 269.A N HIS 265.A O no hydrogen 2.868 N/A TRP 269.A NE1 HIS 144.A O no hydrogen 3.239 N/A TRP 270.A N ARG 266.A O no hydrogen 2.925 N/A PHE 271.A N TRP 267.A O no hydrogen 2.886 N/A ALA 272.A N GLY 268.A O no hydrogen 2.916 N/A VAL 273.A N TRP 269.A O no hydrogen 2.871 N/A LEU 274.A N TRP 270.A O no hydrogen 2.871 N/A THR 275.A N ALA 272.A O no hydrogen 3.300 N/A THR 275.A OG1 PHE 271.A O no hydrogen 2.943 N/A THR 275.A OG1 ALA 272.A O no hydrogen 3.416 N/A VAL 277.A N VAL 273.A O no hydrogen 3.271 N/A THR 278.A N LEU 274.A O no hydrogen 2.944 N/A THR 278.A OG1 LEU 274.A O no hydrogen 3.342 N/A GLY 279.A N THR 275.A O no hydrogen 2.988 N/A GLY 280.A N PRO 276.A O no hydrogen 2.842 N/A ILE 281.A N VAL 277.A O no hydrogen 3.357 N/A GLY 282.A N THR 278.A O no hydrogen 3.226 N/A ILE 283.A N GLY 279.A O no hydrogen 3.081 N/A LEU 284.A N GLY 280.A O no hydrogen 2.926 N/A LEU 285.A N ILE 281.A O no hydrogen 3.090 N/A SER 286.A N ILE 283.A O no hydrogen 2.986 N/A SER 286.A OG GLY 282.A O no hydrogen 2.688 N/A GLY 287.A N VAL 290.A O no hydrogen 2.603 N/A THR 288.A OG1 LEU 284.A O no hydrogen 2.262 N/A VAL 289.A N LEU 285.A O no hydrogen 2.976 N/A VAL 290.A N LEU 285.A O no hydrogen 3.031 N/A TRP 293.A N HIS 192.A O no hydrogen 3.294 N/A TRP 293.A NE1 SER 286.A OG no hydrogen 2.874 N/A SER 294.A N ASP 292.A OD1 no hydrogen 3.155 N/A TRP 296.A N ASP 292.A O no hydrogen 3.148 N/A ALA 297.A N TRP 293.A O no hydrogen 2.901 N/A GLN 298.A N SER 294.A O no hydrogen 2.975 N/A GLN 298.A NE2 ALA 304.A O no hydrogen 3.031 N/A VAL 299.A N VAL 295.A O no hydrogen 2.899 N/A HIS 300.A N TRP 296.A O no hydrogen 2.873 N/A HIS 300.A ND1 TRP 296.A O no hydrogen 3.043 N/A TYR 302.A N ALA 297.A O no hydrogen 2.972 N/A TYR 302.A OH TYR 197.A O no hydrogen 2.872 N/A LYS 303.A N ALA 297.A O no hydrogen 3.239 N/A LYS 303.A NZ SER 294.A OG no hydrogen 3.261 N/A