Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3q7f_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): TYR 2.A OH ASP 37.A OD2 no hydrogen 2.600 N/A MET 5.A N ASP 37.A OD2 no hydrogen 2.961 N/A GLN 7.A N PRO 4.A O no hydrogen 3.030 N/A ARG 8.A N MET 5.A O no hydrogen 3.272 N/A ARG 8.A NE ILE 3.A O no hydrogen 3.031 N/A ARG 8.A NH2 ILE 3.A O no hydrogen 2.764 N/A TRP 11.A N ARG 8.A O no hydrogen 3.114 N/A VAL 14.A N TRP 11.A O no hydrogen 2.960 N/A ILE 17.A N ASP 40.A O no hydrogen 3.027 N/A GLN 19.A NE2 ASP 21.A OD1 no hydrogen 2.834 N/A GLN 19.A NE2 TYR 31.A OH no hydrogen 3.123 N/A TYR 31.A N ILE 29.A O no hydrogen 2.890 N/A GLU 34.A N GLU 34.A OE2 no hydrogen 2.900 N/A TYR 35.A N SER 32.A OG no hydrogen 3.221 N/A TYR 35.A OH HIS 69.A ND1 no hydrogen 3.091 N/A LYS 36.A N SER 32.A O no hydrogen 3.026 N/A LYS 36.A NZ ASP 40.A OD2 no hydrogen 2.936 N/A ASP 37.A N GLU 33.A O no hydrogen 3.137 N/A ALA 38.A N GLU 34.A O no hydrogen 3.003 N/A MET 39.A N TYR 35.A O no hydrogen 2.980 N/A ASP 40.A N LYS 36.A O no hydrogen 2.881 N/A TYR 41.A N ASP 37.A O no hydrogen 3.238 N/A PHE 42.A N ALA 38.A O no hydrogen 2.814 N/A ARG 43.A N MET 39.A O no hydrogen 2.774 N/A ARG 43.A NE ILE 17.A O no hydrogen 2.781 N/A ARG 43.A NH1 GLN 19.A OE1 no hydrogen 3.072 N/A ARG 43.A NH2 ASP 40.A OD1 no hydrogen 2.638 N/A ALA 44.A N ASP 40.A O no hydrogen 3.378 N/A ILE 45.A N TYR 41.A O no hydrogen 2.881 N/A ALA 46.A N PHE 42.A O no hydrogen 2.830 N/A ALA 47.A N ARG 43.A O no hydrogen 3.075 N/A LYS 48.A N ALA 44.A O no hydrogen 3.193 N/A LYS 48.A NZ GLU 50.A OE1 no hydrogen 2.755 N/A GLU 49.A N ALA 46.A O no hydrogen 3.112 N/A GLU 50.A N ILE 45.A O no hydrogen 3.035 N/A SER 52.A OG GLU 50.A OE2 no hydrogen 2.506 N/A ARG 54.A NE GLU 50.A OE2 no hydrogen 2.685 N/A ARG 54.A NH1 SER 10.A O no hydrogen 2.822 N/A ARG 54.A NH1 ASP 13.A OD1 no hydrogen 3.044 N/A ARG 54.A NH2 ASP 13.A OD2 no hydrogen 2.985 N/A ARG 54.A NH2 GLU 50.A OE1 no hydrogen 2.768 N/A ARG 54.A NH2 GLU 50.A OE2 no hydrogen 3.356 N/A ALA 55.A N SER 52.A OG no hydrogen 3.275 N/A LEU 56.A N SER 52.A O no hydrogen 3.022 N/A GLU 57.A N GLU 53.A O no hydrogen 2.892 N/A LEU 58.A N ARG 54.A O no hydrogen 2.922 N/A THR 59.A N ALA 55.A O no hydrogen 3.093 N/A THR 59.A OG1 LEU 56.A O no hydrogen 2.555 N/A GLU 60.A N LEU 56.A O no hydrogen 3.316 N/A ILE 61.A N GLU 57.A O no hydrogen 3.116 N/A ILE 62.A N LEU 58.A O no hydrogen 3.109 N/A VAL 63.A N THR 59.A O no hydrogen 3.071 N/A ARG 64.A N GLU 60.A O no hydrogen 3.200 N/A ARG 64.A NE GLU 60.A OE2 no hydrogen 2.964 N/A ARG 64.A NH1 GLN 100.A OE1 no hydrogen 2.760 N/A ARG 64.A NH2 GLU 60.A OE2 no hydrogen 2.912 N/A ASN 66.A N ILE 62.A O no hydrogen 2.815 N/A ASN 66.A ND2 TYR 35.A OH no hydrogen 3.526 N/A ALA 68.A N ASN 66.A OD1 no hydrogen 3.208 N/A HIS 69.A N ASN 66.A O no hydrogen 3.157 N/A HIS 69.A ND1 TYR 35.A OH no hydrogen 3.091 N/A TRP 73.A N HIS 69.A O no hydrogen 3.203 N/A TRP 73.A NE1 PRO 67.A O no hydrogen 2.814 N/A GLN 74.A N TYR 70.A O no hydrogen 3.047 N/A TYR 75.A N THR 71.A O no hydrogen 3.049 N/A TYR 75.A OH GLU 50.A O no hydrogen 2.641 N/A ARG 76.A N VAL 72.A O no hydrogen 2.827 N/A ARG 76.A NE GLU 90.A OE2 no hydrogen 2.700 N/A ARG 76.A NH1 THR 59.A OG1 no hydrogen 2.989 N/A ARG 76.A NH2 GLU 90.A OE1 no hydrogen 2.903 N/A ARG 76.A NH2 GLU 90.A OE2 no hydrogen 3.547 N/A PHE 77.A N TRP 73.A O no hydrogen 3.022 N/A SER 78.A N GLN 74.A O no hydrogen 3.195 N/A SER 78.A OG GLN 74.A O no hydrogen 3.174 N/A LEU 79.A N TYR 75.A O no hydrogen 2.979 N/A LEU 80.A N ARG 76.A O no hydrogen 2.938 N/A THR 81.A N PHE 77.A O no hydrogen 3.127 N/A THR 81.A OG1 PHE 77.A O no hydrogen 3.167 N/A THR 81.A OG1 SER 78.A O no hydrogen 2.963 N/A SER 82.A N SER 78.A O no hydrogen 2.879 N/A SER 82.A OG SER 78.A O no hydrogen 2.788 N/A LEU 83.A N LEU 79.A O no hydrogen 2.928 N/A ASN 84.A N THR 81.A O no hydrogen 3.276 N/A LYS 85.A N LEU 80.A O no hydrogen 2.915 N/A LYS 85.A NZ GLU 53.A OE1 no hydrogen 3.417 N/A LYS 85.A NZ GLU 53.A OE2 no hydrogen 3.218 N/A GLU 88.A N GLU 88.A OE1 no hydrogen 2.816 N/A ASP 89.A N SER 86.A OG no hydrogen 3.256 N/A GLU 90.A N SER 86.A O no hydrogen 3.308 N/A LEU 91.A N LEU 87.A O no hydrogen 3.140 N/A ARG 92.A N GLU 88.A O no hydrogen 3.245 N/A ARG 92.A NH2 ASP 89.A OD1 no hydrogen 2.685 N/A LEU 93.A N ASP 89.A O no hydrogen 3.054 N/A MET 94.A N GLU 90.A O no hydrogen 2.979 N/A ASN 95.A N LEU 91.A O no hydrogen 3.035 N/A GLU 96.A N ARG 92.A O no hydrogen 3.063 N/A PHE 97.A N LEU 93.A O no hydrogen 3.034 N/A ALA 98.A N MET 94.A O no hydrogen 3.184 N/A VAL 99.A N ASN 95.A O no hydrogen 3.156 N/A GLN 100.A N GLU 96.A O no hydrogen 2.935 N/A ASN 101.A N ALA 98.A O no hydrogen 3.248 N/A LEU 102.A N PHE 97.A O no hydrogen 2.824 N/A SER 104.A OG PRO 67.A O no hydrogen 2.887 N/A GLN 106.A N SER 104.A OG no hydrogen 3.357 N/A GLN 106.A NE2 SER 104.A OG no hydrogen 3.046 N/A HIS 109.A N TYR 105.A O no hydrogen 2.950 N/A HIS 110.A N GLN 106.A O no hydrogen 2.862 N/A HIS 110.A NE2 GLU 90.A OE2 no hydrogen 2.878 N/A ARG 111.A N VAL 107.A O no hydrogen 2.956 N/A ARG 111.A NE GLU 126.A OE2 no hydrogen 3.017 N/A ARG 111.A NH1 ASN 95.A OD1 no hydrogen 2.684 N/A ARG 111.A NH2 ASN 95.A OD1 no hydrogen 3.042 N/A ARG 111.A NH2 GLU 126.A OE1 no hydrogen 2.908 N/A ARG 111.A NH2 GLU 126.A OE2 no hydrogen 3.328 N/A LEU 112.A N TRP 108.A O no hydrogen 3.057 N/A LEU 113.A N HIS 109.A O no hydrogen 3.002 N/A LEU 114.A N HIS 110.A O no hydrogen 3.011 N/A LEU 115.A N ARG 111.A O no hydrogen 2.939 N/A ASP 116.A N LEU 112.A O no hydrogen 2.894 N/A ARG 117.A N LEU 113.A O no hydrogen 3.063 N/A ILE 118.A N LEU 114.A O no hydrogen 2.802 N/A SER 119.A N LEU 115.A O no hydrogen 2.864 N/A VAL 124.A N ASP 122.A OD1 no hydrogen 3.193 N/A ILE 127.A N PRO 123.A O no hydrogen 3.052 N/A GLU 128.A N VAL 124.A O no hydrogen 2.866 N/A TYR 129.A N SER 125.A O no hydrogen 3.013 N/A ILE 130.A N GLU 126.A O no hydrogen 3.037 N/A HIS 131.A N ILE 127.A O no hydrogen 3.031 N/A HIS 131.A NE2 GLU 168.A OE2 no hydrogen 2.757 N/A GLY 132.A N GLU 128.A O no hydrogen 3.074 N/A SER 133.A N TYR 129.A O no hydrogen 2.921 N/A LEU 134.A N ILE 130.A O no hydrogen 2.969 N/A LEU 134.A N HIS 131.A O no hydrogen 3.198 N/A LEU 135.A N HIS 131.A O no hydrogen 3.262 N/A ASP 137.A N LEU 134.A O no hydrogen 3.000 N/A ASN 140.A N ASP 137.A O no hydrogen 3.326 N/A ASN 140.A ND2 ASP 137.A OD1 no hydrogen 2.818 N/A THR 143.A N ASN 140.A OD1 no hydrogen 3.142 N/A TRP 144.A N ASN 140.A O no hydrogen 3.099 N/A TRP 144.A NE1 PRO 138.A O no hydrogen 2.812 N/A ALA 145.A N TYR 141.A O no hydrogen 2.957 N/A TYR 146.A N HIS 142.A O no hydrogen 2.984 N/A TYR 146.A OH GLU 126.A OE2 no hydrogen 2.711 N/A LEU 147.A N THR 143.A O no hydrogen 3.006 N/A HIS 148.A N TRP 144.A O no hydrogen 3.111 N/A TRP 149.A N ALA 145.A O no hydrogen 2.988 N/A LEU 150.A N TYR 146.A O no hydrogen 2.875 N/A TYR 151.A N LEU 147.A O no hydrogen 3.207 N/A TYR 151.A OH GLU 168.A OE1 no hydrogen 2.517 N/A SER 152.A N HIS 148.A O no hydrogen 2.954 N/A SER 152.A OG HIS 148.A O no hydrogen 2.763 N/A SER 152.A OG TYR 191.A OH no hydrogen 2.833 N/A HIS 153.A N TRP 149.A O no hydrogen 2.665 N/A PHE 154.A N LEU 150.A O no hydrogen 3.005 N/A SER 155.A N TYR 151.A O no hydrogen 2.986 N/A SER 155.A OG TYR 151.A O no hydrogen 3.029 N/A SER 155.A OG SER 152.A O no hydrogen 2.895 N/A THR 156.A N SER 152.A O no hydrogen 3.328 N/A THR 156.A OG1 HIS 153.A O no hydrogen 2.765 N/A GLY 158.A N SER 155.A O no hydrogen 2.905 N/A ARG 159.A N PHE 154.A O no hydrogen 2.993 N/A ARG 159.A NH1 SER 119.A OG no hydrogen 2.856 N/A ARG 159.A NH1 PRO 120.A O no hydrogen 2.969 N/A GLN 164.A N SER 161.A OG no hydrogen 3.196 N/A GLN 164.A NE2 TYR 151.A OH no hydrogen 2.843 N/A TRP 165.A N SER 161.A O no hydrogen 2.976 N/A GLY 166.A N GLU 162.A O no hydrogen 2.876 N/A SER 167.A N ALA 163.A O no hydrogen 2.944 N/A SER 167.A OG GLN 164.A O no hydrogen 3.072 N/A GLU 168.A N GLN 164.A O no hydrogen 3.105 N/A LEU 169.A N TRP 165.A O no hydrogen 3.106 N/A ASP 170.A N GLY 166.A O no hydrogen 3.064 N/A TRP 171.A N SER 167.A O no hydrogen 2.909 N/A CYS 172.A N GLU 168.A O no hydrogen 2.895 N/A CYS 172.A SG ALA 185.A O no hydrogen 3.354 N/A ASN 173.A N LEU 169.A O no hydrogen 2.844 N/A GLU 174.A N ASP 170.A O no hydrogen 3.132 N/A MET 175.A N TRP 171.A O no hydrogen 3.086 N/A LEU 176.A N CYS 172.A O no hydrogen 3.135 N/A ARG 177.A N ASN 173.A O no hydrogen 2.890 N/A ARG 177.A NE GLU 174.A OE1 no hydrogen 2.878 N/A ARG 177.A NH2 GLU 174.A OE1 no hydrogen 3.472 N/A ARG 177.A NH2 GLU 174.A OE2 no hydrogen 2.706 N/A VAL 178.A N GLU 174.A O no hydrogen 2.937 N/A ASP 179.A N MET 175.A O no hydrogen 3.069 N/A ARG 181.A N ASP 179.A OD1 no hydrogen 2.933 N/A ASN 182.A N ASP 179.A O no hydrogen 2.991 N/A ASN 182.A ND2 PRO 138.A O no hydrogen 3.084 N/A ASN 183.A ND2 SER 225.A OG no hydrogen 2.766 N/A SER 184.A N ASN 182.A OD1 no hydrogen 3.109 N/A ALA 185.A N ASN 182.A O no hydrogen 3.106 N/A TRP 186.A N ASN 182.A O no hydrogen 3.214 N/A TRP 186.A NE1 GLY 180.A O no hydrogen 2.745 N/A GLY 187.A N ASN 183.A O no hydrogen 2.987 N/A TRP 188.A N SER 184.A O no hydrogen 3.038 N/A TRP 188.A NE1 GLU 168.A OE2 no hydrogen 2.897 N/A ARG 189.A N ALA 185.A O no hydrogen 2.887 N/A ARG 189.A NE GLU 209.A OE2 no hydrogen 2.777 N/A ARG 189.A NH2 GLU 209.A OE1 no hydrogen 2.983 N/A ARG 189.A NH2 GLU 209.A OE2 no hydrogen 3.512 N/A TRP 190.A N TRP 186.A O no hydrogen 2.990 N/A TYR 191.A N GLY 187.A O no hydrogen 3.170 N/A TYR 191.A OH SER 152.A OG no hydrogen 2.833 N/A LEU 192.A N TRP 188.A O no hydrogen 2.992 N/A ARG 193.A N ARG 189.A O no hydrogen 2.804 N/A ARG 193.A NE GLU 209.A OE1 no hydrogen 2.754 N/A ARG 193.A NH2 GLU 209.A OE1 no hydrogen 3.318 N/A VAL 194.A N TRP 190.A O no hydrogen 2.775 N/A SER 195.A N TRP 190.A O no hydrogen 3.000 N/A ARG 196.A N TYR 191.A O no hydrogen 3.009 N/A ARG 196.A NE LEU 192.A O no hydrogen 2.980 N/A ALA 199.A N ARG 196.A O no hydrogen 3.071 N/A SER 202.A N GLU 200.A OE2 no hydrogen 3.459 N/A SER 202.A OG GLU 200.A OE2 no hydrogen 3.154 N/A ARG 204.A NH1 ARG 204.A O no hydrogen 3.238 N/A SER 205.A OG GLU 200.A O no hydrogen 2.699 N/A SER 205.A OG GLU 200.A OE2 no hydrogen 3.368 N/A LEU 206.A N SER 202.A O no hydrogen 3.101 N/A GLN 207.A N SER 203.A O no hydrogen 3.139 N/A ASP 208.A N ARG 204.A O no hydrogen 2.912 N/A GLU 209.A N SER 205.A O no hydrogen 3.132 N/A LEU 210.A N LEU 206.A O no hydrogen 3.083 N/A ILE 211.A N GLN 207.A O no hydrogen 3.155 N/A TYR 212.A N ASP 208.A O no hydrogen 3.093 N/A ILE 213.A N GLU 209.A O no hydrogen 2.961 N/A LEU 214.A N LEU 210.A O no hydrogen 2.974 N/A LYS 215.A N ILE 211.A O no hydrogen 3.006 N/A SER 216.A N TYR 212.A O no hydrogen 3.026 N/A SER 216.A OG TYR 212.A O no hydrogen 2.885 N/A ILE 217.A N ILE 213.A O no hydrogen 2.929 N/A HIS 218.A N LEU 214.A O no hydrogen 2.847 N/A HIS 218.A ND1 TYR 251.A OH no hydrogen 2.772 N/A HIS 218.A NE2 PRO 255.A O no hydrogen 2.858 N/A LEU 219.A N LYS 215.A O no hydrogen 3.018 N/A ILE 220.A N SER 216.A O no hydrogen 3.002 N/A ASN 223.A N ILE 220.A O no hydrogen 2.994 N/A ASN 223.A ND2 GLY 180.A O no hydrogen 2.709 N/A SER 225.A N ASN 223.A OD1 no hydrogen 3.259 N/A TRP 227.A N ASN 223.A O no hydrogen 3.322 N/A TRP 227.A NE1 PRO 221.A O no hydrogen 2.727 N/A ASN 228.A N VAL 224.A O no hydrogen 2.958 N/A TYR 229.A N SER 225.A O no hydrogen 3.029 N/A TYR 229.A OH GLU 209.A OE2 no hydrogen 2.747 N/A LEU 230.A N ALA 226.A O no hydrogen 2.940 N/A ARG 231.A N TRP 227.A O no hydrogen 2.903 N/A ARG 231.A NH1 ASP 275.A OD2 no hydrogen 2.906 N/A ARG 231.A NH2 ASP 275.A OD2 no hydrogen 2.790 N/A GLY 232.A N ASN 228.A O no hydrogen 2.891 N/A PHE 233.A N TYR 229.A O no hydrogen 2.844 N/A LEU 234.A N LEU 230.A O no hydrogen 3.069 N/A LYS 235.A N ARG 231.A O no hydrogen 3.194 N/A HIS 236.A N GLY 232.A O no hydrogen 2.971 N/A PHE 237.A N PHE 233.A O no hydrogen 3.160 N/A SER 238.A N LYS 235.A O no hydrogen 3.315 N/A LEU 239.A N LEU 234.A O no hydrogen 2.808 N/A LEU 241.A N GLU 279.A OE1 no hydrogen 2.853 N/A LEU 241.A N GLU 279.A OE2 no hydrogen 3.209 N/A VAL 242.A N GLU 279.A OE2 no hydrogen 3.310 N/A ILE 244.A N LEU 241.A O no hydrogen 3.115 N/A LEU 245.A N VAL 242.A O no hydrogen 3.041 N/A ALA 247.A N ILE 244.A O no hydrogen 2.999 N/A ILE 248.A N LEU 245.A O no hydrogen 2.940 N/A LEU 249.A N LEU 245.A O no hydrogen 2.843 N/A TYR 251.A N ILE 248.A O no hydrogen 2.874 N/A TYR 251.A OH HIS 218.A ND1 no hydrogen 2.772 N/A THR 252.A N LEU 249.A O no hydrogen 3.042 N/A THR 252.A OG1 LEU 249.A O no hydrogen 2.597 N/A THR 262.A OG1 PRO 259.A O no hydrogen 2.815 N/A VAL 266.A N TYR 251.A O no hydrogen 2.950 N/A ALA 269.A N VAL 266.A O no hydrogen 2.894 N/A LEU 270.A N VAL 266.A O no hydrogen 3.173 N/A GLU 271.A N PRO 267.A O no hydrogen 3.085 N/A TYR 272.A N LEU 268.A O no hydrogen 3.055 N/A TYR 272.A OH LEU 241.A O no hydrogen 2.701 N/A LEU 273.A N ALA 269.A O no hydrogen 2.975 N/A ALA 274.A N LEU 270.A O no hydrogen 2.861 N/A ASP 275.A N GLU 271.A O no hydrogen 2.935 N/A SER 276.A N TYR 272.A O no hydrogen 2.911 N/A SER 276.A OG TYR 272.A O no hydrogen 3.497 N/A SER 276.A OG LEU 273.A O no hydrogen 2.641 N/A PHE 277.A N LEU 273.A O no hydrogen 3.116 N/A ILE 278.A N ALA 274.A O no hydrogen 3.184 N/A GLU 279.A N ASP 275.A O no hydrogen 3.031 N/A GLN 280.A N SER 276.A O no hydrogen 3.250 N/A ASN 281.A N ILE 278.A O no hydrogen 3.084 N/A ARG 282.A N PHE 277.A O no hydrogen 2.799 N/A ARG 282.A NE ASP 285.A OD2 no hydrogen 2.954 N/A ARG 282.A NH1 GLN 280.A OE1 no hydrogen 3.149 N/A ARG 282.A NH2 ASP 285.A OD2 no hydrogen 3.266 N/A ALA 286.A N ARG 282.A O no hydrogen 3.136 N/A ALA 287.A N VAL 283.A O no hydrogen 2.962 N/A LYS 288.A N ASP 284.A O no hydrogen 3.131 N/A PHE 290.A N ALA 286.A O no hydrogen 3.155 N/A GLU 291.A N ALA 287.A O no hydrogen 2.899 N/A LYS 292.A N LYS 288.A O no hydrogen 3.111 N/A LYS 292.A NZ GLU 296.A OE2 no hydrogen 3.408 N/A LEU 293.A N VAL 289.A O no hydrogen 2.840 N/A SER 294.A N PHE 290.A O no hydrogen 2.905 N/A SER 294.A OG ALA 302.A O no hydrogen 2.698 N/A SER 295.A N GLU 291.A O no hydrogen 2.851 N/A SER 295.A OG GLU 291.A O no hydrogen 2.839 N/A SER 295.A OG GLU 291.A OE1 no hydrogen 3.438 N/A SER 295.A OG GLU 291.A OE2 no hydrogen 3.328 N/A GLU 296.A N LYS 292.A O no hydrogen 2.810 N/A TYR 297.A N LYS 292.A O no hydrogen 2.965 N/A ASP 298.A N LEU 293.A O no hydrogen 2.872 N/A GLN 299.A NE2 GLU 296.A O no hydrogen 3.042 N/A ARG 301.A N ASP 298.A O no hydrogen 3.161 N/A ARG 301.A NE ASP 298.A OD2 no hydrogen 2.757 N/A ARG 301.A NH2 ASP 298.A OD1 no hydrogen 3.007 N/A ALA 302.A N GLN 299.A O no hydrogen 2.984 N/A TRP 305.A N ARG 301.A O no hydrogen 3.052 N/A TRP 305.A NE1 ASP 298.A OD2 no hydrogen 2.807 N/A GLU 306.A N ALA 302.A O no hydrogen 3.100 N/A PHE 307.A N GLY 303.A O no hydrogen 2.987 N/A ARG 308.A N TYR 304.A O no hydrogen 2.993 N/A ARG 308.A NH2 ASP 275.A OD1 no hydrogen 2.804 N/A ARG 309.A N TRP 305.A O no hydrogen 2.875 N/A ARG 310.A N GLU 306.A O no hydrogen 2.803 N/A ARG 310.A NE GLU 306.A OE2 no hydrogen 2.795 N/A GLU 311.A N PHE 307.A O no hydrogen 3.142 N/A CYS 312.A N ARG 309.A O no hydrogen 3.042 N/A CYS 312.A SG ARG 308.A O no hydrogen 3.660 N/A ALA 313.A N ARG 309.A O no hydrogen 3.087 N/A