Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3mfr_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LEU 3.A N ASP 6.A OD2 no hydrogen 3.256 N/A ASP 6.A N LEU 3.A O no hydrogen 2.798 N/A VAL 7.A N PHE 4.A O no hydrogen 3.175 N/A TYR 8.A N PHE 4.A O no hydrogen 3.095 N/A TYR 8.A OH GLU 75.A OE2 no hydrogen 2.403 N/A GLU 9.A N ILE 26.A O no hydrogen 2.840 N/A CYS 11.A N ARG 24.A O no hydrogen 2.846 N/A CYS 11.A SG GLU 9.A O no hydrogen 3.855 N/A ILE 14.A N.A VAL 22.A O no hydrogen 2.742 N/A ILE 14.A N.B VAL 22.A O no hydrogen 2.708 N/A GLY 15.A N VAL 22.A O no hydrogen 3.092 N/A VAL 21.A N ILE 38.A O no hydrogen 2.929 N/A VAL 22.A N GLY 15.A O no hydrogen 2.686 N/A ARG 23.A N VAL 36.A O no hydrogen 2.912 N/A ARG 23.A NE CYS 11.A O no hydrogen 2.916 N/A ARG 23.A NH1 CYS 11.A O no hydrogen 2.937 N/A ARG 24.A N GLU 12.A O no hydrogen 2.817 N/A ARG 24.A NE GLU 12.A OE1 no hydrogen 3.188 N/A ARG 24.A NE GLU 12.A OE2 no hydrogen 2.707 N/A ARG 24.A NH1 GLU 12.A OE2 no hydrogen 2.585 N/A ARG 24.A NH2 GLN 33.A OE1 no hydrogen 3.013 N/A CYS 25.A N PHE 34.A O no hydrogen 2.881 N/A ILE 26.A N GLU 9.A O no hydrogen 2.931 N/A ASN 27.A N GLN 32.A O no hydrogen 2.800 N/A ARG 28.A N VAL 7.A O no hydrogen 2.979 N/A ARG 28.A NE GLU 5.A O no hydrogen 2.751 N/A ARG 28.A NE TYR 8.A O no hydrogen 3.322 N/A ARG 28.A NH1 GLU 5.A O no hydrogen 3.048 N/A THR 30.A N ASN 27.A OD1 no hydrogen 3.016 N/A GLY 31.A N ASN 27.A O no hydrogen 2.733 N/A GLN 32.A N THR 30.A OG1 no hydrogen 3.222 N/A PHE 34.A N CYS 25.A O no hydrogen 2.888 N/A ALA 35.A N PHE 87.A O no hydrogen 2.935 N/A VAL 36.A N ARG 23.A O no hydrogen 2.876 N/A LYS 37.A N MET 85.A O no hydrogen 2.804 N/A LYS 37.A NZ GLU 58.A OE2 no hydrogen 2.799 N/A ILE 38.A N VAL 21.A O no hydrogen 2.727 N/A VAL 39.A N LEU 83.A O no hydrogen 2.916 N/A ASP 40.A N PHE 19.A O no hydrogen 2.901 N/A VAL 41.A N GLY 81.A O no hydrogen 3.146 N/A LYS 43.A N ASP 40.A OD2 no hydrogen 3.182 N/A PHE 44.A N ASP 40.A O no hydrogen 2.988 N/A THR 45.A N VAL 41.A O no hydrogen 2.908 N/A THR 45.A OG1 VAL 41.A O no hydrogen 2.840 N/A THR 45.A OG1 ALA 42.A O no hydrogen 3.313 N/A SER 46.A N ALA 42.A O no hydrogen 3.166 N/A SER 51.A N ASP 54.A OD2 no hydrogen 3.090 N/A LYS 56.A N THR 52.A O no hydrogen 3.110 N/A ARG 57.A N GLU 53.A O no hydrogen 2.930 N/A ARG 57.A NH1 ASP 54.A OD1 no hydrogen 2.714 N/A ARG 57.A NH2 ALA 162.A O no hydrogen 2.753 N/A GLU 58.A N ASP 54.A O no hydrogen 3.212 N/A ALA 59.A N LEU 55.A O no hydrogen 3.115 N/A SER 60.A N LYS 56.A O no hydrogen 2.883 N/A ILE 61.A N ARG 57.A O no hydrogen 2.805 N/A CYS 62.A N GLU 58.A O no hydrogen 2.897 N/A CYS 62.A SG GLU 58.A O no hydrogen 3.159 N/A HIS 63.A N ALA 59.A O no hydrogen 2.885 N/A MET 64.A N SER 60.A O no hydrogen 3.235 N/A MET 64.A N ILE 61.A O no hydrogen 3.193 N/A LEU 65.A N ILE 61.A O no hydrogen 3.111 N/A LYS 66.A N TYR 127.A OH no hydrogen 2.877 N/A LYS 66.A NZ HIS 63.A O no hydrogen 3.530 N/A LYS 66.A NZ LEU 73.A O no hydrogen 2.919 N/A HIS 69.A N HIS 67.A ND1 no hydrogen 3.063 N/A HIS 69.A ND1 VAL 154.A O.A no hydrogen 2.831 N/A HIS 69.A ND1 VAL 154.A O.B no hydrogen 2.890 N/A ILE 70.A N HIS 67.A O no hydrogen 3.030 N/A VAL 71.A N LEU 156.A O no hydrogen 2.967 N/A GLU 72.A N GLU 88.A OE1 no hydrogen 2.891 N/A LEU 74.A N VAL 86.A O no hydrogen 2.616 N/A GLU 75.A N VAL 86.A O no hydrogen 3.403 N/A TYR 77.A N TYR 84.A O no hydrogen 2.834 N/A TYR 77.A OH GLU 75.A OE2 no hydrogen 2.544 N/A SER 79.A N MET 82.A O.A no hydrogen 3.041 N/A SER 79.A N MET 82.A O.B no hydrogen 2.986 N/A LEU 83.A N VAL 39.A O no hydrogen 3.117 N/A TYR 84.A N TYR 77.A O no hydrogen 2.868 N/A MET 85.A N LYS 37.A O no hydrogen 2.886 N/A VAL 86.A N GLU 75.A O no hydrogen 2.831 N/A PHE 87.A N ALA 35.A O no hydrogen 2.701 N/A GLU 88.A N GLU 72.A O no hydrogen 3.008 N/A ASP 91.A N ALA 146.A O no hydrogen 2.964 N/A ALA 93.A N GLU 98.A OE1 no hydrogen 2.797 N/A LEU 95.A N.A VAL 143.A O no hydrogen 2.934 N/A LEU 95.A N.B VAL 143.A O no hydrogen 2.970 N/A CYS 96.A N ASP 94.A OD2 no hydrogen 2.903 N/A PHE 97.A N ASP 94.A OD2 no hydrogen 3.119 N/A GLU 98.A N ASP 94.A O no hydrogen 2.938 N/A ILE 99.A N LEU 95.A O.A no hydrogen 2.882 N/A ILE 99.A N LEU 95.A O.B no hydrogen 2.840 N/A LYS 101.A N PHE 97.A O no hydrogen 3.311 N/A LYS 101.A NZ GLU 98.A OE1 no hydrogen 3.327 N/A ARG 102.A N GLU 98.A O no hydrogen 2.836 N/A ARG 102.A NE VAL 108.A O no hydrogen 3.356 N/A ALA 103.A N ILE 99.A O no hydrogen 2.954 N/A ASP 104.A N VAL 100.A O no hydrogen 2.819 N/A ALA 105.A N LYS 101.A O no hydrogen 2.863 N/A GLY 106.A N ALA 103.A O no hydrogen 3.073 N/A PHE 107.A N ARG 102.A O no hydrogen 3.138 N/A TYR 109.A N HIS 283.A ND1 no hydrogen 3.048 N/A TYR 109.A OH LEU 208.A O no hydrogen 2.589 N/A ALA 112.A N TYR 280.A O no hydrogen 3.280 N/A ALA 114.A N SER 110.A O no hydrogen 3.128 N/A SER 115.A N GLU 111.A O no hydrogen 2.663 N/A SER 115.A OG TRP 271.A O no hydrogen 2.711 N/A HIS 116.A N ALA 112.A O no hydrogen 2.978 N/A TYR 117.A N VAL 113.A O no hydrogen 3.209 N/A MET 118.A N.A ALA 114.A O no hydrogen 2.890 N/A MET 118.A N.B ALA 114.A O no hydrogen 2.879 N/A ARG 119.A N SER 115.A O no hydrogen 2.903 N/A GLN 120.A N HIS 116.A O no hydrogen 3.347 N/A GLN 120.A NE2 HIS 116.A O no hydrogen 3.234 N/A ILE 121.A N TYR 117.A O no hydrogen 3.127 N/A LEU 122.A N MET 118.A O.A no hydrogen 3.015 N/A LEU 122.A N MET 118.A O.B no hydrogen 2.986 N/A GLU 123.A N ARG 119.A O no hydrogen 2.798 N/A ALA 124.A N GLN 120.A O no hydrogen 3.127 N/A LEU 125.A N ILE 121.A O no hydrogen 2.984 N/A ARG 126.A N LEU 122.A O no hydrogen 2.682 N/A TYR 127.A N GLU 123.A O no hydrogen 3.361 N/A TYR 127.A OH MET 64.A O no hydrogen 3.236 N/A CYS 128.A N ALA 124.A O no hydrogen 3.052 N/A CYS 128.A SG ALA 124.A O no hydrogen 3.554 N/A HIS 129.A N LEU 125.A O no hydrogen 2.779 N/A HIS 129.A NE2 ASP 197.A OD2 no hydrogen 3.040 N/A ASP 130.A N ARG 126.A O no hydrogen 2.745 N/A ASN 131.A N TYR 127.A O no hydrogen 3.183 N/A ASN 131.A N CYS 128.A O no hydrogen 2.939 N/A ASN 131.A ND2 TYR 127.A O no hydrogen 2.793 N/A ASN 132.A N HIS 129.A O no hydrogen 2.918 N/A ILE 133.A N CYS 128.A O no hydrogen 3.069 N/A ILE 134.A N ILE 163.A O no hydrogen 2.998 N/A HIS 135.A N ASP 197.A OD2 no hydrogen 2.913 N/A HIS 135.A NE2 GLY 157.A O no hydrogen 2.773 N/A ARG 136.A N ASP 197.A OD1 no hydrogen 2.962 N/A ARG 136.A NE VAL 161.A O no hydrogen 2.668 N/A ARG 136.A NH1 VAL 161.A O no hydrogen 2.891 N/A ARG 136.A NH2 TYR 192.A OH no hydrogen 3.030 N/A ASP 137.A N HIS 135.A ND1 no hydrogen 3.006 N/A LYS 139.A NZ THR 178.A OG1 no hydrogen 2.873 N/A GLU 141.A N GLU 141.A OE1 no hydrogen 2.804 N/A ASN 142.A N LYS 139.A O no hydrogen 3.096 N/A ASN 142.A ND2 ASP 137.A O no hydrogen 2.752 N/A ASN 142.A ND2 ASP 137.A OD2 no hydrogen 3.390 N/A VAL 143.A N PRO 140.A O no hydrogen 2.844 N/A LEU 144.A N LYS 155.A O no hydrogen 3.186 N/A LEU 145.A N.A ALA 93.A O no hydrogen 3.080 N/A LEU 145.A N.B ALA 93.A O no hydrogen 3.079 N/A ALA 146.A N PRO 153.A O no hydrogen 2.874 N/A SER 147.A OG GLU 149.A OE2 no hydrogen 2.782 N/A LYS 148.A NZ GLU 98.A OE1 no hydrogen 3.436 N/A ALA 152.A N GLU 149.A O no hydrogen 3.237 N/A VAL 154.A N.A GLN 120.A OE1 no hydrogen 2.933 N/A VAL 154.A N.B GLN 120.A OE1 no hydrogen 2.936 N/A LYS 155.A N LEU 144.A O no hydrogen 3.062 N/A LYS 155.A NZ GLU 88.A OE1 no hydrogen 3.304 N/A LYS 155.A NZ GLU 88.A OE2 no hydrogen 2.827 N/A LEU 156.A N HIS 69.A O no hydrogen 2.753 N/A GLY 157.A N ASN 142.A O no hydrogen 2.852 N/A GLY 160.A N ASP 158.A OD1 no hydrogen 3.188 N/A ALA 162.A N PHE 159.A O no hydrogen 3.193 N/A ILE 163.A N ILE 134.A O no hydrogen 3.003 N/A GLN 164.A NE2 ASN 131.A O no hydrogen 3.201 N/A LEU 165.A N ASN 132.A O no hydrogen 2.816 N/A GLY 169.A N GLY 166.A O no hydrogen 2.990 N/A LEU 170.A N SER 168.A OG no hydrogen 3.135 N/A VAL 171.A N TYR 192.A O no hydrogen 2.740 N/A ARG 175.A NE VAL 187.A O no hydrogen 2.848 N/A ARG 175.A NH1 VAL 187.A O no hydrogen 3.386 N/A THR 178.A OG1 ASP 137.A OD1 no hydrogen 2.667 N/A HIS 180.A ND1 PHE 215.A O no hydrogen 3.166 N/A PHE 181.A N THR 178.A O no hydrogen 2.860 N/A MET 182.A N PRO 179.A O no hydrogen 3.342 N/A GLU 185.A N GLU 185.A OE1 no hydrogen 2.678 N/A VAL 186.A N ALA 183.A O no hydrogen 2.979 N/A VAL 187.A N ALA 183.A O no hydrogen 3.045 N/A LYS 188.A N PRO 184.A O no hydrogen 3.022 N/A ARG 189.A N VAL 186.A O no hydrogen 2.862 N/A GLU 190.A N GLU 185.A O no hydrogen 2.959 N/A TYR 192.A N VAL 171.A O no hydrogen 3.104 N/A LYS 194.A NZ HIS 129.A O no hydrogen 3.002 N/A LYS 194.A NZ ASN 132.A OD1 no hydrogen 2.565 N/A VAL 196.A N GLY 193.A O no hydrogen 3.013 N/A ASP 197.A N LYS 194.A O no hydrogen 3.127 N/A TRP 199.A N PRO 195.A O no hydrogen 3.027 N/A GLY 200.A N VAL 196.A O no hydrogen 3.070 N/A CYS 201.A N ASP 197.A O no hydrogen 3.006 N/A CYS 201.A SG ASP 197.A O no hydrogen 3.450 N/A GLY 202.A N VAL 198.A O no hydrogen 2.860 N/A VAL 203.A N TRP 199.A O no hydrogen 3.004 N/A ILE 204.A N GLY 200.A O no hydrogen 3.060 N/A LEU 205.A N CYS 201.A O no hydrogen 2.839 N/A PHE 206.A N GLY 202.A O no hydrogen 2.923 N/A ILE 207.A N VAL 203.A O no hydrogen 3.003 N/A LEU 208.A N ILE 204.A O no hydrogen 2.656 N/A LEU 209.A N LEU 205.A O no hydrogen 2.943 N/A SER 210.A N PHE 206.A O no hydrogen 3.106 N/A SER 210.A OG PHE 206.A O no hydrogen 2.865 N/A GLY 211.A N ILE 207.A O no hydrogen 2.649 N/A CYS 212.A N SER 210.A OG no hydrogen 3.153 N/A CYS 212.A SG SER 210.A O no hydrogen 3.895 N/A ARG 221.A N THR 218.A O no hydrogen 3.049 N/A LEU 222.A N THR 218.A O no hydrogen 2.763 N/A PHE 223.A N LYS 219.A O no hydrogen 2.882 N/A GLU 224.A N GLU 220.A O no hydrogen 3.085 N/A GLY 225.A N ARG 221.A O no hydrogen 2.800 N/A ILE 226.A N LEU 222.A O no hydrogen 2.925 N/A ILE 227.A N PHE 223.A O no hydrogen 3.057 N/A LYS 228.A N GLU 224.A O no hydrogen 3.021 N/A GLY 229.A N GLY 225.A O no hydrogen 2.918 N/A GLN 237.A N ASN 234.A O no hydrogen 3.286 N/A GLN 237.A NE2 ASN 234.A OD1 no hydrogen 3.084 N/A TRP 238.A N ASN 234.A O no hydrogen 3.052 N/A SER 239.A N PRO 235.A O no hydrogen 2.818 N/A SER 239.A OG PRO 235.A O no hydrogen 2.605 N/A HIS 240.A N GLN 237.A O no hydrogen 3.339 N/A ILE 241.A N TRP 238.A O no hydrogen 3.074 N/A SER 242.A N GLU 111.A OE1 no hydrogen 2.706 N/A SER 242.A OG GLU 111.A OE1 no hydrogen 3.428 N/A SER 242.A OG GLU 111.A OE2 no hydrogen 2.710 N/A ALA 245.A N SER 242.A OG no hydrogen 3.274 N/A LYS 246.A N SER 242.A O no hydrogen 3.275 N/A LYS 246.A NZ TRP 238.A O no hydrogen 3.546 N/A ASP 247.A N GLU 243.A O no hydrogen 2.759 N/A LEU 248.A N SER 244.A O no hydrogen 3.152 N/A VAL 249.A N ALA 245.A O no hydrogen 3.033 N/A ARG 250.A N LYS 246.A O no hydrogen 2.972 N/A ARG 251.A N ASP 247.A O no hydrogen 3.061 N/A ARG 251.A NE ASP 247.A OD1 no hydrogen 2.862 N/A ARG 251.A NE ASP 247.A OD2 no hydrogen 3.332 N/A ARG 251.A NH2 ASP 247.A OD2 no hydrogen 3.371 N/A MET 252.A N LEU 248.A O no hydrogen 2.934 N/A LEU 253.A N VAL 249.A O no hydrogen 2.909 N/A ALA 258.A N ASP 256.A OD1 no hydrogen 2.993 N/A GLU 259.A N ASP 256.A O no hydrogen 2.893 N/A ARG 260.A N ASP 256.A O no hydrogen 3.118 N/A ARG 260.A NE MET 254.A O no hydrogen 2.914 N/A ARG 260.A NH1 GLU 185.A OE1 no hydrogen 3.545 N/A ARG 260.A NH1 GLU 185.A OE2 no hydrogen 2.777 N/A ARG 260.A NH1 PRO 195.A O no hydrogen 2.923 N/A ARG 260.A NH2 GLU 185.A OE1 no hydrogen 3.041 N/A ARG 260.A NH2 MET 254.A O no hydrogen 3.076 N/A ARG 260.A NH2 LEU 255.A O no hydrogen 3.113 N/A ILE 261.A N ARG 251.A O no hydrogen 3.173 N/A THR 262.A N GLU 265.A OE2 no hydrogen 2.966 N/A TYR 264.A OH ASP 130.A OD2 no hydrogen 2.729 N/A GLU 265.A N THR 262.A OG1 no hydrogen 3.044 N/A ALA 266.A N THR 262.A O no hydrogen 2.859 N/A LEU 267.A N VAL 263.A O no hydrogen 2.983 N/A ASN 268.A N GLU 265.A O no hydrogen 2.969 N/A HIS 269.A N ALA 266.A O no hydrogen 2.771 N/A HIS 269.A NE2 ASP 247.A OD1 no hydrogen 2.783 N/A TRP 271.A N HIS 269.A ND1 no hydrogen 3.146 N/A TRP 271.A NE1 GLU 111.A OE2 no hydrogen 2.934 N/A LEU 272.A N HIS 269.A O no hydrogen 2.894 N/A LYS 273.A N HIS 269.A O no hydrogen 2.733 N/A GLU 274.A N PRO 270.A O no hydrogen 2.846 N/A ARG 277.A N GLU 274.A O no hydrogen 3.087 N/A TYR 278.A N GLU 274.A O no hydrogen 2.999 N/A ALA 279.A N ARG 275.A O no hydrogen 2.912 N/A TYR 280.A N GLU 111.A OE2 no hydrogen 3.075 N/A LYS 281.A NZ ASP 276.A O no hydrogen 2.733 N/A LEU 284.A N TYR 109.A O no hydrogen 2.825 N/A THR 287.A OG1 LEU 209.A O no hydrogen 2.694 N/A VAL 288.A N LEU 284.A O no hydrogen 3.001 N/A GLU 289.A N PRO 285.A O no hydrogen 3.025 N/A GLN 290.A N GLU 286.A O no hydrogen 3.049 N/A LEU 291.A N THR 287.A O no hydrogen 2.838 N/A ARG 292.A N VAL 288.A O no hydrogen 2.866 N/A ARG 292.A NE GLU 289.A OE1 no hydrogen 3.085 N/A ARG 292.A NE GLU 289.A OE2 no hydrogen 3.277 N/A ARG 292.A NH1 ASP 104.A OD2 no hydrogen 2.793 N/A ARG 292.A NH1 GLU 289.A OE2 no hydrogen 2.835 N/A ARG 292.A NH2 ASP 104.A OD1 no hydrogen 2.833 N/A ARG 292.A NH2 ASP 104.A OD2 no hydrogen 3.405 N/A LYS 293.A N GLU 289.A O no hydrogen 3.236 N/A PHE 294.A N GLN 290.A O no hydrogen 2.698 N/A ASN 295.A N LEU 291.A O no hydrogen 2.705 N/A ASN 295.A ND2 CYS 96.A O no hydrogen 3.106 N/A ALA 296.A N ARG 292.A O no hydrogen 3.049 N/A ARG 297.A N LYS 293.A O no hydrogen 3.008 N/A ARG 298.A N PHE 294.A O no hydrogen 3.031 N/A ARG 298.A NE ASN 295.A OD1 no hydrogen 3.154 N/A ARG 298.A NH1 ASP 94.A OD1 no hydrogen 2.710 N/A ARG 298.A NH1 GLU 141.A OE2 no hydrogen 2.796 N/A ARG 298.A NH2 ASP 94.A OD1 no hydrogen 3.179 N/A ARG 298.A NH2 ASP 94.A OD2 no hydrogen 2.906 N/A ARG 298.A NH2 ASN 295.A OD1 no hydrogen 2.803 N/A LYS 299.A N ASN 295.A O no hydrogen 3.021 N/A LEU 300.A N ALA 296.A O no hydrogen 3.111 N/A LYS 301.A N ARG 297.A O no hydrogen 3.129 N/A LYS 301.A N ARG 298.A O no hydrogen 3.303 N/A GLY 302.A N ARG 298.A O no hydrogen 2.983 N/A