Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3h41_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): SER 1.A N VAL 65.A O no hydrogen 3.281 N/A LYS 2.A NZ GLU 62.A OE2 no hydrogen 3.197 N/A ALA 3.A N VAL 63.A O no hydrogen 3.036 N/A PHE 4.A N THR 98.A O no hydrogen 2.885 N/A ILE 5.A N GLN 61.A O no hydrogen 2.943 N/A ASP 6.A N GLN 96.A O no hydrogen 2.816 N/A ALA 10.A N ALA 57.A O no hydrogen 2.798 N/A LEU 12.A N THR 55.A O no hydrogen 2.933 N/A TRP 13.A N TRP 92.A O no hydrogen 2.603 N/A THR 14.A N LYS 52.A O no hydrogen 2.851 N/A THR 14.A OG1 ASN 51.A O no hydrogen 2.730 N/A THR 14.A OG1 LYS 52.A O no hydrogen 3.302 N/A SER 18.A OG ALA 15.A O no hydrogen 3.507 N/A SER 18.A OG PRO 16.A O no hydrogen 3.204 N/A ARG 20.A N ASP 23.A OD2 no hydrogen 2.833 N/A ARG 20.A NE ASP 23.A OD2 no hydrogen 2.809 N/A ARG 20.A NH1 GLU 43.A O no hydrogen 2.945 N/A ARG 20.A NH2 ASP 23.A OD1 no hydrogen 2.894 N/A ARG 20.A NH2 ASP 23.A OD2 no hydrogen 3.554 N/A ARG 20.A NH2 GLU 43.A O no hydrogen 3.330 N/A ASP 23.A N ARG 20.A O no hydrogen 2.851 N/A VAL 24.A N PRO 21.A O no hydrogen 3.251 N/A SER 26.A N ASP 23.A O no hydrogen 2.926 N/A SER 26.A OG ASP 23.A O no hydrogen 2.658 N/A ALA 27.A N VAL 24.A O no hydrogen 2.822 N/A THR 28.A OG1 PRO 30.A O no hydrogen 2.620 N/A ASN 29.A ND2 ASP 6.A OD2 no hydrogen 3.066 N/A ASN 29.A ND2 LYS 95.A O no hydrogen 3.020 N/A ASP 32.A N PRO 25.A O no hydrogen 2.890 N/A TRP 34.A NE1 GLU 133.A OE2 no hydrogen 3.012 N/A LYS 35.A N ASP 32.A OD1 no hydrogen 2.983 N/A TRP 36.A N ASP 32.A O no hydrogen 2.992 N/A TRP 36.A NE1 ASP 23.A OD1 no hydrogen 2.870 N/A THR 37.A N LEU 33.A O no hydrogen 3.080 N/A THR 37.A OG1 LEU 33.A O no hydrogen 2.951 N/A LYS 38.A N TRP 34.A O no hydrogen 2.883 N/A SER 39.A N LYS 35.A O no hydrogen 3.137 N/A SER 39.A OG.A LYS 35.A O no hydrogen 2.936 N/A SER 39.A OG.A TRP 36.A O no hydrogen 2.891 N/A SER 39.A OG.B LYS 35.A O no hydrogen 2.707 N/A THR 40.A OG1 GLU 43.A OE1 no hydrogen 2.779 N/A GLU 43.A N THR 40.A OG1 no hydrogen 3.066 N/A LYS 44.A N THR 40.A O no hydrogen 3.019 N/A LEU 45.A N LEU 41.A O no hydrogen 2.882 N/A TRP 46.A N ASP 42.A O no hydrogen 3.061 N/A LEU 47.A N LYS 44.A O no hydrogen 3.181 N/A ASN 49.A N LEU 45.A O no hydrogen 2.818 N/A ALA 50.A N TRP 46.A O no hydrogen 2.869 N/A ASN 51.A N THR 48.A O no hydrogen 2.941 N/A LYS 52.A N LEU 47.A O no hydrogen 2.923 N/A LYS 52.A NZ ALA 50.A O no hydrogen 2.630 N/A GLU 54.A N LEU 12.A O no hydrogen 2.776 N/A THR 55.A OG1 GLN 56.A O no hydrogen 3.389 N/A THR 55.A OG1 GLN 80.A OE1 no hydrogen 2.658 N/A GLN 56.A N THR 200.A OG1 no hydrogen 3.247 N/A GLN 56.A NE2 THR 11.A OG1 no hydrogen 3.023 N/A ALA 57.A N ALA 10.A O no hydrogen 2.883 N/A LEU 58.A N GLN 61.A OE1 no hydrogen 3.015 N/A LEU 59.A N SER 8.A O no hydrogen 2.967 N/A GLY 60.A N ILE 5.A O no hydrogen 2.869 N/A GLN 61.A N LEU 58.A O no hydrogen 2.829 N/A GLN 61.A NE2 HIS 78.A O no hydrogen 2.966 N/A VAL 63.A N ALA 3.A O no hydrogen 2.873 N/A THR 64.A N LEU 76.A O no hydrogen 2.972 N/A THR 64.A OG1 HIS 78.A NE2 no hydrogen 2.653 N/A THR 64.A OG1 GLU 87.A OE2 no hydrogen 2.654 N/A VAL 65.A N SER 1.A O no hydrogen 2.819 N/A VAL 66.A N LYS 74.A O no hydrogen 2.888 N/A ASP 67.A N LYS 74.A O no hydrogen 3.416 N/A LYS 68.A N ASP 67.A OD1 no hydrogen 2.821 N/A LYS 68.A NZ GLU 94.A OE1 no hydrogen 2.677 N/A LYS 69.A N TRP 72.A O no hydrogen 2.797 N/A TRP 72.A N LYS 69.A O no hydrogen 3.004 N/A LYS 74.A N ASP 67.A O no hydrogen 2.923 N/A VAL 75.A N GLY 91.A O no hydrogen 2.977 N/A LEU 76.A N THR 64.A O no hydrogen 2.861 N/A VAL 77.A N TYR 89.A O no hydrogen 2.807 N/A HIS 78.A N GLU 62.A O no hydrogen 3.092 N/A HIS 78.A NE2 THR 64.A OG1 no hydrogen 2.653 N/A GLN 80.A NE2 GLN 56.A O no hydrogen 2.897 N/A ARG 84.A N THR 82.A OG1 no hydrogen 3.002 N/A ARG 84.A NH1 GLU 54.A OE1 no hydrogen 2.681 N/A ARG 84.A NH2 GLU 54.A OE1 no hydrogen 3.555 N/A ARG 84.A NH2 GLU 54.A OE2 no hydrogen 3.029 N/A ASN 85.A N THR 82.A O no hydrogen 3.463 N/A GLU 87.A N ASN 85.A OD1 no hydrogen 2.794 N/A TYR 89.A N VAL 77.A O no hydrogen 3.020 N/A TYR 89.A OH ASP 224.A OD1 no hydrogen 3.346 N/A TYR 89.A OH ASP 224.A OD2 no hydrogen 2.491 N/A GLY 91.A N VAL 75.A O no hydrogen 3.131 N/A TRP 92.A N TRP 13.A O no hydrogen 2.764 N/A GLU 94.A N ASP 71.A O no hydrogen 2.927 N/A GLN 96.A N PRO 93.A O no hydrogen 3.011 N/A GLN 96.A NE2 SER 26.A O no hydrogen 2.931 N/A GLN 96.A NE2 THR 28.A O no hydrogen 2.926 N/A LEU 97.A N GLU 94.A O no hydrogen 3.018 N/A THR 98.A N PHE 4.A O no hydrogen 2.844 N/A TYR 99.A OH GLN 101.A OE1 no hydrogen 2.759 N/A GLN 101.A NE2 ASP 105.A OD1 no hydrogen 2.851 N/A GLN 101.A NE2 ASP 105.A OD2 no hydrogen 3.545 N/A PHE 103.A N ASN 100.A OD1 no hydrogen 3.013 N/A ALA 104.A N ASN 100.A O no hydrogen 2.795 N/A ASP 105.A N GLN 101.A O no hydrogen 2.729 N/A LYS 106.A N GLU 102.A O no hydrogen 3.086 N/A LYS 106.A N PHE 103.A O no hydrogen 2.983 N/A LYS 106.A NZ GLU 109.A OE1 no hydrogen 2.949 N/A THR 107.A N ALA 104.A O no hydrogen 3.439 N/A THR 107.A OG1.A ALA 104.A O no hydrogen 3.186 N/A THR 107.A OG1.A ASN 108.A OD1 no hydrogen 3.418 N/A GLU 109.A N LYS 106.A O no hydrogen 3.077 N/A PHE 111.A N TYR 170.A O no hydrogen 2.877 N/A VAL 112.A N LEU 140.A O no hydrogen 2.855 N/A LEU 113.A N THR 168.A O no hydrogen 2.762 N/A VAL 114.A N THR 138.A O no hydrogen 2.954 N/A THR 115.A N ASP 166.A O no hydrogen 2.988 N/A LYS 116.A NZ ASN 165.A O no hydrogen 2.739 N/A THR 118.A OG1 GLU 133.A OE2 no hydrogen 2.676 N/A ALA 119.A N VAL 134.A O no hydrogen 2.851 N/A LEU 121.A N LEU 132.A O no hydrogen 2.799 N/A TYR 122.A N TRP 161.A O no hydrogen 2.851 N/A ILE 123.A N LYS 130.A O no hydrogen 3.018 N/A ASN 124.A N LYS 159.A O no hydrogen 2.909 N/A HIS 129.A N SER 126.A O no hydrogen 3.044 N/A LYS 130.A N SER 126.A OG no hydrogen 2.954 N/A LEU 132.A N LEU 121.A O no hydrogen 2.833 N/A VAL 134.A N ALA 119.A O no hydrogen 2.759 N/A SER 135.A OG TYR 136.A O no hydrogen 2.634 N/A TYR 136.A N PRO 117.A O no hydrogen 2.949 N/A TYR 136.A OH SER 216.A OG no hydrogen 2.610 N/A ASN 137.A N VAL 114.A O no hydrogen 2.917 N/A THR 138.A N SER 135.A O no hydrogen 3.069 N/A THR 138.A OG1 SER 135.A O no hydrogen 2.646 N/A ARG 139.A NE ASN 137.A O no hydrogen 3.059 N/A ARG 139.A NE ASN 137.A OD1 no hydrogen 3.274 N/A ARG 139.A NH1 GLN 173.A OE1 no hydrogen 2.711 N/A ARG 139.A NH2 ASN 137.A OD1 no hydrogen 3.075 N/A ARG 139.A NH2 GLN 173.A OE1 no hydrogen 2.913 N/A ARG 139.A NH2 LYS 215.A O no hydrogen 3.055 N/A LEU 140.A N VAL 112.A O no hydrogen 3.072 N/A LEU 142.A N PRO 110.A O no hydrogen 3.006 N/A LEU 143.A N ARG 151.A O no hydrogen 2.701 N/A SER 144.A N ARG 151.A O no hydrogen 3.448 N/A ASP 146.A N SER 149.A O no hydrogen 3.038 N/A ILE 148.A N ASP 146.A OD1 no hydrogen 2.809 N/A SER 149.A N ASP 146.A OD1 no hydrogen 2.742 N/A SER 149.A OG ASP 146.A OD1 no hydrogen 2.750 N/A SER 149.A OG ASP 146.A OD2 no hydrogen 3.060 N/A TYR 150.A N LEU 162.A O no hydrogen 3.008 N/A ARG 151.A N SER 144.A O no hydrogen 2.752 N/A ARG 151.A NH2 ASN 124.A O no hydrogen 2.895 N/A VAL 152.A N ALA 160.A O no hydrogen 2.778 N/A LEU 153.A N PRO 141.A O no hydrogen 3.057 N/A LEU 154.A N GLN 158.A O no hydrogen 2.811 N/A ASN 156.A ND2 GLN 158.A OE1 no hydrogen 2.869 N/A GLY 157.A N LEU 154.A O no hydrogen 2.840 N/A GLN 158.A N ASN 156.A OD1 no hydrogen 2.922 N/A ALA 160.A N VAL 152.A O no hydrogen 3.024 N/A TRP 161.A N TYR 122.A O no hydrogen 2.829 N/A LEU 162.A N TYR 150.A O no hydrogen 3.068 N/A LYS 164.A N ILE 148.A O no hydrogen 2.907 N/A LYS 164.A NZ ASP 146.A O no hydrogen 2.615 N/A ASP 166.A N ARG 163.A O no hydrogen 2.949 N/A GLY 167.A N LYS 164.A O no hydrogen 3.412 N/A THR 168.A N LEU 113.A O no hydrogen 2.983 N/A TYR 170.A N PHE 111.A O no hydrogen 2.878 N/A SER 172.A OG ASP 175.A OD2 no hydrogen 2.735 N/A GLN 173.A NE2 LYS 215.A O no hydrogen 2.946 N/A ASP 175.A N SER 172.A O no hydrogen 2.868 N/A ASP 175.A N SER 172.A OG no hydrogen 3.225 N/A ILE 176.A N GLN 173.A O no hydrogen 3.193 N/A ALA 180.A N ASP 183.A OD2 no hydrogen 3.026 N/A ASP 183.A N ALA 180.A O no hydrogen 3.062 N/A LEU 184.A N ALA 180.A O no hydrogen 3.501 N/A ILE 185.A N ALA 181.A O no hydrogen 3.050 N/A ASN 186.A N ASP 182.A O no hydrogen 2.800 N/A THR 187.A N ASP 183.A O no hydrogen 2.915 N/A THR 187.A OG1 ASP 183.A O no hydrogen 2.965 N/A THR 187.A OG1 HIS 217.A NE2 no hydrogen 2.700 N/A GLY 188.A N LEU 184.A O no hydrogen 2.986 N/A LYS 189.A N ILE 185.A O no hydrogen 2.838 N/A LEU 191.A N LYS 189.A O no hydrogen 3.195 N/A GLY 192.A N VAL 277.A O no hydrogen 2.844 N/A LEU 193.A N PHE 190.A O no hydrogen 2.947 N/A TYR 195.A N ARG 275.A O no hydrogen 3.149 N/A ILE 196.A N PHE 205.A O no hydrogen 3.240 N/A ALA 198.A N ASP 206.A OD2 no hydrogen 2.957 N/A GLY 199.A N ILE 196.A O no hydrogen 3.008 N/A THR 200.A N GLN 56.A OE1 no hydrogen 2.888 N/A THR 200.A OG1 ALA 198.A O no hydrogen 2.770 N/A GLY 202.A N SER 135.A OG no hydrogen 2.920 N/A PHE 203.A N SER 201.A OG no hydrogen 3.107 N/A GLY 204.A N SER 201.A O no hydrogen 2.971 N/A ASP 206.A N GLY 199.A O no hydrogen 3.092 N/A SER 207.A OG ASP 206.A OD1 no hydrogen 3.394 N/A SER 207.A OG ARG 223.A O no hydrogen 3.414 N/A GLY 208.A N ASP 206.A OD1 no hydrogen 2.767 N/A PHE 209.A N ASP 206.A O no hydrogen 3.021 N/A THR 210.A OG1 SER 207.A O no hydrogen 3.201 N/A THR 210.A OG1 GLN 228.A OE1 no hydrogen 2.702 N/A HIS 211.A N SER 207.A O no hydrogen 2.923 N/A HIS 211.A ND1 ILE 221.A O no hydrogen 2.882 N/A THR 212.A N GLY 208.A O no hydrogen 2.879 N/A THR 212.A OG1 GLY 208.A O no hydrogen 2.697 N/A ILE 213.A N PHE 209.A O no hydrogen 2.968 N/A TYR 214.A N THR 210.A O no hydrogen 3.074 N/A TYR 214.A OH GLY 243.A O no hydrogen 2.625 N/A LYS 215.A N HIS 211.A O no hydrogen 2.888 N/A LYS 215.A NZ GLY 79.A O no hydrogen 3.096 N/A SER 216.A N THR 212.A O no hydrogen 3.017 N/A SER 216.A OG TYR 136.A OH no hydrogen 2.610 N/A SER 216.A OG THR 212.A O no hydrogen 3.211 N/A SER 216.A OG ILE 213.A O no hydrogen 2.912 N/A HIS 217.A N TYR 214.A O no hydrogen 3.038 N/A HIS 217.A NE2 THR 187.A OG1 no hydrogen 2.700 N/A GLY 218.A N LYS 215.A O no hydrogen 3.028 N/A ILE 219.A N TYR 214.A O no hydrogen 3.014 N/A ARG 223.A N PRO 81.A O no hydrogen 3.044 N/A ARG 223.A NE THR 55.A OG1 no hydrogen 2.996 N/A ARG 223.A NE THR 200.A OG1 no hydrogen 3.329 N/A ARG 223.A NH1 ASP 206.A OD1 no hydrogen 3.216 N/A ARG 223.A NH1 SER 207.A OG no hydrogen 2.841 N/A ARG 223.A NH1 ARG 223.A O no hydrogen 2.886 N/A ARG 223.A NH2 THR 200.A OG1 no hydrogen 2.923 N/A ARG 223.A NH2 ASP 206.A OD1 no hydrogen 2.906 N/A ARG 223.A NH2 ASP 206.A OD2 no hydrogen 3.513 N/A GLN 228.A N ASP 224.A O no hydrogen 2.933 N/A GLN 228.A NE2 SER 207.A O no hydrogen 3.116 N/A GLN 228.A NE2 PRO 222.A O no hydrogen 2.968 N/A GLN 228.A NE2 ARG 223.A O no hydrogen 3.443 N/A SER 229.A N SER 225.A O no hydrogen 2.933 N/A SER 229.A N GLY 226.A O no hydrogen 2.989 N/A SER 229.A OG GLY 226.A O no hydrogen 2.504 N/A ARG 230.A N PRO 227.A O no hydrogen 3.010 N/A ARG 230.A NH1 SER 229.A OG no hydrogen 2.981 N/A ASN 231.A N GLN 228.A O no hydrogen 3.428 N/A ASN 231.A ND2 PRO 227.A O no hydrogen 2.865 N/A VAL 233.A N ARG 296.A O no hydrogen 2.907 N/A VAL 235.A N ALA 294.A O no hydrogen 2.850 N/A HIS 239.A N ASP 236.A O no hydrogen 2.710 N/A HIS 239.A ND1 ASP 236.A OD1 no hydrogen 2.741 N/A GLN 241.A N ASP 244.A OD2 no hydrogen 2.754 N/A LYS 242.A NZ ASP 182.A OD1 no hydrogen 3.027 N/A GLY 243.A N TYR 262.A O no hydrogen 2.865 N/A ASP 244.A N GLN 241.A O no hydrogen 2.966 N/A LEU 245.A N ARG 295.A O no hydrogen 2.883 N/A ILE 246.A N ALA 261.A O no hydrogen 2.800 N/A PHE 247.A N GLY 293.A O no hydrogen 3.035 N/A PHE 248.A N HIS 259.A O no hydrogen 2.937 N/A ALA 249.A N GLU 290.A O no hydrogen 2.852 N/A HIS 250.A N SER 256.A O no hydrogen 2.938 N/A GLY 253.A N ALA 249.A O no hydrogen 3.148 N/A LYS 254.A N ASP 251.A O no hydrogen 3.117 N/A GLY 255.A N HIS 250.A O no hydrogen 2.811 N/A HIS 258.A N PHE 248.A O no hydrogen 2.919 N/A HIS 258.A NE2 GLU 290.A OE1 no hydrogen 2.589 N/A HIS 259.A N PHE 248.A O no hydrogen 3.252 N/A HIS 259.A NE2.A HIS 269.A ND1 no hydrogen 2.718 N/A ALA 261.A N ILE 246.A O no hydrogen 2.868 N/A ILE 263.A N ASN 267.A O no hydrogen 2.968 N/A GLY 266.A N TYR 262.A OH no hydrogen 2.975 N/A ASN 267.A N GLY 264.A O no hydrogen 3.079 N/A HIS 269.A N GLU 278.A O no hydrogen 3.124 N/A HIS 269.A ND1 HIS 259.A NE2.A no hydrogen 2.718 N/A HIS 269.A NE2 GLU 278.A OE2 no hydrogen 2.784 N/A SER 270.A OG PHE 205.A O no hydrogen 2.785 N/A GLU 274.A N GLU 274.A OE1 no hydrogen 2.776 N/A ARG 275.A N ARG 272.A O no hydrogen 2.864 N/A ARG 275.A NE GLU 278.A OE1 no hydrogen 2.935 N/A ARG 275.A NE GLU 278.A OE2 no hydrogen 3.474 N/A ARG 275.A NH2 GLU 278.A OE2 no hydrogen 2.871 N/A SER 276.A OG GLY 192.A O no hydrogen 3.393 N/A VAL 277.A N LEU 193.A O no hydrogen 2.934 N/A GLU 278.A N HIS 269.A O no hydrogen 3.034 N/A LEU 282.A N GLY 266.A O no hydrogen 2.810 N/A THR 284.A OG1 PRO 281.A O no hydrogen 2.656 N/A GLY 286.A N GLU 289.A OE1 no hydrogen 2.771 N/A ILE 288.A N THR 284.A O no hydrogen 3.039 N/A GLU 289.A N GLU 289.A OE1 no hydrogen 2.832 N/A GLU 290.A N TYR 287.A O no hydrogen 3.032 N/A TYR 291.A N ILE 288.A O no hydrogen 3.422 N/A ALA 292.A N PHE 247.A O no hydrogen 2.785 N/A ARG 295.A N LEU 245.A O no hydrogen 2.858 N/A ARG 295.A NH1 GLY 232.A O no hydrogen 3.047 N/A ARG 296.A N VAL 233.A O no hydrogen 2.803 N/A ARG 296.A NE ASP 244.A OD1 no hydrogen 2.849 N/A ARG 296.A NH2 HIS 239.A O no hydrogen 2.881 N/A ARG 296.A NH2 ASP 244.A OD2 no hydrogen 2.807 N/A TYR 297.A OH GLN 228.A O no hydrogen 2.577 N/A