Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3e96_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ALA 5.A N PRO 1.A O no hydrogen 3.207 N/A LEU 6.A N LEU 2.A O no hydrogen 2.956 N/A LEU 6.A N ALA 3.A O no hydrogen 3.127 N/A GLU 7.A N LYS 4.A O no hydrogen 3.077 N/A ILE 9.A N THR 8.A OG1 no hydrogen 2.624 N/A SER 10.A N PHE 205.A O no hydrogen 2.948 N/A GLY 11.A N VAL 43.A O no hydrogen 2.805 N/A ILE 12.A N SER 207.A O no hydrogen 3.088 N/A ILE 14.A N ASN 211.A OD1 no hydrogen 2.992 N/A THR 15.A OG1 SER 51.A O no hydrogen 2.661 N/A THR 15.A OG1 GLU 64.A OE1 no hydrogen 2.556 N/A THR 15.A OG1 GLU 64.A OE2 no hydrogen 3.431 N/A ARG 18.A N SER 23.A O no hydrogen 2.769 N/A ARG 18.A NH1 SER 23.A OG no hydrogen 2.854 N/A ARG 18.A NH1 ILE 24.A O no hydrogen 2.771 N/A SER 20.A OG ASP 21.A OD1 no hydrogen 3.412 N/A GLY 22.A N ARG 18.A O no hydrogen 2.765 N/A SER 23.A N ASP 21.A OD1 no hydrogen 3.004 N/A SER 23.A OG ASP 21.A OD1 no hydrogen 2.765 N/A SER 23.A OG ASP 21.A OD2 no hydrogen 3.564 N/A ASP 25.A N PRO 16.A O no hydrogen 3.090 N/A HIS 28.A N ASP 25.A OD1 no hydrogen 2.919 N/A TYR 29.A N ASP 25.A O no hydrogen 2.995 N/A TYR 29.A OH THR 68.A OG1 no hydrogen 2.650 N/A LYS 30.A N TRP 26.A O no hydrogen 2.952 N/A GLU 31.A N HIS 27.A O no hydrogen 3.097 N/A THR 32.A N HIS 28.A O no hydrogen 2.987 N/A THR 32.A OG1 HIS 28.A O no hydrogen 3.067 N/A VAL 33.A N TYR 29.A O no hydrogen 2.876 N/A ASP 34.A N LYS 30.A O no hydrogen 2.855 N/A ARG 35.A N GLU 31.A O no hydrogen 3.007 N/A ARG 35.A NH1 ASN 211.A O no hydrogen 3.235 N/A ILE 36.A N THR 32.A O no hydrogen 3.086 N/A VAL 37.A N VAL 33.A O no hydrogen 2.992 N/A ASP 38.A N ASP 34.A O no hydrogen 2.821 N/A ASN 39.A N ILE 36.A O no hydrogen 3.343 N/A ILE 44.A N LEU 77.A O no hydrogen 3.010 N/A VAL 45.A N GLY 11.A O no hydrogen 2.787 N/A CYS 47.A N GLU 64.A OE2 no hydrogen 2.882 N/A CYS 47.A SG ALA 61.A O no hydrogen 3.221 N/A GLY 48.A N SER 51.A OG no hydrogen 3.014 N/A SER 51.A N GLY 48.A O no hydrogen 3.027 N/A SER 51.A OG PRO 13.A O no hydrogen 2.663 N/A GLU 52.A N ASN 49.A O no hydrogen 3.032 N/A ALA 55.A N GLU 52.A O no hydrogen 2.865 N/A LEU 56.A N PHE 53.A O no hydrogen 3.001 N/A SER 57.A N GLU 60.A OE1 no hydrogen 2.949 N/A GLU 60.A N SER 57.A OG no hydrogen 3.090 N/A ALA 61.A N SER 57.A O no hydrogen 2.968 N/A LYS 62.A N LEU 58.A O no hydrogen 2.986 N/A LYS 62.A NZ GLU 91.A OE2 no hydrogen 2.555 N/A GLU 63.A N GLU 59.A O no hydrogen 3.007 N/A GLU 64.A N GLU 60.A O no hydrogen 2.864 N/A VAL 65.A N ALA 61.A O no hydrogen 3.296 N/A ARG 66.A N LYS 62.A O no hydrogen 3.025 N/A ARG 67.A N GLU 63.A O no hydrogen 2.746 N/A ARG 67.A NE GLU 63.A OE2 no hydrogen 2.782 N/A ARG 67.A NH1 TYR 71.A OH no hydrogen 3.059 N/A ARG 67.A NH2 GLU 63.A OE2 no hydrogen 2.895 N/A THR 68.A N GLU 64.A O no hydrogen 2.875 N/A THR 68.A OG1 TYR 29.A OH no hydrogen 2.650 N/A THR 68.A OG1 GLU 64.A O no hydrogen 2.565 N/A VAL 69.A N VAL 65.A O no hydrogen 3.070 N/A GLU 70.A N ARG 66.A O no hydrogen 3.297 N/A TYR 71.A N ARG 67.A O no hydrogen 2.859 N/A VAL 72.A N THR 68.A O no hydrogen 2.809 N/A HIS 73.A N VAL 69.A O no hydrogen 3.136 N/A HIS 73.A ND1 HIS 73.A O no hydrogen 2.591 N/A ARG 75.A N VAL 72.A O no hydrogen 2.950 N/A ARG 75.A NE VAL 72.A O no hydrogen 3.129 N/A ARG 75.A NH1 ASP 34.A OD1 no hydrogen 3.065 N/A ARG 75.A NH1 ASP 38.A OD1 no hydrogen 2.620 N/A ARG 75.A NH2 ASP 34.A OD1 no hydrogen 2.630 N/A ARG 75.A NH2 TYR 71.A O no hydrogen 2.635 N/A LEU 77.A N ASP 42.A O no hydrogen 2.858 N/A VAL 78.A N ASP 102.A OD2 no hydrogen 2.717 N/A VAL 79.A N ILE 44.A O no hydrogen 2.955 N/A ALA 80.A N ALA 103.A O no hydrogen 2.853 N/A GLY 81.A N PRO 46.A O no hydrogen 2.956 N/A ILE 82.A N MET 105.A O no hydrogen 2.950 N/A ALA 89.A N ALA 85.A O no hydrogen 2.782 N/A ILE 90.A N THR 86.A O no hydrogen 2.942 N/A GLU 91.A N SER 87.A O no hydrogen 3.011 N/A LEU 92.A N THR 88.A O no hydrogen 2.901 N/A GLY 93.A N ALA 89.A O no hydrogen 2.870 N/A ASN 94.A N ILE 90.A O no hydrogen 2.870 N/A ALA 95.A N GLU 91.A O no hydrogen 3.073 N/A ALA 96.A N LEU 92.A O no hydrogen 2.998 N/A LYS 97.A N GLY 93.A O no hydrogen 2.804 N/A LYS 97.A NZ LEU 130.A O no hydrogen 3.014 N/A ALA 98.A N ASN 94.A O no hydrogen 3.041 N/A ALA 99.A N ALA 95.A O no hydrogen 2.944 N/A GLY 100.A N LYS 97.A O no hydrogen 3.175 N/A ALA 101.A N ALA 96.A O no hydrogen 3.036 N/A ASP 102.A N VAL 78.A O no hydrogen 2.818 N/A VAL 104.A N PRO 133.A O no hydrogen 3.013 N/A MET 105.A N ALA 80.A O no hydrogen 2.817 N/A ILE 106.A N LEU 135.A O no hydrogen 2.767 N/A HIS 107.A N ILE 82.A O no hydrogen 2.923 N/A HIS 107.A NE2 CYS 47.A O no hydrogen 2.746 N/A HIS 111.A N HIS 111.A ND1 no hydrogen 2.781 N/A VAL 119.A N THR 115.A O no hydrogen 2.822 N/A TYR 120.A N ALA 116.A O no hydrogen 3.024 N/A ALA 121.A N GLY 117.A O no hydrogen 3.212 N/A TYR 122.A N GLY 118.A O no hydrogen 2.818 N/A TYR 122.A OH TYR 84.A O no hydrogen 2.562 N/A PHE 123.A N VAL 119.A O no hydrogen 3.090 N/A ARG 124.A N TYR 120.A O no hydrogen 2.900 N/A ARG 124.A NE ASP 125.A OD1 no hydrogen 2.996 N/A ARG 124.A NH2 ASP 125.A OD1 no hydrogen 3.053 N/A ASP 125.A N ALA 121.A O no hydrogen 2.875 N/A ILE 126.A N TYR 122.A O no hydrogen 3.353 N/A ILE 127.A N PHE 123.A O no hydrogen 2.996 N/A GLU 128.A N ARG 124.A O no hydrogen 2.867 N/A ALA 129.A N ASP 125.A O no hydrogen 3.015 N/A LEU 130.A N ILE 126.A O no hydrogen 2.945 N/A ASP 131.A N ILE 127.A O no hydrogen 2.932 N/A SER 134.A N ASN 156.A O no hydrogen 2.578 N/A SER 134.A OG PHE 132.A O no hydrogen 2.758 N/A LEU 135.A N VAL 104.A O no hydrogen 2.858 N/A VAL 136.A N GLY 159.A O no hydrogen 3.330 N/A TYR 137.A N ILE 106.A O no hydrogen 3.081 N/A TYR 137.A OH GLY 188.A O no hydrogen 2.730 N/A PHE 138.A N LYS 161.A O no hydrogen 3.091 N/A GLU 142.A N ASP 140.A OD1 no hydrogen 2.887 N/A ILE 143.A N ASP 140.A O no hydrogen 3.040 N/A ARG 146.A N SER 144.A OG no hydrogen 3.045 N/A VAL 147.A N SER 144.A O no hydrogen 3.146 N/A LEU 148.A N ASP 145.A O no hydrogen 2.904 N/A VAL 149.A N ASP 145.A O no hydrogen 3.269 N/A ASP 150.A N ARG 146.A O no hydrogen 2.896 N/A LEU 151.A N VAL 147.A O no hydrogen 3.044 N/A ALA 152.A N LEU 148.A O no hydrogen 2.968 N/A LEU 154.A N LEU 151.A O no hydrogen 2.930 N/A LEU 157.A N LEU 154.A O no hydrogen 3.181 N/A VAL 158.A N SER 134.A O no hydrogen 2.929 N/A VAL 160.A N ALA 184.A O no hydrogen 2.938 N/A LYS 161.A N VAL 136.A O no hydrogen 2.834 N/A TYR 162.A N ILE 186.A O no hydrogen 2.889 N/A TYR 162.A OH ASP 145.A OD1 no hydrogen 2.710 N/A TYR 162.A OH ASP 145.A OD2 no hydrogen 3.390 N/A ALA 163.A N PHE 138.A O no hydrogen 2.684 N/A ASP 166.A N ILE 164.A O no hydrogen 2.764 N/A ARG 169.A N ASP 166.A OD1 no hydrogen 3.108 N/A ARG 169.A NE ASP 145.A OD2 no hydrogen 2.918 N/A ARG 169.A NH1 PRO 141.A O no hydrogen 2.690 N/A ARG 169.A NH2 ILE 143.A O no hydrogen 2.897 N/A ARG 169.A NH2 ASP 145.A OD1 no hydrogen 2.953 N/A PHE 170.A N ASP 166.A O no hydrogen 3.004 N/A ALA 171.A N LEU 167.A O no hydrogen 2.854 N/A LYS 172.A N PRO 168.A O no hydrogen 3.059 N/A VAL 173.A N ARG 169.A O no hydrogen 2.932 N/A VAL 174.A N PHE 170.A O no hydrogen 2.995 N/A ARG 175.A N ALA 171.A O no hydrogen 3.325 N/A ARG 175.A NH1 ALA 171.A O no hydrogen 2.881 N/A ARG 175.A NH1 ALA 200.A O no hydrogen 2.918 N/A SER 176.A N VAL 173.A O no hydrogen 3.023 N/A SER 176.A OG LYS 172.A O no hydrogen 2.715 N/A HIS 181.A N PRO 178.A O no hydrogen 3.165 N/A GLN 182.A N GLU 179.A O no hydrogen 3.050 N/A GLN 182.A NE2 GLU 179.A O no hydrogen 2.681 N/A ALA 184.A N VAL 158.A O no hydrogen 3.020 N/A ILE 186.A N VAL 160.A O no hydrogen 2.970 N/A CYS 187.A N GLY 204.A O no hydrogen 2.855 N/A CYS 187.A SG THR 189.A OG1 no hydrogen 3.393 N/A CYS 187.A SG ALA 190.A O no hydrogen 3.827 N/A GLY 188.A N TYR 162.A O no hydrogen 2.901 N/A THR 189.A OG1 ASN 165.A OD1 no hydrogen 2.734 N/A GLU 191.A N GLU 191.A OE1 no hydrogen 2.683 N/A LYS 192.A NZ ASP 244.A OD1 no hydrogen 2.790 N/A TRP 193.A N ALA 190.A O no hydrogen 3.037 N/A ALA 194.A N ALA 190.A O no hydrogen 2.897 N/A PHE 197.A N TRP 193.A O no hydrogen 3.065 N/A TRP 198.A N ALA 194.A O no hydrogen 2.741 N/A HIS 199.A N PRO 195.A O no hydrogen 3.132 N/A ALA 200.A N PHE 196.A O no hydrogen 3.246 N/A GLY 201.A N TRP 198.A O no hydrogen 3.031 N/A ALA 202.A N PHE 197.A O no hydrogen 2.947 N/A LYS 203.A N TRP 185.A O no hydrogen 2.913 N/A PHE 205.A N THR 8.A O no hydrogen 3.150 N/A THR 206.A N CYS 187.A O no hydrogen 2.946 N/A THR 206.A OG1 CYS 187.A O no hydrogen 3.446 N/A SER 207.A N SER 10.A O no hydrogen 3.083 N/A SER 207.A OG GLU 191.A OE1 no hydrogen 3.428 N/A SER 207.A OG GLU 191.A OE2 no hydrogen 2.508 N/A VAL 210.A N SER 207.A OG no hydrogen 3.335 N/A ASN 211.A N GLY 208.A O no hydrogen 3.079 N/A ASN 211.A ND2 ILE 12.A O no hydrogen 2.877 N/A ASN 211.A ND2 GLY 208.A O no hydrogen 2.884 N/A LEU 212.A N LEU 209.A O no hydrogen 2.987 N/A LEU 213.A N LEU 209.A O no hydrogen 2.855 N/A LYS 216.A N LEU 213.A O no hydrogen 3.141 N/A VAL 218.A N PRO 214.A O no hydrogen 3.048 N/A GLU 219.A N GLN 215.A O no hydrogen 2.966 N/A MET 220.A N LYS 216.A O no hydrogen 3.151 N/A LEU 221.A N ALA 217.A O no hydrogen 2.972 N/A GLU 222.A N VAL 218.A O no hydrogen 2.948 N/A ALA 223.A N GLU 219.A O no hydrogen 2.989 N/A LEU 224.A N MET 220.A O no hydrogen 2.943 N/A ARG 225.A N LEU 221.A O no hydrogen 2.918 N/A ARG 225.A NH2 GLU 7.A O no hydrogen 2.813 N/A ASN 226.A N GLU 222.A O no hydrogen 2.886 N/A ASN 227.A N LEU 224.A O no hydrogen 3.090 N/A ASN 227.A ND2 LEU 224.A O no hydrogen 3.309 N/A ASP 228.A N ALA 223.A O no hydrogen 3.028 N/A ALA 231.A N ASP 228.A OD1 no hydrogen 3.127 N/A VAL 232.A N ASP 228.A O no hydrogen 2.915 N/A TRP 233.A N ASN 229.A O no hydrogen 2.974 N/A ARG 234.A N ASP 230.A O no hydrogen 3.111 N/A ILE 235.A N ALA 231.A O no hydrogen 2.949 N/A TRP 236.A N VAL 232.A O no hydrogen 2.880 N/A TRP 236.A NE1 LYS 192.A O no hydrogen 2.864 N/A GLU 237.A N TRP 233.A O no hydrogen 2.859 N/A ASP 238.A N ARG 234.A O no hydrogen 3.122 N/A ILE 239.A N ILE 235.A O no hydrogen 2.966 N/A VAL 240.A N TRP 236.A O no hydrogen 2.837 N/A PHE 242.A N ILE 239.A O no hydrogen 2.926 N/A GLU 243.A N ILE 239.A O no hydrogen 3.382 N/A ASP 244.A N VAL 240.A O no hydrogen 2.771 N/A LEU 245.A N PRO 241.A O no hydrogen 3.056 N/A ARG 246.A N PHE 242.A O no hydrogen 3.049 N/A ARG 246.A NE ASN 254.A O no hydrogen 2.906 N/A ARG 246.A NH1 GLU 243.A OE2 no hydrogen 2.991 N/A ARG 246.A NH2 ASN 254.A O no hydrogen 3.479 N/A ARG 246.A NH2 ASN 254.A OD1 no hydrogen 2.717 N/A GLY 247.A N GLU 243.A O no hydrogen 3.007 N/A LYS 248.A N LEU 245.A O no hydrogen 3.262 N/A LYS 248.A NZ TYR 249.A OH no hydrogen 3.336 N/A LYS 248.A NZ ASP 283.A OD1 no hydrogen 2.767 N/A TYR 249.A OH ASP 283.A OD2 no hydrogen 2.595 N/A GLN 251.A N GLY 247.A O no hydrogen 2.960 N/A GLY 252.A N TYR 249.A O no hydrogen 3.023 N/A ASN 253.A N LYS 248.A O no hydrogen 3.251 N/A ASN 254.A N GLN 251.A O no hydrogen 2.985 N/A ASN 254.A ND2 GLN 251.A OE1 no hydrogen 2.953 N/A VAL 257.A N ASN 253.A O no hydrogen 3.062 N/A LYS 259.A N VAL 255.A O no hydrogen 2.935 N/A LYS 259.A NZ THR 15.A O no hydrogen 2.806 N/A LYS 259.A NZ GLU 52.A OE2 no hydrogen 2.697 N/A LYS 259.A NZ VAL 271.A O no hydrogen 2.849 N/A GLU 260.A N VAL 256.A O no hydrogen 2.942 N/A ALA 261.A N VAL 257.A O no hydrogen 3.002 N/A MET 262.A N ILE 258.A O no hydrogen 2.898 N/A GLU 263.A N LYS 259.A O no hydrogen 2.995 N/A MET 264.A N GLU 260.A O no hydrogen 3.049 N/A LEU 265.A N ALA 261.A O no hydrogen 3.110 N/A LEU 265.A N MET 262.A O no hydrogen 2.891 N/A ARG 266.A N GLU 263.A O no hydrogen 2.934 N/A GLN 267.A N MET 262.A O no hydrogen 2.834 N/A GLN 267.A NE2 LEU 212.A O no hydrogen 3.218 N/A ALA 269.A N GLU 263.A OE2 no hydrogen 2.839 N/A GLY 270.A N GLU 263.A OE2 no hydrogen 2.873 N/A VAL 271.A N PHE 17.A O no hydrogen 2.966 N/A THR 272.A OG1 VAL 276.A O no hydrogen 2.676 N/A ARG 273.A N GLU 52.A OE1 no hydrogen 3.082 N/A ARG 273.A NE GLY 22.A O no hydrogen 2.910 N/A ARG 273.A NH1 GLY 22.A O no hydrogen 2.881 N/A ARG 273.A NH1 GLU 60.A OE2 no hydrogen 2.799 N/A ARG 273.A NH2 ALA 55.A O no hydrogen 2.823 N/A ARG 273.A NH2 GLU 60.A OE1 no hydrogen 2.808 N/A ARG 273.A NH2 GLU 60.A OE2 no hydrogen 3.445 N/A VAL 276.A N ARG 273.A O no hydrogen 3.051 N/A LEU 279.A N GLU 260.A OE2 no hydrogen 2.773 N/A ASP 283.A N SER 280.A OG no hydrogen 3.128 N/A LYS 284.A N SER 280.A O no hydrogen 2.889 N/A LYS 284.A NZ GLU 260.A OE1 no hydrogen 2.900 N/A LYS 284.A NZ GLU 260.A OE2 no hydrogen 3.174 N/A LYS 284.A NZ LEU 279.A O no hydrogen 2.906 N/A GLN 285.A N ASN 281.A O no hydrogen 3.017 N/A LEU 286.A N GLU 282.A O no hydrogen 3.200 N/A VAL 287.A N ASP 283.A O no hydrogen 2.937 N/A THR 288.A N LYS 284.A O no hydrogen 3.001 N/A THR 288.A OG1 LYS 284.A O no hydrogen 2.933 N/A GLU 289.A N GLN 285.A O no hydrogen 2.829 N/A LEU 290.A N LEU 286.A O no hydrogen 3.024 N/A LEU 291.A N VAL 287.A O no hydrogen 3.025 N/A SER 292.A N THR 288.A O no hydrogen 2.921 N/A SER 293.A N GLU 289.A O no hydrogen 2.928 N/A TRP 294.A N LEU 290.A O no hydrogen 2.886 N/A TRP 294.A NE1 ASP 238.A O no hydrogen 2.945 N/A LYS 295.A N SER 292.A O no hydrogen 2.893 N/A LEU 296.A N LEU 291.A O no hydrogen 2.959 N/A