Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3vrn_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ARG 5.A N TRP 1.A O no hydrogen 3.331 N/A ALA 6.A N GLU 2.A O no hydrogen 2.963 N/A LEU 7.A N GLU 3.A O no hydrogen 2.858 N/A GLY 8.A N ALA 4.A O no hydrogen 2.994 N/A ARG 9.A N ARG 5.A O no hydrogen 2.910 N/A ALA 10.A N ALA 6.A O no hydrogen 2.998 N/A VAL 11.A N LEU 7.A O no hydrogen 2.999 N/A ARG 12.A N GLY 8.A O no hydrogen 2.927 N/A MET 13.A N ARG 9.A O no hydrogen 2.907 N/A LEU 14.A N ALA 10.A O no hydrogen 2.968 N/A GLN 15.A N VAL 11.A O no hydrogen 2.900 N/A ARG 16.A N ARG 12.A O no hydrogen 2.935 N/A LEU 17.A N MET 13.A O no hydrogen 3.045 N/A GLU 18.A N LEU 14.A O no hydrogen 2.910 N/A GLU 19.A N GLN 15.A O no hydrogen 3.007 N/A GLN 20.A N ARG 16.A O no hydrogen 3.041 N/A CYS 21.A N LEU 17.A O no hydrogen 2.939 N/A CYS 21.A N GLU 18.A O no hydrogen 3.356 N/A CYS 21.A SG LEU 17.A O no hydrogen 3.354 N/A SER 24.A OG ASP 215.A OD2 no hydrogen 2.839 N/A ASP 30.A N SER 27.A O no hydrogen 3.131 N/A ASP 30.A N SER 27.A OG no hydrogen 3.316 N/A LEU 31.A N SER 27.A O no hydrogen 2.876 N/A LEU 32.A N LEU 28.A O no hydrogen 2.890 N/A ARG 34.A N ASP 30.A O no hydrogen 3.414 N/A ARG 34.A NE ASP 30.A OD1 no hydrogen 3.404 N/A ARG 34.A NH2 ASP 30.A OD1 no hydrogen 3.150 N/A THR 35.A N LEU 31.A O no hydrogen 2.888 N/A THR 35.A OG1 LEU 31.A O no hydrogen 2.802 N/A ALA 36.A N LEU 32.A O no hydrogen 3.026 N/A GLN 37.A N PRO 33.A O no hydrogen 2.937 N/A LEU 38.A N ARG 34.A O no hydrogen 3.048 N/A LEU 39.A N THR 35.A O no hydrogen 2.944 N/A ARG 40.A N ALA 36.A O no hydrogen 3.010 N/A GLU 41.A N GLN 37.A O no hydrogen 3.132 N/A VAL 42.A N LEU 38.A O no hydrogen 2.940 N/A ALA 43.A N LEU 39.A O no hydrogen 2.912 N/A HIS 44.A N ARG 40.A O no hydrogen 3.062 N/A SER 45.A N GLU 41.A O no hydrogen 3.124 N/A SER 45.A OG GLY 112.A O no hydrogen 3.502 N/A ARG 46.A N VAL 42.A O no hydrogen 2.950 N/A ARG 46.A NE GLU 3.A OE2 no hydrogen 2.496 N/A ARG 46.A NH1 SER 60.A OG no hydrogen 2.833 N/A ARG 46.A NH2 GLU 3.A OE1 no hydrogen 2.868 N/A ARG 47.A N HIS 44.A O no hydrogen 3.288 N/A ARG 47.A NH2 HIS 44.A ND1 no hydrogen 2.858 N/A ALA 48.A N SER 45.A O no hydrogen 3.048 N/A GLY 58.A N ASP 62.A OD2 no hydrogen 2.600 N/A GLY 59.A N GLY 56.A O no hydrogen 3.230 N/A SER 60.A OG GLY 52.A O no hydrogen 2.664 N/A PHE 63.A N GLY 59.A O no hydrogen 2.877 N/A LEU 64.A N SER 60.A O no hydrogen 2.956 N/A LEU 65.A N GLY 61.A O no hydrogen 3.021 N/A ILE 66.A N ASP 62.A O no hydrogen 3.168 N/A TYR 67.A N PHE 63.A O no hydrogen 2.748 N/A TYR 67.A OH MET 101.A O no hydrogen 2.763 N/A LEU 68.A N LEU 64.A O no hydrogen 2.769 N/A ALA 69.A N LEU 65.A O no hydrogen 3.225 N/A ASN 70.A N ILE 66.A O no hydrogen 2.973 N/A ASN 70.A ND2 THR 171.A O no hydrogen 2.946 N/A LEU 71.A N TYR 67.A O no hydrogen 2.752 N/A GLU 72.A N LEU 68.A O no hydrogen 2.904 N/A ALA 73.A N ALA 69.A O no hydrogen 3.079 N/A LYS 74.A N ASN 70.A O no hydrogen 2.897 N/A LYS 74.A NZ ASN 70.A OD1 no hydrogen 2.822 N/A LYS 74.A NZ CYS 172.A O no hydrogen 3.035 N/A SER 75.A N LEU 71.A O no hydrogen 2.886 N/A SER 75.A OG LEU 71.A O no hydrogen 2.751 N/A ARG 76.A N GLU 72.A O no hydrogen 2.902 N/A GLN 77.A N ALA 73.A O no hydrogen 3.117 N/A VAL 78.A N LYS 74.A O no hydrogen 3.077 N/A ALA 79.A N SER 75.A O no hydrogen 2.959 N/A ALA 80.A N ARG 76.A O no hydrogen 3.015 N/A LEU 81.A N VAL 78.A O no hydrogen 3.014 N/A LEU 82.A N VAL 78.A O no hydrogen 3.137 N/A ARG 86.A NH1 GLN 90.A OE1 no hydrogen 2.655 N/A ARG 89.A N SER 85.A O no hydrogen 3.249 N/A ARG 89.A NH1 PHE 211.A O no hydrogen 2.864 N/A ARG 89.A NH1 GLU 216.A OE2 no hydrogen 2.997 N/A ARG 89.A NH2 PHE 211.A O no hydrogen 2.946 N/A GLN 90.A N ARG 86.A O no hydrogen 2.846 N/A LEU 91.A N LEU 87.A O no hydrogen 2.894 N/A ALA 92.A N ARG 88.A O no hydrogen 2.895 N/A LYS 93.A N ARG 89.A O no hydrogen 2.906 N/A LEU 94.A N GLN 90.A O no hydrogen 3.131 N/A ALA 95.A N LEU 91.A O no hydrogen 2.859 N/A ILE 96.A N ALA 92.A O no hydrogen 2.928 N/A ILE 97.A N LYS 93.A O no hydrogen 2.923 N/A PHE 98.A N LEU 94.A O no hydrogen 2.790 N/A SER 99.A N ALA 95.A O no hydrogen 2.873 N/A SER 99.A OG CYS 237.A O no hydrogen 2.748 N/A HIS 100.A N ILE 96.A O no hydrogen 2.941 N/A HIS 100.A ND1 LEU 170.A O no hydrogen 2.778 N/A MET 101.A N ILE 97.A O no hydrogen 2.837 N/A HIS 102.A N PHE 98.A O no hydrogen 2.851 N/A ALA 103.A N SER 99.A O no hydrogen 2.943 N/A GLU 104.A N HIS 100.A O no hydrogen 2.907 N/A LEU 105.A N MET 101.A O no hydrogen 3.078 N/A HIS 106.A N HIS 102.A O no hydrogen 2.907 N/A ALA 107.A N ALA 103.A O no hydrogen 2.871 N/A LEU 108.A N GLU 104.A O no hydrogen 2.982 N/A PHE 109.A N LEU 105.A O no hydrogen 2.735 N/A GLY 112.A N PHE 109.A O no hydrogen 2.800 N/A LYS 113.A N PRO 110.A O no hydrogen 3.036 N/A CYS 115.A N LEU 108.A O no hydrogen 2.798 N/A CYS 115.A SG ALA 107.A O no hydrogen 3.217 N/A CYS 115.A SG LEU 108.A O no hydrogen 3.725 N/A HIS 117.A N HIS 117.A ND1 no hydrogen 2.795 N/A MET 118.A N CYS 115.A O no hydrogen 2.896 N/A TYR 119.A OH ASP 182.A OD2 no hydrogen 2.547 N/A THR 122.A N ASP 182.A OD1 no hydrogen 2.763 N/A THR 122.A OG1 ASP 182.A OD1 no hydrogen 2.877 N/A THR 122.A OG1 ASP 182.A OD2 no hydrogen 3.544 N/A LYS 123.A NZ GLN 189.A OE1 no hydrogen 3.331 N/A HIS 127.A N LYS 123.A O no hydrogen 2.943 N/A THR 128.A N ALA 124.A O no hydrogen 2.980 N/A THR 128.A OG1 ALA 124.A O no hydrogen 3.268 N/A PHE 129.A N PRO 125.A O no hydrogen 3.014 N/A TRP 130.A N ALA 126.A O no hydrogen 2.939 N/A TRP 130.A NE1 ARG 137.A O no hydrogen 2.840 N/A ARG 131.A N HIS 127.A O no hydrogen 2.979 N/A ARG 131.A NH1 GLY 135.A O no hydrogen 2.834 N/A ARG 131.A NH2 GLY 116.A O no hydrogen 2.854 N/A ARG 131.A NH2 TYR 119.A O no hydrogen 2.902 N/A GLU 132.A N THR 128.A O no hydrogen 2.924 N/A SER 133.A N PHE 129.A O no hydrogen 2.896 N/A SER 133.A OG PHE 129.A O no hydrogen 2.951 N/A CYS 134.A N TRP 130.A O no hydrogen 2.714 N/A GLY 135.A N ARG 131.A O no hydrogen 3.035 N/A ARG 137.A N CYS 134.A O no hydrogen 3.351 N/A ARG 137.A NE CYS 134.A O no hydrogen 3.083 N/A ARG 137.A NH1 GLU 144.A OE1 no hydrogen 3.376 N/A ARG 137.A NH1 GLU 144.A OE2 no hydrogen 3.070 N/A ARG 137.A NH2 GLU 144.A OE2 no hydrogen 3.491 N/A CYS 138.A N GLY 58.A O no hydrogen 2.785 N/A CYS 138.A SG GLY 58.A O no hydrogen 3.609 N/A CYS 138.A SG TYR 114.A OH no hydrogen 3.297 N/A LEU 140.A N VAL 176.A O no hydrogen 3.023 N/A TRP 142.A N GLY 174.A O no hydrogen 2.987 N/A TRP 142.A NE1 GLU 146.A OE1 no hydrogen 2.791 N/A PHE 145.A N PRO 141.A O no hydrogen 3.000 N/A GLU 146.A N TRP 142.A O no hydrogen 2.782 N/A SER 147.A N ALA 143.A O no hydrogen 3.179 N/A LEU 148.A N GLU 144.A O no hydrogen 2.863 N/A LEU 149.A N PHE 145.A O no hydrogen 2.757 N/A GLY 150.A N GLU 146.A O no hydrogen 2.975 N/A THR 151.A N LEU 148.A O no hydrogen 3.058 N/A THR 151.A OG1 LEU 148.A O no hydrogen 2.837 N/A CYS 152.A N LEU 149.A O no hydrogen 3.065 N/A HIS 153.A N LEU 149.A O no hydrogen 2.782 N/A ALA 161.A N GLU 156.A O no hydrogen 3.063 N/A LEU 162.A N GLY 158.A O no hydrogen 2.930 N/A ALA 163.A N CYS 159.A O no hydrogen 2.911 N/A LEU 164.A N THR 160.A O no hydrogen 2.900 N/A ARG 165.A N ALA 161.A O no hydrogen 2.870 N/A THR 166.A N LEU 162.A O no hydrogen 2.939 N/A THR 166.A OG1 LEU 162.A O no hydrogen 3.050 N/A THR 167.A N ALA 163.A O no hydrogen 3.015 N/A THR 167.A OG1 ALA 163.A O no hydrogen 3.086 N/A ILE 168.A N LEU 164.A O no hydrogen 2.900 N/A ASP 169.A N ARG 165.A O no hydrogen 2.869 N/A LEU 170.A N ILE 168.A O no hydrogen 2.932 N/A THR 171.A N GLU 180.A OE2 no hydrogen 3.035 N/A THR 171.A OG1 SER 173.A OG no hydrogen 3.219 N/A THR 171.A OG1 GLU 180.A OE2 no hydrogen 3.321 N/A CYS 172.A N ASP 169.A O no hydrogen 3.022 N/A CYS 172.A SG ASP 169.A O no hydrogen 3.857 N/A SER 173.A N ASP 169.A OD1 no hydrogen 3.096 N/A SER 173.A OG THR 171.A OG1 no hydrogen 3.219 N/A GLY 174.A N ASP 169.A OD2 no hydrogen 2.750 N/A HIS 175.A N SER 173.A OG no hydrogen 3.139 N/A HIS 175.A ND1 SER 173.A O no hydrogen 3.115 N/A VAL 176.A N LEU 140.A O no hydrogen 2.735 N/A SER 177.A N GLU 180.A OE1 no hydrogen 2.862 N/A SER 177.A OG GLU 104.A OE2 no hydrogen 2.568 N/A SER 177.A OG GLU 180.A OE1 no hydrogen 3.568 N/A ILE 178.A N CYS 138.A O no hydrogen 2.719 N/A GLU 180.A N SER 177.A OG no hydrogen 3.091 N/A PHE 181.A N SER 177.A O no hydrogen 2.995 N/A ASP 182.A N ILE 178.A O no hydrogen 2.959 N/A VAL 183.A N PHE 179.A O no hydrogen 2.924 N/A PHE 184.A N GLU 180.A O no hydrogen 2.994 N/A THR 185.A N PHE 181.A O no hydrogen 2.936 N/A THR 185.A OG1 PHE 181.A O no hydrogen 2.807 N/A THR 185.A OG1 ASP 182.A O no hydrogen 3.191 N/A ARG 186.A N ASP 182.A O no hydrogen 2.971 N/A LEU 187.A N VAL 183.A O no hydrogen 2.923 N/A PHE 188.A N PHE 184.A O no hydrogen 2.923 N/A GLN 189.A NE2 ARG 186.A O no hydrogen 2.880 N/A THR 193.A N PRO 190.A O no hydrogen 3.208 N/A THR 193.A OG1 ASN 197.A OD1 no hydrogen 2.814 N/A LEU 194.A N TRP 191.A O no hydrogen 2.968 N/A ASN 197.A N THR 193.A O no hydrogen 2.873 N/A ASN 197.A ND2 PHE 188.A O no hydrogen 2.912 N/A ASN 197.A ND2 PRO 190.A O no hydrogen 2.977 N/A TRP 198.A N LEU 194.A O no hydrogen 3.055 N/A TRP 198.A NE1 THR 167.A OG1 no hydrogen 3.108 N/A GLN 199.A N LEU 195.A O no hydrogen 2.833 N/A LEU 200.A N LYS 196.A O no hydrogen 2.935 N/A LEU 201.A N ASN 197.A O no hydrogen 2.894 N/A ALA 202.A N TRP 198.A O no hydrogen 2.815 N/A VAL 203.A N GLN 199.A O no hydrogen 3.279 N/A ASN 204.A N GLN 199.A O no hydrogen 2.973 N/A GLY 207.A N HIS 205.A ND1 no hydrogen 2.920 N/A TYR 208.A N HIS 205.A O no hydrogen 3.283 N/A MET 209.A N PHE 233.A O no hydrogen 2.945 N/A THR 213.A N GLU 216.A OE1 no hydrogen 2.917 N/A THR 213.A OG1 GLU 216.A OE1 no hydrogen 3.368 N/A GLU 216.A N THR 213.A OG1 no hydrogen 3.165 N/A VAL 217.A N THR 213.A O no hydrogen 2.940 N/A GLN 218.A N TYR 214.A O no hydrogen 2.996 N/A GLU 219.A N ASP 215.A O no hydrogen 3.154 N/A ARG 220.A N GLU 216.A O no hydrogen 3.034 N/A ARG 220.A NE ASP 281.A OD1 no hydrogen 3.335 N/A ARG 220.A NH2 ASP 281.A OD2 no hydrogen 2.899 N/A LEU 221.A N VAL 217.A O no hydrogen 2.804 N/A GLN 222.A N GLN 218.A O no hydrogen 2.901 N/A CYS 224.A N LEU 221.A O no hydrogen 2.813 N/A ARG 225.A N GLN 222.A O no hydrogen 2.952 N/A LYS 227.A N CYS 224.A O no hydrogen 2.802 N/A GLY 229.A N VAL 248.A O no hydrogen 2.902 N/A SER 230.A N LYS 227.A O no hydrogen 3.105 N/A SER 230.A OG LYS 227.A O no hydrogen 2.734 N/A TYR 231.A N TYR 279.A O no hydrogen 3.123 N/A TYR 231.A OH ASN 286.A OD1 no hydrogen 2.678 N/A ILE 232.A N GLY 246.A O no hydrogen 2.935 N/A PHE 233.A N GLY 207.A O no hydrogen 2.825 N/A ARG 234.A N ALA 244.A O no hydrogen 3.013 N/A SER 236.A N GLN 242.A O no hydrogen 2.827 N/A THR 238.A N SER 236.A OG no hydrogen 3.174 N/A THR 238.A OG1 SER 236.A OG no hydrogen 3.236 N/A ARG 239.A N SER 236.A OG no hydrogen 2.875 N/A GLN 242.A N ARG 239.A O no hydrogen 3.156 N/A TRP 243.A NE1 LEU 187.A O no hydrogen 2.939 N/A ALA 244.A N ARG 234.A O no hydrogen 2.911 N/A ILE 245.A N THR 257.A O no hydrogen 2.883 N/A GLY 246.A N ILE 232.A O no hydrogen 2.866 N/A TYR 247.A N LEU 255.A O no hydrogen 2.899 N/A VAL 248.A N SER 230.A O no hydrogen 2.781 N/A SER 249.A N SER 253.A O no hydrogen 2.690 N/A SER 249.A OG ASP 251.A OD1 no hydrogen 2.634 N/A SER 249.A OG SER 253.A O no hydrogen 3.175 N/A SER 249.A OG SER 253.A OG no hydrogen 2.744 N/A GLY 252.A N SER 249.A O no hydrogen 2.734 N/A SER 253.A N ASP 251.A OD1 no hydrogen 3.215 N/A SER 253.A OG SER 249.A OG no hydrogen 2.744 N/A SER 253.A OG ASP 251.A OD1 no hydrogen 2.664 N/A LEU 255.A N TYR 247.A O no hydrogen 2.929 N/A THR 257.A N ILE 245.A O no hydrogen 2.842 N/A THR 257.A OG1 TYR 277.A OH no hydrogen 2.704 N/A LYS 262.A NZ GLU 270.A OE1 no hydrogen 2.667 N/A LYS 262.A NZ GLU 270.A OE2 no hydrogen 3.133 N/A GLN 266.A NE2 GLU 270.A OE2 no hydrogen 3.058 N/A VAL 267.A N PRO 263.A O no hydrogen 3.125 N/A LEU 268.A N LEU 264.A O no hydrogen 2.933 N/A LEU 269.A N SER 265.A O no hydrogen 2.843 N/A GLU 270.A N GLN 266.A O no hydrogen 2.758 N/A GLY 271.A N VAL 267.A O no hydrogen 2.960 N/A GLN 272.A N LEU 268.A O no hydrogen 2.767 N/A LYS 273.A N LEU 269.A O no hydrogen 3.128 N/A ASP 274.A N GLU 270.A O no hydrogen 3.048 N/A GLY 275.A N GLN 272.A O no hydrogen 2.820 N/A PHE 276.A N GLY 271.A O no hydrogen 2.662 N/A TYR 277.A N GLY 271.A O no hydrogen 3.095 N/A TYR 277.A OH THR 257.A OG1 no hydrogen 2.704 N/A LEU 278.A N GLY 229.A O no hydrogen 2.782 N/A TYR 279.A N GLY 229.A O no hydrogen 2.974 N/A ASP 281.A N TYR 231.A O no hydrogen 2.775 N/A GLY 282.A N TYR 279.A O no hydrogen 2.950 N/A LYS 283.A N PRO 280.A O no hydrogen 2.862 N/A ASN 286.A ND2 TYR 277.A O no hydrogen 3.387 N/A THR 290.A N ASP 288.A OD1 no hydrogen 3.391 N/A THR 290.A OG1 ASP 288.A OD1 no hydrogen 3.184 N/A THR 290.A OG1 ASP 288.A OD2 no hydrogen 3.350 N/A