Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3v1n_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): THR 2.A N SER 5.A OG no hydrogen 3.310 N/A THR 2.A OG1 SER 5.A OG no hydrogen 3.221 N/A SER 5.A N THR 2.A OG1 no hydrogen 3.052 N/A SER 5.A OG THR 2.A O no hydrogen 3.281 N/A SER 5.A OG THR 2.A OG1 no hydrogen 3.221 N/A THR 6.A N THR 2.A O no hydrogen 3.198 N/A THR 6.A OG1 THR 2.A O no hydrogen 2.823 N/A THR 6.A OG1 GLU 3.A O no hydrogen 3.143 N/A SER 7.A OG HIS 23.A NE2 no hydrogen 2.635 N/A LYS 8.A N TYR 24.A O no hydrogen 2.750 N/A LYS 8.A NZ GLU 26.A OE1 no hydrogen 2.867 N/A VAL 10.A N ILE 22.A O no hydrogen 2.863 N/A ILE 12.A N PHE 20.A O no hydrogen 2.695 N/A ASN 13.A ND2 ASP 19.A OD1 no hydrogen 3.394 N/A GLU 14.A N PHE 17.A O no hydrogen 3.233 N/A PHE 17.A N GLU 14.A O no hydrogen 2.834 N/A ASP 19.A N ASN 13.A OD1 no hydrogen 2.818 N/A PHE 20.A N ILE 12.A O no hydrogen 3.034 N/A ASN 21.A N ASP 75.A OD2 no hydrogen 2.858 N/A ILE 22.A N VAL 10.A O no hydrogen 2.832 N/A HIS 23.A N SER 74.A OG no hydrogen 3.007 N/A HIS 23.A ND1 ASP 67.A OD2 no hydrogen 2.763 N/A HIS 23.A NE2 SER 7.A OG no hydrogen 2.635 N/A TYR 24.A N LYS 8.A O no hydrogen 2.943 N/A ASN 25.A N LEU 65.A O no hydrogen 2.912 N/A ASN 25.A ND2 GLU 3.A OE2 no hydrogen 3.168 N/A ASN 25.A ND2 THR 6.A OG1 no hydrogen 2.964 N/A GLU 26.A N THR 6.A O no hydrogen 2.923 N/A ALA 27.A N VAL 63.A O no hydrogen 3.045 N/A VAL 33.A N ARG 62.A O no hydrogen 2.812 N/A ILE 34.A N HIS 104.A O no hydrogen 2.873 N/A MET 35.A N ILE 64.A O no hydrogen 2.850 N/A LEU 36.A N VAL 106.A O no hydrogen 2.765 N/A HIS 37.A ND1 GLY 38.A O no hydrogen 2.730 N/A ALA 43.A N GLY 40.A O no hydrogen 3.002 N/A GLY 45.A N ASP 67.A OD1 no hydrogen 2.871 N/A SER 47.A OG GLY 44.A O no hydrogen 3.356 N/A ASN 48.A N GLY 44.A O no hydrogen 3.164 N/A ASN 48.A ND2 ASN 108.A OD1 no hydrogen 3.304 N/A TYR 49.A N GLY 45.A O no hydrogen 3.110 N/A TYR 49.A N TRP 46.A O no hydrogen 3.315 N/A TYR 49.A OH LEU 36.A O no hydrogen 2.652 N/A ARG 51.A NH1 TRP 266.A O no hydrogen 2.880 N/A ASN 52.A N TYR 49.A O no hydrogen 2.924 N/A ASN 52.A ND2 GLN 265.A O no hydrogen 2.992 N/A ASN 52.A ND2 ASN 273.A OD1 no hydrogen 2.874 N/A VAL 53.A N TYR 49.A O no hydrogen 3.056 N/A PHE 56.A N ASN 52.A O no hydrogen 3.124 N/A VAL 57.A N VAL 53.A O no hydrogen 3.031 N/A ASP 58.A N GLY 54.A O no hydrogen 2.865 N/A ALA 59.A N PRO 55.A O no hydrogen 3.006 N/A GLY 60.A N VAL 57.A O no hydrogen 2.922 N/A TYR 61.A N PHE 56.A O no hydrogen 3.120 N/A ARG 62.A N GLU 31.A O no hydrogen 2.917 N/A ARG 62.A NE GLU 26.A OE2 no hydrogen 3.306 N/A ARG 62.A NH1 THR 32.A OG1 no hydrogen 3.268 N/A VAL 63.A N ALA 27.A O no hydrogen 2.795 N/A ILE 64.A N VAL 33.A O no hydrogen 2.900 N/A LEU 65.A N ASN 25.A O no hydrogen 2.783 N/A LYS 66.A N MET 35.A O no hydrogen 3.124 N/A LYS 66.A NZ ASP 67.A O no hydrogen 3.206 N/A ASP 67.A N HIS 23.A O no hydrogen 2.942 N/A SER 68.A N HIS 37.A NE2 no hydrogen 2.979 N/A GLY 70.A N ASP 75.A O no hydrogen 2.869 N/A PHE 71.A N SER 68.A O no hydrogen 3.053 N/A ASN 72.A ND2 ASP 67.A OD2 no hydrogen 2.806 N/A LYS 73.A N ASP 67.A OD2 no hydrogen 3.251 N/A LYS 73.A NZ GLU 3.A OE1 no hydrogen 3.395 N/A LYS 73.A NZ GLU 3.A OE2 no hydrogen 2.741 N/A SER 74.A N PHE 71.A O no hydrogen 3.098 N/A SER 74.A OG ASP 67.A O no hydrogen 2.821 N/A ASP 75.A N ASN 21.A O no hydrogen 2.888 N/A MET 79.A N SER 204.A OG no hydrogen 2.807 N/A GLN 82.A NE2 ASN 117.A OD1 no hydrogen 2.939 N/A ARG 83.A NH2 PRO 69.A O no hydrogen 3.318 N/A LEU 85.A N GLN 82.A OE1 no hydrogen 3.070 N/A VAL 86.A N GLN 82.A O no hydrogen 3.432 N/A ASN 87.A N ARG 83.A O no hydrogen 2.855 N/A ASN 87.A ND2 THR 114.A OG1 no hydrogen 3.128 N/A ALA 88.A N GLY 84.A O no hydrogen 2.995 N/A ARG 89.A N LEU 85.A O no hydrogen 2.995 N/A ARG 89.A NH1 GLU 81.A OE2 no hydrogen 2.838 N/A ALA 90.A N VAL 86.A O no hydrogen 3.062 N/A VAL 91.A N ASN 87.A O no hydrogen 2.980 N/A LYS 92.A N ALA 88.A O no hydrogen 3.014 N/A LYS 92.A NZ GLU 14.A OE1 no hydrogen 2.950 N/A LYS 92.A NZ ASP 96.A OD2 no hydrogen 2.831 N/A GLY 93.A N ARG 89.A O no hydrogen 2.869 N/A LEU 94.A N ALA 90.A O no hydrogen 2.925 N/A MET 95.A N VAL 91.A O no hydrogen 2.896 N/A ASP 96.A N LYS 92.A O no hydrogen 2.893 N/A ALA 97.A N GLY 93.A O no hydrogen 3.020 N/A LEU 98.A N LEU 94.A O no hydrogen 3.058 N/A ASP 99.A N ASP 96.A O no hydrogen 3.257 N/A ILE 100.A N MET 95.A O no hydrogen 2.979 N/A ARG 102.A NH1 ILE 126.A O no hydrogen 2.821 N/A ALA 103.A N ARG 125.A O no hydrogen 3.087 N/A HIS 104.A N THR 32.A O no hydrogen 3.105 N/A HIS 104.A NE2 GLU 31.A OE1 no hydrogen 3.019 N/A LEU 105.A N LYS 128.A O no hydrogen 3.038 N/A VAL 106.A N ILE 34.A O no hydrogen 2.961 N/A GLY 107.A N ILE 130.A O no hydrogen 2.914 N/A ASN 108.A N LEU 36.A O no hydrogen 3.172 N/A ASN 108.A ND2 MET 132.A O no hydrogen 3.023 N/A ASN 108.A ND2 GLN 262.A O no hydrogen 3.358 N/A ASN 108.A ND2 GLN 262.A OE1 no hydrogen 3.098 N/A SER 109.A N MET 132.A O no hydrogen 3.051 N/A GLY 111.A N ASN 108.A O no hydrogen 2.812 N/A ALA 113.A N SER 109.A O no hydrogen 2.995 N/A THR 114.A N MET 110.A O no hydrogen 2.880 N/A THR 114.A OG1 MET 110.A O no hydrogen 2.984 N/A ALA 115.A N GLY 111.A O no hydrogen 2.959 N/A LEU 116.A N GLY 112.A O no hydrogen 2.948 N/A ASN 117.A N ALA 113.A O no hydrogen 2.989 N/A ASN 117.A ND2 ALA 113.A O no hydrogen 2.847 N/A PHE 118.A N THR 114.A O no hydrogen 2.897 N/A ALA 119.A N ALA 115.A O no hydrogen 2.944 N/A LEU 120.A N LEU 116.A O no hydrogen 3.045 N/A GLU 121.A N ASN 117.A O no hydrogen 2.839 N/A TYR 122.A N PHE 118.A O no hydrogen 2.752 N/A ARG 125.A N TYR 122.A O no hydrogen 2.984 N/A ARG 125.A NE ASP 101.A O no hydrogen 2.752 N/A ARG 125.A NH1 ASP 96.A OD1 no hydrogen 2.918 N/A ARG 125.A NH2 ASP 96.A OD1 no hydrogen 3.002 N/A ARG 125.A NH2 ILE 100.A O no hydrogen 2.805 N/A GLY 127.A N ALA 103.A O no hydrogen 2.894 N/A LYS 128.A N HIS 104.A ND1 no hydrogen 2.948 N/A LYS 128.A NZ PHE 279.A O no hydrogen 2.867 N/A LYS 128.A NZ LEU 280.A O no hydrogen 2.832 N/A LYS 128.A NZ ALA 283.A O no hydrogen 2.909 N/A LEU 129.A N LYS 225.A O no hydrogen 3.042 N/A ILE 130.A N LEU 105.A O no hydrogen 2.781 N/A LEU 131.A N PHE 227.A O.A no hydrogen 2.886 N/A LEU 131.A N PHE 227.A O.B no hydrogen 2.798 N/A MET 132.A N GLY 107.A O no hydrogen 2.857 N/A GLY 133.A N THR 229.A O no hydrogen 3.071 N/A GLY 135.A N SER 109.A O no hydrogen 3.003 N/A SER 140.A OG ASP 240.A OD1 no hydrogen 2.573 N/A SER 140.A OG ASP 240.A OD2 no hydrogen 3.416 N/A MET 141.A N ASP 240.A OD2 no hydrogen 2.891 N/A PHE 142.A N SER 140.A OG no hydrogen 3.061 N/A ALA 143.A N SER 140.A OG no hydrogen 2.863 N/A GLY 149.A N ARG 235.A O no hydrogen 2.816 N/A ILE 150.A N MET 147.A O.A no hydrogen 2.896 N/A LYS 151.A N MET 147.A O.A no hydrogen 3.010 N/A LYS 151.A N MET 147.A O.B no hydrogen 2.967 N/A LEU 152.A N GLU 148.A O no hydrogen 3.320 N/A LEU 153.A N GLY 149.A O no hydrogen 2.909 N/A PHE 154.A N ILE 150.A O no hydrogen 2.947 N/A LYS 155.A N LYS 151.A O no hydrogen 2.920 N/A LEU 156.A N LEU 152.A O no hydrogen 2.942 N/A TYR 157.A N LEU 153.A O no hydrogen 3.118 N/A TYR 157.A OH GLY 39.A O no hydrogen 2.647 N/A ALA 158.A N PHE 154.A O no hydrogen 3.108 N/A GLU 159.A N LYS 155.A O no hydrogen 2.830 N/A SER 161.A OG THR 164.A OG1 no hydrogen 2.956 N/A THR 164.A N SER 161.A OG no hydrogen 3.058 N/A THR 164.A OG1 SER 161.A OG no hydrogen 2.956 N/A LEU 165.A N SER 161.A O no hydrogen 2.917 N/A LYS 166.A N TYR 162.A O no hydrogen 3.036 N/A GLN 167.A N GLU 163.A O no hydrogen 3.023 N/A MET 168.A N THR 164.A O no hydrogen 2.874 N/A LEU 169.A N LEU 165.A O no hydrogen 2.904 N/A GLN 170.A N LYS 166.A O no hydrogen 2.922 N/A VAL 171.A N GLN 167.A O no hydrogen 3.221 N/A VAL 171.A N MET 168.A O no hydrogen 3.108 N/A PHE 172.A N MET 168.A O no hydrogen 2.947 N/A LEU 173.A N LEU 169.A O no hydrogen 3.141 N/A TYR 174.A N GLU 267.A OE1 no hydrogen 2.901 N/A ASP 175.A N GLU 267.A OE2 no hydrogen 2.868 N/A SER 177.A N ASP 175.A OD1 no hydrogen 3.046 N/A SER 177.A OG ASP 175.A OD1 no hydrogen 2.716 N/A SER 177.A OG ASP 175.A OD2 no hydrogen 3.364 N/A LEU 178.A N ASP 175.A O no hydrogen 3.270 N/A ILE 179.A N GLN 176.A O no hydrogen 3.189 N/A THR 180.A N LEU 178.A O no hydrogen 3.032 N/A LEU 183.A N THR 180.A OG1 no hydrogen 3.333 N/A LEU 184.A N THR 180.A O no hydrogen 3.080 N/A GLN 185.A N GLU 181.A O no hydrogen 2.784 N/A GLY 186.A N GLU 182.A O no hydrogen 2.887 N/A ARG 187.A N LEU 183.A O no hydrogen 3.033 N/A ARG 187.A NE PRO 41.A O no hydrogen 2.893 N/A ARG 187.A NH2 PRO 41.A O no hydrogen 3.035 N/A TRP 188.A N LEU 184.A O no hydrogen 3.060 N/A GLU 189.A N GLN 185.A O no hydrogen 2.865 N/A ALA 190.A N GLY 186.A O no hydrogen 3.188 N/A ILE 191.A N ARG 187.A O no hydrogen 3.060 N/A GLN 192.A N TRP 188.A O no hydrogen 2.821 N/A ARG 193.A N GLU 189.A O no hydrogen 2.826 N/A ARG 193.A NH2 ASN 72.A OD1 no hydrogen 2.695 N/A GLN 194.A N ILE 191.A O no hydrogen 3.340 N/A GLN 194.A NE2 GLU 196.A OE2 no hydrogen 2.614 N/A HIS 197.A N GLN 194.A O no hydrogen 3.096 N/A HIS 197.A NE2 ASN 72.A O no hydrogen 2.852 N/A LEU 198.A N PRO 195.A O no hydrogen 3.047 N/A ASN 200.A N GLU 196.A O no hydrogen 3.069 N/A PHE 201.A N HIS 197.A O no hydrogen 2.974 N/A LEU 202.A N LEU 198.A O no hydrogen 3.255 N/A ILE 203.A N LYS 199.A O no hydrogen 3.024 N/A SER 204.A N ASN 200.A O no hydrogen 2.920 N/A SER 204.A OG MET 79.A O no hydrogen 3.530 N/A SER 204.A OG ASN 200.A O no hydrogen 2.790 N/A ALA 205.A N PHE 201.A O no hydrogen 2.946 N/A GLN 206.A N LEU 202.A O no hydrogen 3.191 N/A LYS 207.A N ILE 203.A O no hydrogen 3.167 N/A ALA 208.A N SER 204.A O no hydrogen 2.902 N/A THR 212.A N PRO 209.A O no hydrogen 2.825 N/A THR 212.A OG1 PRO 209.A O no hydrogen 2.559 N/A TRP 213.A N LEU 210.A O no hydrogen 2.910 N/A ASP 214.A N SER 211.A O no hydrogen 3.189 N/A THR 216.A N ASP 214.A OD1 no hydrogen 2.963 N/A THR 216.A OG1 LEU 137.A O no hydrogen 3.555 N/A THR 216.A OG1 ASP 214.A OD1 no hydrogen 2.540 N/A ARG 218.A N VAL 215.A O no hydrogen 2.867 N/A ARG 218.A NE GLU 221.A OE2 no hydrogen 3.002 N/A ARG 218.A NH1 GLU 121.A OE2 no hydrogen 2.954 N/A ARG 218.A NH2 GLU 221.A OE1 no hydrogen 3.077 N/A LEU 219.A N THR 216.A O no hydrogen 3.150 N/A GLU 221.A N ARG 218.A O no hydrogen 2.944 N/A ILE 222.A N LEU 219.A O no hydrogen 3.143 N/A LYS 225.A NZ ALA 283.A O no hydrogen 3.098 N/A LYS 225.A NZ ALA 283.A OXT no hydrogen 2.665 N/A THR 226.A N ASP 251.A O no hydrogen 2.866 N/A THR 226.A OG1 ALA 224.A O no hydrogen 3.010 N/A PHE 227.A N.A LEU 129.A O no hydrogen 2.854 N/A PHE 227.A N.B LEU 129.A O no hydrogen 2.854 N/A ILE 228.A N ARG 253.A O no hydrogen 2.861 N/A THR 229.A N LEU 131.A O no hydrogen 2.764 N/A TRP 230.A N HIS 255.A O no hydrogen 2.983 N/A TRP 230.A NE1 VAL 237.A O no hydrogen 3.029 N/A ARG 232.A N PHE 257.A O no hydrogen 2.858 N/A ARG 232.A NE ASP 233.A OD1 no hydrogen 3.263 N/A ARG 232.A NE ASP 233.A OD2 no hydrogen 2.925 N/A ARG 232.A NH2 ASP 233.A OD1 no hydrogen 3.385 N/A ARG 232.A NH2 ASP 233.A OD2 no hydrogen 2.958 N/A ASP 233.A N CYS 260.A O no hydrogen 2.842 N/A ASP 234.A N GLY 231.A O no hydrogen 3.238 N/A ARG 235.A NH1 GLU 148.A OE1 no hydrogen 2.813 N/A PHE 236.A N ASP 234.A OD1 no hydrogen 2.796 N/A VAL 237.A N ASP 234.A OD1 no hydrogen 2.992 N/A HIS 241.A N PRO 238.A O no hydrogen 2.960 N/A HIS 241.A NE2 PRO 139.A O no hydrogen 2.849 N/A GLY 242.A N LEU 239.A O no hydrogen 2.937 N/A LYS 244.A N ASP 240.A O no hydrogen 2.974 N/A LYS 244.A NZ LEU 137.A O no hydrogen 2.569 N/A LYS 244.A NZ THR 216.A OG1 no hydrogen 2.939 N/A LEU 245.A N HIS 241.A O no hydrogen 3.031 N/A LEU 246.A N GLY 242.A O no hydrogen 3.070 N/A TRP 247.A N LEU 243.A O no hydrogen 2.884 N/A ASN 248.A N LYS 244.A O no hydrogen 3.194 N/A ASN 248.A N LEU 245.A O no hydrogen 3.259 N/A ASN 248.A ND2 LYS 244.A O no hydrogen 2.871 N/A ILE 249.A N LEU 245.A O no hydrogen 2.954 N/A ARG 253.A N THR 226.A O no hydrogen 3.165 N/A ARG 253.A NH1 THR 226.A O no hydrogen 2.949 N/A ARG 253.A NH1 ASP 251.A O no hydrogen 3.313 N/A ARG 253.A NH1 ASP 251.A OD1 no hydrogen 2.973 N/A ARG 253.A NH2 ASP 251.A OD1 no hydrogen 3.233 N/A HIS 255.A N ILE 228.A O no hydrogen 2.902 N/A HIS 255.A NE2 GLU 271.A OE1 no hydrogen 3.036 N/A PHE 257.A N TRP 230.A O no hydrogen 2.930 N/A LYS 259.A NZ TYR 174.A OH no hydrogen 3.511 N/A CYS 260.A N ASP 233.A OD1 no hydrogen 2.773 N/A CYS 260.A SG GLY 261.A O no hydrogen 3.580 N/A GLY 261.A N GLU 267.A OE1 no hydrogen 2.967 N/A GLN 262.A N PHE 172.A O no hydrogen 3.283 N/A GLN 262.A NE2 GLY 133.A O no hydrogen 3.504 N/A GLN 262.A NE2 ASP 234.A OD2 no hydrogen 2.802 N/A GLN 265.A N GLN 265.A OE1 no hydrogen 2.748 N/A GLN 265.A NE2 ASN 48.A O no hydrogen 3.023 N/A GLN 265.A NE2 ASN 108.A OD1 no hydrogen 3.657 N/A TRP 266.A N TRP 263.A O no hydrogen 2.999 N/A TRP 266.A NE1 SER 47.A O no hydrogen 2.918 N/A GLU 267.A N TRP 263.A O no hydrogen 2.886 N/A HIS 268.A N ALA 264.A O no hydrogen 2.820 N/A HIS 268.A NE2 LYS 259.A O no hydrogen 2.899 N/A PHE 272.A N HIS 268.A O no hydrogen 2.850 N/A ASN 273.A N ALA 269.A O no hydrogen 2.828 N/A ASN 273.A ND2 ARG 51.A O no hydrogen 3.132 N/A ARG 274.A N ASP 270.A O no hydrogen 2.987 N/A LEU 275.A N GLU 271.A O no hydrogen 2.918 N/A VAL 276.A N PHE 272.A O no hydrogen 2.963 N/A ILE 277.A N ASN 273.A O no hydrogen 2.967 N/A ASP 278.A N ARG 274.A O no hydrogen 2.944 N/A PHE 279.A N LEU 275.A O no hydrogen 3.008 N/A LEU 280.A N VAL 276.A O no hydrogen 2.905 N/A ARG 281.A N ILE 277.A O no hydrogen 2.936 N/A ARG 281.A NH2 ALA 59.A O no hydrogen 3.334 N/A HIS 282.A N ASP 278.A O no hydrogen 2.872 N/A HIS 282.A ND1 ASP 278.A OD1 no hydrogen 2.747 N/A ALA 283.A N PHE 279.A O no hydrogen 3.063 N/A