Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3gni_B.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): HIS 4.A N HIS 2.A ND1 no hydrogen 3.082 N/A HIS 6.A N HIS 6.A ND1 no hydrogen 3.013 N/A ASN 10.A N HIS 6.A O no hydrogen 2.700 N/A LEU 11.A N HIS 7.A O no hydrogen 3.129 N/A PHE 17.A N ARG 89.A O no hydrogen 3.312 N/A LEU 18.A N TYR 45.A OH no hydrogen 2.789 N/A CYS 23.A N GLU 20.A O no hydrogen 3.118 N/A TYR 24.A N GLY 21.A O no hydrogen 3.059 N/A TYR 24.A OH LEU 18.A O no hydrogen 2.768 N/A GLU 25.A N ARG 44.A O no hydrogen 3.002 N/A LEU 27.A N LEU 42.A O no hydrogen 2.789 N/A ILE 30.A N VAL 40.A O no hydrogen 2.755 N/A GLY 31.A N VAL 40.A O no hydrogen 3.212 N/A LYS 32.A NZ THR 39.A OG1 no hydrogen 3.213 N/A GLY 33.A N MET 38.A O no hydrogen 2.984 N/A LEU 37.A N PHE 34.A O no hydrogen 2.898 N/A MET 38.A N GLY 33.A O no hydrogen 2.953 N/A THR 39.A N ARG 56.A O no hydrogen 2.891 N/A VAL 40.A N GLY 31.A O no hydrogen 2.989 N/A ASN 41.A N VAL 54.A O no hydrogen 2.767 N/A ASN 41.A ND2 LEU 27.A O no hydrogen 3.539 N/A ASN 41.A ND2 THR 28.A O no hydrogen 3.407 N/A LEU 42.A N THR 28.A O no hydrogen 2.843 N/A ALA 43.A N VAL 52.A O no hydrogen 2.842 N/A ARG 44.A N GLU 25.A O no hydrogen 2.962 N/A ARG 44.A NE GLU 25.A OE1 no hydrogen 3.005 N/A ARG 44.A NH1 LYS 46.A O no hydrogen 3.449 N/A TYR 45.A N GLU 50.A O no hydrogen 2.846 N/A LYS 46.A N CYS 23.A O no hydrogen 2.648 N/A LYS 46.A NZ GLY 22.A O no hydrogen 2.940 N/A LYS 46.A NZ TYR 24.A O no hydrogen 3.260 N/A THR 48.A N TYR 45.A O no hydrogen 3.056 N/A GLY 49.A N TYR 45.A O no hydrogen 2.701 N/A VAL 52.A N ALA 43.A O no hydrogen 2.904 N/A THR 53.A N THR 102.A O no hydrogen 2.889 N/A VAL 54.A N ASN 41.A O no hydrogen 2.830 N/A ARG 55.A N VAL 100.A O no hydrogen 2.674 N/A ARG 56.A N THR 39.A O no hydrogen 2.808 N/A ARG 56.A NE ASN 41.A OD1 no hydrogen 2.755 N/A ARG 56.A NH1 GLU 97.A OE1 no hydrogen 3.078 N/A ARG 56.A NH2 ASN 41.A OD1 no hydrogen 3.126 N/A ILE 57.A N LEU 98.A O no hydrogen 3.163 N/A LEU 59.A N ASN 96.A O no hydrogen 2.847 N/A GLU 60.A N ASN 58.A OD1 no hydrogen 2.888 N/A ALA 61.A N ASN 58.A O no hydrogen 3.189 N/A CYS 62.A N LEU 59.A O no hydrogen 3.077 N/A CYS 62.A SG ASN 58.A O no hydrogen 3.612 N/A MET 66.A N SER 63.A OG no hydrogen 3.343 N/A VAL 67.A N SER 63.A O no hydrogen 3.098 N/A THR 68.A N ASN 64.A O no hydrogen 3.052 N/A THR 68.A OG1 ASN 64.A O no hydrogen 3.246 N/A PHE 69.A N GLU 65.A O no hydrogen 2.952 N/A LEU 70.A N MET 66.A O no hydrogen 3.098 N/A GLN 71.A N VAL 67.A O no hydrogen 2.980 N/A GLY 72.A N THR 68.A O no hydrogen 3.083 N/A HIS 75.A N GLN 71.A O no hydrogen 3.185 N/A VAL 76.A N GLY 72.A O no hydrogen 2.993 N/A SER 77.A N GLU 73.A O no hydrogen 3.074 N/A SER 77.A OG GLU 73.A O no hydrogen 3.146 N/A SER 77.A OG LEU 74.A O no hydrogen 3.095 N/A LEU 79.A N VAL 76.A O no hydrogen 3.237 N/A ASN 81.A N TYR 140.A OH no hydrogen 3.057 N/A ASN 84.A N HIS 82.A ND1 no hydrogen 3.057 N/A ASN 84.A ND2 VAL 164.A O no hydrogen 2.711 N/A ILE 85.A N HIS 82.A O no hydrogen 3.040 N/A VAL 86.A N LEU 166.A O no hydrogen 3.272 N/A TYR 88.A OH GLU 73.A OE2 no hydrogen 2.515 N/A ARG 89.A N VAL 101.A O no hydrogen 2.779 N/A PHE 92.A N TRP 99.A O no hydrogen 2.982 N/A ALA 94.A N GLU 97.A O no hydrogen 2.920 N/A ASN 96.A N ASP 95.A OD1 no hydrogen 3.262 N/A ASN 96.A ND2 ASP 95.A O no hydrogen 3.361 N/A GLU 97.A N ALA 94.A O no hydrogen 3.003 N/A LEU 98.A N ILE 57.A O no hydrogen 2.934 N/A TRP 99.A N PHE 92.A O no hydrogen 2.759 N/A TRP 99.A NE1 GLU 97.A OE1 no hydrogen 2.935 N/A VAL 100.A N ARG 55.A O no hydrogen 2.927 N/A VAL 101.A N ALA 90.A O no hydrogen 2.897 N/A THR 102.A N THR 53.A O no hydrogen 2.924 N/A TYR 107.A N ILE 158.A O no hydrogen 2.964 N/A GLY 108.A N MET 105.A O no hydrogen 2.837 N/A SER 109.A N ASP 112.A OD2 no hydrogen 2.748 N/A ALA 110.A N ILE 156.A O no hydrogen 2.945 N/A LYS 111.A NZ GLU 226.A OE1 no hydrogen 3.031 N/A ASP 112.A N SER 109.A OG no hydrogen 3.154 N/A LEU 113.A N SER 109.A O no hydrogen 3.021 N/A ILE 114.A N ALA 110.A O no hydrogen 3.069 N/A CYS 115.A N LYS 111.A O no hydrogen 2.924 N/A CYS 115.A SG LYS 111.A O no hydrogen 3.378 N/A THR 116.A N ASP 112.A O no hydrogen 2.892 N/A HIS 117.A N LEU 113.A O no hydrogen 3.183 N/A PHE 118.A N LEU 113.A O no hydrogen 3.141 N/A GLY 121.A N PHE 118.A O no hydrogen 2.814 N/A MET 122.A N LEU 227.A O no hydrogen 2.808 N/A ILE 127.A N ASN 123.A O no hydrogen 3.317 N/A ALA 128.A N GLU 124.A O no hydrogen 3.088 N/A TYR 129.A N LEU 125.A O no hydrogen 3.160 N/A ILE 130.A N ALA 126.A O no hydrogen 2.922 N/A LEU 131.A N ILE 127.A O no hydrogen 2.814 N/A GLN 132.A N ALA 128.A O no hydrogen 3.024 N/A GLY 133.A N TYR 129.A O no hydrogen 3.459 N/A VAL 134.A N ILE 130.A O no hydrogen 3.285 N/A LEU 135.A N LEU 131.A O no hydrogen 3.017 N/A LYS 136.A N GLN 132.A O no hydrogen 2.943 N/A ALA 137.A N GLY 133.A O no hydrogen 3.178 N/A LEU 138.A N VAL 134.A O no hydrogen 2.958 N/A ASP 139.A N LEU 135.A O no hydrogen 2.928 N/A TYR 140.A N LYS 136.A O no hydrogen 3.255 N/A ILE 141.A N ALA 137.A O no hydrogen 2.894 N/A HIS 142.A N LEU 138.A O no hydrogen 2.768 N/A HIS 142.A NE2 ASP 216.A OD2 no hydrogen 2.648 N/A HIS 143.A N ASP 139.A O no hydrogen 2.882 N/A HIS 143.A ND1 ASP 139.A O no hydrogen 2.959 N/A MET 144.A N TYR 140.A O no hydrogen 3.075 N/A GLY 145.A N HIS 142.A O no hydrogen 3.073 N/A TYR 146.A N ILE 141.A O no hydrogen 3.102 N/A VAL 147.A N LEU 173.A O no hydrogen 2.907 N/A HIS 148.A N ASP 216.A OD2 no hydrogen 2.862 N/A HIS 148.A NE2 SER 167.A O no hydrogen 2.718 N/A ARG 149.A N ASP 216.A OD1 no hydrogen 2.905 N/A ARG 149.A NE SER 171.A O no hydrogen 2.785 N/A ARG 149.A NH1 ASP 187.A OD1 no hydrogen 2.710 N/A ARG 149.A NH1 TYR 211.A OH no hydrogen 2.919 N/A ARG 149.A NH2 SER 171.A O no hydrogen 3.261 N/A ARG 149.A NH2 ASP 187.A OD1 no hydrogen 3.435 N/A SER 150.A N HIS 148.A ND1 no hydrogen 3.005 N/A SER 150.A OG HIS 155.A ND1 no hydrogen 3.113 N/A SER 150.A OG SER 171.A OG no hydrogen 2.731 N/A ALA 153.A N GLU 226.A OE2 no hydrogen 2.930 N/A HIS 155.A N LYS 152.A O no hydrogen 2.975 N/A HIS 155.A ND1 SER 150.A O no hydrogen 2.646 N/A ILE 156.A N ALA 153.A O no hydrogen 3.284 N/A LEU 157.A N TYR 165.A O no hydrogen 2.860 N/A ILE 158.A N GLY 108.A O no hydrogen 2.946 N/A SER 159.A N LYS 163.A O no hydrogen 3.064 N/A SER 159.A OG ASP 161.A OD1 no hydrogen 2.838 N/A SER 159.A OG LYS 163.A O no hydrogen 3.395 N/A GLY 162.A N SER 159.A O no hydrogen 2.929 N/A LYS 163.A N SER 159.A OG no hydrogen 3.073 N/A TYR 165.A N LEU 157.A O no hydrogen 2.926 N/A LEU 166.A N ASN 84.A O no hydrogen 2.676 N/A SER 167.A N HIS 155.A O no hydrogen 2.877 N/A SER 171.A OG HIS 148.A O no hydrogen 2.667 N/A SER 171.A OG SER 150.A OG no hydrogen 2.731 N/A SER 171.A OG GLY 168.A O no hydrogen 3.269 N/A ASN 172.A N LEU 169.A O no hydrogen 3.091 N/A LEU 173.A N VAL 147.A O no hydrogen 2.866 N/A MET 175.A N GLY 145.A O no hydrogen 3.170 N/A ILE 176.A N SER 174.A OG no hydrogen 3.090 N/A SER 177.A N GLN 180.A O no hydrogen 2.817 N/A GLN 180.A N SER 177.A O no hydrogen 3.003 N/A GLN 182.A N MET 175.A O no hydrogen 2.754 N/A GLN 182.A NE2 SER 177.A O no hydrogen 3.547 N/A GLN 182.A NE2 GLN 180.A O no hydrogen 3.529 N/A VAL 185.A N TYR 211.A O no hydrogen 2.965 N/A SER 192.A OG PRO 189.A O no hydrogen 2.953 N/A VAL 195.A N SER 192.A O no hydrogen 2.981 N/A TRP 198.A N VAL 195.A O no hydrogen 3.075 N/A TRP 198.A NE1 GLU 226.A OE2 no hydrogen 3.053 N/A LEU 199.A N LEU 196.A O no hydrogen 2.864 N/A GLU 202.A N GLU 202.A OE2 no hydrogen 2.931 N/A VAL 203.A N SER 200.A O no hydrogen 3.123 N/A LEU 204.A N SER 200.A O no hydrogen 3.105 N/A GLN 205.A N PRO 201.A O no hydrogen 2.836 N/A GLN 206.A N LEU 204.A O no hydrogen 2.714 N/A GLN 206.A NE2 HIS 186.A O no hydrogen 2.779 N/A LEU 208.A N GLN 205.A O no hydrogen 3.411 N/A TYR 211.A N VAL 185.A O no hydrogen 3.049 N/A TYR 211.A OH ASP 187.A O no hydrogen 2.420 N/A LYS 214.A N ASP 212.A OD1 no hydrogen 2.997 N/A LYS 214.A NZ PRO 263.A O no hydrogen 3.522 N/A LYS 214.A NZ ASP 264.A O no hydrogen 3.097 N/A SER 215.A N ASP 212.A O no hydrogen 3.030 N/A SER 215.A OG ASP 212.A O no hydrogen 2.755 N/A ASP 216.A N ALA 213.A O no hydrogen 2.964 N/A ILE 217.A N LYS 214.A O no hydrogen 3.326 N/A TYR 218.A N LYS 214.A O no hydrogen 3.448 N/A SER 219.A N SER 215.A O no hydrogen 3.340 N/A SER 219.A OG TRP 198.A O no hydrogen 2.739 N/A SER 219.A OG SER 215.A O no hydrogen 3.318 N/A VAL 220.A N ASP 216.A O no hydrogen 3.063 N/A GLY 221.A N ILE 217.A O no hydrogen 3.310 N/A ILE 222.A N TYR 218.A O no hydrogen 3.089 N/A THR 223.A N SER 219.A O no hydrogen 2.926 N/A THR 223.A OG1 SER 219.A O no hydrogen 2.608 N/A ALA 224.A N VAL 220.A O no hydrogen 2.840 N/A CYS 225.A N GLY 221.A O no hydrogen 3.054 N/A CYS 225.A SG GLY 221.A O no hydrogen 3.782 N/A GLU 226.A N ILE 222.A O no hydrogen 2.807 N/A LEU 227.A N THR 223.A O no hydrogen 2.714 N/A ALA 228.A N ALA 224.A O no hydrogen 2.996 N/A ASN 229.A N CYS 225.A O no hydrogen 2.949 N/A GLY 230.A N GLU 226.A O no hydrogen 2.844 N/A MET 237.A N PHE 234.A O no hydrogen 3.411 N/A GLN 241.A NE2 LEU 196.A O no hydrogen 3.406 N/A GLN 241.A NE2 GLU 245.A OE1 no hydrogen 3.281 N/A GLN 241.A NE2 GLU 245.A OE2 no hydrogen 2.818 N/A GLU 245.A N GLN 241.A O no hydrogen 3.243 N/A LYS 246.A N MET 242.A O no hydrogen 2.959 N/A LYS 246.A NZ GLN 205.A OE1 no hydrogen 2.727 N/A SER 248.A N GLU 124.A OE2 no hydrogen 2.670 N/A SER 248.A OG GLU 124.A OE1 no hydrogen 2.620 N/A HIS 252.A N SER 248.A O no hydrogen 3.414 N/A HIS 252.A ND1 SER 248.A O no hydrogen 3.202 N/A HIS 253.A N PRO 249.A O no hydrogen 3.037 N/A PHE 254.A N HIS 250.A O no hydrogen 2.875 N/A VAL 255.A N PHE 251.A O no hydrogen 2.985 N/A GLU 256.A N HIS 252.A O no hydrogen 2.936 N/A GLN 257.A N HIS 253.A O no hydrogen 3.120 N/A CYS 258.A N PHE 254.A O no hydrogen 3.256 N/A CYS 258.A SG PHE 254.A O no hydrogen 3.509 N/A LEU 259.A N VAL 255.A O no hydrogen 3.141 N/A GLN 260.A NE2 GLN 257.A O no hydrogen 2.551 N/A GLN 260.A NE2 ALA 265.A O no hydrogen 3.386 N/A ASP 264.A N ASN 262.A OD1 no hydrogen 2.991 N/A ALA 265.A N ASN 262.A O no hydrogen 3.228 N/A ARG 266.A N PRO 263.A O no hydrogen 3.036 N/A ARG 266.A NE GLN 260.A O no hydrogen 2.844 N/A ARG 266.A NH1 GLU 202.A OE1 no hydrogen 2.656 N/A ARG 266.A NH1 LYS 214.A O no hydrogen 2.781 N/A ARG 266.A NH2 GLU 202.A OE1 no hydrogen 3.395 N/A ARG 266.A NH2 GLU 202.A OE2 no hydrogen 3.191 N/A ARG 266.A NH2 GLN 260.A O no hydrogen 3.124 N/A SER 268.A OG SER 270.A OG no hydrogen 3.381 N/A SER 268.A OG THR 271.A OG1 no hydrogen 3.043 N/A SER 270.A OG SER 268.A OG no hydrogen 3.381 N/A THR 271.A OG1 SER 268.A O no hydrogen 3.379 N/A THR 271.A OG1 SER 268.A OG no hydrogen 3.043 N/A LEU 272.A N SER 268.A O no hydrogen 2.989 N/A LEU 273.A N ALA 269.A O no hydrogen 3.128 N/A ASN 274.A N THR 271.A O no hydrogen 3.129 N/A HIS 275.A N LEU 272.A O no hydrogen 3.141 N/A PHE 277.A N HIS 275.A ND1 no hydrogen 2.969 N/A PHE 278.A N HIS 275.A O no hydrogen 3.143 N/A LYS 279.A N SER 276.A O no hydrogen 2.942 N/A GLN 280.A NE2 GLU 124.A OE1 no hydrogen 3.461 N/A GLN 280.A NE2 PHE 277.A O no hydrogen 2.673 N/A ILE 281.A N PHE 278.A O no hydrogen 3.200 N/A LEU 289.A N ALA 285.A O no hydrogen 3.375 N/A LEU 290.A N LEU 286.A O no hydrogen 3.052 N/A LEU 290.A N PRO 287.A O no hydrogen 3.192 N/A ARG 291.A N GLU 288.A O no hydrogen 3.090 N/A VAL 293.A N LEU 290.A O no hydrogen 3.020 N/A THR 294.A OG1 PRO 295.A O no hydrogen 3.303 N/A