Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3h2a_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): TRP 2.A N ASN 16.A OD1 no hydrogen 2.760 N/A TRP 2.A NE1 GLU 238.A OE1 no hydrogen 2.935 N/A LEU 6.A N LEU 13.A O no hydrogen 2.714 N/A ARG 7.A NH1 GLY 9.A O no hydrogen 3.086 N/A ARG 7.A NH2 GLY 9.A O no hydrogen 2.984 N/A CYS 8.A N TYR 11.A O no hydrogen 2.866 N/A TYR 11.A N CYS 8.A O no hydrogen 3.168 N/A TYR 11.A OH GLU 10.A OE2 no hydrogen 3.390 N/A LEU 13.A N LEU 6.A O no hydrogen 2.702 N/A ASN 16.A N ASN 14.A OD1 no hydrogen 2.666 N/A ASN 16.A ND2 TRP 2.A O no hydrogen 2.846 N/A GLU 17.A N ASN 14.A OD1 no hydrogen 2.942 N/A LYS 18.A NZ HIS 55.A NE2 no hydrogen 3.077 N/A THR 19.A N ASP 256.A OD1 no hydrogen 2.938 N/A THR 19.A OG1 ASP 256.A OD2 no hydrogen 2.799 N/A LEU 20.A N GLU 238.A O no hydrogen 2.908 N/A ILE 21.A N HIS 55.A ND1 no hydrogen 2.847 N/A MET 22.A N VAL 240.A O no hydrogen 2.732 N/A GLY 23.A N ILE 56.A O no hydrogen 2.831 N/A ILE 24.A N VAL 242.A O no hydrogen 3.005 N/A LEU 25.A N ASP 58.A O no hydrogen 3.114 N/A ASN 26.A N HIS 45.A ND1 no hydrogen 3.270 N/A SER 33.A OG GLU 38.A OE1 no hydrogen 2.622 N/A SER 35.A N GLU 38.A OE1 no hydrogen 3.155 N/A SER 35.A OG SER 33.A OG no hydrogen 3.290 N/A VAL 39.A N SER 35.A O no hydrogen 3.099 N/A ASP 40.A N TYR 36.A O no hydrogen 2.997 N/A ALA 41.A N ASN 37.A O no hydrogen 3.138 N/A ALA 42.A N GLU 38.A O no hydrogen 3.128 N/A VAL 43.A N VAL 39.A O no hydrogen 2.910 N/A ARG 44.A N ASP 40.A O no hydrogen 2.967 N/A HIS 45.A N ALA 41.A O no hydrogen 3.019 N/A ALA 46.A N ALA 42.A O no hydrogen 2.869 N/A LYS 47.A N VAL 43.A O no hydrogen 2.895 N/A GLU 48.A N ARG 44.A O no hydrogen 2.987 N/A MET 49.A N HIS 45.A O no hydrogen 2.897 N/A ARG 50.A N ALA 46.A O no hydrogen 2.864 N/A ARG 50.A NH1 ASP 51.A OD1 no hydrogen 2.773 N/A ARG 50.A NH2 GLU 80.A O no hydrogen 3.532 N/A ASP 51.A N LYS 47.A O no hydrogen 2.897 N/A GLU 52.A N GLU 48.A O no hydrogen 2.941 N/A GLU 52.A N MET 49.A O no hydrogen 3.210 N/A GLY 53.A N ARG 50.A O no hydrogen 3.417 N/A ALA 54.A N MET 49.A O no hydrogen 2.997 N/A HIS 55.A N ILE 21.A O no hydrogen 2.661 N/A ILE 56.A N ILE 21.A O no hydrogen 3.194 N/A ILE 57.A N PRO 84.A O no hydrogen 2.916 N/A ASP 58.A N GLY 23.A O no hydrogen 2.837 N/A ILE 59.A N SER 86.A O no hydrogen 2.968 N/A GLU 66.A N SER 62.A O no hydrogen 2.748 N/A ILE 67.A N VAL 63.A O no hydrogen 3.256 N/A LYS 68.A N GLU 64.A O no hydrogen 3.177 N/A ARG 69.A N GLU 65.A O no hydrogen 3.164 N/A VAL 70.A N GLU 66.A O no hydrogen 3.072 N/A VAL 71.A N ILE 67.A O no hydrogen 2.881 N/A ILE 74.A N VAL 70.A O no hydrogen 3.046 N/A GLN 75.A N VAL 71.A O no hydrogen 2.934 N/A ALA 76.A N PRO 72.A O no hydrogen 2.970 N/A VAL 77.A N MET 73.A O no hydrogen 2.996 N/A SER 78.A N ILE 74.A O no hydrogen 2.799 N/A LYS 79.A N GLN 75.A O no hydrogen 3.329 N/A GLU 80.A N ALA 76.A O no hydrogen 3.009 N/A VAL 81.A N VAL 77.A O no hydrogen 2.730 N/A LYS 82.A NZ GLU 10.A OE1 no hydrogen 3.173 N/A LEU 83.A N VAL 81.A O no hydrogen 2.861 N/A ILE 85.A N HIS 104.A ND1 no hydrogen 2.933 N/A SER 86.A N ILE 57.A O no hydrogen 2.995 N/A SER 86.A OG ASP 58.A OD2 no hydrogen 2.539 N/A ILE 87.A N ILE 105.A O no hydrogen 2.801 N/A ASP 88.A N ILE 59.A O no hydrogen 2.945 N/A THR 89.A OG1 GLU 66.A OE1 no hydrogen 3.356 N/A LYS 91.A N THR 89.A OG1 no hydrogen 3.086 N/A LYS 91.A NZ GLU 66.A OE2 no hydrogen 3.163 N/A ALA 92.A N GLU 115.A OE1 no hydrogen 2.703 N/A ALA 95.A N LYS 91.A O no hydrogen 3.080 N/A LYS 96.A N ALA 92.A O no hydrogen 2.898 N/A GLN 97.A N GLU 93.A O no hydrogen 3.160 N/A GLN 97.A NE2 GLU 93.A OE2 no hydrogen 2.635 N/A ALA 98.A N VAL 94.A O no hydrogen 3.085 N/A ILE 99.A N ALA 95.A O no hydrogen 3.119 N/A GLU 100.A N LYS 96.A O no hydrogen 3.081 N/A ALA 101.A N GLN 97.A O no hydrogen 2.774 N/A GLY 102.A N ILE 99.A O no hydrogen 3.090 N/A ALA 103.A N ALA 98.A O no hydrogen 2.696 N/A HIS 104.A N ILE 85.A O no hydrogen 2.451 N/A HIS 104.A NE2 GLU 10.A OE2 no hydrogen 3.143 N/A ILE 105.A N ILE 85.A O no hydrogen 2.998 N/A ILE 106.A N PRO 128.A O no hydrogen 2.844 N/A ASN 107.A N ILE 87.A O no hydrogen 2.679 N/A ASN 107.A ND2 ASP 58.A OD1 no hydrogen 3.447 N/A ASN 107.A ND2 ASP 58.A OD2 no hydrogen 3.064 N/A ASP 108.A N ILE 130.A O no hydrogen 3.090 N/A TRP 110.A N ASP 108.A OD2 no hydrogen 2.698 N/A GLY 111.A N ASP 108.A O no hydrogen 3.350 N/A ALA 112.A N ASP 108.A OD1 no hydrogen 2.895 N/A LYS 113.A N TRP 110.A O no hydrogen 2.845 N/A LYS 113.A NZ ASP 150.A O no hydrogen 2.647 N/A ILE 118.A N GLU 115.A O no hydrogen 2.994 N/A ALA 119.A N PRO 116.A O no hydrogen 2.986 N/A VAL 121.A N LYS 117.A O no hydrogen 2.943 N/A ALA 122.A N ILE 118.A O no hydrogen 2.766 N/A ALA 123.A N ALA 119.A O no hydrogen 2.704 N/A HIS 124.A N GLU 120.A O no hydrogen 3.052 N/A TYR 125.A N VAL 121.A O no hydrogen 3.143 N/A ASP 126.A N ALA 122.A O no hydrogen 2.732 N/A VAL 127.A N ALA 122.A O no hydrogen 3.174 N/A ILE 129.A N ASN 167.A O no hydrogen 2.743 N/A ILE 130.A N ILE 106.A O no hydrogen 2.732 N/A LEU 131.A N ILE 169.A O no hydrogen 2.824 N/A MET 132.A N ASP 108.A O no hydrogen 3.254 N/A HIS 133.A N ASP 171.A O no hydrogen 2.785 N/A HIS 133.A NE2 ASP 150.A OD2 no hydrogen 2.929 N/A ASN 134.A ND2 ILE 109.A O no hydrogen 2.909 N/A ARG 135.A NH1 ASN 137.A OD1 no hydrogen 2.976 N/A ASN 137.A ND2 ASP 136.A OD1 no hydrogen 3.058 N/A ASN 139.A N ASN 137.A OD1 no hydrogen 2.838 N/A TYR 140.A N MET 138.A O no hydrogen 2.755 N/A TYR 140.A OH ALA 177.A O no hydrogen 2.719 N/A ASN 142.A N ASP 146.A OD2 no hydrogen 2.929 N/A ASP 146.A N ASN 142.A O no hydrogen 2.720 N/A MET 147.A N LEU 143.A O no hydrogen 2.815 N/A ILE 148.A N MET 144.A O no hydrogen 2.963 N/A ALA 149.A N ALA 145.A O no hydrogen 2.956 N/A ASP 150.A N ASP 146.A O no hydrogen 2.676 N/A LEU 151.A N MET 147.A O no hydrogen 2.737 N/A TYR 152.A N.A ILE 148.A O no hydrogen 2.992 N/A TYR 152.A N.B ILE 148.A O no hydrogen 2.987 N/A ASP 153.A N ALA 149.A O no hydrogen 3.065 N/A SER 154.A N ASP 150.A O no hydrogen 3.272 N/A SER 154.A N LEU 151.A O no hydrogen 2.978 N/A SER 154.A OG GLY 111.A O no hydrogen 2.720 N/A ILE 155.A N LEU 151.A O no hydrogen 3.040 N/A LYS 156.A N TYR 152.A O.A no hydrogen 2.870 N/A LYS 156.A N TYR 152.A O.B no hydrogen 2.910 N/A ILE 157.A N ASP 153.A O no hydrogen 3.367 N/A ALA 158.A N SER 154.A O no hydrogen 2.890 N/A LYS 159.A N ILE 155.A O no hydrogen 2.726 N/A LYS 159.A NZ ASP 165.A OD2 no hydrogen 3.306 N/A ASP 160.A N LYS 156.A O no hydrogen 2.793 N/A ALA 161.A N ILE 157.A O no hydrogen 3.161 N/A ALA 161.A N ALA 158.A O no hydrogen 2.991 N/A GLY 162.A N LYS 159.A O no hydrogen 3.061 N/A VAL 163.A N ALA 158.A O no hydrogen 3.120 N/A ARG 164.A NE ASP 126.A OD2 no hydrogen 3.370 N/A ARG 164.A NH2 ASP 126.A OD1 no hydrogen 3.477 N/A ASN 167.A N ARG 164.A O no hydrogen 2.775 N/A ILE 168.A N ASP 165.A O no hydrogen 3.197 N/A ILE 169.A N ILE 129.A O no hydrogen 3.069 N/A LEU 170.A N PRO 199.A O no hydrogen 2.804 N/A ASP 171.A N LEU 131.A O no hydrogen 2.916 N/A GLY 173.A N ASP 171.A OD2 no hydrogen 2.958 N/A GLY 175.A N ASN 183.A OD1 no hydrogen 2.905 N/A PHE 176.A N GLY 173.A O no hydrogen 3.056 N/A LYS 178.A NZ HIS 133.A ND1 no hydrogen 2.864 N/A LYS 178.A NZ PRO 172.A O no hydrogen 3.298 N/A LYS 178.A NZ GLY 173.A O no hydrogen 2.788 N/A LYS 178.A NZ PHE 176.A O no hydrogen 2.666 N/A THR 179.A N GLN 182.A OE1 no hydrogen 3.000 N/A GLN 182.A N THR 179.A OG1 no hydrogen 3.014 N/A ASN 183.A N THR 179.A O no hydrogen 2.896 N/A ASN 183.A ND2 LYS 178.A O no hydrogen 3.397 N/A LEU 184.A N PRO 180.A O no hydrogen 3.166 N/A GLU 185.A N GLU 181.A O no hydrogen 2.907 N/A ALA 186.A N GLN 182.A O no hydrogen 2.868 N/A MET 187.A N ASN 183.A O no hydrogen 3.054 N/A ARG 188.A N LEU 184.A O no hydrogen 2.796 N/A ASN 189.A N ALA 186.A O no hydrogen 3.226 N/A ASN 189.A ND2 GLU 185.A O no hydrogen 2.882 N/A GLU 191.A N GLU 191.A OE2 no hydrogen 2.778 N/A GLN 192.A N ASN 189.A O no hydrogen 3.142 N/A GLN 192.A NE2 ASN 189.A OD1 no hydrogen 3.500 N/A LEU 193.A N LEU 190.A O no hydrogen 3.071 N/A ASN 194.A N GLU 191.A O no hydrogen 3.021 N/A ASN 194.A ND2 LYS 235.A O no hydrogen 3.077 N/A VAL 195.A N GLN 192.A O no hydrogen 3.360 N/A LEU 196.A N LEU 193.A O no hydrogen 3.171 N/A GLY 197.A N ASN 194.A O no hydrogen 3.068 N/A TYR 198.A OH ASP 165.A OD1 no hydrogen 2.468 N/A VAL 200.A N GLU 238.A OE2 no hydrogen 2.739 N/A LEU 201.A N LEU 170.A O no hydrogen 2.756 N/A LEU 202.A N PHE 239.A O no hydrogen 2.891 N/A THR 204.A OG1 THR 228.A OG1 no hydrogen 2.502 N/A SER 205.A OG HIS 243.A ND1 no hydrogen 2.586 N/A ARG 206.A N THR 225.A OG1 no hydrogen 2.907 N/A ARG 206.A NE ASP 244.A OD1 no hydrogen 3.454 N/A ARG 206.A NH2 ASP 244.A OD2 no hydrogen 3.019 N/A LYS 207.A N THR 204.A O no hydrogen 3.167 N/A LYS 207.A NZ ILE 174.A O no hydrogen 2.619 N/A LYS 207.A NZ GLY 203.A O no hydrogen 2.565 N/A ILE 210.A N LYS 207.A O no hydrogen 3.019 N/A HIS 212.A N SER 208.A O no hydrogen 2.842 N/A VAL 213.A N PHE 209.A O no hydrogen 3.170 N/A LEU 214.A N ILE 210.A O no hydrogen 2.933 N/A GLU 219.A N GLU 219.A OE1 no hydrogen 2.729 N/A GLU 220.A N PRO 217.A O no hydrogen 2.782 N/A ARG 221.A NE LEU 216.A O no hydrogen 2.874 N/A ARG 221.A NH1 ARG 206.A O no hydrogen 2.598 N/A ARG 221.A NH2 LEU 216.A O no hydrogen 3.235 N/A THR 225.A N ARG 221.A O no hydrogen 2.785 N/A THR 225.A OG1 ARG 221.A O no hydrogen 2.714 N/A GLY 226.A N LEU 222.A O no hydrogen 2.999 N/A ALA 227.A N GLU 223.A O no hydrogen 3.008 N/A THR 228.A N GLY 224.A O no hydrogen 3.256 N/A THR 228.A OG1 THR 204.A OG1 no hydrogen 2.502 N/A THR 228.A OG1 THR 225.A O no hydrogen 2.725 N/A VAL 229.A N THR 225.A O no hydrogen 2.923 N/A CYS 230.A N GLY 226.A O no hydrogen 2.843 N/A CYS 230.A SG GLY 226.A O no hydrogen 3.325 N/A LEU 231.A N ALA 227.A O no hydrogen 2.885 N/A GLY 232.A N THR 228.A O no hydrogen 2.817 N/A ILE 233.A N VAL 229.A O no hydrogen 2.952 N/A GLU 234.A N CYS 230.A O no hydrogen 3.037 N/A LYS 235.A N LEU 231.A O no hydrogen 2.913 N/A LYS 235.A N GLY 232.A O no hydrogen 3.179 N/A LYS 235.A NZ ARG 188.A O no hydrogen 2.941 N/A LYS 235.A NZ GLU 191.A OE2 no hydrogen 2.646 N/A GLY 236.A N ILE 233.A O no hydrogen 2.985 N/A CYS 237.A N GLY 232.A O no hydrogen 3.136 N/A CYS 237.A SG.A PHE 239.A O no hydrogen 3.674 N/A CYS 237.A SG.B GLY 232.A O no hydrogen 3.358 N/A GLU 238.A N VAL 200.A O no hydrogen 2.762 N/A PHE 239.A N VAL 200.A O no hydrogen 3.171 N/A VAL 240.A N LEU 20.A O no hydrogen 3.047 N/A ARG 241.A N LEU 202.A O no hydrogen 2.811 N/A ARG 241.A NE ASP 58.A OD1 no hydrogen 2.835 N/A ARG 241.A NH2 ASP 58.A OD1 no hydrogen 2.997 N/A VAL 242.A N MET 22.A O no hydrogen 2.781 N/A HIS 243.A N SER 205.A OG no hydrogen 2.865 N/A HIS 243.A ND1 SER 205.A OG no hydrogen 2.586 N/A VAL 245.A N HIS 243.A O no hydrogen 2.994 N/A GLU 247.A N GLU 247.A OE1 no hydrogen 2.762 N/A MET 248.A N ASP 244.A O no hydrogen 2.997 N/A SER 249.A N VAL 245.A O no hydrogen 2.836 N/A SER 249.A OG GLU 52.A O no hydrogen 3.462 N/A SER 249.A OG VAL 245.A O no hydrogen 2.754 N/A ARG 250.A N LYS 246.A O no hydrogen 3.293 N/A MET 251.A N GLU 247.A O no hydrogen 2.993 N/A ALA 252.A N MET 248.A O no hydrogen 2.785 N/A LYS 253.A N SER 249.A O no hydrogen 2.928 N/A MET 254.A N ARG 250.A O no hydrogen 3.172 N/A MET 254.A N MET 251.A O no hydrogen 3.193 N/A MET 255.A N MET 251.A O no hydrogen 2.997 N/A ASP 256.A N ALA 252.A O no hydrogen 2.894 N/A ALA 257.A N LYS 253.A O no hydrogen 3.222 N/A MET 258.A N MET 254.A O no hydrogen 3.074 N/A ILE 259.A N MET 255.A O no hydrogen 2.763 N/A GLY 260.A N ASP 256.A O no hydrogen 3.006 N/A LYS 261.A N ASP 256.A O no hydrogen 2.906 N/A LYS 261.A NZ THR 19.A OG1 no hydrogen 2.720 N/A LYS 261.A NZ CYS 237.A O no hydrogen 3.129 N/A