Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 6gh1_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): SER 2.A OG LEU 103.A O no hydrogen 3.364 N/A HIS 3.A ND1 ASP 29.A OD2 no hydrogen 2.788 N/A SER 4.A N ASP 29.A OD1 no hydrogen 2.984 N/A LEU 5.A N CYS 101.A O no hydrogen 3.078 N/A LYS 6.A N TYR 27.A O no hydrogen 2.850 N/A TYR 7.A N HIS 99.A O no hydrogen 3.030 N/A PHE 8.A N VAL 25.A O no hydrogen 2.952 N/A HIS 9.A N TRP 97.A O no hydrogen 2.714 N/A HIS 9.A ND1 SER 24.A OG no hydrogen 2.606 N/A HIS 9.A NE2 HIS 99.A NE2 no hydrogen 2.979 N/A THR 10.A N ILE 23.A O no hydrogen 2.906 N/A SER 11.A N LEU 95.A O no hydrogen 2.855 N/A VAL 12.A N ARG 21.A O no hydrogen 2.770 N/A SER 13.A N HIS 93.A O no hydrogen 3.041 N/A SER 13.A OG HIS 93.A O no hydrogen 3.451 N/A ARG 14.A NE GLU 19.A O no hydrogen 2.899 N/A ARG 14.A NH2 GLU 19.A O no hydrogen 2.792 N/A ARG 17.A N ARG 14.A O no hydrogen 3.304 N/A ARG 21.A N VAL 12.A O no hydrogen 2.751 N/A ARG 21.A NE ASP 37.A OD1 no hydrogen 2.913 N/A ARG 21.A NH2 ASP 37.A OD1 no hydrogen 3.509 N/A ARG 21.A NH2 ASP 37.A OD2 no hydrogen 2.810 N/A PHE 22.A N ASN 38.A OD1 no hydrogen 2.783 N/A ILE 23.A N THR 10.A O no hydrogen 2.902 N/A SER 24.A N PHE 36.A O no hydrogen 2.800 N/A SER 24.A OG HIS 9.A ND1 no hydrogen 2.606 N/A VAL 25.A N PHE 8.A O no hydrogen 3.142 N/A GLY 26.A N VAL 34.A O no hydrogen 3.286 N/A TYR 27.A N LYS 6.A O no hydrogen 2.665 N/A VAL 28.A N THR 31.A O no hydrogen 2.795 N/A ASP 29.A N SER 4.A O no hydrogen 2.988 N/A THR 31.A N VAL 28.A O no hydrogen 2.901 N/A THR 31.A OG1 TYR 209.A OH no hydrogen 2.633 N/A GLN 32.A NE2 VAL 34.A O no hydrogen 3.218 N/A PHE 33.A N GLY 26.A O no hydrogen 2.925 N/A ARG 35.A N VAL 46.A O no hydrogen 2.977 N/A PHE 36.A N SER 24.A O no hydrogen 2.773 N/A ASN 38.A N PHE 22.A O no hydrogen 3.035 N/A ASN 38.A ND2 PRO 20.A O no hydrogen 2.964 N/A ASP 39.A N ASP 37.A OD1 no hydrogen 3.030 N/A ARG 44.A NH2 ASP 61.A OD1 no hydrogen 2.936 N/A MET 45.A N THR 64.A OG1 no hydrogen 3.100 N/A VAL 46.A N ARG 35.A O no hydrogen 2.867 N/A ARG 48.A N PHE 33.A O no hydrogen 2.843 N/A MET 52.A N ALA 49.A O no hydrogen 3.135 N/A GLU 53.A N PRO 50.A O no hydrogen 3.164 N/A GLN 54.A N TRP 51.A O no hydrogen 3.483 N/A GLU 55.A N MET 52.A O no hydrogen 3.198 N/A TYR 59.A N GLY 56.A O no hydrogen 3.200 N/A TYR 59.A OH TYR 171.A OH no hydrogen 2.496 N/A TRP 60.A N GLY 56.A O no hydrogen 3.510 N/A ASP 61.A N SER 57.A O no hydrogen 2.910 N/A ARG 62.A N GLU 58.A O no hydrogen 3.166 N/A GLU 63.A N TYR 59.A O no hydrogen 2.961 N/A THR 64.A N TRP 60.A O no hydrogen 2.963 N/A THR 64.A OG1 TRP 60.A O no hydrogen 2.748 N/A ARG 65.A N ASP 61.A O no hydrogen 3.076 N/A SER 66.A N ARG 62.A O no hydrogen 2.909 N/A SER 66.A OG ARG 62.A O no hydrogen 3.074 N/A ALA 67.A N GLU 63.A O no hydrogen 2.862 N/A ARG 68.A N THR 64.A O no hydrogen 2.857 N/A ARG 68.A NE PRO 43.A O no hydrogen 2.925 N/A ARG 68.A NH2 PRO 43.A O no hydrogen 2.683 N/A ASP 69.A N ARG 65.A O no hydrogen 3.001 N/A THR 70.A N SER 66.A O no hydrogen 2.920 N/A THR 70.A OG1 SER 66.A O no hydrogen 2.691 N/A ALA 71.A N ALA 67.A O no hydrogen 2.930 N/A GLN 72.A N ARG 68.A O no hydrogen 3.201 N/A ILE 73.A N ASP 69.A O no hydrogen 2.985 N/A PHE 74.A N THR 70.A O no hydrogen 2.912 N/A ARG 75.A N ALA 71.A O no hydrogen 3.038 N/A VAL 76.A N GLN 72.A O no hydrogen 3.080 N/A ASN 77.A N ILE 73.A O no hydrogen 2.865 N/A LEU 78.A N PHE 74.A O no hydrogen 2.885 N/A ARG 79.A N ARG 75.A O no hydrogen 3.216 N/A THR 80.A N VAL 76.A O no hydrogen 2.853 N/A THR 80.A OG1 VAL 76.A O no hydrogen 2.829 N/A LEU 81.A N ASN 77.A O no hydrogen 2.833 N/A ARG 82.A N LEU 78.A O no hydrogen 2.999 N/A GLY 83.A N ARG 79.A O no hydrogen 3.147 N/A TYR 84.A N THR 80.A O no hydrogen 2.960 N/A TYR 85.A N LEU 81.A O no hydrogen 3.094 N/A TYR 85.A OH ASP 137.A OD1 no hydrogen 3.342 N/A TYR 85.A OH ASP 137.A OD2 no hydrogen 2.682 N/A ASN 86.A N GLY 83.A O no hydrogen 3.223 N/A GLN 87.A N ARG 82.A O no hydrogen 2.874 N/A ALA 90.A N SER 88.A OG no hydrogen 3.012 N/A SER 92.A OG SER 13.A O no hydrogen 2.704 N/A HIS 93.A N SER 13.A OG no hydrogen 3.010 N/A HIS 93.A ND1 ASP 119.A OD2 no hydrogen 2.928 N/A THR 94.A N ASP 119.A OD1 no hydrogen 2.901 N/A LEU 95.A N SER 11.A O no hydrogen 2.845 N/A GLN 96.A N ALA 117.A O no hydrogen 2.930 N/A TRP 97.A N HIS 9.A O no hydrogen 2.873 N/A MET 98.A N GLN 115.A O no hydrogen 3.076 N/A HIS 99.A N TYR 7.A O no hydrogen 3.302 N/A HIS 99.A NE2 HIS 9.A NE2 no hydrogen 2.979 N/A GLY 100.A N TYR 113.A O no hydrogen 3.170 N/A CYS 101.A N LEU 5.A O no hydrogen 3.209 N/A GLU 102.A N ARG 111.A O no hydrogen 2.734 N/A LEU 103.A N HIS 3.A O no hydrogen 2.789 N/A GLY 104.A N ARG 108.A O no hydrogen 3.036 N/A GLY 107.A N GLY 104.A O no hydrogen 2.953 N/A ARG 108.A N ASP 106.A OD1 no hydrogen 3.133 N/A LEU 110.A N GLU 102.A O no hydrogen 2.799 N/A ARG 111.A N GLU 102.A O no hydrogen 3.258 N/A ARG 111.A NH1 GLU 102.A OE2 no hydrogen 3.089 N/A TYR 113.A N GLY 100.A O no hydrogen 3.129 N/A GLN 115.A N MET 98.A O no hydrogen 2.964 N/A GLN 115.A NE2 THR 125.A OG1 no hydrogen 2.900 N/A PHE 116.A N LEU 124.A O no hydrogen 2.736 N/A ALA 117.A N GLN 96.A O no hydrogen 2.939 N/A TYR 118.A N LYS 121.A O no hydrogen 2.987 N/A TYR 118.A OH GLN 87.A OE1 no hydrogen 2.530 N/A ASP 119.A N THR 94.A O no hydrogen 2.793 N/A LYS 121.A N TYR 118.A O no hydrogen 3.376 N/A TYR 123.A N PHE 116.A O no hydrogen 2.902 N/A TYR 123.A OH SER 143.A OG no hydrogen 2.596 N/A LEU 124.A N PHE 116.A O no hydrogen 3.442 N/A THR 125.A N THR 134.A O no hydrogen 3.075 N/A LEU 126.A N GLU 114.A O no hydrogen 2.757 N/A ASN 127.A N SER 132.A O no hydrogen 3.036 N/A ASN 127.A ND2 SER 132.A OG no hydrogen 3.064 N/A ASN 127.A ND2 THR 134.A OG1 no hydrogen 2.970 N/A GLU 128.A N GLU 128.A OE2 no hydrogen 2.790 N/A LEU 130.A N ASN 127.A O no hydrogen 2.810 N/A ARG 131.A N ASP 129.A OD1 no hydrogen 3.208 N/A SER 132.A OG ASP 129.A OD1 no hydrogen 3.306 N/A SER 132.A OG ASP 129.A OD2 no hydrogen 3.010 N/A THR 134.A N THR 125.A O no hydrogen 2.914 N/A THR 134.A OG1 ASN 127.A OD1 no hydrogen 3.225 N/A VAL 136.A N TYR 123.A O no hydrogen 3.057 N/A ALA 140.A N ASP 137.A OD1 no hydrogen 2.901 N/A GLN 141.A N ASP 137.A O no hydrogen 3.039 N/A ILE 142.A N ALA 139.A O no hydrogen 3.179 N/A SER 143.A N ALA 139.A O no hydrogen 3.486 N/A SER 143.A OG TYR 123.A OH no hydrogen 2.596 N/A GLU 144.A N ALA 140.A O no hydrogen 2.793 N/A GLN 145.A N GLN 141.A O no hydrogen 2.951 N/A LYS 146.A N ILE 142.A O no hydrogen 2.973 N/A LYS 146.A NZ TYR 84.A OH no hydrogen 3.125 N/A SER 147.A N SER 143.A O no hydrogen 3.022 N/A SER 147.A OG SER 143.A O no hydrogen 2.901 N/A ASN 148.A N GLU 144.A O no hydrogen 2.879 N/A ASP 149.A N GLN 145.A O no hydrogen 2.775 N/A ALA 150.A N LYS 146.A O no hydrogen 3.066 N/A SER 151.A N ASN 148.A O no hydrogen 3.227 N/A GLU 152.A N SER 147.A O no hydrogen 2.848 N/A GLU 154.A N GLU 154.A OE1 no hydrogen 2.634 N/A HIS 155.A N SER 151.A O no hydrogen 3.205 N/A GLN 156.A N GLU 152.A O no hydrogen 2.796 N/A GLN 156.A NE2 GLU 114.A OE2 no hydrogen 2.332 N/A ARG 157.A N ALA 153.A O no hydrogen 2.741 N/A ALA 158.A N GLU 154.A O no hydrogen 3.103 N/A TYR 159.A N HIS 155.A O no hydrogen 3.218 N/A LEU 160.A N GLN 156.A O no hydrogen 2.967 N/A GLU 161.A N ARG 157.A O no hydrogen 2.866 N/A ASP 162.A N ALA 158.A O no hydrogen 3.135 N/A CYS 164.A N TYR 159.A O no hydrogen 2.585 N/A CYS 164.A SG LEU 5.A O no hydrogen 3.922 N/A GLU 166.A N ASP 162.A O no hydrogen 2.937 N/A TRP 167.A N THR 163.A O no hydrogen 3.075 N/A LEU 168.A N CYS 164.A O no hydrogen 3.025 N/A HIS 169.A N VAL 165.A O no hydrogen 3.188 N/A LYS 170.A N GLU 166.A O no hydrogen 3.190 N/A LYS 170.A NZ GLU 166.A OE2 no hydrogen 2.846 N/A TYR 171.A N TRP 167.A O no hydrogen 2.796 N/A TYR 171.A OH TYR 59.A OH no hydrogen 2.496 N/A LEU 172.A N LEU 168.A O no hydrogen 2.880 N/A GLU 173.A N HIS 169.A O no hydrogen 3.130 N/A LYS 174.A N LYS 170.A O no hydrogen 3.057 N/A GLY 175.A N TYR 171.A O no hydrogen 2.938 N/A LYS 176.A N GLU 173.A O no hydrogen 3.327 N/A THR 178.A N GLY 175.A O no hydrogen 3.102 N/A THR 178.A OG1 GLY 175.A O no hydrogen 3.273 N/A LEU 179.A N GLY 175.A O no hydrogen 2.580 N/A LEU 180.A N LYS 176.A O no hydrogen 3.197 N/A GLU 183.A N TYR 209.A O no hydrogen 2.800 N/A LYS 186.A N LEU 206.A O no hydrogen 2.771 N/A THR 190.A N ARG 202.A O no hydrogen 2.874 N/A THR 190.A OG1 ARG 202.A O no hydrogen 3.357 N/A HIS 191.A NE2 GLU 254.A OE2 no hydrogen 2.819 N/A HIS 192.A N THR 200.A O no hydrogen 2.919 N/A ILE 194.A N GLU 198.A O no hydrogen 3.054 N/A SER 195.A N GLU 198.A O no hydrogen 3.199 N/A HIS 197.A N SER 195.A OG no hydrogen 3.397 N/A GLU 198.A N SER 195.A OG no hydrogen 3.225 N/A ALA 199.A N VAL 249.A O no hydrogen 2.958 N/A THR 200.A N HIS 192.A O no hydrogen 2.796 N/A LEU 201.A N VAL 247.A O no hydrogen 2.903 N/A ARG 202.A N THR 190.A O no hydrogen 2.960 N/A CYS 203.A N ALA 245.A O no hydrogen 2.752 N/A TRP 204.A N HIS 188.A O no hydrogen 2.827 N/A TRP 204.A NE1 THR 190.A OG1 no hydrogen 3.116 N/A ALA 205.A N LYS 243.A O no hydrogen 2.812 N/A LEU 206.A N LYS 186.A O no hydrogen 2.887 N/A PHE 208.A N PHE 241.A O no hydrogen 3.360 N/A TYR 209.A N GLU 183.A O no hydrogen 3.038 N/A TYR 209.A OH THR 31.A OG1 no hydrogen 2.633 N/A ALA 211.A N ASP 30.A OD2 no hydrogen 2.900 N/A THR 214.A N GLN 262.A O no hydrogen 3.095 N/A THR 216.A N HIS 260.A O no hydrogen 3.146 N/A TRP 217.A NE1 ALA 245.A O no hydrogen 2.706 N/A GLN 218.A N THR 258.A O no hydrogen 2.592 N/A GLN 218.A NE2 ASP 220.A O no hydrogen 3.044 N/A GLN 219.A N GLU 222.A O no hydrogen 2.888 N/A ASP 220.A N ARG 256.A O no hydrogen 3.342 N/A GLU 222.A N GLN 219.A O no hydrogen 3.028 N/A HIS 224.A N GLU 222.A OE1 no hydrogen 3.111 N/A THR 225.A N TRP 217.A O no hydrogen 3.147 N/A THR 225.A OG1 TRP 217.A O no hydrogen 3.003 N/A THR 228.A OG1 THR 225.A O no hydrogen 3.157 N/A GLU 229.A N ALA 246.A O no hydrogen 2.646 N/A VAL 231.A N TRP 244.A O no hydrogen 3.461 N/A ARG 234.A N GLN 242.A O no hydrogen 2.959 N/A ARG 234.A NE GLN 242.A OE1 no hydrogen 3.143 N/A ARG 234.A NH2 GLN 242.A OE1 no hydrogen 3.398 N/A ALA 236.A N THR 240.A O no hydrogen 2.848 N/A THR 240.A N ASP 238.A OD1 no hydrogen 3.225 N/A THR 240.A OG1 ASP 238.A OD1 no hydrogen 2.693 N/A PHE 241.A N PHE 208.A O no hydrogen 2.875 N/A GLN 242.A N ARG 234.A O no hydrogen 2.760 N/A LYS 243.A N ALA 205.A O no hydrogen 3.002 N/A LYS 243.A NZ VAL 231.A O no hydrogen 2.772 N/A LYS 243.A NZ THR 233.A OG1 no hydrogen 3.083 N/A ALA 245.A N CYS 203.A O no hydrogen 2.984 N/A ALA 246.A N GLU 229.A O no hydrogen 2.794 N/A VAL 247.A N LEU 201.A O no hydrogen 2.966 N/A VAL 249.A N ALA 199.A O no hydrogen 2.813 N/A SER 251.A N HIS 197.A O no hydrogen 2.700 N/A GLY 252.A N GLU 254.A OE1 no hydrogen 2.965 N/A GLU 253.A N PRO 250.A O no hydrogen 3.060 N/A GLU 254.A N GLU 254.A OE1 no hydrogen 2.757 N/A GLN 255.A NE2 TRP 274.A O no hydrogen 2.942 N/A ARG 256.A N GLU 253.A O no hydrogen 3.009 N/A TYR 257.A N GLU 254.A O no hydrogen 3.371 N/A THR 258.A N GLN 218.A O no hydrogen 2.765 N/A CYS 259.A N LEU 272.A O no hydrogen 2.812 N/A CYS 259.A SG HIS 260.A O no hydrogen 3.978 N/A HIS 260.A N THR 216.A O no hydrogen 2.805 N/A HIS 260.A NE2 GLN 218.A OE1 no hydrogen 2.809 N/A VAL 261.A N VAL 270.A O no hydrogen 2.728 N/A GLN 262.A N THR 214.A O no hydrogen 3.061 N/A HIS 263.A N GLN 262.A OE1 no hydrogen 2.979 N/A HIS 263.A NE2 PRO 210.A O no hydrogen 2.853 N/A GLY 265.A N HIS 263.A ND1 no hydrogen 2.953 N/A LEU 266.A N HIS 263.A O no hydrogen 3.039 N/A VAL 270.A N VAL 261.A O no hydrogen 2.865 N/A LEU 272.A N CYS 259.A O no hydrogen 2.803 N/A