Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1gwq_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LYS 2.A N GLU 165.A OE2 no hydrogen 2.990 N/A LYS 2.A NZ ASP 64.A O no hydrogen 3.386 N/A SER 5.A OG ASP 64.A OD2 no hydrogen 2.442 N/A ALA 7.A N SER 5.A OG no hydrogen 3.039 N/A LEU 8.A N SER 5.A O no hydrogen 2.995 N/A SER 9.A N LEU 6.A O no hydrogen 2.755 N/A THR 11.A N GLN 14.A OE1 no hydrogen 2.738 N/A THR 11.A OG1 GLN 14.A OE1 no hydrogen 3.094 N/A GLN 14.A N THR 11.A OG1 no hydrogen 3.275 N/A MET 15.A N THR 11.A O no hydrogen 3.056 N/A VAL 16.A N ALA 12.A O no hydrogen 3.118 N/A SER 17.A N ASP 13.A O no hydrogen 3.140 N/A SER 17.A OG ASP 13.A O no hydrogen 2.770 N/A ALA 18.A N GLN 14.A O no hydrogen 2.957 N/A LEU 19.A N MET 15.A O no hydrogen 2.705 N/A LEU 20.A N VAL 16.A O no hydrogen 2.796 N/A ASP 21.A N SER 17.A O no hydrogen 3.015 N/A ALA 22.A N ALA 18.A O no hydrogen 3.092 N/A GLU 23.A N LEU 20.A O no hydrogen 3.211 N/A SER 29.A N ASN 102.A OD1 no hydrogen 2.837 N/A SER 29.A OG GLU 30.A O no hydrogen 3.132 N/A SER 36.A N SER 33.A OG no hydrogen 3.230 N/A MET 37.A N SER 33.A O no hydrogen 2.968 N/A MET 38.A N GLU 34.A O no hydrogen 3.364 N/A GLY 39.A N ALA 35.A O no hydrogen 3.235 N/A LEU 40.A N SER 36.A O no hydrogen 3.263 N/A LEU 41.A N MET 37.A O no hydrogen 3.132 N/A THR 42.A N MET 38.A O no hydrogen 3.148 N/A ASN 43.A N GLY 39.A O no hydrogen 2.985 N/A LEU 44.A N LEU 40.A O no hydrogen 2.984 N/A ALA 45.A N LEU 41.A O no hydrogen 2.887 N/A ASP 46.A N THR 42.A O no hydrogen 2.975 N/A ARG 47.A N ASN 43.A O no hydrogen 3.274 N/A ARG 47.A NH1 TYR 28.A O no hydrogen 2.704 N/A GLU 48.A N LEU 44.A O no hydrogen 2.870 N/A LEU 49.A N ALA 45.A O no hydrogen 2.740 N/A VAL 50.A N ASP 46.A O no hydrogen 3.339 N/A HIS 51.A N ARG 47.A O no hydrogen 3.459 N/A MET 52.A N GLU 48.A O no hydrogen 2.836 N/A ILE 53.A N LEU 49.A O no hydrogen 3.008 N/A TRP 55.A N HIS 51.A O no hydrogen 2.851 N/A ALA 56.A N MET 52.A O no hydrogen 2.842 N/A LYS 57.A N ILE 53.A O no hydrogen 3.371 N/A ARG 58.A N TRP 55.A O no hydrogen 2.873 N/A VAL 59.A N ALA 56.A O no hydrogen 2.938 N/A PHE 62.A N VAL 59.A O no hydrogen 3.160 N/A ASP 64.A N GLY 61.A O no hydrogen 3.367 N/A LEU 65.A N PHE 62.A O no hydrogen 3.401 N/A THR 66.A N GLU 166.A OE2 no hydrogen 2.771 N/A THR 66.A OG1 GLU 166.A OE2 no hydrogen 3.346 N/A ASP 69.A N THR 66.A OG1 no hydrogen 3.031 N/A GLN 70.A N THR 66.A O no hydrogen 2.928 N/A GLN 70.A NE2 LEU 65.A O no hydrogen 2.897 N/A VAL 71.A N LEU 67.A O no hydrogen 2.680 N/A HIS 72.A N HIS 68.A O no hydrogen 2.836 N/A HIS 72.A NE2 GLY 152.A O no hydrogen 2.695 N/A HIS 72.A NE2 THR 155.A OG1 no hydrogen 2.825 N/A LEU 73.A N ASP 69.A O no hydrogen 2.822 N/A LEU 74.A N GLN 70.A O no hydrogen 3.250 N/A GLU 75.A N VAL 71.A O no hydrogen 3.053 N/A CYS 76.A N HIS 72.A O no hydrogen 2.957 N/A CYS 76.A SG.A HIS 72.A O no hydrogen 3.488 N/A CYS 76.A SG.B SER 151.A O no hydrogen 3.032 N/A ALA 77.A N LEU 73.A O no hydrogen 2.894 N/A TRP 78.A N LEU 74.A O no hydrogen 2.793 N/A ILE 81.A N ALA 77.A O no hydrogen 3.073 N/A LEU 82.A N TRP 78.A O no hydrogen 3.107 N/A MET 83.A N LEU 79.A O no hydrogen 2.927 N/A ILE 84.A N GLU 80.A O no hydrogen 2.728 N/A GLY 85.A N ILE 81.A O no hydrogen 3.197 N/A LEU 86.A N LEU 82.A O no hydrogen 3.021 N/A VAL 87.A N MET 83.A O no hydrogen 2.952 N/A TRP 88.A N ILE 84.A O no hydrogen 3.063 N/A ARG 89.A N GLY 85.A O no hydrogen 2.938 N/A ARG 89.A NE LEU 98.A O no hydrogen 2.912 N/A ARG 89.A NH2 LEU 98.A O no hydrogen 3.498 N/A SER 90.A N LEU 86.A O no hydrogen 3.002 N/A SER 90.A OG LEU 86.A O no hydrogen 2.983 N/A MET 91.A N TRP 88.A O no hydrogen 3.198 N/A HIS 93.A N SER 90.A O no hydrogen 2.869 N/A LYS 96.A N HIS 93.A O no hydrogen 2.819 N/A LYS 96.A NZ ASP 106.A OD1 no hydrogen 3.459 N/A LEU 97.A N LEU 105.A O no hydrogen 3.048 N/A LEU 98.A N SER 90.A OG no hydrogen 2.853 N/A PHE 99.A N LEU 103.A O no hydrogen 3.078 N/A ASN 102.A ND2 SER 29.A O no hydrogen 2.909 N/A LEU 103.A N ALA 100.A O no hydrogen 2.802 N/A LEU 105.A N LEU 97.A O no hydrogen 3.034 N/A ASP 106.A N GLN 109.A OE1 no hydrogen 2.792 N/A ARG 107.A N GLY 95.A O no hydrogen 3.238 N/A ARG 107.A NE ASP 121.A OD1 no hydrogen 2.859 N/A ARG 107.A NH2 ASP 121.A OD1 no hydrogen 3.323 N/A ARG 107.A NH2 ASP 121.A OD2 no hydrogen 2.543 N/A GLN 109.A N ASP 106.A O no hydrogen 2.803 N/A GLY 110.A N ARG 107.A O no hydrogen 2.897 N/A LYS 111.A N ASN 108.A O no hydrogen 2.888 N/A CYS 112.A N GLN 109.A O no hydrogen 3.394 N/A CYS 112.A SG GLN 109.A O no hydrogen 3.525 N/A VAL 113.A N GLY 110.A O no hydrogen 3.139 N/A GLU 114.A N GLU 34.A OE1 no hydrogen 3.063 N/A MET 116.A N VAL 113.A O no hydrogen 3.194 N/A PHE 120.A N MET 116.A O no hydrogen 2.842 N/A ASP 121.A N VAL 117.A O no hydrogen 2.885 N/A MET 122.A N GLU 118.A O no hydrogen 3.274 N/A LEU 123.A N ILE 119.A O no hydrogen 2.859 N/A LEU 124.A N PHE 120.A O no hydrogen 2.668 N/A ALA 125.A N ASP 121.A O no hydrogen 2.808 N/A THR 126.A N MET 122.A O no hydrogen 2.811 N/A THR 126.A OG1 MET 122.A O no hydrogen 2.931 N/A THR 126.A OG1 HIS 208.A ND1.B no hydrogen 2.879 N/A SER 127.A N LEU 123.A O no hydrogen 2.949 N/A SER 127.A OG VAL 87.A O no hydrogen 3.320 N/A SER 128.A N LEU 124.A O no hydrogen 2.872 N/A SER 128.A OG LEU 124.A O no hydrogen 2.841 N/A ARG 129.A N ALA 125.A O no hydrogen 2.972 N/A PHE 130.A N THR 126.A O no hydrogen 2.934 N/A ARG 131.A N SER 127.A O no hydrogen 3.288 N/A ARG 131.A NE MET 91.A O no hydrogen 3.016 N/A ARG 131.A NH2 MET 91.A O no hydrogen 3.267 N/A MET 132.A N SER 128.A O no hydrogen 2.771 N/A MET 133.A N ARG 129.A O no hydrogen 3.035 N/A ASN 134.A N ARG 131.A O no hydrogen 2.973 N/A LEU 135.A N PHE 130.A O no hydrogen 3.128 N/A GLN 136.A N GLU 139.A OE1 no hydrogen 2.891 N/A GLN 136.A NE2 ASN 134.A O no hydrogen 3.045 N/A GLU 139.A N GLN 136.A O no hydrogen 2.742 N/A PHE 140.A N GLN 136.A O no hydrogen 2.600 N/A VAL 141.A N GLY 137.A O no hydrogen 2.933 N/A CYS 142.A N GLU 138.A O no hydrogen 3.416 N/A CYS 142.A SG GLU 138.A O no hydrogen 3.342 N/A LEU 143.A N GLU 139.A O no hydrogen 2.956 N/A LYS 144.A N PHE 140.A O no hydrogen 2.780 N/A LYS 144.A NZ GLU 23.A OE1 no hydrogen 3.278 N/A LYS 144.A NZ GLU 23.A OE2 no hydrogen 2.523 N/A SER 145.A N VAL 141.A O no hydrogen 3.259 N/A ILE 146.A N CYS 142.A O no hydrogen 2.948 N/A ILE 147.A N LEU 143.A O no hydrogen 2.973 N/A LEU 148.A N LYS 144.A O no hydrogen 3.247 N/A LEU 149.A N SER 145.A O no hydrogen 3.117 N/A ASN 150.A N ILE 146.A O no hydrogen 2.822 N/A SER 151.A N ILE 147.A O no hydrogen 3.208 N/A SER 151.A OG GLU 80.A OE2 no hydrogen 2.520 N/A SER 151.A OG ILE 147.A O no hydrogen 3.335 N/A TYR 154.A OH HIS 171.A NE2 no hydrogen 2.825 N/A THR 155.A N GLY 152.A O no hydrogen 3.068 N/A THR 155.A OG1 HIS 72.A NE2 no hydrogen 2.825 N/A THR 155.A OG1 GLY 152.A O no hydrogen 2.958 N/A SER 158.A OG THR 160.A OG1 no hydrogen 2.826 N/A SER 158.A OG SER 163.A OG no hydrogen 2.329 N/A THR 160.A N SER 158.A OG no hydrogen 2.685 N/A THR 160.A OG1 SER 158.A OG no hydrogen 2.826 N/A THR 160.A OG1 SER 163.A OG no hydrogen 2.569 N/A SER 163.A N THR 160.A OG1 no hydrogen 3.146 N/A SER 163.A OG SER 158.A OG no hydrogen 2.329 N/A SER 163.A OG THR 160.A O no hydrogen 3.085 N/A SER 163.A OG THR 160.A OG1 no hydrogen 2.569 N/A LEU 164.A N THR 160.A O no hydrogen 3.048 N/A GLU 165.A N LEU 161.A O no hydrogen 2.818 N/A GLU 166.A N LYS 162.A O no hydrogen 2.765 N/A LYS 167.A N SER 163.A O no hydrogen 2.938 N/A ASP 168.A N LEU 164.A O no hydrogen 3.015 N/A HIS 169.A N GLU 165.A O no hydrogen 3.152 N/A HIS 169.A NE2 GLY 61.A O no hydrogen 2.857 N/A ILE 170.A N GLU 166.A O no hydrogen 2.879 N/A HIS 171.A N LYS 167.A O no hydrogen 2.848 N/A ARG 172.A N ASP 168.A O no hydrogen 3.155 N/A ARG 172.A N HIS 169.A O no hydrogen 3.065 N/A ARG 172.A NE ASP 168.A OD1 no hydrogen 3.424 N/A ARG 172.A NE ASP 168.A OD2 no hydrogen 2.739 N/A VAL 173.A N HIS 169.A O no hydrogen 3.082 N/A LEU 174.A N ILE 170.A O no hydrogen 3.014 N/A ASP 175.A N HIS 171.A O no hydrogen 2.981 N/A LYS 176.A N ARG 172.A O no hydrogen 3.026 N/A ILE 177.A N VAL 173.A O no hydrogen 2.863 N/A THR 178.A N LEU 174.A O no hydrogen 3.014 N/A THR 178.A OG1 LEU 174.A O no hydrogen 3.174 N/A ASP 179.A N ASP 175.A O no hydrogen 2.913 N/A THR 180.A N LYS 176.A O no hydrogen 2.752 N/A THR 180.A OG1 LYS 176.A O no hydrogen 2.920 N/A LEU 181.A N ILE 177.A O no hydrogen 2.691 N/A ILE 182.A N THR 178.A O no hydrogen 2.984 N/A HIS 183.A N ASP 179.A O no hydrogen 2.951 N/A LEU 184.A N THR 180.A O no hydrogen 2.887 N/A MET 185.A N LEU 181.A O no hydrogen 3.077 N/A ALA 186.A N ILE 182.A O no hydrogen 2.942 N/A LYS 187.A N HIS 183.A O no hydrogen 3.110 N/A LYS 187.A NZ ASP 13.A OD1.A no hydrogen 2.673 N/A LYS 187.A NZ HIS 183.A NE2 no hydrogen 3.143 N/A ALA 188.A N MET 185.A O no hydrogen 3.277 N/A GLY 189.A N ALA 186.A O no hydrogen 2.962 N/A LEU 190.A N MET 185.A O no hydrogen 3.151 N/A THR 191.A N GLN 194.A OE1 no hydrogen 2.635 N/A THR 191.A OG1 GLN 194.A OE1 no hydrogen 3.239 N/A GLN 194.A N THR 191.A OG1 no hydrogen 2.869 N/A GLN 195.A N THR 191.A O no hydrogen 2.711 N/A GLN 195.A NE2 LEU 190.A O no hydrogen 3.104 N/A HIS 196.A N LEU 192.A O no hydrogen 2.909 N/A GLN 197.A N GLN 193.A O no hydrogen 3.010 N/A ARG 198.A N GLN 194.A O no hydrogen 2.879 N/A ARG 198.A NE GLU 139.A OE2 no hydrogen 2.664 N/A ARG 198.A NH1 MET 133.A O no hydrogen 2.863 N/A ARG 198.A NH2 MET 133.A O no hydrogen 2.957 N/A ARG 198.A NH2 GLU 139.A OE1 no hydrogen 2.872 N/A ARG 198.A NH2 GLU 139.A OE2 no hydrogen 3.451 N/A LEU 199.A N GLN 195.A O no hydrogen 3.087 N/A ALA 200.A N HIS 196.A O no hydrogen 3.241 N/A GLN 201.A N GLN 197.A O no hydrogen 2.942 N/A LEU 202.A N ARG 198.A O no hydrogen 2.780 N/A LEU 203.A N LEU 199.A O no hydrogen 2.864 N/A LEU 204.A N ALA 200.A O no hydrogen 2.777 N/A LEU 206.A N LEU 203.A O no hydrogen 2.866 N/A SER 207.A N LEU 204.A O no hydrogen 2.967 N/A HIS 208.A ND1.A LEU 204.A O no hydrogen 3.267 N/A HIS 208.A ND1.B THR 126.A OG1 no hydrogen 2.879 N/A ILE 209.A N ILE 205.A O no hydrogen 2.989 N/A ARG 210.A N LEU 206.A O no hydrogen 2.969 N/A HIS 211.A N SER 207.A O no hydrogen 3.109 N/A MET 212.A N HIS 208.A O no hydrogen 2.961 N/A SER 213.A N ILE 209.A O no hydrogen 2.850 N/A ASN 214.A N ARG 210.A O no hydrogen 2.801 N/A LYS 215.A N HIS 211.A O no hydrogen 3.129 N/A GLY 216.A N MET 212.A O no hydrogen 2.895 N/A MET 217.A N SER 213.A O no hydrogen 2.851 N/A GLU 218.A N ASN 214.A O no hydrogen 3.179 N/A HIS 219.A N LYS 215.A O no hydrogen 2.794 N/A HIS 219.A NE2 GLU 114.A O no hydrogen 2.725 N/A LEU 220.A N GLY 216.A O no hydrogen 2.653 N/A TYR 221.A N MET 217.A O no hydrogen 2.802 N/A SER 222.A N GLU 218.A O no hydrogen 2.881 N/A MET 223.A N HIS 219.A O no hydrogen 3.012 N/A LYS 224.A N LEU 220.A O no hydrogen 3.088 N/A LYS 224.A NZ ASP 240.A OD1 no hydrogen 3.530 N/A CYS 225.A N TYR 221.A O no hydrogen 2.956 N/A CYS 225.A N SER 222.A O no hydrogen 2.745 N/A CYS 225.A SG TYR 221.A O no hydrogen 3.701 N/A LYS 226.A N SER 222.A O no hydrogen 2.935 N/A LYS 226.A N MET 223.A O no hydrogen 3.291 N/A VAL 228.A N MET 223.A O no hydrogen 3.230 N/A TYR 232.A N PRO 230.A O no hydrogen 2.919 N/A LEU 235.A N ASP 46.A OD1 no hydrogen 2.730 N/A LEU 236.A N TYR 232.A O no hydrogen 2.527 N/A GLU 237.A N ASP 233.A O no hydrogen 2.805 N/A MET 238.A N LEU 234.A O no hydrogen 3.178 N/A LEU 239.A N LEU 235.A O no hydrogen 3.132 N/A ASP 240.A N LEU 236.A O no hydrogen 3.138 N/A HIS 242.A N LEU 239.A O no hydrogen 3.115 N/A HIS 242.A NE2 GLU 75.A O no hydrogen 2.850 N/A ARG 243.A N ASP 240.A O no hydrogen 2.956 N/A