Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4qyg_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ASP 8.A N VAL 25.A O no hydrogen 2.685 N/A VAL 10.A N LEU 23.A O no hydrogen 3.081 N/A THR 12.A OG1 GLN 22.A OE1 no hydrogen 3.165 N/A LEU 13.A N VAL 21.A O no hydrogen 2.744 N/A GLY 14.A N VAL 21.A O no hydrogen 3.276 N/A GLY 16.A N GLY 19.A O no hydrogen 2.651 N/A TYR 18.A OH GLY 141.A O no hydrogen 2.755 N/A GLU 20.A N ILE 37.A O no hydrogen 3.139 N/A VAL 21.A N GLY 14.A O no hydrogen 2.795 N/A GLN 22.A N VAL 35.A O no hydrogen 2.871 N/A GLN 22.A NE2 THR 12.A OG1 no hydrogen 2.862 N/A LEU 23.A N GLN 11.A O no hydrogen 2.873 N/A ALA 24.A N VAL 33.A O no hydrogen 2.710 N/A VAL 25.A N ASP 8.A O no hydrogen 2.804 N/A ASN 26.A N GLU 31.A O no hydrogen 2.565 N/A ASN 26.A ND2 VAL 4.A O no hydrogen 2.714 N/A ARG 27.A N ASN 26.A OD1 no hydrogen 2.583 N/A VAL 33.A N ALA 24.A O no hydrogen 2.725 N/A ALA 34.A N LEU 75.A O no hydrogen 2.693 N/A VAL 35.A N GLN 22.A O no hydrogen 2.843 N/A LYS 36.A N LEU 73.A O no hydrogen 2.892 N/A LYS 36.A NZ GLU 46.A OE2 no hydrogen 2.684 N/A ILE 37.A N GLU 20.A O no hydrogen 2.753 N/A VAL 38.A N GLN 71.A O no hydrogen 3.099 N/A MET 40.A N ASN 69.A O no hydrogen 2.721 N/A LYS 45.A NZ THR 144.A OG1 no hydrogen 2.774 N/A GLU 46.A N ASN 42.A O no hydrogen 2.953 N/A ILE 47.A N ILE 43.A O no hydrogen 2.853 N/A CYS 48.A N LYS 44.A O no hydrogen 3.042 N/A CYS 48.A SG LYS 44.A O no hydrogen 3.332 N/A ILE 49.A N LYS 45.A O no hydrogen 2.964 N/A ASN 50.A N GLU 46.A O no hydrogen 3.047 N/A ASN 50.A ND2 GLU 46.A O no hydrogen 3.013 N/A LYS 51.A N ILE 47.A O no hydrogen 3.031 N/A LYS 51.A NZ HIS 64.A NE2 no hydrogen 2.969 N/A MET 52.A N ILE 49.A O no hydrogen 2.911 N/A LEU 53.A N ASN 50.A O no hydrogen 3.189 N/A ASN 54.A N TYR 111.A OH no hydrogen 2.833 N/A GLU 56.A N GLU 56.A OE2 no hydrogen 2.950 N/A ASN 57.A N HIS 55.A ND1 no hydrogen 2.921 N/A ASN 57.A ND2 LEU 135.A O no hydrogen 2.858 N/A VAL 58.A N HIS 55.A O no hydrogen 3.038 N/A VAL 59.A N ILE 137.A O no hydrogen 2.888 N/A LYS 60.A N GLU 76.A OE1 no hydrogen 2.981 N/A TYR 62.A N PHE 74.A O no hydrogen 2.716 N/A GLY 63.A N PHE 74.A O no hydrogen 3.335 N/A ARG 65.A N TYR 72.A O no hydrogen 3.081 N/A GLU 67.A N ILE 70.A O no hydrogen 3.048 N/A ASN 69.A N GLU 67.A O no hydrogen 2.897 N/A GLN 71.A N VAL 38.A O no hydrogen 2.948 N/A TYR 72.A N ARG 65.A O no hydrogen 3.072 N/A LEU 73.A N LYS 36.A O no hydrogen 2.983 N/A PHE 74.A N GLY 63.A O no hydrogen 2.669 N/A LEU 75.A N ALA 34.A O no hydrogen 2.694 N/A GLU 76.A N LYS 60.A O no hydrogen 2.931 N/A CYS 78.A SG GLU 76.A O no hydrogen 3.984 N/A GLY 80.A N LEU 129.A O no hydrogen 2.763 N/A GLY 81.A N CYS 78.A O no hydrogen 3.051 N/A LEU 83.A N LEU 127.A O no hydrogen 2.754 N/A PHE 84.A N PRO 124.A O no hydrogen 3.204 N/A ASP 85.A N GLU 82.A O no hydrogen 3.020 N/A ARG 86.A N LEU 83.A O no hydrogen 2.856 N/A ARG 86.A NH1 ASP 133.A OD1 no hydrogen 3.025 N/A ARG 86.A NH1 ASP 133.A OD2 no hydrogen 3.413 N/A ARG 86.A NH2 GLY 80.A O no hydrogen 3.230 N/A ARG 86.A NH2 ASP 133.A OD1 no hydrogen 3.186 N/A ILE 87.A N PHE 84.A O no hydrogen 3.328 N/A GLU 88.A N GLY 92.A O no hydrogen 2.873 N/A ASP 90.A N GLY 195.A O no hydrogen 2.819 N/A ILE 91.A N GLU 88.A O no hydrogen 2.938 N/A GLY 92.A N GLU 88.A O no hydrogen 2.804 N/A ALA 98.A N PRO 94.A O no hydrogen 3.046 N/A GLN 99.A N GLU 95.A O no hydrogen 2.867 N/A GLN 99.A NE2 TRP 255.A O no hydrogen 3.020 N/A GLN 99.A NE2 LYS 258.A O no hydrogen 2.771 N/A ARG 100.A N PRO 96.A O no hydrogen 3.163 N/A ARG 100.A NH1 ASP 133.A O no hydrogen 2.957 N/A ARG 100.A NH2 ARG 132.A O no hydrogen 3.423 N/A ARG 100.A NH2 ASP 133.A O no hydrogen 3.260 N/A PHE 101.A N ASP 97.A O no hydrogen 3.032 N/A PHE 102.A N ALA 98.A O no hydrogen 2.862 N/A HIS 103.A N GLN 99.A O no hydrogen 2.876 N/A HIS 103.A NE2 TYR 256.A O no hydrogen 2.797 N/A GLN 104.A N ARG 100.A O no hydrogen 3.096 N/A GLN 104.A NE2 ASN 134.A OD1 no hydrogen 3.327 N/A LEU 105.A N PHE 101.A O no hydrogen 2.813 N/A MET 106.A N PHE 102.A O no hydrogen 2.919 N/A ALA 107.A N HIS 103.A O no hydrogen 3.038 N/A GLY 108.A N GLN 104.A O no hydrogen 3.025 N/A VAL 109.A N LEU 105.A O no hydrogen 2.928 N/A VAL 110.A N MET 106.A O no hydrogen 2.833 N/A TYR 111.A N ALA 107.A O no hydrogen 3.093 N/A TYR 111.A OH MET 52.A O no hydrogen 3.405 N/A LEU 112.A N GLY 108.A O no hydrogen 3.060 N/A HIS 113.A N VAL 109.A O no hydrogen 2.875 N/A HIS 113.A NE2 ASP 181.A OD2 no hydrogen 2.812 N/A GLY 114.A N VAL 110.A O no hydrogen 2.868 N/A ILE 115.A N TYR 111.A O no hydrogen 3.233 N/A ILE 115.A N LEU 112.A O no hydrogen 3.141 N/A GLY 116.A N HIS 113.A O no hydrogen 3.002 N/A ILE 117.A N LEU 112.A O no hydrogen 2.961 N/A THR 118.A N THR 144.A O no hydrogen 2.916 N/A THR 118.A OG1 ASP 181.A OD2 no hydrogen 2.650 N/A HIS 119.A N ASP 181.A OD2 no hydrogen 3.289 N/A HIS 119.A NE2 SER 138.A O no hydrogen 2.790 N/A ARG 120.A N ASP 181.A OD1 no hydrogen 3.164 N/A ARG 120.A NE LEU 142.A O no hydrogen 2.710 N/A ARG 120.A NH2 LEU 142.A O no hydrogen 3.086 N/A ASP 121.A N HIS 119.A ND1 no hydrogen 3.061 N/A LYS 123.A NZ THR 161.A OG1 no hydrogen 2.863 N/A GLU 125.A N GLU 125.A OE1 no hydrogen 2.740 N/A ASN 126.A N LYS 123.A O no hydrogen 2.920 N/A ASN 126.A ND2 ASP 121.A O no hydrogen 2.891 N/A ASN 126.A ND2 ASP 121.A OD2 no hydrogen 3.490 N/A LEU 127.A N PRO 124.A O no hydrogen 3.381 N/A LEU 128.A N LYS 136.A O no hydrogen 2.839 N/A LEU 129.A N GLY 81.A O no hydrogen 2.771 N/A ASP 130.A N ASN 134.A O no hydrogen 3.015 N/A GLU 131.A N GLU 131.A OE1 no hydrogen 2.793 N/A ARG 132.A N ASP 130.A OD1 no hydrogen 2.878 N/A ASP 133.A N ASP 130.A O no hydrogen 3.068 N/A ASN 134.A N ASP 130.A OD1 no hydrogen 2.864 N/A ASN 134.A ND2 ASP 130.A OD2 no hydrogen 3.478 N/A LEU 135.A N GLN 104.A OE1 no hydrogen 2.726 N/A LYS 136.A N LEU 128.A O no hydrogen 2.743 N/A LYS 136.A NZ GLU 56.A O no hydrogen 3.032 N/A LYS 136.A NZ GLU 76.A OE2 no hydrogen 3.444 N/A ILE 137.A N ASN 57.A O no hydrogen 2.858 N/A SER 138.A N ASN 126.A O no hydrogen 2.841 N/A SER 138.A OG ASN 126.A O no hydrogen 2.742 N/A GLY 141.A N ASP 139.A OD1 no hydrogen 3.114 N/A ALA 143.A N PHE 140.A O no hydrogen 3.125 N/A THR 144.A N THR 118.A O no hydrogen 3.059 N/A PHE 146.A N GLY 116.A O no hydrogen 2.796 N/A ARG 147.A N GLY 116.A O no hydrogen 3.430 N/A ARG 147.A NH1 HIS 113.A O no hydrogen 2.898 N/A ARG 147.A NH1 GLY 114.A O no hydrogen 3.519 N/A ARG 147.A NH2 HIS 113.A O no hydrogen 3.159 N/A TYR 148.A N ARG 151.A O no hydrogen 3.025 N/A ARG 151.A N TYR 148.A O no hydrogen 2.991 N/A ARG 153.A N PHE 146.A O no hydrogen 2.774 N/A LEU 155.A N PHE 175.A O no hydrogen 2.902 N/A THR 161.A OG1 ASP 121.A OD1 no hydrogen 2.682 N/A TYR 164.A N THR 161.A O no hydrogen 2.813 N/A VAL 165.A N LEU 162.A O no hydrogen 3.258 N/A GLU 168.A N GLU 168.A OE1 no hydrogen 2.743 N/A LEU 169.A N ALA 166.A O no hydrogen 3.100 N/A LEU 170.A N PRO 167.A O no hydrogen 2.923 N/A LYS 171.A N GLU 168.A O no hydrogen 3.212 N/A LYS 171.A NZ PRO 167.A O no hydrogen 2.803 N/A LYS 171.A NZ PRO 202.A O no hydrogen 2.774 N/A ARG 172.A N GLU 168.A O no hydrogen 2.858 N/A PHE 175.A N LEU 155.A O no hydrogen 2.973 N/A HIS 176.A ND1 GLU 152.A OE2 no hydrogen 2.822 N/A VAL 180.A N ALA 177.A O no hydrogen 3.204 N/A ASP 181.A N ALA 177.A O no hydrogen 3.466 N/A VAL 182.A N GLU 178.A O no hydrogen 3.033 N/A TRP 183.A N PRO 179.A O no hydrogen 2.966 N/A SER 184.A N VAL 180.A O no hydrogen 3.205 N/A SER 184.A OG VAL 180.A O no hydrogen 3.469 N/A SER 184.A OG ASP 181.A O no hydrogen 2.833 N/A CYS 185.A N ASP 181.A O no hydrogen 3.097 N/A CYS 185.A SG ASP 181.A O no hydrogen 3.273 N/A GLY 186.A N VAL 182.A O no hydrogen 3.065 N/A ILE 187.A N TRP 183.A O no hydrogen 3.068 N/A VAL 188.A N SER 184.A O no hydrogen 2.907 N/A LEU 189.A N CYS 185.A O no hydrogen 2.920 N/A THR 190.A N GLY 186.A O no hydrogen 2.938 N/A THR 190.A OG1 GLY 186.A O no hydrogen 2.952 N/A ALA 191.A N ILE 187.A O no hydrogen 2.957 N/A MET 192.A N VAL 188.A O no hydrogen 2.922 N/A LEU 193.A N LEU 189.A O no hydrogen 3.013 N/A LEU 193.A N THR 190.A O no hydrogen 3.249 N/A GLY 195.A N ALA 191.A O no hydrogen 2.750 N/A GLN 201.A NE2 SER 203.A OG no hydrogen 2.965 N/A SER 203.A OG SER 205.A OG no hydrogen 3.179 N/A SER 205.A OG SER 203.A OG no hydrogen 3.179 N/A CYS 206.A N SER 203.A O no hydrogen 2.921 N/A CYS 206.A SG GLU 208.A OE1 no hydrogen 3.709 N/A GLN 207.A NE2 ASP 211.A OD1 no hydrogen 2.833 N/A SER 210.A N CYS 206.A O no hydrogen 3.021 N/A SER 210.A OG CYS 206.A O no hydrogen 3.441 N/A ASP 211.A N GLN 207.A O no hydrogen 2.853 N/A TRP 212.A N GLU 208.A O no hydrogen 3.213 N/A TRP 212.A NE1 LEU 237.A O no hydrogen 3.027 N/A LYS 213.A N TYR 209.A O no hydrogen 3.043 N/A GLU 214.A N SER 210.A O no hydrogen 2.850 N/A LYS 215.A N TRP 212.A O no hydrogen 2.876 N/A LYS 216.A N ASP 211.A O no hydrogen 3.024 N/A LYS 216.A NZ ASP 211.A OD1 no hydrogen 3.556 N/A LYS 216.A NZ GLU 214.A OE1 no hydrogen 3.025 N/A LEU 219.A N LYS 216.A O no hydrogen 3.169 N/A LYS 223.A N LEU 219.A O no hydrogen 2.975 N/A LYS 223.A NZ TYR 218.A O no hydrogen 3.306 N/A LYS 224.A N PRO 221.A O no hydrogen 3.116 N/A LYS 224.A NZ ASP 90.A O no hydrogen 3.277 N/A LYS 224.A NZ ASP 90.A OD1 no hydrogen 2.759 N/A LYS 224.A NZ ALA 194.A O no hydrogen 2.908 N/A LYS 224.A NZ GLU 196.A OE2 no hydrogen 2.496 N/A ILE 225.A N TRP 222.A O no hydrogen 2.981 N/A ALA 228.A N ASP 226.A OD1 no hydrogen 3.137 N/A LEU 230.A N ASP 226.A O no hydrogen 2.980 N/A ALA 231.A N SER 227.A O no hydrogen 2.922 N/A LEU 232.A N ALA 228.A O no hydrogen 3.371 N/A LEU 233.A N PRO 229.A O no hydrogen 2.918 N/A HIS 234.A N LEU 230.A O no hydrogen 2.892 N/A HIS 234.A ND1 LEU 230.A O no hydrogen 3.086 N/A LYS 235.A N LEU 232.A O no hydrogen 2.953 N/A LYS 235.A NZ ASP 253.A OD2 no hydrogen 2.730 N/A ILE 236.A N LEU 232.A O no hydrogen 3.032 N/A LEU 237.A N LEU 233.A O no hydrogen 2.854 N/A SER 242.A N ASN 240.A OD1 no hydrogen 2.812 N/A ALA 243.A N ASN 240.A O no hydrogen 3.014 N/A ARG 244.A N ASN 240.A O no hydrogen 2.924 N/A ARG 244.A NE VAL 238.A O no hydrogen 2.928 N/A ARG 244.A NH1 GLU 168.A OE1 no hydrogen 3.537 N/A ARG 244.A NH1 GLU 168.A OE2 no hydrogen 2.918 N/A ARG 244.A NH1 PRO 179.A O no hydrogen 2.860 N/A ARG 244.A NH2 GLU 168.A OE1 no hydrogen 2.818 N/A ARG 244.A NH2 VAL 238.A O no hydrogen 2.900 N/A ARG 244.A NH2 GLU 239.A O no hydrogen 3.207 N/A ILE 245.A N LYS 235.A O no hydrogen 3.114 N/A ILE 250.A N THR 246.A O no hydrogen 2.886 N/A LYS 251.A N ILE 247.A O no hydrogen 2.940 N/A LYS 252.A N ASP 249.A O no hydrogen 2.949 N/A LYS 252.A NZ ASP 249.A OD1 no hydrogen 2.736 N/A ASP 253.A N ILE 250.A O no hydrogen 2.982 N/A TRP 255.A NE1 GLU 95.A OE2 no hydrogen 2.856 N/A TYR 256.A N ASP 253.A OD1 no hydrogen 2.916 N/A ASN 257.A N ASP 253.A O no hydrogen 3.062 N/A ASN 257.A N ARG 254.A O no hydrogen 3.212 N/A ASN 257.A ND2 LYS 251.A O no hydrogen 2.816 N/A ASN 257.A ND2 ASP 253.A O no hydrogen 2.940 N/A LYS 258.A N TRP 255.A O no hydrogen 2.972 N/A LYS 261.A NZ ASP 97.A OD1 no hydrogen 3.211 N/A