Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4qug_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): TYR 4.A N GLU 228.A O no hydrogen 2.919 N/A TYR 4.A OH ASP 148.A OD1 no hydrogen 2.447 N/A TYR 4.A OH THR 226.A OG1 no hydrogen 3.408 N/A LYS 5.A NZ ASP 7.A OD2 no hydrogen 2.270 N/A TYR 8.A N SER 79.A OG no hydrogen 3.248 N/A GLU 10.A N LYS 77.A O no hydrogen 2.938 N/A CYS 14.A N GLU 51.A O no hydrogen 2.853 N/A ILE 15.A N VAL 82.A O no hydrogen 2.870 N/A ILE 16.A N ARG 53.A O no hydrogen 2.843 N/A ILE 17.A N VAL 84.A O no hydrogen 2.795 N/A ASN 18.A N LYS 55.A O no hydrogen 2.769 N/A ASN 18.A ND2 ASP 35.A OD1 no hydrogen 2.900 N/A ASN 18.A ND2 ASN 56.A OD1 no hydrogen 3.210 N/A ASN 19.A N LEU 86.A O no hydrogen 2.907 N/A ASN 19.A ND2 LEU 58.A O no hydrogen 3.165 N/A ASN 19.A ND2 PHE 95.A O no hydrogen 2.997 N/A LYS 20.A N ASP 57.A OD1 no hydrogen 2.871 N/A LYS 20.A NZ ASP 35.A OD2 no hydrogen 3.120 N/A ASN 21.A N ASP 57.A OD1 no hydrogen 3.023 N/A ASN 21.A ND2 ASP 57.A OD2 no hydrogen 3.017 N/A HIS 23.A N THR 97.A O no hydrogen 2.778 N/A THR 26.A N HIS 23.A O no hydrogen 3.007 N/A THR 26.A OG1 HIS 23.A O no hydrogen 2.651 N/A GLY 27.A N LYS 24.A O no hydrogen 3.063 N/A ALA 28.A N THR 26.A OG1 no hydrogen 3.043 N/A ARG 31.A N LYS 20.A O no hydrogen 2.939 N/A ARG 31.A NH1 ASN 19.A O no hydrogen 2.931 N/A ARG 31.A NH1 THR 34.A OG1 no hydrogen 2.944 N/A THR 34.A N ARG 31.A O no hydrogen 3.154 N/A THR 34.A OG1 ASN 18.A OD1 no hydrogen 2.553 N/A ASP 37.A N GLY 33.A O no hydrogen 3.389 N/A ALA 38.A N THR 34.A O no hydrogen 2.898 N/A ALA 39.A N ASP 35.A O no hydrogen 2.987 N/A ASN 40.A N VAL 36.A O no hydrogen 2.987 N/A LEU 41.A N ASP 37.A O no hydrogen 2.838 N/A ARG 42.A N ALA 38.A O no hydrogen 3.017 N/A ARG 42.A NH1 ASN 54.A OD1 no hydrogen 2.830 N/A GLU 43.A N ALA 39.A O no hydrogen 3.119 N/A THR 44.A N ASN 40.A O no hydrogen 2.948 N/A THR 44.A OG1 ASN 40.A O no hydrogen 2.761 N/A THR 44.A OG1 ASN 40.A OD1 no hydrogen 3.532 N/A PHE 45.A N LEU 41.A O no hydrogen 2.911 N/A ARG 46.A N ARG 42.A O no hydrogen 2.931 N/A ARG 46.A NE GLU 43.A OE2 no hydrogen 2.959 N/A ARG 46.A NH2 GLU 43.A OE1 no hydrogen 3.015 N/A ASN 47.A N GLU 43.A O no hydrogen 3.070 N/A ASN 47.A ND2 GLU 43.A OE1 no hydrogen 3.122 N/A LEU 48.A N PHE 45.A O no hydrogen 3.184 N/A LYS 49.A N ARG 46.A O no hydrogen 2.897 N/A TYR 50.A N PHE 45.A O no hydrogen 2.880 N/A TYR 50.A OH SER 80.A OG no hydrogen 2.733 N/A GLU 51.A N GLY 12.A O no hydrogen 2.957 N/A ARG 53.A N CYS 14.A O no hydrogen 2.859 N/A ARG 53.A NH1 GLU 73.A OE2 no hydrogen 2.653 N/A ARG 53.A NH2 GLU 51.A OE2 no hydrogen 3.314 N/A ARG 53.A NH2 GLU 73.A OE1 no hydrogen 3.142 N/A ARG 53.A NH2 GLU 73.A OE2 no hydrogen 3.433 N/A ASN 54.A ND2 ALA 38.A O no hydrogen 3.551 N/A LYS 55.A N ILE 16.A O no hydrogen 2.760 N/A ASP 57.A N ASN 18.A O no hydrogen 2.964 N/A LEU 58.A N ASN 19.A OD1 no hydrogen 2.809 N/A THR 59.A N GLU 62.A OE1 no hydrogen 2.887 N/A ARG 60.A N ASN 98.A OD1 no hydrogen 2.855 N/A ARG 60.A NE GLU 61.A OE2 no hydrogen 3.499 N/A ARG 60.A NH1 PRO 100.A O no hydrogen 3.244 N/A GLU 62.A N THR 59.A OG1 no hydrogen 3.061 N/A ILE 63.A N THR 59.A O no hydrogen 2.981 N/A VAL 64.A N ARG 60.A O no hydrogen 3.135 N/A GLU 65.A N GLU 61.A O no hydrogen 2.950 N/A LEU 66.A N GLU 62.A O no hydrogen 2.835 N/A MET 67.A N ILE 63.A O no hydrogen 3.022 N/A ARG 68.A N VAL 64.A O no hydrogen 2.897 N/A ASP 69.A N GLU 65.A O no hydrogen 2.890 N/A VAL 70.A N LEU 66.A O no hydrogen 2.854 N/A SER 71.A N MET 67.A O no hydrogen 2.914 N/A SER 71.A OG MET 67.A O no hydrogen 3.295 N/A SER 71.A OG ARG 68.A O no hydrogen 2.751 N/A LYS 72.A N ASP 69.A O no hydrogen 3.027 N/A LYS 72.A NZ ARG 114.A O no hydrogen 3.420 N/A GLU 73.A N VAL 70.A O no hydrogen 3.108 N/A HIS 75.A N SER 117.A OG no hydrogen 2.897 N/A HIS 75.A NE2 VAL 70.A O no hydrogen 2.726 N/A SER 76.A N ASP 74.A OD1 no hydrogen 3.170 N/A SER 76.A OG.A ASP 74.A OD1 no hydrogen 2.675 N/A SER 76.A OG.B ASP 74.A OD1 no hydrogen 2.927 N/A SER 76.A OG.B ASP 74.A OD2 no hydrogen 3.015 N/A ARG 78.A N HIS 75.A O no hydrogen 2.871 N/A ARG 78.A NE GLU 10.A OE1 no hydrogen 3.324 N/A ARG 78.A NH1 GLU 73.A OE1 no hydrogen 3.083 N/A ARG 78.A NH2 GLU 73.A OE1 no hydrogen 3.434 N/A SER 79.A N GLU 10.A O no hydrogen 2.782 N/A SER 79.A OG GLU 10.A O no hydrogen 3.306 N/A SER 80.A N MET 11.A O no hydrogen 2.858 N/A SER 80.A OG MET 11.A O no hydrogen 2.846 N/A SER 80.A OG TYR 50.A OH no hydrogen 2.733 N/A PHE 81.A N PRO 122.A O no hydrogen 3.079 N/A VAL 82.A N LEU 13.A O no hydrogen 2.927 N/A CYS 83.A N LEU 124.A O no hydrogen 2.774 N/A VAL 84.A N ILE 15.A O no hydrogen 2.715 N/A LEU 85.A N ILE 126.A O no hydrogen 2.767 N/A LEU 86.A N ILE 17.A O no hydrogen 2.950 N/A SER 87.A N GLN 128.A O no hydrogen 3.107 N/A SER 87.A OG HIS 88.A O no hydrogen 3.473 N/A SER 87.A OG PHE 95.A O no hydrogen 2.616 N/A HIS 88.A NE2 THR 29.A O no hydrogen 2.728 N/A GLU 90.A N ILE 93.A O no hydrogen 3.255 N/A ILE 93.A N GLU 90.A O no hydrogen 2.871 N/A ILE 94.A N VAL 101.A O no hydrogen 2.993 N/A PHE 95.A N HIS 88.A O no hydrogen 2.842 N/A GLY 96.A N GLY 99.A O no hydrogen 2.659 N/A THR 97.A N LEU 58.A O no hydrogen 2.917 N/A ASN 98.A ND2 GLU 61.A OE1 no hydrogen 2.958 N/A GLY 99.A N GLY 96.A O no hydrogen 3.267 N/A VAL 101.A N ILE 94.A O no hydrogen 2.811 N/A LEU 103.A N GLY 92.A O no hydrogen 2.879 N/A LYS 104.A NZ GLU 146.A OE1 no hydrogen 3.414 N/A LYS 104.A NZ GLU 146.A OE2 no hydrogen 2.913 N/A LYS 105.A N ASP 102.A O no hydrogen 3.054 N/A THR 107.A N LEU 103.A O no hydrogen 3.004 N/A THR 107.A OG1 LEU 103.A O no hydrogen 3.316 N/A THR 107.A OG1 LYS 104.A O no hydrogen 3.487 N/A ASN 108.A N LYS 104.A O no hydrogen 3.005 N/A PHE 110.A N THR 107.A O no hydrogen 2.984 N/A ARG 111.A N ASN 108.A O no hydrogen 3.141 N/A ARG 111.A NE ASP 113.A OD1 no hydrogen 3.201 N/A ARG 111.A NH2 ASP 113.A OD2 no hydrogen 3.180 N/A GLY 112.A N VAL 145.A O no hydrogen 3.012 N/A ARG 114.A N ARG 111.A O no hydrogen 2.873 N/A CYS 115.A N ARG 111.A O no hydrogen 2.972 N/A CYS 115.A SG SER 71.A O no hydrogen 3.460 N/A LEU 118.A N CYS 115.A O no hydrogen 3.014 N/A THR 119.A N ARG 116.A O no hydrogen 3.188 N/A THR 119.A OG1 GLY 112.A O no hydrogen 2.652 N/A THR 119.A OG1 ARG 116.A O no hydrogen 3.106 N/A LYS 121.A N LEU 118.A O no hydrogen 2.875 N/A LYS 121.A NZ HIS 75.A O no hydrogen 2.893 N/A LYS 121.A NZ SER 76.A O no hydrogen 3.317 N/A LYS 121.A NZ ARG 78.A O no hydrogen 2.839 N/A LYS 121.A NZ SER 117.A O no hydrogen 2.898 N/A LYS 123.A N ASP 148.A O no hydrogen 2.789 N/A LYS 123.A NZ LEU 118.A O no hydrogen 2.920 N/A LYS 123.A NZ LYS 121.A O no hydrogen 2.670 N/A LEU 124.A N PHE 81.A O no hydrogen 2.775 N/A PHE 125.A N LEU 150.A O.A no hydrogen 2.813 N/A PHE 125.A N LEU 150.A O.B no hydrogen 2.827 N/A ILE 126.A N CYS 83.A O no hydrogen 2.782 N/A ILE 127.A N ALA 152.A O no hydrogen 2.989 N/A GLN 128.A N LEU 85.A O no hydrogen 2.854 N/A GLN 128.A NE2 SER 161.A OG no hydrogen 3.004 N/A CYS 130.A SG SER 161.A O no hydrogen 3.765 N/A ARG 131.A N TYR 159.A O no hydrogen 2.839 N/A ARG 131.A NH1 THR 155.A O no hydrogen 3.010 N/A ARG 131.A NH2 GLU 91.A OE2 no hydrogen 3.033 N/A GLU 134.A N GLY 158.A O no hydrogen 2.956 N/A GLY 138.A N ASP 136.A OD1 no hydrogen 2.972 N/A ALA 147.A N PRO 144.A O no hydrogen 3.082 N/A ASP 148.A N MET 224.A O no hydrogen 2.858 N/A LEU 150.A N.A LYS 123.A O no hydrogen 2.920 N/A LEU 150.A N.B LYS 123.A O no hydrogen 2.917 N/A TYR 151.A N VAL 222.A O no hydrogen 2.743 N/A ALA 152.A N PHE 125.A O no hydrogen 2.794 N/A TYR 153.A N CYS 220.A O no hydrogen 2.985 N/A SER 154.A N ILE 127.A O no hydrogen 2.967 N/A SER 154.A OG ILE 127.A O no hydrogen 3.378 N/A SER 154.A OG SER 161.A OG no hydrogen 2.667 N/A THR 155.A OG1 TYR 160.A O no hydrogen 2.792 N/A GLY 158.A N GLU 91.A OE1 no hydrogen 3.076 N/A TYR 159.A N ALA 156.A O no hydrogen 3.116 N/A TYR 160.A N GLU 134.A O no hydrogen 2.925 N/A SER 161.A OG SER 154.A OG no hydrogen 2.667 N/A TRP 162.A N GLN 217.A OE1 no hydrogen 2.638 N/A ARG 163.A NH2 SER 32.A O no hydrogen 2.894 N/A ASN 164.A N GLY 168.A O no hydrogen 3.000 N/A LYS 166.A N ASN 164.A OD1 no hydrogen 2.865 N/A ASP 167.A N ASN 164.A OD1 no hydrogen 2.846 N/A GLY 168.A N ASN 164.A O no hydrogen 2.909 N/A SER 169.A N ASP 37.A OD1 no hydrogen 3.018 N/A SER 169.A N ASP 37.A OD2 no hydrogen 3.219 N/A SER 169.A OG ASP 37.A OD1 no hydrogen 3.524 N/A SER 169.A OG ASP 37.A OD2 no hydrogen 2.556 N/A TRP 170.A N TRP 162.A O no hydrogen 3.287 N/A ILE 172.A N SER 169.A OG no hydrogen 3.261 N/A GLN 173.A N SER 169.A O no hydrogen 2.984 N/A GLN 173.A NE2 GLY 168.A O no hydrogen 2.872 N/A GLN 173.A NE2 SER 169.A O no hydrogen 3.337 N/A SER 174.A N TRP 170.A O no hydrogen 3.061 N/A SER 174.A OG TRP 170.A O no hydrogen 2.843 N/A LEU 175.A N PHE 171.A O no hydrogen 2.718 N/A CYS 176.A N ILE 172.A O no hydrogen 2.975 N/A CYS 176.A SG THR 44.A OG1 no hydrogen 3.463 N/A CYS 176.A SG ILE 172.A O no hydrogen 3.412 N/A ALA 177.A N GLN 173.A O no hydrogen 3.186 N/A MET 178.A N SER 174.A O no hydrogen 2.906 N/A LEU 179.A N LEU 175.A O no hydrogen 2.910 N/A LYS 180.A N CYS 176.A O no hydrogen 2.873 N/A GLN 181.A N ALA 177.A O no hydrogen 2.912 N/A TYR 182.A N MET 178.A O no hydrogen 2.810 N/A ALA 183.A N LEU 179.A O no hydrogen 2.889 N/A LYS 185.A N TYR 182.A O no hydrogen 2.858 N/A LYS 185.A NZ ASP 184.A OD1 no hydrogen 3.456 N/A LYS 185.A NZ ASP 184.A OD2 no hydrogen 3.024 N/A LEU 186.A N TYR 182.A O no hydrogen 2.884 N/A PHE 188.A N LEU 229.A O no hydrogen 2.865 N/A MET 189.A N GLU 187.A OE1 no hydrogen 2.940 N/A HIS 190.A N GLU 187.A O no hydrogen 2.996 N/A ILE 191.A N GLU 187.A O no hydrogen 3.089 N/A LEU 192.A N PHE 188.A O no hydrogen 2.869 N/A THR 193.A N MET 189.A O no hydrogen 2.928 N/A THR 193.A OG1 MET 189.A O no hydrogen 2.766 N/A ARG 194.A N HIS 190.A O no hydrogen 3.164 N/A VAL 195.A N ILE 191.A O no hydrogen 3.022 N/A ASN 196.A N LEU 192.A O no hydrogen 2.863 N/A ARG 197.A N THR 193.A O no hydrogen 3.003 N/A LYS 198.A N ARG 194.A O no hydrogen 2.878 N/A LYS 198.A NZ.A SER 174.A OG no hydrogen 2.897 N/A LYS 198.A NZ.B GLU 202.A OE1 no hydrogen 2.687 N/A VAL 199.A N VAL 195.A O no hydrogen 2.931 N/A ALA 200.A N ASN 196.A O no hydrogen 3.009 N/A THR 201.A N ARG 197.A O no hydrogen 2.957 N/A THR 201.A OG1 ARG 197.A O no hydrogen 2.581 N/A GLU 202.A N LYS 198.A O no hydrogen 2.970 N/A SER 205.A N LYS 215.A O no hydrogen 2.936 N/A SER 205.A OG PHE 212.A O no hydrogen 2.576 N/A SER 207.A N HIS 213.A ND1 no hydrogen 3.160 N/A SER 207.A OG ASP 209.A O no hydrogen 3.244 N/A ASP 209.A N SER 207.A OG no hydrogen 2.761 N/A THR 211.A N ASP 209.A OD1 no hydrogen 3.108 N/A PHE 212.A N ASP 209.A O no hydrogen 2.873 N/A HIS 213.A N ALA 210.A O no hydrogen 3.327 N/A ALA 214.A N SER 205.A O no hydrogen 2.790 N/A LYS 215.A N SER 205.A OG no hydrogen 2.855 N/A LYS 216.A N ASP 136.A O no hydrogen 2.685 N/A LYS 216.A NZ ALA 200.A O no hydrogen 2.701 N/A LYS 216.A NZ PHE 203.A O no hydrogen 2.898 N/A GLN 217.A NE2 SER 154.A O no hydrogen 2.781 N/A CYS 220.A N TYR 153.A O no hydrogen 2.929 N/A VAL 222.A N TYR 151.A O no hydrogen 2.806 N/A MET 224.A N PHE 149.A O no hydrogen 2.802 N/A LEU 225.A N SER 223.A OG no hydrogen 3.139 N/A THR 226.A N TYR 4.A OH no hydrogen 2.952 N/A THR 226.A OG1 TYR 4.A OH no hydrogen 3.408 N/A THR 226.A OG1 ASP 148.A OD1 no hydrogen 2.669 N/A GLU 228.A N ASN 2.A O no hydrogen 2.874 N/A LEU 229.A N GLU 187.A OE2 no hydrogen 2.756 N/A TYR 230.A OH GLU 228.A OE1 no hydrogen 2.642 N/A