Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4d0s_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LEU 2.A N GLN 30.A OE1 no hydrogen 2.854 N/A LEU 3.A N GLN 30.A O no hydrogen 2.861 N/A ASP 4.A N GLY 1.A O no hydrogen 3.300 N/A GLY 5.A N GLY 31.A O no hydrogen 3.294 N/A LYS 6.A N LEU 3.A O no hydrogen 2.962 N/A LYS 6.A NZ ASP 235.A OD1 no hydrogen 2.807 N/A ARG 7.A N ASP 85.A OD2 no hydrogen 2.904 N/A ILE 8.A N GLN 33.A O no hydrogen 2.922 N/A LEU 9.A N GLY 86.A O no hydrogen 2.899 N/A VAL 10.A N VAL 35.A O no hydrogen 2.817 N/A SER 11.A N VAL 88.A O no hydrogen 3.067 N/A SER 11.A OG VAL 88.A O no hydrogen 2.779 N/A ILE 14.A N SER 18.A OG no hydrogen 3.033 N/A THR 15.A N SER 18.A OG no hydrogen 3.071 N/A THR 15.A OG1 SER 17.A OG no hydrogen 2.723 N/A SER 17.A N THR 15.A OG1 no hydrogen 3.027 N/A SER 17.A OG THR 15.A OG1 no hydrogen 2.723 N/A SER 18.A N THR 15.A O no hydrogen 3.135 N/A SER 18.A OG THR 15.A O no hydrogen 3.166 N/A PHE 21.A N SER 18.A O no hydrogen 2.999 N/A HIS 22.A N SER 18.A O no hydrogen 3.431 N/A ILE 23.A N ILE 19.A O no hydrogen 2.896 N/A ALA 24.A N ALA 20.A O no hydrogen 2.828 N/A ARG 25.A N PHE 21.A O no hydrogen 2.921 N/A ARG 25.A NH1 GLU 29.A OE2 no hydrogen 3.020 N/A ARG 25.A NH2 HIS 22.A ND1 no hydrogen 3.271 N/A ARG 25.A NH2 THR 223.A OG1 no hydrogen 3.285 N/A VAL 26.A N HIS 22.A O no hydrogen 2.914 N/A ALA 27.A N ILE 23.A O no hydrogen 2.825 N/A GLN 28.A N ALA 24.A O no hydrogen 2.929 N/A GLN 28.A NE2 ALA 52.A O no hydrogen 2.990 N/A GLU 29.A N ARG 25.A O no hydrogen 2.953 N/A GLN 30.A N VAL 26.A O no hydrogen 2.939 N/A GLY 31.A N GLN 28.A O no hydrogen 3.018 N/A ALA 32.A N ALA 27.A O no hydrogen 3.066 N/A GLN 33.A N LYS 6.A O no hydrogen 2.799 N/A VAL 35.A N ILE 8.A O no hydrogen 3.023 N/A LEU 36.A N PRO 55.A O no hydrogen 2.870 N/A THR 37.A N VAL 10.A O no hydrogen 3.031 N/A GLY 38.A N LEU 57.A O no hydrogen 3.059 N/A GLN 44.A NE2 GLN 44.A O no hydrogen 3.082 N/A GLN 44.A NE2 ASP 48.A OD1 no hydrogen 2.708 N/A ARG 45.A N LEU 42.A O no hydrogen 3.297 N/A THR 47.A N ILE 43.A O no hydrogen 2.846 N/A THR 47.A OG1 ILE 43.A O no hydrogen 3.403 N/A THR 47.A OG1 GLN 44.A O no hydrogen 3.299 N/A ASP 48.A N GLN 44.A O no hydrogen 2.828 N/A ARG 49.A N ILE 46.A O no hydrogen 2.945 N/A ARG 49.A NH1 ASP 16.A OD2 no hydrogen 2.775 N/A LEU 50.A N THR 47.A O no hydrogen 3.101 N/A ALA 52.A N GLN 28.A OE1 no hydrogen 3.003 N/A LEU 57.A N LEU 36.A O no hydrogen 2.782 N/A LEU 59.A N GLY 38.A O no hydrogen 2.942 N/A ASP 60.A N HIS 66.A ND1 no hydrogen 2.892 N/A GLN 62.A N ASP 60.A OD1 no hydrogen 2.962 N/A GLN 62.A NE2 HIS 117.A ND1 no hydrogen 3.028 N/A ASN 63.A N ASP 60.A O no hydrogen 2.918 N/A HIS 66.A N ASN 63.A OD1 no hydrogen 3.099 N/A LEU 67.A N ASN 63.A O no hydrogen 3.189 N/A ALA 68.A N GLU 64.A O no hydrogen 2.887 N/A SER 69.A N GLU 65.A O no hydrogen 3.123 N/A SER 69.A OG GLU 65.A O no hydrogen 3.187 N/A SER 69.A OG HIS 66.A O no hydrogen 3.318 N/A LEU 70.A N LEU 67.A O no hydrogen 3.390 N/A ARG 73.A N SER 69.A O no hydrogen 2.991 N/A ARG 73.A NE SER 69.A OG no hydrogen 2.843 N/A ARG 73.A NH1 GLU 58.A O no hydrogen 2.802 N/A ARG 73.A NH2 GLU 58.A O no hydrogen 3.043 N/A ARG 73.A NH2 HIS 66.A O no hydrogen 2.879 N/A VAL 74.A N LEU 70.A O no hydrogen 2.849 N/A THR 75.A N ALA 71.A O no hydrogen 2.873 N/A THR 75.A OG1 ALA 71.A O no hydrogen 3.029 N/A GLU 76.A N GLY 72.A O no hydrogen 3.025 N/A ALA 77.A N ARG 73.A O no hydrogen 3.130 N/A ILE 78.A N VAL 74.A O no hydrogen 2.875 N/A GLY 79.A N THR 75.A O no hydrogen 2.826 N/A ASN 82.A N GLY 79.A O no hydrogen 3.043 N/A ASN 82.A ND2 ILE 78.A O no hydrogen 2.804 N/A LYS 83.A NZ PRO 132.A O no hydrogen 3.170 N/A LEU 84.A N ILE 133.A O no hydrogen 2.802 N/A ASP 85.A N ARG 7.A O no hydrogen 2.658 N/A GLY 86.A N ARG 7.A O no hydrogen 3.149 N/A VAL 87.A N SER 139.A O no hydrogen 2.957 N/A VAL 88.A N LEU 9.A O no hydrogen 2.779 N/A HIS 89.A N VAL 141.A O no hydrogen 2.793 N/A HIS 89.A NE2 SER 122.A OG no hydrogen 2.753 N/A SER 90.A N SER 11.A OG no hydrogen 3.254 N/A PHE 93.A N SER 119.A OG no hydrogen 2.946 N/A THR 97.A OG1 ASP 111.A OD2 no hydrogen 2.673 N/A GLY 98.A N PRO 95.A O no hydrogen 2.791 N/A GLY 100.A N ALA 153.A O no hydrogen 2.801 N/A ASN 102.A ND2 THR 97.A O no hydrogen 2.857 N/A ASP 106.A N PRO 103.A O no hydrogen 2.914 N/A ASP 111.A N PRO 108.A O no hydrogen 3.118 N/A VAL 112.A N PRO 108.A O no hydrogen 3.188 N/A SER 113.A N TYR 109.A O no hydrogen 2.729 N/A LYS 114.A N ALA 110.A O no hydrogen 3.120 N/A GLY 115.A N ASP 111.A O no hydrogen 3.065 N/A ILE 116.A N VAL 112.A O no hydrogen 2.810 N/A HIS 117.A N SER 113.A O no hydrogen 2.873 N/A ILE 118.A N LYS 114.A O no hydrogen 3.124 N/A SER 119.A N GLY 115.A O no hydrogen 2.883 N/A SER 119.A OG PHE 93.A O no hydrogen 2.858 N/A SER 119.A OG GLY 115.A O no hydrogen 2.853 N/A ALA 120.A N ILE 116.A O no hydrogen 2.887 N/A TYR 121.A N ILE 116.A O no hydrogen 3.063 N/A SER 122.A N HIS 117.A O no hydrogen 2.935 N/A SER 122.A OG HIS 89.A NE2 no hydrogen 2.753 N/A SER 122.A OG ILE 118.A O no hydrogen 2.612 N/A TYR 123.A N ALA 120.A O no hydrogen 3.051 N/A TYR 123.A OH SER 182.A OG no hydrogen 2.785 N/A SER 125.A N TYR 121.A O no hydrogen 3.133 N/A SER 125.A OG TYR 121.A O no hydrogen 3.544 N/A MET 126.A N SER 122.A O no hydrogen 2.883 N/A ALA 127.A N TYR 123.A O no hydrogen 3.157 N/A LYS 128.A N ALA 124.A O no hydrogen 2.860 N/A ALA 129.A N SER 125.A O no hydrogen 3.034 N/A LEU 130.A N MET 126.A O no hydrogen 2.909 N/A LEU 131.A N ALA 127.A O no hydrogen 2.843 N/A ILE 133.A N LEU 130.A O no hydrogen 2.882 N/A MET 134.A N LEU 131.A O no hydrogen 3.006 N/A ASN 135.A N LEU 84.A O no hydrogen 2.849 N/A ASN 135.A ND2 ASP 85.A OD1 no hydrogen 2.931 N/A GLY 137.A N GLY 179.A O no hydrogen 2.800 N/A GLY 138.A N ASN 135.A O no hydrogen 3.015 N/A SER 139.A N ASP 85.A O no hydrogen 2.985 N/A SER 139.A OG LEU 232.A O no hydrogen 2.759 N/A ILE 140.A N ARG 181.A O no hydrogen 2.791 N/A VAL 141.A N VAL 87.A O no hydrogen 2.855 N/A GLY 142.A N ASN 183.A O no hydrogen 2.981 N/A MET 143.A N HIS 89.A O no hydrogen 3.119 N/A ASP 144.A N VAL 185.A O no hydrogen 2.831 N/A SER 148.A N ASP 146.A OD1 no hydrogen 3.095 N/A SER 148.A OG ASP 146.A OD1 no hydrogen 2.861 N/A SER 148.A OG ASP 146.A OD2 no hydrogen 3.392 N/A TYR 154.A N PRO 152.A O no hydrogen 2.865 N/A TRP 156.A N GLY 98.A O no hydrogen 2.900 N/A TRP 156.A NE1 PHE 104.A O no hydrogen 2.851 N/A MET 157.A N TYR 154.A O no hydrogen 2.777 N/A THR 158.A N TYR 154.A O no hydrogen 3.278 N/A VAL 159.A N ASN 155.A O no hydrogen 3.300 N/A ALA 160.A N TRP 156.A O no hydrogen 2.865 N/A LYS 161.A N MET 157.A O no hydrogen 2.869 N/A LYS 161.A NZ MET 143.A O no hydrogen 2.963 N/A SER 162.A N THR 158.A O no hydrogen 2.921 N/A SER 162.A OG THR 158.A O no hydrogen 3.396 N/A ALA 163.A N VAL 159.A O no hydrogen 2.981 N/A LEU 164.A N ALA 160.A O no hydrogen 2.836 N/A GLU 165.A N LYS 161.A O no hydrogen 2.870 N/A SER 166.A N SER 162.A O no hydrogen 3.315 N/A VAL 167.A N ALA 163.A O no hydrogen 2.845 N/A ASN 168.A N LEU 164.A O no hydrogen 2.865 N/A ASN 168.A ND2 ASP 243.A O no hydrogen 3.101 N/A ARG 169.A N GLU 165.A O no hydrogen 3.346 N/A PHE 170.A N SER 166.A O no hydrogen 3.309 N/A VAL 171.A N VAL 167.A O no hydrogen 2.819 N/A ALA 172.A N ASN 168.A O no hydrogen 2.898 N/A GLU 174.A N PHE 170.A O no hydrogen 3.289 N/A ALA 175.A N VAL 171.A O no hydrogen 2.736 N/A GLY 176.A N ALA 172.A O no hydrogen 2.952 N/A LYS 177.A N GLU 174.A O no hydrogen 3.273 N/A TYR 178.A N ALA 175.A O no hydrogen 2.947 N/A GLY 179.A N GLY 176.A O no hydrogen 2.988 N/A VAL 180.A N ALA 175.A O no hydrogen 3.003 N/A ARG 181.A N GLY 138.A O no hydrogen 2.972 N/A ARG 181.A NH1 LEU 232.A O no hydrogen 2.917 N/A ARG 181.A NH2 GLY 137.A O no hydrogen 3.382 N/A ARG 181.A NH2 SER 234.A O no hydrogen 3.026 N/A SER 182.A N THR 241.A OG1 no hydrogen 2.950 N/A SER 182.A OG TYR 123.A OH no hydrogen 2.785 N/A SER 182.A OG ASN 168.A OD1 no hydrogen 2.652 N/A ASN 183.A N ILE 140.A O no hydrogen 2.907 N/A ASN 183.A ND2 THR 240.A O no hydrogen 2.997 N/A LEU 184.A N ASP 243.A O no hydrogen 2.857 N/A VAL 185.A N GLY 142.A O no hydrogen 2.838 N/A ALA 186.A N ILE 245.A O no hydrogen 2.822 N/A ALA 187.A N ASP 144.A O no hydrogen 3.040 N/A GLY 188.A N ALA 247.A O no hydrogen 3.268 N/A ARG 191.A N MET 219.A O no hydrogen 2.848 N/A GLY 199.A N GLY 195.A O no hydrogen 3.089 N/A ALA 200.A N GLU 196.A O no hydrogen 2.973 N/A GLN 201.A N GLU 197.A O no hydrogen 3.190 N/A ILE 202.A N ALA 198.A O no hydrogen 2.969 N/A GLN 203.A N GLY 199.A O no hydrogen 3.090 N/A LEU 204.A N ALA 200.A O no hydrogen 3.011 N/A LEU 205.A N GLN 201.A O no hydrogen 3.049 N/A GLU 206.A N ILE 202.A O no hydrogen 3.008 N/A GLU 207.A N GLN 203.A O no hydrogen 2.955 N/A GLY 208.A N LEU 204.A O no hydrogen 2.922 N/A TRP 209.A N LEU 205.A O no hydrogen 3.161 N/A TRP 209.A NE1 ASP 248.A O no hydrogen 2.983 N/A ASP 210.A N GLU 206.A O no hydrogen 3.337 N/A GLN 211.A N GLU 207.A O no hydrogen 3.044 N/A GLN 211.A NE2 GLU 207.A O no hydrogen 3.354 N/A ARG 212.A N GLY 208.A O no hydrogen 2.808 N/A ALA 213.A N TRP 209.A O no hydrogen 2.896 N/A GLY 216.A N ALA 213.A O no hydrogen 2.872 N/A TRP 217.A N ASP 210.A OD1 no hydrogen 2.942 N/A TRP 217.A NE1 PRO 189.A O no hydrogen 2.761 N/A LYS 220.A N ASN 218.A OD1 no hydrogen 2.987 N/A ASP 221.A N ASN 218.A O no hydrogen 3.132 N/A THR 223.A N ASP 221.A OD1 no hydrogen 3.135 N/A THR 223.A OG1 ASP 221.A OD1 no hydrogen 3.133 N/A ALA 226.A N ALA 222.A O no hydrogen 2.960 N/A LYS 227.A N THR 223.A O no hydrogen 2.865 N/A THR 228.A N PRO 224.A O no hydrogen 3.153 N/A THR 228.A OG1 PRO 224.A O no hydrogen 2.800 N/A VAL 229.A N VAL 225.A O no hydrogen 3.035 N/A CYS 230.A N ALA 226.A O no hydrogen 2.981 N/A CYS 230.A SG ALA 226.A O no hydrogen 3.433 N/A ALA 231.A N LYS 227.A O no hydrogen 2.844 N/A LEU 232.A N THR 228.A O no hydrogen 3.131 N/A LEU 233.A N VAL 229.A O no hydrogen 2.934 N/A SER 234.A N CYS 230.A O no hydrogen 3.003 N/A SER 234.A N ALA 231.A O no hydrogen 3.294 N/A SER 234.A OG ALA 231.A O no hydrogen 2.693 N/A TRP 236.A N SER 234.A OG no hydrogen 3.004 N/A THR 241.A OG1 SER 182.A O no hydrogen 3.480 N/A GLY 242.A N SER 182.A O no hydrogen 2.692 N/A ASP 243.A N ASN 183.A OD1 no hydrogen 3.027 N/A ILE 244.A N ASP 243.A OD1 no hydrogen 2.921 N/A ILE 245.A N LEU 184.A O no hydrogen 2.915 N/A ALA 247.A N ALA 186.A O no hydrogen 2.816 N/A GLY 250.A N ASP 248.A OD1 no hydrogen 2.902 N/A ALA 251.A N ASP 248.A O no hydrogen 3.260 N/A HIS 252.A N ASP 248.A OD2 no hydrogen 2.908 N/A THR 253.A N GLY 250.A O no hydrogen 3.026 N/A THR 253.A OG1 GLY 250.A O no hydrogen 2.702 N/A GLN 254.A N ALA 251.A O no hydrogen 3.145 N/A GLN 254.A NE2 THR 253.A OG1 no hydrogen 2.935 N/A