Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4xu1_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ARG 2.A NH1 THR 158.A O no hydrogen 2.878 N/A ARG 2.A NH1 ASP 173.A OD2 no hydrogen 2.969 N/A ARG 2.A NH2 ASP 173.A OD1 no hydrogen 2.608 N/A ARG 2.A NH2 ASP 173.A OD2 no hydrogen 3.330 N/A ASP 3.A N ASP 1.A OD2 no hydrogen 2.942 N/A ARG 4.A N ASP 1.A O no hydrogen 3.483 N/A LEU 5.A N ARG 2.A O no hydrogen 2.966 N/A ARG 6.A N ASP 3.A O no hydrogen 3.419 N/A ARG 6.A NE THR 158.A OG1 no hydrogen 2.767 N/A ARG 6.A NH1 THR 158.A O no hydrogen 3.041 N/A ARG 6.A NH1 GLU 163.A OE1 no hydrogen 3.204 N/A LEU 9.A N GLU 59.A OE2 no hydrogen 2.767 N/A ASP 10.A N ASN 182.A OD1 no hydrogen 2.888 N/A SER 13.A N ASP 10.A OD1 no hydrogen 2.997 N/A LEU 14.A N ASP 10.A O no hydrogen 3.135 N/A ARG 15.A N GLU 11.A O no hydrogen 2.986 N/A ARG 15.A NE LEU 28.A O no hydrogen 2.751 N/A ARG 15.A NH2 LEU 28.A O no hydrogen 3.117 N/A ARG 15.A NH2 ASP 29.A OD1 no hydrogen 2.976 N/A ASP 16.A N ARG 12.A O no hydrogen 2.937 N/A GLN 17.A N SER 13.A O no hydrogen 2.973 N/A LEU 18.A N LEU 14.A O no hydrogen 2.893 N/A ILE 19.A N ARG 15.A O no hydrogen 2.930 N/A SER 23.A N GLY 20.A O no hydrogen 2.986 N/A SER 23.A OG LEU 18.A O no hydrogen 2.531 N/A GLY 24.A N GLU 193.A OE2 no hydrogen 2.722 N/A TRP 25.A N SER 23.A OG no hydrogen 3.244 N/A TRP 25.A NE1 LEU 189.A O no hydrogen 3.112 N/A ARG 26.A N GLY 53.A O no hydrogen 2.745 N/A ARG 26.A NE.A ASP 52.A O no hydrogen 2.904 N/A ARG 26.A NH1.A ASP 50.A O no hydrogen 2.660 N/A ARG 26.A NH1.A ASP 52.A O no hydrogen 2.844 N/A GLN 27.A NE2 ASP 29.A OD2 no hydrogen 2.777 N/A ASP 29.A N VAL 55.A O no hydrogen 3.102 N/A VAL 30.A N GLU 11.A OE2 no hydrogen 2.866 N/A VAL 31.A N ILE 57.A O no hydrogen 2.846 N/A THR 34.A N HIS 60.A O no hydrogen 3.155 N/A THR 34.A OG1 ASP 40.A OD1 no hydrogen 3.475 N/A THR 34.A OG1 ASP 40.A OD2 no hydrogen 2.510 N/A THR 37.A N GLN 61.A OE1 no hydrogen 2.878 N/A THR 37.A OG1 GLN 61.A OE1 no hydrogen 3.401 N/A THR 37.A OG1 SER 83.A OG no hydrogen 2.688 N/A ASN 38.A ND2 LEU 141.A O no hydrogen 3.332 N/A ASN 38.A ND2 GLU 143.A OE1 no hydrogen 2.940 N/A ALA 39.A N SER 36.A OG no hydrogen 3.157 N/A ASP 40.A N SER 36.A O no hydrogen 2.961 N/A LEU 41.A N THR 37.A O no hydrogen 3.047 N/A LEU 42.A N ASN 38.A O no hydrogen 2.944 N/A ALA 43.A N ALA 39.A O no hydrogen 2.889 N/A ARG 44.A N ASP 40.A O no hydrogen 3.016 N/A ALA 45.A N LEU 41.A O no hydrogen 3.029 N/A ALA 46.A N LEU 42.A O no hydrogen 2.878 N/A SER 47.A N ALA 43.A O no hydrogen 3.250 N/A SER 47.A N ARG 44.A O no hydrogen 3.192 N/A GLY 48.A N ALA 45.A O no hydrogen 3.062 N/A ALA 49.A N ARG 44.A O no hydrogen 3.053 N/A ASP 52.A N ASP 50.A OD1 no hydrogen 3.053 N/A GLY 53.A N GLY 85.A O no hydrogen 2.914 N/A VAL 54.A N ILE 51.A O no hydrogen 3.112 N/A VAL 55.A N GLN 27.A O no hydrogen 2.785 N/A LEU 56.A N SER 83.A O no hydrogen 2.947 N/A ILE 57.A N ASP 29.A O no hydrogen 2.884 N/A ALA 58.A N ILE 81.A O no hydrogen 2.932 N/A GLU 59.A N VAL 31.A O no hydrogen 2.936 N/A HIS 60.A N ALA 32.A O no hydrogen 3.083 N/A THR 62.A N THR 34.A O no hydrogen 2.925 N/A THR 62.A OG1 THR 34.A O no hydrogen 3.490 N/A ALA 63.A N GLY 35.A O no hydrogen 2.860 N/A ARG 65.A NH1 GLU 143.A OE1 no hydrogen 3.046 N/A ARG 65.A NH1 GLU 143.A OE2 no hydrogen 3.068 N/A ARG 65.A NH2 GLU 143.A OE1 no hydrogen 2.778 N/A GLY 66.A N ARG 70.A O no hydrogen 2.700 N/A ARG 67.A NH1 ILE 140.A O no hydrogen 2.952 N/A ARG 67.A NH2 ASP 129.A OD1 no hydrogen 2.981 N/A ARG 70.A N ARG 67.A O no hydrogen 3.026 N/A ARG 70.A NH1 ASP 259.A OD1 no hydrogen 2.877 N/A ARG 70.A NH2 ASP 259.A OD1 no hydrogen 3.193 N/A TRP 72.A N GLY 64.A O no hydrogen 3.069 N/A TRP 72.A NE1 GLN 79.A OE1 no hydrogen 2.902 N/A THR 75.A N GLN 159.A OE1 no hydrogen 3.005 N/A THR 75.A OG1 GLU 163.A OE2 no hydrogen 3.245 N/A ARG 77.A N GLU 59.A O no hydrogen 2.773 N/A ARG 77.A NH1 ASP 3.A OD1 no hydrogen 3.321 N/A ARG 77.A NH2 ASP 3.A OD1 no hydrogen 3.382 N/A ARG 77.A NH2 ARG 6.A O no hydrogen 2.776 N/A ALA 78.A N THR 75.A O no hydrogen 3.224 N/A GLN 79.A NE2 ALA 73.A O no hydrogen 2.849 N/A GLN 79.A NE2 GLN 159.A OE1 no hydrogen 2.997 N/A ILE 80.A N LEU 155.A O no hydrogen 2.967 N/A LEU 82.A N VAL 153.A O no hydrogen 3.010 N/A SER 83.A N LEU 56.A O no hydrogen 2.854 N/A SER 83.A OG THR 37.A OG1 no hydrogen 2.688 N/A SER 83.A OG ASN 38.A OD1 no hydrogen 2.656 N/A VAL 84.A N LEU 151.A O no hydrogen 2.894 N/A GLY 85.A N VAL 54.A O no hydrogen 3.080 N/A VAL 86.A N VAL 149.A O no hydrogen 2.882 N/A ARG 87.A N ASP 52.A OD1 no hydrogen 2.882 N/A VAL 88.A N PRO 147.A O no hydrogen 2.910 N/A VAL 91.A N VAL 88.A O no hydrogen 2.911 N/A ALA 95.A N PRO 92.A O no hydrogen 2.951 N/A TRP 96.A N VAL 93.A O no hydrogen 3.112 N/A TRP 96.A NE1 VAL 91.A O no hydrogen 2.893 N/A TRP 98.A N ALA 95.A O no hydrogen 3.077 N/A TRP 98.A NE1 ASP 239.A O no hydrogen 3.043 N/A LEU 99.A N TRP 96.A O no hydrogen 3.077 N/A ALA 102.A N TRP 98.A O no hydrogen 2.830 N/A ALA 103.A N LEU 99.A O no hydrogen 3.081 N/A GLY 104.A N SER 100.A O no hydrogen 3.313 N/A LEU 105.A N LEU 101.A O no hydrogen 3.127 N/A ALA 106.A N ALA 102.A O no hydrogen 3.003 N/A VAL 107.A N ALA 103.A O no hydrogen 3.012 N/A LEU 108.A N GLY 104.A O no hydrogen 2.941 N/A ASP 109.A N LEU 105.A O no hydrogen 2.872 N/A SER 110.A N ALA 106.A O no hydrogen 3.041 N/A SER 110.A N VAL 107.A O no hydrogen 3.197 N/A SER 110.A OG ALA 106.A O no hydrogen 3.565 N/A SER 110.A OG VAL 107.A O no hydrogen 2.762 N/A VAL 111.A N VAL 107.A O no hydrogen 3.287 N/A VAL 111.A N LEU 108.A O no hydrogen 3.139 N/A ALA 112.A N LEU 108.A O no hydrogen 2.858 N/A LEU 114.A N VAL 111.A O no hydrogen 2.943 N/A ILE 115.A N ALA 112.A O no hydrogen 3.359 N/A THR 122.A OG1 PRO 119.A O no hydrogen 2.702 N/A GLY 123.A N LEU 131.A O no hydrogen 2.942 N/A LEU 124.A N ARG 213.A O no hydrogen 2.799 N/A LYS 125.A N ASP 129.A O no hydrogen 2.854 N/A LYS 125.A NZ VAL 260.A O no hydrogen 3.152 N/A TRP 126.A N THR 216.A OG1 no hydrogen 2.910 N/A TRP 126.A NE1 GLY 242.A O no hydrogen 3.041 N/A ASN 128.A ND2 SER 100.A O no hydrogen 2.874 N/A VAL 130.A N ALA 138.A O no hydrogen 3.045 N/A LEU 131.A N GLY 123.A O no hydrogen 2.840 N/A ALA 132.A N GLY 135.A O no hydrogen 3.023 N/A ARG 133.A N THR 122.A OG1 no hydrogen 3.247 N/A GLY 134.A N GLU 121.A O no hydrogen 3.054 N/A GLY 135.A N ALA 132.A O no hydrogen 2.925 N/A LYS 136.A N ASP 167.A O no hydrogen 2.744 N/A LYS 136.A NZ ASP 129.A OD1 no hydrogen 2.924 N/A LYS 136.A NZ ASP 129.A OD2 no hydrogen 3.265 N/A LEU 137.A N VAL 130.A O no hydrogen 2.741 N/A ALA 138.A N VAL 130.A O no hydrogen 3.332 N/A GLY 139.A N GLY 154.A O no hydrogen 3.046 N/A LEU 141.A N GLY 152.A O no hydrogen 2.901 N/A GLU 143.A N VAL 150.A O no hydrogen 2.982 N/A ALA 145.A N PHE 148.A O no hydrogen 2.871 N/A PHE 148.A N ALA 145.A O no hydrogen 2.742 N/A VAL 149.A N VAL 86.A O no hydrogen 2.841 N/A VAL 150.A N GLU 143.A O no hydrogen 2.774 N/A LEU 151.A N VAL 84.A O no hydrogen 2.892 N/A GLY 152.A N LEU 141.A O no hydrogen 2.756 N/A VAL 153.A N LEU 82.A O no hydrogen 2.800 N/A GLY 154.A N GLY 139.A O no hydrogen 2.928 N/A LEU 155.A N ILE 80.A O no hydrogen 2.915 N/A ASN 156.A N LEU 137.A O no hydrogen 2.859 N/A ASN 156.A ND2 LYS 136.A O no hydrogen 3.266 N/A ASN 156.A ND2 THR 169.A O no hydrogen 3.205 N/A VAL 157.A N ALA 78.A O no hydrogen 3.003 N/A THR 158.A N ALA 78.A O no hydrogen 2.958 N/A GLN 159.A N ALA 78.A O no hydrogen 3.210 N/A GLN 159.A NE2 THR 75.A OG1 no hydrogen 2.915 N/A GLN 159.A NE2 GLU 163.A OE1 no hydrogen 2.795 N/A ALA 160.A N GLU 163.A OE1 no hydrogen 2.846 N/A GLU 162.A N GLU 162.A OE1 no hydrogen 2.699 N/A GLU 163.A N ALA 160.A O no hydrogen 2.917 N/A VAL 164.A N PRO 161.A O no hydrogen 3.002 N/A ASP 165.A N PRO 161.A O no hydrogen 2.860 N/A ASP 167.A N ASP 165.A OD2 no hydrogen 2.894 N/A ALA 168.A N ASP 165.A O no hydrogen 3.061 N/A THR 169.A N LYS 136.A O no hydrogen 3.084 N/A SER 170.A OG ASP 173.A OD2 no hydrogen 2.687 N/A LEU 171.A N ASN 156.A O no hydrogen 3.157 N/A LEU 172.A N VAL 157.A O no hydrogen 2.911 N/A ASP 173.A N SER 170.A OG no hydrogen 3.097 N/A LEU 174.A N SER 170.A O no hydrogen 3.030 N/A LEU 174.A N LEU 171.A O no hydrogen 3.087 N/A GLY 175.A N LEU 172.A O no hydrogen 3.024 N/A VAL 176.A N LEU 171.A O no hydrogen 3.054 N/A ARG 181.A NH1 GLU 59.A OE1 no hydrogen 3.041 N/A ARG 181.A NH1 GLN 79.A O no hydrogen 2.912 N/A ARG 181.A NH2 PRO 7.A O no hydrogen 3.020 N/A ARG 181.A NH2 GLU 59.A OE1 no hydrogen 2.697 N/A ASN 182.A ND2 ASP 10.A O no hydrogen 3.146 N/A ARG 183.A N ASP 180.A OD1 no hydrogen 2.931 N/A ILE 184.A N ASP 180.A O no hydrogen 2.975 N/A ALA 185.A N ARG 181.A O no hydrogen 2.799 N/A SER 186.A N ASN 182.A O no hydrogen 3.083 N/A SER 186.A OG GLN 17.A OE1 no hydrogen 3.284 N/A ARG 187.A N ARG 183.A O no hydrogen 3.015 N/A LEU 188.A N ILE 184.A O no hydrogen 2.872 N/A LEU 189.A N ALA 185.A O no hydrogen 3.009 N/A ARG 190.A N SER 186.A O no hydrogen 3.007 N/A ARG 190.A NH2 GLN 17.A O no hydrogen 3.332 N/A GLU 191.A N ARG 187.A O no hydrogen 2.931 N/A LEU 192.A N LEU 188.A O no hydrogen 2.842 N/A GLU 193.A N LEU 189.A O no hydrogen 2.999 N/A ALA 194.A N ARG 190.A O no hydrogen 3.303 N/A ARG 195.A N GLU 191.A O no hydrogen 3.036 N/A ARG 195.A NH1 GLN 198.A OE1 no hydrogen 2.802 N/A ARG 195.A NH1 ASP 209.A OD2 no hydrogen 2.914 N/A ARG 195.A NH2 ASP 109.A OD2 no hydrogen 3.021 N/A ARG 195.A NH2 ASP 209.A OD2 no hydrogen 3.017 N/A ILE 196.A N LEU 192.A O no hydrogen 2.835 N/A ILE 197.A N GLU 193.A O no hydrogen 3.020 N/A GLN 198.A N ALA 194.A O no hydrogen 2.945 N/A TRP 199.A N ARG 195.A O no hydrogen 2.928 N/A TRP 199.A NE1 ALA 95.A O no hydrogen 2.865 N/A ARG 200.A N ILE 196.A O no hydrogen 2.924 N/A ARG 200.A NH1 ARG 87.A O no hydrogen 2.827 N/A ARG 200.A NH1 ASP 90.A OD2.A no hydrogen 2.967 N/A ARG 200.A NH2 ARG 87.A O no hydrogen 3.122 N/A ASN 201.A N ILE 197.A O no hydrogen 3.089 N/A ASN 201.A N GLN 198.A O no hydrogen 3.157 N/A ASN 201.A ND2 ILE 197.A O no hydrogen 2.929 N/A ALA 202.A N TRP 199.A O no hydrogen 3.097 N/A ASN 203.A N GLN 198.A O no hydrogen 2.925 N/A GLN 205.A N ASN 203.A OD1 no hydrogen 2.920 N/A GLN 205.A NE2 ASP 209.A OD2 no hydrogen 3.013 N/A LEU 206.A N ASN 203.A O no hydrogen 3.161 N/A ALA 208.A N PRO 204.A O no hydrogen 3.196 N/A ASP 209.A N GLN 205.A O no hydrogen 2.834 N/A TYR 210.A N LEU 206.A O no hydrogen 2.936 N/A TYR 210.A OH PRO 127.A O no hydrogen 2.614 N/A ARG 211.A N ALA 207.A O no hydrogen 2.986 N/A ARG 211.A NE ASP 237.A OD1 no hydrogen 2.721 N/A ARG 211.A NH2 ASP 237.A OD1 no hydrogen 3.174 N/A ARG 211.A NH2 ASP 237.A OD2 no hydrogen 3.522 N/A ALA 212.A N ALA 208.A O no hydrogen 3.026 N/A ARG 213.A N ASP 209.A O no hydrogen 3.272 N/A ARG 213.A N TYR 210.A O no hydrogen 3.016 N/A ARG 213.A NE ASP 109.A OD1 no hydrogen 2.843 N/A ARG 213.A NH1 ASP 109.A OD1 no hydrogen 3.317 N/A ARG 213.A NH1 ASP 109.A OD2 no hydrogen 2.958 N/A SER 214.A N ARG 211.A O no hydrogen 3.210 N/A LEU 215.A N LEU 124.A O no hydrogen 2.770 N/A THR 216.A N SER 214.A OG no hydrogen 3.160 N/A THR 216.A OG1 HIS 262.A NE2 no hydrogen 2.911 N/A ILE 217.A N SER 214.A OG no hydrogen 3.088 N/A GLY 218.A N ALA 235.A O no hydrogen 2.716 N/A SER 219.A N THR 216.A O no hydrogen 2.952 N/A SER 219.A OG.A ARG 220.A O no hydrogen 2.992 N/A SER 219.A OG.B LEU 215.A O no hydrogen 2.741 N/A VAL 221.A N GLY 233.A O no hydrogen 2.798 N/A ARG 222.A N VAL 261.A O no hydrogen 2.995 N/A ARG 222.A NE GLU 224.A OE2 no hydrogen 3.125 N/A VAL 223.A N VAL 231.A O no hydrogen 2.681 N/A GLU 224.A N ASP 259.A O no hydrogen 2.794 N/A LEU 225.A N GLN 229.A O no hydrogen 2.737 N/A GLY 228.A N LEU 225.A O no hydrogen 2.974 N/A VAL 231.A N VAL 223.A O no hydrogen 2.901 N/A GLY 233.A N VAL 221.A O no hydrogen 2.942 N/A ILE 234.A N ASP 247.A O no hydrogen 2.877 N/A ALA 235.A N SER 219.A O no hydrogen 2.913 N/A ARG 236.A N CYS 245.A O no hydrogen 2.847 N/A ARG 236.A NH1 ASP 247.A OD2 no hydrogen 2.876 N/A ILE 238.A N ASP 237.A OD1 no hydrogen 2.800 N/A ASP 239.A N ARG 243.A O no hydrogen 2.951 N/A GLN 241.A N ASP 239.A OD1 no hydrogen 2.834 N/A GLY 242.A N ASP 239.A O no hydrogen 3.045 N/A ARG 243.A N ASP 239.A OD1 no hydrogen 2.926 N/A ARG 243.A NE ASP 239.A OD2 no hydrogen 2.801 N/A ARG 243.A NH1 ASP 239.A OD2 no hydrogen 3.077 N/A LEU 244.A N VAL 255.A O no hydrogen 2.961 N/A CYS 245.A N ASP 237.A O no hydrogen 2.753 N/A LEU 246.A N VAL 253.A O no hydrogen 2.832 N/A ASP 247.A N ILE 234.A O no hydrogen 2.772 N/A VAL 248.A N ARG 251.A O no hydrogen 2.695 N/A GLY 250.A N ASP 247.A OD1 no hydrogen 2.810 N/A ARG 251.A N VAL 248.A O no hydrogen 2.896 N/A VAL 253.A N LEU 246.A O no hydrogen 2.925 N/A VAL 255.A N LEU 244.A O no hydrogen 2.846 N/A ASP 259.A N GLU 224.A O no hydrogen 2.828 N/A VAL 261.A N ARG 222.A O no hydrogen 2.798 N/A HIS 262.A ND1 GLU 121.A OE2 no hydrogen 2.485 N/A HIS 262.A NE2 THR 216.A OG1 no hydrogen 2.911 N/A LEU 263.A N ARG 220.A O no hydrogen 2.857 N/A