Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4xu2_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ASP 1.A N ASP 1.A OD1 no hydrogen 2.444 N/A ARG 2.A NH1 THR 156.A O no hydrogen 2.896 N/A ARG 2.A NH1 ASP 171.A OD2 no hydrogen 3.027 N/A ARG 2.A NH2 ASP 171.A OD1 no hydrogen 2.812 N/A ARG 2.A NH2 ASP 171.A OD2 no hydrogen 3.447 N/A LEU 5.A N ARG 2.A O no hydrogen 2.915 N/A ARG 6.A N ASP 3.A O no hydrogen 3.265 N/A ARG 6.A NE THR 156.A OG1 no hydrogen 2.903 N/A ARG 6.A NH1 THR 156.A O no hydrogen 3.017 N/A ARG 6.A NH1 GLU 161.A OE1 no hydrogen 3.123 N/A LEU 9.A N GLU 59.A OE2 no hydrogen 2.724 N/A ASP 10.A N ASN 180.A OD1 no hydrogen 2.841 N/A SER 13.A N ASP 10.A OD1 no hydrogen 3.137 N/A LEU 14.A N ASP 10.A O no hydrogen 3.069 N/A ARG 15.A N GLU 11.A O no hydrogen 2.993 N/A ARG 15.A NE LEU 28.A O no hydrogen 2.767 N/A ARG 15.A NH2 LEU 28.A O no hydrogen 3.148 N/A ASP 16.A N ARG 12.A O no hydrogen 3.122 N/A GLN 17.A N SER 13.A O no hydrogen 3.143 N/A GLN 17.A NE2 SER 13.A O no hydrogen 3.406 N/A GLN 17.A NE2 SER 13.A OG no hydrogen 3.018 N/A LEU 18.A N LEU 14.A O no hydrogen 2.985 N/A ILE 19.A N ARG 15.A O no hydrogen 2.945 N/A SER 23.A N GLY 20.A O no hydrogen 3.215 N/A SER 23.A OG LEU 18.A O no hydrogen 2.537 N/A SER 23.A OG GLU 191.A OE1 no hydrogen 3.409 N/A GLY 24.A N GLU 191.A OE1 no hydrogen 3.263 N/A GLY 24.A N GLU 191.A OE2 no hydrogen 3.052 N/A TRP 25.A NE1 LEU 187.A O no hydrogen 3.033 N/A ARG 26.A N GLY 53.A O no hydrogen 2.839 N/A ARG 26.A NE ASP 52.A O no hydrogen 2.696 N/A ARG 26.A NH1 ASP 50.A O no hydrogen 2.777 N/A ARG 26.A NH1 ASP 52.A O no hydrogen 2.769 N/A GLN 27.A NE2 ASP 29.A OD2 no hydrogen 2.746 N/A ASP 29.A N VAL 55.A O no hydrogen 3.067 N/A VAL 30.A N GLU 11.A OE2 no hydrogen 2.862 N/A VAL 31.A N ILE 57.A O no hydrogen 2.773 N/A THR 34.A N HIS 60.A O no hydrogen 3.233 N/A THR 34.A OG1 ASP 40.A OD1 no hydrogen 3.496 N/A THR 34.A OG1 ASP 40.A OD2 no hydrogen 2.467 N/A THR 37.A N GLN 61.A OE1 no hydrogen 2.979 N/A THR 37.A OG1 GLN 61.A OE1 no hydrogen 3.427 N/A THR 37.A OG1 SER 83.A OG no hydrogen 2.599 N/A ASN 38.A ND2 LEU 139.A O no hydrogen 3.395 N/A ASN 38.A ND2 GLU 141.A OE1 no hydrogen 2.859 N/A ALA 39.A N SER 36.A OG no hydrogen 3.327 N/A ASP 40.A N SER 36.A O no hydrogen 2.977 N/A LEU 41.A N THR 37.A O no hydrogen 3.174 N/A LEU 42.A N ASN 38.A O no hydrogen 3.024 N/A ALA 43.A N ALA 39.A O no hydrogen 2.874 N/A ARG 44.A N ASP 40.A O no hydrogen 2.990 N/A ALA 45.A N LEU 41.A O no hydrogen 3.108 N/A ALA 46.A N LEU 42.A O no hydrogen 2.964 N/A SER 47.A N ALA 43.A O no hydrogen 3.199 N/A SER 47.A N ARG 44.A O no hydrogen 3.015 N/A SER 47.A OG ALA 43.A O no hydrogen 3.401 N/A GLY 48.A N ALA 45.A O no hydrogen 3.106 N/A ALA 49.A N ARG 44.A O no hydrogen 3.042 N/A ASP 52.A N ASP 50.A OD1 no hydrogen 3.408 N/A GLY 53.A N GLY 85.A O no hydrogen 2.945 N/A VAL 54.A N ILE 51.A O no hydrogen 3.053 N/A VAL 55.A N GLN 27.A O no hydrogen 2.685 N/A LEU 56.A N SER 83.A O no hydrogen 2.944 N/A ILE 57.A N ASP 29.A O no hydrogen 2.824 N/A ALA 58.A N ILE 81.A O no hydrogen 2.855 N/A GLU 59.A N VAL 31.A O no hydrogen 2.963 N/A THR 62.A N THR 34.A O no hydrogen 3.006 N/A THR 62.A OG1 THR 34.A O no hydrogen 3.501 N/A ALA 63.A N GLY 35.A O no hydrogen 2.865 N/A ARG 65.A NH1 GLU 141.A OE2 no hydrogen 3.350 N/A GLY 66.A N ARG 70.A O no hydrogen 2.742 N/A ARG 67.A NH1 ASN 126.A O no hydrogen 3.279 N/A ARG 67.A NH1 ILE 138.A O no hydrogen 2.978 N/A ARG 67.A NH2 ASP 127.A OD1 no hydrogen 3.014 N/A ARG 70.A N ARG 67.A O no hydrogen 3.160 N/A ARG 70.A NH1 ASP 257.A OD2 no hydrogen 3.037 N/A ARG 70.A NH2 ASP 257.A OD1 no hydrogen 2.825 N/A TRP 72.A N GLY 64.A O no hydrogen 3.158 N/A TRP 72.A NE1 GLN 79.A OE1 no hydrogen 3.045 N/A THR 75.A N GLN 157.A OE1 no hydrogen 2.982 N/A ARG 77.A N GLU 59.A O no hydrogen 2.858 N/A ARG 77.A NH1 ASP 3.A OD1 no hydrogen 3.493 N/A ARG 77.A NH2 ASP 3.A OD1 no hydrogen 3.431 N/A ARG 77.A NH2 ARG 6.A O no hydrogen 2.696 N/A ALA 78.A N THR 75.A O no hydrogen 3.375 N/A GLN 79.A NE2 ALA 73.A O no hydrogen 2.973 N/A GLN 79.A NE2 GLN 157.A OE1 no hydrogen 2.945 N/A ILE 80.A N LEU 153.A O no hydrogen 2.955 N/A LEU 82.A N VAL 151.A O no hydrogen 3.089 N/A SER 83.A N LEU 56.A O no hydrogen 2.924 N/A SER 83.A OG THR 37.A OG1 no hydrogen 2.599 N/A SER 83.A OG ASN 38.A OD1 no hydrogen 2.574 N/A VAL 84.A N LEU 149.A O no hydrogen 2.905 N/A GLY 85.A N VAL 54.A O no hydrogen 3.154 N/A VAL 86.A N VAL 147.A O no hydrogen 2.973 N/A ARG 87.A N ASP 52.A OD1 no hydrogen 2.926 N/A VAL 88.A N PRO 145.A O no hydrogen 3.086 N/A VAL 91.A N VAL 88.A O no hydrogen 2.918 N/A ALA 95.A N PRO 92.A O no hydrogen 3.055 N/A TRP 96.A N VAL 93.A O no hydrogen 3.313 N/A TRP 96.A NE1 VAL 91.A O no hydrogen 2.781 N/A TRP 98.A N ALA 95.A O no hydrogen 3.191 N/A TRP 98.A NE1 ASP 237.A O no hydrogen 3.091 N/A LEU 99.A N TRP 96.A O no hydrogen 3.215 N/A SER 100.A OG.A ASN 126.A OD1 no hydrogen 2.088 N/A ALA 102.A N TRP 98.A O no hydrogen 2.881 N/A ALA 103.A N LEU 99.A O no hydrogen 3.227 N/A GLY 104.A N SER 100.A O no hydrogen 3.487 N/A LEU 105.A N LEU 101.A O no hydrogen 3.214 N/A ALA 106.A N ALA 102.A O no hydrogen 3.082 N/A VAL 107.A N ALA 103.A O no hydrogen 3.076 N/A LEU 108.A N GLY 104.A O no hydrogen 3.048 N/A ASP 109.A N LEU 105.A O no hydrogen 3.021 N/A SER 110.A N ALA 106.A O no hydrogen 3.123 N/A SER 110.A N VAL 107.A O no hydrogen 3.299 N/A SER 110.A OG ALA 106.A O no hydrogen 3.507 N/A SER 110.A OG VAL 107.A O no hydrogen 2.575 N/A VAL 111.A N LEU 108.A O no hydrogen 3.238 N/A ALA 112.A N LEU 108.A O no hydrogen 2.875 N/A LEU 114.A N VAL 111.A O no hydrogen 3.020 N/A ILE 115.A N VAL 111.A O no hydrogen 3.395 N/A ILE 115.A N ALA 112.A O no hydrogen 3.170 N/A THR 120.A OG1 PRO 117.A O no hydrogen 2.974 N/A GLY 121.A N LEU 129.A O no hydrogen 2.899 N/A LEU 122.A N ARG 211.A O no hydrogen 2.866 N/A LYS 123.A N ASP 127.A O no hydrogen 2.745 N/A LYS 123.A NZ VAL 258.A O no hydrogen 3.239 N/A TRP 124.A N THR 214.A OG1 no hydrogen 2.956 N/A TRP 124.A NE1 GLY 240.A O no hydrogen 3.022 N/A ASN 126.A ND2 SER 100.A O no hydrogen 2.615 N/A ASN 126.A ND2 PRO 125.A O no hydrogen 3.395 N/A ASP 127.A N LYS 123.A O no hydrogen 3.007 N/A VAL 128.A N ALA 136.A O no hydrogen 3.105 N/A LEU 129.A N GLY 121.A O no hydrogen 2.770 N/A ALA 130.A N GLY 133.A O no hydrogen 2.983 N/A GLY 133.A N ALA 130.A O no hydrogen 3.048 N/A LYS 134.A N ASP 165.A O no hydrogen 2.931 N/A LYS 134.A NZ ASP 127.A OD1 no hydrogen 3.188 N/A LEU 135.A N VAL 128.A O no hydrogen 2.757 N/A ALA 136.A N VAL 128.A O no hydrogen 3.341 N/A GLY 137.A N GLY 152.A O no hydrogen 3.040 N/A LEU 139.A N GLY 150.A O no hydrogen 2.960 N/A GLU 141.A N VAL 148.A O no hydrogen 2.995 N/A ALA 143.A N PHE 146.A O no hydrogen 2.817 N/A PHE 146.A N ALA 143.A O no hydrogen 2.668 N/A VAL 147.A N VAL 86.A O no hydrogen 2.794 N/A VAL 148.A N GLU 141.A O no hydrogen 2.774 N/A LEU 149.A N VAL 84.A O no hydrogen 2.940 N/A GLY 150.A N LEU 139.A O no hydrogen 2.717 N/A VAL 151.A N LEU 82.A O no hydrogen 2.782 N/A GLY 152.A N GLY 137.A O no hydrogen 3.007 N/A LEU 153.A N ILE 80.A O no hydrogen 3.041 N/A ASN 154.A N LEU 135.A O no hydrogen 2.951 N/A VAL 155.A N ALA 78.A O no hydrogen 3.135 N/A THR 156.A N ALA 78.A O no hydrogen 3.046 N/A GLN 157.A NE2 THR 75.A OG1 no hydrogen 2.766 N/A GLN 157.A NE2 GLU 161.A OE1 no hydrogen 2.716 N/A ALA 158.A N GLU 161.A OE1 no hydrogen 3.035 N/A GLU 160.A N GLU 160.A OE1 no hydrogen 2.781 N/A GLU 161.A N ALA 158.A O no hydrogen 2.880 N/A VAL 162.A N PRO 159.A O no hydrogen 3.212 N/A ASP 163.A N PRO 159.A O no hydrogen 2.836 N/A ASP 165.A N ASP 163.A OD2 no hydrogen 2.890 N/A ALA 166.A N ASP 163.A O no hydrogen 3.078 N/A THR 167.A N LYS 134.A O no hydrogen 3.133 N/A SER 168.A OG GLN 157.A O no hydrogen 3.253 N/A SER 168.A OG ASP 171.A OD2 no hydrogen 2.522 N/A LEU 169.A N ASN 154.A O no hydrogen 3.248 N/A LEU 170.A N VAL 155.A O no hydrogen 3.058 N/A ASP 171.A N SER 168.A OG no hydrogen 3.231 N/A LEU 172.A N LEU 169.A O no hydrogen 3.069 N/A GLY 173.A N LEU 170.A O no hydrogen 3.219 N/A VAL 174.A N LEU 169.A O no hydrogen 2.967 N/A ARG 179.A NH1 GLU 59.A OE1 no hydrogen 3.057 N/A ARG 179.A NH1 GLN 79.A O no hydrogen 2.893 N/A ARG 179.A NH2 PRO 7.A O no hydrogen 3.002 N/A ARG 179.A NH2 GLU 59.A OE1 no hydrogen 2.633 N/A ARG 181.A N ASP 178.A OD1 no hydrogen 3.285 N/A ILE 182.A N ASP 178.A O no hydrogen 2.985 N/A ALA 183.A N ARG 179.A O no hydrogen 2.797 N/A SER 184.A N ASN 180.A O no hydrogen 3.282 N/A SER 184.A OG GLN 17.A OE1 no hydrogen 3.165 N/A ARG 185.A N ARG 181.A O no hydrogen 3.069 N/A LEU 186.A N ILE 182.A O no hydrogen 2.805 N/A LEU 187.A N ALA 183.A O no hydrogen 3.103 N/A ARG 188.A N SER 184.A O no hydrogen 3.186 N/A ARG 188.A NH1 GLN 17.A O no hydrogen 3.202 N/A GLU 189.A N ARG 185.A O no hydrogen 3.004 N/A LEU 190.A N LEU 186.A O no hydrogen 2.822 N/A GLU 191.A N LEU 187.A O no hydrogen 3.076 N/A ALA 192.A N ARG 188.A O no hydrogen 3.363 N/A ARG 193.A N GLU 189.A O no hydrogen 3.091 N/A ARG 193.A NH1 GLN 196.A OE1 no hydrogen 2.811 N/A ARG 193.A NH1 ASP 207.A OD2 no hydrogen 2.845 N/A ARG 193.A NH2 ASP 109.A OD2 no hydrogen 3.227 N/A ARG 193.A NH2 ASP 207.A OD2 no hydrogen 3.088 N/A ILE 194.A N LEU 190.A O no hydrogen 2.952 N/A ILE 195.A N GLU 191.A O no hydrogen 3.106 N/A GLN 196.A N ALA 192.A O no hydrogen 3.008 N/A TRP 197.A N ARG 193.A O no hydrogen 2.903 N/A TRP 197.A NE1 ALA 95.A O no hydrogen 2.690 N/A ARG 198.A N ILE 194.A O no hydrogen 2.902 N/A ARG 198.A NH1 ARG 87.A O no hydrogen 2.826 N/A ARG 198.A NH1 ASP 90.A OD2 no hydrogen 3.141 N/A ARG 198.A NH2 ARG 87.A O no hydrogen 3.090 N/A ASN 199.A N ILE 195.A O no hydrogen 3.111 N/A ASN 199.A ND2 ILE 195.A O no hydrogen 2.899 N/A ALA 200.A N TRP 197.A O no hydrogen 3.201 N/A ASN 201.A N GLN 196.A O no hydrogen 2.846 N/A GLN 203.A N ASN 201.A OD1 no hydrogen 2.966 N/A GLN 203.A NE2 ASP 207.A OD2 no hydrogen 3.145 N/A LEU 204.A N ASN 201.A O no hydrogen 3.100 N/A ALA 206.A N PRO 202.A O no hydrogen 3.192 N/A ASP 207.A N GLN 203.A O no hydrogen 2.738 N/A TYR 208.A N LEU 204.A O no hydrogen 3.041 N/A ARG 209.A N ALA 205.A O no hydrogen 3.105 N/A ARG 209.A NH2 ILE 236.A O no hydrogen 2.969 N/A ALA 210.A N ALA 206.A O no hydrogen 3.237 N/A ALA 210.A N ASP 207.A O no hydrogen 3.260 N/A ARG 211.A N TYR 208.A O no hydrogen 3.115 N/A ARG 211.A NE ASP 109.A OD1 no hydrogen 3.210 N/A ARG 211.A NH1 ASP 109.A OD1 no hydrogen 3.281 N/A ARG 211.A NH1 ASP 109.A OD2 no hydrogen 3.340 N/A SER 212.A N ARG 209.A O no hydrogen 3.464 N/A LEU 213.A N LEU 122.A O no hydrogen 2.858 N/A THR 214.A N SER 212.A OG no hydrogen 3.303 N/A THR 214.A OG1 HIS 260.A NE2 no hydrogen 2.988 N/A ILE 215.A N SER 212.A OG no hydrogen 3.084 N/A GLY 216.A N ALA 233.A O no hydrogen 2.671 N/A SER 217.A N THR 214.A O no hydrogen 3.015 N/A SER 217.A OG.A ARG 218.A O no hydrogen 3.301 N/A SER 217.A OG.B LEU 213.A O no hydrogen 2.987 N/A VAL 219.A N GLY 231.A O no hydrogen 2.849 N/A ARG 220.A N VAL 259.A O no hydrogen 2.942 N/A VAL 221.A N VAL 229.A O no hydrogen 2.808 N/A GLU 222.A N ASP 257.A O no hydrogen 2.808 N/A LEU 223.A N GLN 227.A O no hydrogen 2.720 N/A GLY 226.A N LEU 223.A O no hydrogen 3.149 N/A VAL 229.A N VAL 221.A O no hydrogen 2.922 N/A GLY 231.A N VAL 219.A O no hydrogen 3.057 N/A ILE 232.A N ASP 245.A O no hydrogen 2.961 N/A ALA 233.A N SER 217.A O no hydrogen 3.149 N/A ARG 234.A N CYS 243.A O no hydrogen 2.907 N/A ARG 234.A NH1 ASP 245.A OD2 no hydrogen 3.109 N/A ILE 236.A N ASP 235.A OD1 no hydrogen 2.554 N/A ASP 237.A N ARG 241.A O no hydrogen 3.058 N/A GLN 239.A N ASP 237.A OD1 no hydrogen 3.052 N/A GLY 240.A N ASP 237.A O no hydrogen 3.225 N/A ARG 241.A N ASP 237.A OD1 no hydrogen 2.613 N/A ARG 241.A NE ASP 237.A OD2 no hydrogen 2.734 N/A ARG 241.A NH1 ASP 237.A OD2 no hydrogen 3.277 N/A LEU 242.A N VAL 253.A O no hydrogen 2.876 N/A CYS 243.A N ASP 235.A O no hydrogen 2.839 N/A LEU 244.A N VAL 251.A O no hydrogen 2.814 N/A ASP 245.A N ILE 232.A O no hydrogen 2.771 N/A VAL 246.A N ARG 249.A O no hydrogen 2.789 N/A GLY 248.A N ASP 245.A OD1 no hydrogen 2.981 N/A ARG 249.A N VAL 246.A O no hydrogen 3.123 N/A VAL 251.A N LEU 244.A O no hydrogen 2.972 N/A VAL 253.A N LEU 242.A O no hydrogen 2.819 N/A ASP 257.A N GLU 222.A O no hydrogen 3.000 N/A VAL 259.A N ARG 220.A O no hydrogen 2.995 N/A HIS 260.A NE2 THR 214.A OG1 no hydrogen 2.988 N/A LEU 261.A N ARG 218.A O no hydrogen 2.685 N/A