Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 2xyu_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ILE 5.A N VAL 77.A O no hydrogen 2.879 N/A SER 8.A N ASP 6.A OD1 no hydrogen 2.804 N/A SER 8.A OG ASP 6.A OD1 no hydrogen 3.125 N/A SER 8.A OG ASP 6.A OD2 no hydrogen 3.197 N/A CYS 9.A N ASP 6.A O no hydrogen 2.807 N/A ILE 10.A N ALA 7.A O no hydrogen 3.316 N/A LYS 11.A N ARG 28.A O no hydrogen 3.045 N/A GLU 13.A N SER 26.A O no hydrogen 2.908 N/A LYS 14.A N SER 26.A O no hydrogen 3.261 N/A ILE 16.A N VAL 24.A O no hydrogen 2.899 N/A GLY 17.A N VAL 24.A O no hydrogen 3.089 N/A GLY 19.A N GLY 22.A O no hydrogen 3.148 N/A GLY 22.A N GLY 19.A O no hydrogen 3.027 N/A GLU 23.A N THR 43.A O no hydrogen 3.459 N/A VAL 24.A N GLY 17.A O no hydrogen 2.936 N/A CYS 25.A N ILE 41.A O no hydrogen 2.772 N/A SER 26.A N LYS 14.A O no hydrogen 2.823 N/A GLY 27.A N VAL 39.A O no hydrogen 2.984 N/A ARG 28.A N LYS 11.A O no hydrogen 2.866 N/A LEU 29.A N ILE 37.A O no hydrogen 2.780 N/A LYS 30.A N CYS 9.A O no hydrogen 2.927 N/A LYS 34.A N VAL 31.A O no hydrogen 2.822 N/A ILE 37.A N LEU 29.A O no hydrogen 2.938 N/A VAL 39.A N GLY 27.A O no hydrogen 2.946 N/A ALA 40.A N THR 88.A O no hydrogen 2.894 N/A ILE 41.A N CYS 25.A O no hydrogen 2.683 N/A LYS 42.A N ILE 86.A O no hydrogen 2.826 N/A THR 43.A N GLU 23.A O no hydrogen 2.955 N/A LYS 45.A N PHE 21.A O no hydrogen 2.857 N/A THR 49.A N GLN 52.A OE1 no hydrogen 2.773 N/A THR 49.A OG1 GLN 52.A OE1 no hydrogen 3.260 N/A GLN 52.A N THR 49.A OG1 no hydrogen 3.235 N/A ARG 53.A N THR 49.A O no hydrogen 3.044 N/A ARG 54.A N ASP 50.A O no hydrogen 3.000 N/A ASP 55.A N LYS 51.A O no hydrogen 2.943 N/A PHE 56.A N GLN 52.A O no hydrogen 2.971 N/A PHE 56.A N ARG 53.A O no hydrogen 2.836 N/A LEU 57.A N ARG 53.A O no hydrogen 2.805 N/A SER 58.A OG ASP 55.A O no hydrogen 2.636 N/A GLU 59.A N PHE 56.A O no hydrogen 3.067 N/A SER 61.A N LEU 57.A O no hydrogen 3.208 N/A ILE 62.A N SER 58.A O no hydrogen 3.158 N/A MET 63.A N GLU 59.A O no hydrogen 3.097 N/A GLY 64.A N ALA 60.A O no hydrogen 2.804 N/A GLN 65.A N ILE 62.A O no hydrogen 2.887 N/A GLN 65.A NE2 SER 61.A O no hydrogen 3.669 N/A PHE 66.A N MET 63.A O no hydrogen 3.044 N/A ASP 67.A N TYR 125.A OH no hydrogen 2.819 N/A ASN 70.A N HIS 68.A ND1 no hydrogen 2.925 N/A ILE 71.A N HIS 68.A O no hydrogen 3.045 N/A ILE 72.A N VAL 151.A O no hydrogen 3.003 N/A HIS 73.A N GLU 89.A OE2 no hydrogen 2.714 N/A GLU 75.A N ILE 87.A O no hydrogen 2.787 N/A GLY 76.A N ILE 87.A O no hydrogen 3.181 N/A VAL 77.A N LYS 3.A O no hydrogen 2.782 N/A VAL 78.A N MET 85.A O no hydrogen 3.073 N/A THR 79.A N GLU 4.A OE2 no hydrogen 2.699 N/A THR 79.A OG1 GLU 4.A OE1 no hydrogen 2.492 N/A THR 79.A OG1 GLU 4.A OE2 no hydrogen 3.214 N/A LYS 80.A N GLU 4.A OE2 no hydrogen 2.893 N/A VAL 84.A N TYR 48.A OH no hydrogen 3.193 N/A MET 85.A N VAL 78.A O no hydrogen 3.154 N/A ILE 86.A N LYS 42.A O no hydrogen 2.898 N/A ILE 87.A N GLY 76.A O no hydrogen 2.831 N/A THR 88.A N ALA 40.A O no hydrogen 3.030 N/A THR 88.A OG1 GLU 89.A O no hydrogen 3.563 N/A GLU 89.A N HIS 73.A O no hydrogen 3.028 N/A TYR 90.A N CYS 38.A O no hydrogen 3.309 N/A GLU 92.A N GLU 92.A OE1 no hydrogen 2.664 N/A ASN 93.A N VAL 143.A O no hydrogen 2.831 N/A ASN 93.A ND2 ASN 144.A O no hydrogen 3.346 N/A GLY 94.A N MET 91.A O no hydrogen 3.121 N/A LEU 96.A N ILE 141.A O no hydrogen 2.866 N/A ALA 98.A N ASP 97.A OD1 no hydrogen 2.603 N/A PHE 99.A N SER 95.A O no hydrogen 2.910 N/A LEU 100.A N LEU 96.A O no hydrogen 2.919 N/A ARG 101.A N ASP 97.A O no hydrogen 3.099 N/A ARG 101.A NE GLY 190.A O no hydrogen 2.789 N/A ARG 101.A NH1 ASP 97.A OD2 no hydrogen 3.276 N/A ARG 101.A NH2 GLY 190.A O no hydrogen 3.464 N/A LYS 102.A N ALA 98.A O no hydrogen 3.138 N/A LYS 102.A N PHE 99.A O no hydrogen 3.295 N/A ASN 103.A N LEU 100.A O no hydrogen 2.921 N/A ASN 103.A ND2 PHE 99.A O no hydrogen 2.866 N/A ARG 106.A N ASN 103.A O no hydrogen 3.020 N/A PHE 107.A N TYR 189.A OH no hydrogen 2.976 N/A THR 108.A N GLN 111.A OE1 no hydrogen 2.975 N/A GLN 111.A N THR 108.A OG1 no hydrogen 3.179 N/A LEU 112.A N THR 108.A O no hydrogen 3.025 N/A VAL 113.A N VAL 109.A O no hydrogen 2.926 N/A GLY 114.A N ILE 110.A O no hydrogen 2.926 N/A MET 115.A N GLN 111.A O no hydrogen 3.062 N/A LEU 116.A N LEU 112.A O no hydrogen 3.009 N/A ARG 117.A N VAL 113.A O no hydrogen 2.766 N/A ARG 117.A NE ASP 248.A OD1 no hydrogen 2.817 N/A ARG 117.A NH2 ASP 248.A OD1 no hydrogen 3.384 N/A ARG 117.A NH2 ASP 248.A OD2 no hydrogen 3.010 N/A GLY 118.A N GLY 114.A O no hydrogen 2.960 N/A ILE 119.A N MET 115.A O no hydrogen 3.037 N/A GLY 120.A N LEU 116.A O no hydrogen 2.946 N/A SER 121.A N ARG 117.A O no hydrogen 2.916 N/A SER 121.A OG HIS 68.A NE2 no hydrogen 3.415 N/A GLY 122.A N GLY 118.A O no hydrogen 3.032 N/A MET 123.A N ILE 119.A O no hydrogen 2.980 N/A LYS 124.A N GLY 120.A O no hydrogen 2.934 N/A TYR 125.A N SER 121.A O no hydrogen 3.253 N/A LEU 126.A N GLY 122.A O no hydrogen 2.948 N/A SER 127.A N MET 123.A O no hydrogen 2.864 N/A SER 127.A OG MET 123.A O no hydrogen 2.857 N/A SER 127.A OG LYS 124.A O no hydrogen 3.242 N/A ASP 128.A N LYS 124.A O no hydrogen 2.764 N/A MET 129.A N TYR 125.A O no hydrogen 3.356 N/A MET 129.A N LEU 126.A O no hydrogen 3.146 N/A SER 130.A N SER 127.A O no hydrogen 2.879 N/A TYR 131.A N LEU 126.A O no hydrogen 3.150 N/A HIS 133.A N ASP 175.A OD2 no hydrogen 2.813 N/A HIS 133.A NE2 SER 152.A O no hydrogen 2.888 N/A ARG 134.A N ASP 175.A OD1 no hydrogen 3.093 N/A ASP 135.A N HIS 133.A ND1 no hydrogen 2.994 N/A ALA 138.A N GLU 185.A OE1 no hydrogen 3.016 N/A ASN 140.A N ALA 137.A O no hydrogen 2.832 N/A ASN 140.A ND2 ASP 135.A O no hydrogen 2.790 N/A ILE 141.A N ALA 138.A O no hydrogen 3.247 N/A LEU 142.A N LYS 150.A O no hydrogen 2.906 N/A VAL 143.A N GLY 94.A O no hydrogen 2.710 N/A ASN 144.A N VAL 148.A O no hydrogen 3.145 N/A SER 145.A N GLU 92.A OE1 no hydrogen 3.033 N/A SER 145.A OG GLU 92.A OE2 no hydrogen 3.220 N/A ASN 146.A N ASN 144.A OD1 no hydrogen 2.956 N/A LEU 147.A N ASN 144.A O no hydrogen 2.760 N/A VAL 148.A N ASN 144.A OD1 no hydrogen 2.824 N/A CYS 149.A SG LEU 147.A O no hydrogen 3.864 N/A LYS 150.A N LEU 142.A O no hydrogen 2.941 N/A LYS 150.A NZ GLU 89.A OE1 no hydrogen 3.005 N/A LYS 150.A NZ GLU 89.A OE2 no hydrogen 3.065 N/A VAL 151.A N ASN 70.A O no hydrogen 2.719 N/A SER 152.A N ASN 140.A O no hydrogen 2.914 N/A ARG 158.A NH1 PRO 193.A O no hydrogen 3.177 N/A ARG 158.A NH1 MET 197.A O no hydrogen 3.043 N/A ARG 158.A NH2 MET 197.A O no hydrogen 2.559 N/A ARG 158.A NH2 ASN 199.A OD1 no hydrogen 3.436 N/A TRP 159.A N PRO 156.A O no hydrogen 2.979 N/A TRP 159.A NE1 GLU 185.A OE1 no hydrogen 2.780 N/A THR 160.A N ILE 157.A O no hydrogen 2.994 N/A THR 160.A OG1 PRO 156.A O no hydrogen 2.899 N/A GLU 163.A N GLU 163.A OE1 no hydrogen 2.749 N/A ALA 164.A N ALA 161.A O no hydrogen 3.016 N/A ILE 165.A N ALA 161.A O no hydrogen 3.088 N/A ALA 166.A N PRO 162.A O no hydrogen 2.786 N/A TYR 167.A N GLU 163.A O no hydrogen 2.866 N/A LYS 169.A N GLU 163.A O no hydrogen 3.254 N/A THR 171.A N SER 174.A OG no hydrogen 2.884 N/A ALA 173.A N THR 171.A OG1 no hydrogen 2.976 N/A SER 174.A N THR 171.A OG1 no hydrogen 3.419 N/A SER 174.A OG THR 171.A O no hydrogen 2.958 N/A ASP 175.A N THR 171.A O no hydrogen 3.129 N/A VAL 176.A N SER 172.A O no hydrogen 2.999 N/A TRP 177.A N ALA 173.A O no hydrogen 3.324 N/A SER 178.A N SER 174.A O no hydrogen 3.158 N/A SER 178.A OG TRP 159.A O no hydrogen 2.607 N/A SER 178.A OG SER 174.A O no hydrogen 3.280 N/A TYR 179.A N ASP 175.A O no hydrogen 2.778 N/A TYR 179.A OH LEU 116.A O no hydrogen 2.636 N/A GLY 180.A N VAL 176.A O no hydrogen 2.966 N/A ILE 181.A N TRP 177.A O no hydrogen 3.148 N/A VAL 182.A N SER 178.A O no hydrogen 2.903 N/A MET 183.A N TYR 179.A O no hydrogen 2.854 N/A TRP 184.A N GLY 180.A O no hydrogen 3.195 N/A TRP 184.A NE1 PRO 213.A O no hydrogen 2.875 N/A GLU 185.A N ILE 181.A O no hydrogen 2.853 N/A VAL 186.A N VAL 182.A O no hydrogen 2.842 N/A MET 187.A N MET 183.A O no hydrogen 2.981 N/A SER 188.A N TRP 184.A O no hydrogen 3.117 N/A SER 188.A N GLU 185.A O no hydrogen 3.205 N/A SER 188.A OG TRP 184.A O no hydrogen 2.855 N/A SER 188.A OG GLU 185.A O no hydrogen 2.965 N/A TYR 189.A N VAL 186.A O no hydrogen 2.888 N/A GLY 190.A N GLU 185.A O no hydrogen 2.803 N/A GLU 191.A N SER 188.A OG no hydrogen 3.113 N/A ARG 192.A NH1 TRP 195.A O no hydrogen 2.732 N/A TRP 195.A N ARG 192.A O no hydrogen 2.946 N/A MET 197.A N TYR 194.A O no hydrogen 3.014 N/A SER 198.A N ASP 201.A OD2 no hydrogen 3.040 N/A ASP 201.A N SER 198.A OG no hydrogen 3.146 N/A VAL 202.A N SER 198.A O no hydrogen 3.006 N/A ILE 203.A N ASN 199.A O no hydrogen 2.994 N/A LYS 204.A N GLN 200.A O no hydrogen 3.085 N/A ALA 205.A N ASP 201.A O no hydrogen 2.850 N/A ILE 206.A N VAL 202.A O no hydrogen 2.899 N/A GLU 207.A N ILE 203.A O no hydrogen 3.084 N/A GLU 208.A N LYS 204.A O no hydrogen 3.036 N/A GLY 209.A N ILE 206.A O no hydrogen 2.861 N/A TYR 210.A N ALA 205.A O no hydrogen 2.861 N/A ARG 211.A NE TRP 230.A O no hydrogen 2.852 N/A ARG 211.A NH1 ILE 206.A O no hydrogen 2.989 N/A ARG 211.A NH1 TYR 210.A O no hydrogen 2.817 N/A ARG 211.A NH2 TRP 230.A O no hydrogen 3.009 N/A CYS 218.A N PRO 215.A O no hydrogen 2.931 N/A CYS 218.A SG PRO 219.A O no hydrogen 3.328 N/A ILE 220.A N ARG 259.A O no hydrogen 2.821 N/A HIS 223.A N PRO 219.A O no hydrogen 3.277 N/A HIS 223.A NE2 LEU 212.A O no hydrogen 2.652 N/A GLN 224.A N ILE 220.A O no hydrogen 2.849 N/A LEU 225.A N ALA 221.A O no hydrogen 3.221 N/A MET 226.A N LEU 222.A O no hydrogen 3.022 N/A LEU 227.A N HIS 223.A O no hydrogen 3.013 N/A ASP 228.A N GLN 224.A O no hydrogen 2.987 N/A CYS 229.A N LEU 225.A O no hydrogen 3.002 N/A CYS 229.A SG LEU 225.A O no hydrogen 3.349 N/A TRP 230.A N MET 226.A O no hydrogen 3.015 N/A TRP 230.A N LEU 227.A O no hydrogen 3.096 N/A GLN 231.A N ASP 228.A O no hydrogen 3.229 N/A ASP 236.A N GLU 233.A O no hydrogen 2.842 N/A ARG 237.A N ARG 234.A O no hydrogen 3.266 N/A ARG 237.A NE GLN 231.A O no hydrogen 2.824 N/A ARG 237.A NH1 GLU 163.A OE2 no hydrogen 2.825 N/A ARG 237.A NH1 ALA 173.A O no hydrogen 2.931 N/A ARG 237.A NH2 GLU 163.A OE1 no hydrogen 2.837 N/A ARG 237.A NH2 GLN 231.A O no hydrogen 3.222 N/A LYS 239.A N GLN 242.A OE1 no hydrogen 2.884 N/A ILE 243.A N LYS 239.A O no hydrogen 2.954 N/A VAL 244.A N PHE 240.A O no hydrogen 2.884 N/A ASN 245.A N GLY 241.A O no hydrogen 3.043 N/A MET 246.A N GLN 242.A O no hydrogen 2.839 N/A LEU 247.A N ILE 243.A O no hydrogen 2.974 N/A ASP 248.A N VAL 244.A O no hydrogen 2.926 N/A LYS 249.A N ASN 245.A O no hydrogen 3.020 N/A LEU 250.A N MET 246.A O no hydrogen 3.047 N/A ILE 251.A N LEU 247.A O no hydrogen 2.883 N/A ARG 252.A N ASP 248.A O no hydrogen 2.654 N/A ASN 253.A N LYS 249.A O no hydrogen 2.866 N/A ASN 253.A ND2 LYS 249.A O no hydrogen 2.950 N/A SER 256.A N ASN 253.A O no hydrogen 2.841 N/A SER 256.A OG ASN 253.A O no hydrogen 2.846 N/A LEU 257.A N PRO 254.A O no hydrogen 3.202 N/A LYS 258.A N ASN 255.A O no hydrogen 3.157 N/A