Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 8iu2_R.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ARG 13.A NH1 ARG 13.A O no hydrogen 3.461 N/A TYR 16.A OH ASN 7.A O no hydrogen 3.345 N/A HIS 17.A N ARG 13.A O no hydrogen 3.088 N/A LEU 18.A N TRP 14.A O no hydrogen 2.898 N/A THR 19.A N VAL 15.A O no hydrogen 2.976 N/A THR 19.A OG1 VAL 15.A O no hydrogen 3.086 N/A THR 19.A OG1 TYR 16.A O no hydrogen 2.803 N/A SER 20.A N TYR 16.A O no hydrogen 3.073 N/A SER 20.A OG HIS 17.A O no hydrogen 2.655 N/A VAL 21.A N HIS 17.A O no hydrogen 3.140 N/A TRP 22.A N LEU 18.A O no hydrogen 2.940 N/A MET 23.A N THR 19.A O no hydrogen 2.849 N/A ILE 24.A N SER 20.A O no hydrogen 3.006 N/A PHE 25.A N VAL 21.A O no hydrogen 3.047 N/A VAL 26.A N TRP 22.A O no hydrogen 3.032 N/A VAL 27.A N MET 23.A O no hydrogen 2.948 N/A THR 28.A N ILE 24.A O no hydrogen 2.947 N/A THR 28.A OG1 ILE 24.A O no hydrogen 3.154 N/A THR 28.A OG1 PHE 25.A O no hydrogen 2.820 N/A ALA 29.A N PHE 25.A O no hydrogen 3.005 N/A SER 30.A N VAL 26.A O no hydrogen 2.868 N/A SER 30.A OG VAL 26.A O no hydrogen 2.814 N/A SER 30.A OG VAL 27.A O no hydrogen 2.788 N/A VAL 31.A N VAL 27.A O no hydrogen 2.948 N/A PHE 32.A N THR 28.A O no hydrogen 3.050 N/A THR 33.A N ALA 29.A O no hydrogen 2.918 N/A THR 33.A OG1 ALA 29.A O no hydrogen 3.319 N/A THR 33.A OG1 SER 30.A O no hydrogen 2.894 N/A ASN 34.A N SER 30.A O no hydrogen 2.853 N/A GLY 35.A N VAL 31.A O no hydrogen 2.890 N/A LEU 36.A N PHE 32.A O no hydrogen 3.228 N/A LEU 38.A N ASN 34.A O no hydrogen 3.092 N/A ALA 39.A N GLY 35.A O no hydrogen 2.818 N/A ALA 40.A N LEU 36.A O no hydrogen 2.876 N/A THR 41.A N VAL 37.A O no hydrogen 2.999 N/A THR 41.A OG1 VAL 37.A O no hydrogen 2.882 N/A MET 42.A N LEU 38.A O no hydrogen 2.958 N/A LYS 43.A N ALA 39.A O no hydrogen 2.897 N/A PHE 44.A N ALA 40.A O no hydrogen 3.447 N/A HIS 49.A N LEU 47.A O no hydrogen 2.663 N/A LEU 51.A N HIS 49.A ND1 no hydrogen 3.203 N/A ASN 52.A N HIS 49.A O no hydrogen 3.189 N/A ASN 52.A ND2 LEU 47.A O no hydrogen 3.047 N/A ASN 57.A N TRP 53.A O no hydrogen 2.957 N/A LEU 58.A N ILE 54.A O no hydrogen 2.946 N/A ALA 59.A N LEU 55.A O no hydrogen 2.982 N/A VAL 60.A N VAL 56.A O no hydrogen 2.945 N/A ALA 61.A N ASN 57.A O no hydrogen 2.967 N/A ASP 62.A N LEU 58.A O no hydrogen 3.062 N/A LEU 63.A N ALA 59.A O no hydrogen 2.965 N/A ALA 64.A N VAL 60.A O no hydrogen 2.917 N/A GLU 65.A N ALA 61.A O no hydrogen 3.070 N/A THR 66.A N ASP 62.A O no hydrogen 3.000 N/A THR 66.A OG1 ASP 62.A O no hydrogen 2.923 N/A THR 66.A OG1 LEU 63.A O no hydrogen 3.223 N/A VAL 67.A N LEU 63.A O no hydrogen 2.936 N/A ILE 68.A N ALA 64.A O no hydrogen 3.043 N/A ALA 69.A N GLU 65.A O no hydrogen 2.930 N/A SER 70.A N VAL 67.A O no hydrogen 3.177 N/A SER 70.A OG THR 66.A O no hydrogen 3.183 N/A SER 70.A OG VAL 67.A O no hydrogen 2.328 N/A THR 71.A N VAL 67.A O no hydrogen 3.085 N/A THR 71.A OG1 VAL 67.A O no hydrogen 3.513 N/A SER 73.A OG ALA 69.A O no hydrogen 2.657 N/A SER 73.A OG SER 70.A O no hydrogen 2.631 N/A ILE 74.A N SER 70.A O no hydrogen 2.886 N/A VAL 75.A N THR 71.A O no hydrogen 3.015 N/A ASN 76.A N ILE 72.A O no hydrogen 2.963 N/A ASN 76.A ND2 THR 164.A O no hydrogen 2.897 N/A GLN 77.A N SER 73.A O no hydrogen 2.863 N/A VAL 78.A N ILE 74.A O no hydrogen 2.948 N/A SER 79.A N VAL 75.A O no hydrogen 2.976 N/A SER 79.A OG VAL 75.A O no hydrogen 3.299 N/A SER 79.A OG ASN 76.A O no hydrogen 3.053 N/A SER 79.A OG TYR 81.A O no hydrogen 2.807 N/A GLY 80.A N ASN 76.A O no hydrogen 2.834 N/A PHE 82.A N PRO 2.A O no hydrogen 3.198 N/A VAL 83.A N ASN 76.A OD1 no hydrogen 3.499 N/A CYS 89.A N GLY 85.A O no hydrogen 3.028 N/A VAL 90.A N HIS 86.A O no hydrogen 2.958 N/A LEU 91.A N PRO 87.A O no hydrogen 2.927 N/A GLN 92.A N MET 88.A O no hydrogen 2.889 N/A GLY 93.A N CYS 89.A O no hydrogen 2.938 N/A TYR 94.A N VAL 90.A O no hydrogen 2.936 N/A THR 95.A N LEU 91.A O no hydrogen 2.977 N/A THR 95.A OG1 LEU 91.A O no hydrogen 2.860 N/A THR 95.A OG1 GLN 92.A O no hydrogen 2.871 N/A VAL 96.A N GLN 92.A O no hydrogen 2.919 N/A SER 97.A N GLY 93.A O no hydrogen 3.011 N/A SER 97.A OG GLY 93.A O no hydrogen 2.930 N/A SER 97.A OG TYR 94.A O no hydrogen 3.114 N/A SER 97.A OG TYR 157.A OH no hydrogen 3.002 N/A LEU 98.A N TYR 94.A O no hydrogen 2.945 N/A CYS 99.A N THR 95.A O no hydrogen 2.955 N/A CYS 99.A SG THR 95.A O no hydrogen 3.206 N/A GLY 100.A N VAL 96.A O no hydrogen 2.966 N/A ILE 101.A N SER 97.A O no hydrogen 3.028 N/A THR 102.A N LEU 98.A O no hydrogen 3.002 N/A THR 102.A OG1 LEU 98.A O no hydrogen 3.146 N/A THR 102.A OG1 CYS 99.A O no hydrogen 2.656 N/A GLY 103.A N CYS 99.A O no hydrogen 2.976 N/A LEU 104.A N GLY 100.A O no hydrogen 3.010 N/A TRP 105.A N ILE 101.A O no hydrogen 2.931 N/A SER 106.A N THR 102.A O no hydrogen 2.882 N/A SER 106.A OG THR 102.A O no hydrogen 2.931 N/A LEU 107.A N GLY 103.A O no hydrogen 3.077 N/A ALA 108.A N LEU 104.A O no hydrogen 3.180 N/A ILE 109.A N TRP 105.A O no hydrogen 2.893 N/A ILE 110.A N SER 106.A O no hydrogen 2.902 N/A SER 111.A N LEU 107.A O no hydrogen 3.132 N/A SER 111.A OG ALA 108.A O no hydrogen 2.496 N/A TRP 112.A N ALA 108.A O no hydrogen 3.020 N/A GLU 113.A N ILE 109.A O no hydrogen 2.876 N/A ARG 114.A N ILE 110.A O no hydrogen 3.015 N/A TRP 115.A N SER 111.A O no hydrogen 3.016 N/A MET 116.A N TRP 112.A O no hydrogen 2.966 N/A VAL 117.A N GLU 113.A O no hydrogen 2.939 N/A VAL 118.A N ARG 114.A O no hydrogen 2.976 N/A CYS 119.A N TRP 115.A O no hydrogen 3.001 N/A CYS 119.A SG GLN 204.A O no hydrogen 3.791 N/A LYS 120.A N MET 116.A O no hydrogen 3.221 N/A ARG 126.A NH1 VAL 125.A O no hydrogen 3.565 N/A ILE 133.A N ALA 129.A O no hydrogen 2.957 N/A VAL 134.A N LYS 130.A O no hydrogen 2.795 N/A GLY 135.A N LEU 131.A O no hydrogen 2.937 N/A ILE 136.A N ALA 132.A O no hydrogen 2.909 N/A ALA 137.A N ILE 133.A O no hydrogen 2.964 N/A PHE 138.A N VAL 134.A O no hydrogen 2.944 N/A SER 139.A N GLY 135.A O no hydrogen 3.135 N/A SER 139.A OG ILE 136.A O no hydrogen 2.744 N/A TRP 140.A N ILE 136.A O no hydrogen 3.402 N/A TRP 140.A NE1 ASN 57.A OD1 no hydrogen 2.994 N/A ILE 141.A N ALA 137.A O no hydrogen 3.024 N/A TRP 142.A N PHE 138.A O no hydrogen 2.933 N/A ALA 143.A N SER 139.A O no hydrogen 3.192 N/A ALA 144.A N TRP 140.A O no hydrogen 3.077 N/A VAL 145.A N ILE 141.A O no hydrogen 2.969 N/A TRP 146.A N TRP 142.A O no hydrogen 3.131 N/A THR 147.A N ALA 143.A O no hydrogen 2.937 N/A THR 147.A OG1 ALA 143.A O no hydrogen 2.757 N/A THR 147.A OG1 ALA 144.A O no hydrogen 3.410 N/A ALA 148.A N VAL 145.A O no hydrogen 3.227 N/A PHE 152.A N ALA 148.A O no hydrogen 3.264 N/A GLY 153.A N PRO 150.A O no hydrogen 3.065 N/A TRP 154.A N PRO 149.A O no hydrogen 2.968 N/A TYR 157.A OH SER 97.A OG no hydrogen 3.002 N/A TYR 157.A OH THR 147.A O no hydrogen 2.949 N/A TRP 158.A N GLY 167.A O no hydrogen 3.129 N/A LYS 163.A N HIS 160.A O no hydrogen 2.884 N/A GLY 167.A N TRP 158.A O no hydrogen 3.367 N/A SER 172.A OG ASP 169.A OD1 no hydrogen 2.926 N/A SER 172.A OG ASP 169.A OD2 no hydrogen 3.094 N/A SER 174.A OG ASP 169.A OD2 no hydrogen 2.969 N/A SER 174.A OG SER 172.A OG no hydrogen 2.771 N/A GLN 180.A NE2 ALA 254.A O no hydrogen 3.094 N/A GLN 180.A NE2 ALA 255.A O no hydrogen 3.244 N/A SER 181.A OG GLY 178.A O no hydrogen 3.105 N/A TYR 182.A N GLY 178.A O no hydrogen 2.703 N/A TYR 182.A OH TRP 146.A O no hydrogen 3.184 N/A MET 183.A N VAL 179.A O no hydrogen 3.495 N/A VAL 185.A N SER 181.A O no hydrogen 2.940 N/A LEU 186.A N TYR 182.A O no hydrogen 2.786 N/A MET 187.A N MET 183.A O no hydrogen 2.908 N/A VAL 188.A N ILE 184.A O no hydrogen 3.259 N/A THR 189.A N VAL 185.A O no hydrogen 2.891 N/A THR 189.A OG1 VAL 185.A O no hydrogen 3.041 N/A THR 189.A OG1 LEU 186.A O no hydrogen 3.316 N/A CYS 190.A N LEU 186.A O no hydrogen 2.725 N/A CYS 190.A SG THR 189.A OG1 no hydrogen 3.730 N/A CYS 191.A N MET 187.A O no hydrogen 2.959 N/A ILE 192.A N MET 187.A O no hydrogen 2.873 N/A ILE 193.A N VAL 188.A O no hydrogen 3.135 N/A LEU 195.A N CYS 191.A O no hydrogen 3.140 N/A ALA 196.A N ILE 192.A O no hydrogen 2.988 N/A ILE 197.A N ILE 193.A O no hydrogen 3.155 N/A ILE 198.A N PRO 194.A O no hydrogen 3.002 N/A MET 199.A N LEU 195.A O no hydrogen 2.847 N/A LEU 200.A N ALA 196.A O no hydrogen 2.992 N/A CYS 201.A N ILE 197.A O no hydrogen 2.943 N/A CYS 201.A SG ILE 197.A O no hydrogen 3.243 N/A TYR 202.A N ILE 198.A O no hydrogen 3.013 N/A LEU 203.A N MET 199.A O no hydrogen 2.932 N/A GLN 204.A N LEU 200.A O no hydrogen 3.123 N/A VAL 205.A N CYS 201.A O no hydrogen 3.054 N/A TRP 206.A N TYR 202.A O no hydrogen 2.995 N/A TRP 206.A NE1 THR 230.A OG1 no hydrogen 2.386 N/A LEU 207.A N LEU 203.A O no hydrogen 2.983 N/A ALA 208.A N GLN 204.A O no hydrogen 3.178 N/A ARG 210.A N TRP 206.A O no hydrogen 3.257 N/A ALA 211.A N LEU 207.A O no hydrogen 3.126 N/A VAL 212.A N ALA 208.A O no hydrogen 3.125 N/A ALA 213.A N ILE 209.A O no hydrogen 2.976 N/A LYS 214.A N ARG 210.A O no hydrogen 3.048 N/A GLN 215.A N ALA 211.A O no hydrogen 3.104 N/A GLN 216.A N VAL 212.A O no hydrogen 3.079 N/A SER 221.A OG SER 219.A OG no hydrogen 3.250 N/A GLN 223.A N SER 219.A O no hydrogen 3.171 N/A GLN 223.A NE2 ALA 213.A O no hydrogen 3.275 N/A GLN 223.A NE2 GLN 216.A O no hydrogen 3.287 N/A LYS 224.A N GLU 220.A O no hydrogen 2.872 N/A ALA 225.A N SER 221.A O no hydrogen 3.008 N/A GLU 226.A N THR 222.A O no hydrogen 3.116 N/A LYS 227.A N GLN 223.A O no hydrogen 3.299 N/A GLU 228.A N LYS 224.A O no hydrogen 2.981 N/A VAL 229.A N ALA 225.A O no hydrogen 2.938 N/A THR 230.A N GLU 226.A O no hydrogen 3.141 N/A THR 230.A OG1 GLU 226.A O no hydrogen 3.091 N/A ARG 231.A N LYS 227.A O no hydrogen 2.979 N/A MET 232.A N GLU 228.A O no hydrogen 2.966 N/A VAL 233.A N VAL 229.A O no hydrogen 2.940 N/A VAL 234.A N THR 230.A O no hydrogen 3.142 N/A VAL 235.A N ARG 231.A O no hydrogen 2.999 N/A MET 236.A N MET 232.A O no hydrogen 2.956 N/A ILE 237.A N VAL 233.A O no hydrogen 3.096 N/A PHE 238.A N VAL 234.A O no hydrogen 2.950 N/A ALA 239.A N VAL 235.A O no hydrogen 2.911 N/A TYR 240.A N MET 236.A O no hydrogen 2.967 N/A TYR 240.A OH CYS 191.A O no hydrogen 3.296 N/A CYS 241.A N ILE 237.A O no hydrogen 3.018 N/A CYS 241.A SG ILE 237.A O no hydrogen 3.599 N/A VAL 242.A N PHE 238.A O no hydrogen 2.962 N/A CYS 243.A N ALA 239.A O no hydrogen 3.273 N/A CYS 243.A SG ALA 239.A O no hydrogen 2.912 N/A CYS 243.A SG TYR 240.A O no hydrogen 3.417 N/A TRP 244.A N TYR 240.A O no hydrogen 3.216 N/A GLY 245.A N CYS 241.A O no hydrogen 2.770 N/A THR 248.A N TRP 244.A O no hydrogen 3.426 N/A THR 248.A OG1 GLY 245.A O no hydrogen 2.683 N/A PHE 249.A N GLY 245.A O no hydrogen 2.916 N/A PHE 250.A N PRO 246.A O no hydrogen 2.959 N/A ALA 251.A N TYR 247.A O no hydrogen 2.969 N/A CYS 252.A N THR 248.A O no hydrogen 2.878 N/A CYS 252.A SG THR 248.A O no hydrogen 3.226 N/A PHE 253.A N PHE 249.A O no hydrogen 3.095 N/A ALA 254.A N PHE 250.A O no hydrogen 3.071 N/A ALA 255.A N ALA 251.A O no hydrogen 2.953 N/A ALA 256.A N CYS 252.A O no hydrogen 2.936 N/A ASN 257.A N PHE 253.A O no hydrogen 2.827 N/A ALA 267.A N HIS 263.A O no hydrogen 2.893 N/A ALA 268.A N PRO 264.A O no hydrogen 2.859 N/A PHE 273.A N LEU 269.A O no hydrogen 3.280 N/A ALA 274.A N PRO 270.A O no hydrogen 3.360 N/A LYS 275.A N ALA 271.A O no hydrogen 2.979 N/A SER 276.A N TYR 272.A O no hydrogen 2.836 N/A SER 276.A N PHE 273.A O no hydrogen 3.215 N/A SER 276.A OG TYR 272.A O no hydrogen 3.368 N/A SER 276.A OG PHE 273.A O no hydrogen 2.773 N/A ALA 277.A N PHE 273.A O no hydrogen 3.076 N/A ALA 277.A N ALA 274.A O no hydrogen 3.129 N/A THR 278.A OG1 LYS 275.A O no hydrogen 3.433 N/A ILE 279.A N SER 276.A O no hydrogen 3.102 N/A ASN 281.A N ALA 277.A O no hydrogen 2.974 N/A ILE 284.A N TYR 280.A O no hydrogen 3.081 N/A TYR 285.A N PRO 282.A O no hydrogen 3.250 N/A PHE 287.A N PRO 282.A O no hydrogen 3.125 N/A ARG 293.A N ASN 289.A O no hydrogen 3.158 N/A ARG 293.A NE PHE 287.A O no hydrogen 3.390 N/A ARG 293.A NH1 MET 288.A O no hydrogen 3.066 N/A ASN 294.A N ARG 290.A O no hydrogen 3.043 N/A CYS 295.A N GLN 291.A O no hydrogen 3.115 N/A CYS 295.A SG GLN 291.A O no hydrogen 3.359 N/A ILE 296.A N PHE 292.A O no hydrogen 2.830 N/A LEU 297.A N ARG 293.A O no hydrogen 2.967 N/A GLN 298.A N ASN 294.A O no hydrogen 3.202 N/A