Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 8u5g_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ILE 8.A N ASN 4.A O no hydrogen 3.188 N/A ILE 9.A N LEU 5.A O no hydrogen 2.870 N/A GLY 10.A N ASP 6.A O no hydrogen 2.843 N/A ARG 11.A N SER 7.A O no hydrogen 3.179 N/A ARG 11.A NE SER 7.A O no hydrogen 3.168 N/A ARG 11.A NE SER 7.A OG no hydrogen 3.344 N/A ARG 11.A NH1 GLU 30.A OE1 no hydrogen 3.042 N/A ARG 11.A NH2 SER 7.A OG no hydrogen 3.147 N/A ARG 11.A NH2 GLU 30.A OE1 no hydrogen 3.148 N/A ARG 11.A NH2 GLU 30.A OE2 no hydrogen 2.412 N/A LEU 12.A N ILE 8.A O no hydrogen 3.001 N/A LEU 13.A N ILE 9.A O no hydrogen 2.864 N/A GLN 16.A N LEU 13.A O no hydrogen 3.145 N/A GLN 16.A NE2 GLU 73.A OE1 no hydrogen 2.791 N/A SER 18.A N VAL 15.A O no hydrogen 3.193 N/A SER 18.A OG VAL 15.A O no hydrogen 3.158 N/A GLY 21.A N GLN 95.A OE1 no hydrogen 2.972 N/A ASN 23.A ND2 LYS 94.A O no hydrogen 3.033 N/A ASN 23.A ND2 GLU 98.A OE2 no hydrogen 3.111 N/A VAL 24.A N GLU 98.A OE2 no hydrogen 3.235 N/A THR 27.A N GLU 30.A OE1 no hydrogen 2.791 N/A GLU 30.A N THR 27.A OG1 no hydrogen 3.255 N/A ILE 31.A N THR 27.A O no hydrogen 3.187 N/A ARG 32.A N GLU 28.A O no hydrogen 2.982 N/A ARG 32.A NH2 GLU 28.A OE2 no hydrogen 3.314 N/A GLY 33.A N ASN 29.A O no hydrogen 2.792 N/A LEU 34.A N GLU 30.A O no hydrogen 3.016 N/A CYS 35.A N ILE 31.A O no hydrogen 3.005 N/A CYS 35.A SG ILE 31.A O no hydrogen 3.485 N/A LEU 36.A N ARG 32.A O no hydrogen 2.869 N/A LYS 37.A N GLY 33.A O no hydrogen 2.843 N/A SER 38.A N LEU 34.A O no hydrogen 3.206 N/A SER 38.A OG LEU 34.A O no hydrogen 2.739 N/A SER 38.A OG CYS 35.A O no hydrogen 3.073 N/A ARG 39.A N CYS 35.A O no hydrogen 2.979 N/A GLU 40.A N LEU 36.A O no hydrogen 3.177 N/A ILE 41.A N LYS 37.A O no hydrogen 3.340 N/A PHE 42.A N SER 38.A O no hydrogen 2.864 N/A LEU 43.A N ARG 39.A O no hydrogen 3.060 N/A SER 44.A N GLU 40.A O no hydrogen 3.075 N/A SER 44.A N ILE 41.A O no hydrogen 3.138 N/A SER 44.A OG GLU 40.A O no hydrogen 3.277 N/A SER 44.A OG ILE 41.A O no hydrogen 2.835 N/A GLN 45.A N PHE 42.A O no hydrogen 3.309 N/A GLN 45.A NE2 PRO 111.A O no hydrogen 2.674 N/A LEU 49.A N ALA 158.A O no hydrogen 2.879 N/A LEU 51.A N ILE 160.A O no hydrogen 3.100 N/A ALA 53.A N ASP 162.A OD2 no hydrogen 2.924 N/A LEU 55.A N VAL 281.A O no hydrogen 3.055 N/A LYS 56.A N ASN 82.A O no hydrogen 2.615 N/A LYS 56.A NZ SER 280.A OG no hydrogen 3.291 N/A LYS 56.A NZ GLN 290.A OE1 no hydrogen 3.494 N/A ILE 57.A N MET 279.A O no hydrogen 2.692 N/A CYS 58.A N LEU 84.A O no hydrogen 3.095 N/A GLY 59.A N SER 264.A OG no hydrogen 2.757 N/A ILE 61.A N ASP 88.A O no hydrogen 2.852 N/A HIS 62.A N ASP 88.A O no hydrogen 2.841 N/A HIS 62.A NE2 ASP 60.A OD2 no hydrogen 2.871 N/A GLY 63.A N TYR 89.A O no hydrogen 2.789 N/A GLN 64.A N ILE 61.A O no hydrogen 2.958 N/A TYR 65.A OH LEU 12.A O no hydrogen 2.453 N/A ASP 67.A N GLN 64.A O no hydrogen 3.058 N/A LEU 68.A N GLN 64.A O no hydrogen 3.082 N/A LEU 69.A N TYR 65.A O no hydrogen 3.053 N/A ARG 70.A N TYR 66.A O no hydrogen 3.292 N/A ARG 70.A NH1 ASP 67.A OD1 no hydrogen 3.120 N/A ARG 70.A NH2 LYS 293.A O no hydrogen 2.999 N/A LEU 71.A N ASP 67.A O no hydrogen 2.878 N/A PHE 72.A N LEU 68.A O no hydrogen 3.082 N/A GLU 73.A N LEU 69.A O no hydrogen 3.113 N/A TYR 74.A N ARG 70.A O no hydrogen 3.096 N/A GLY 75.A N LEU 71.A O no hydrogen 2.784 N/A GLU 80.A N PHE 77.A O no hydrogen 2.867 N/A SER 81.A OG GLY 75.A O no hydrogen 2.955 N/A ASN 82.A ND2 PRO 54.A O no hydrogen 3.238 N/A TYR 83.A N ASN 113.A O no hydrogen 3.248 N/A TYR 83.A OH GLY 76.A O no hydrogen 2.430 N/A LEU 84.A N LYS 56.A O no hydrogen 3.033 N/A PHE 85.A N PHE 115.A O no hydrogen 2.797 N/A LEU 86.A N CYS 58.A O no hydrogen 3.069 N/A ASP 88.A N GLU 122.A OE1 no hydrogen 2.868 N/A TYR 89.A N GLU 122.A OE2 no hydrogen 2.828 N/A TYR 89.A OH LEU 117.A O no hydrogen 2.710 N/A ASP 91.A N SER 96.A OG no hydrogen 2.918 N/A LYS 94.A N ARG 92.A O no hydrogen 2.129 N/A SER 96.A N GLU 135.A OE1 no hydrogen 3.007 N/A LEU 97.A N GLU 135.A OE2 no hydrogen 2.932 N/A GLU 98.A N GLU 98.A OE1 no hydrogen 2.527 N/A THR 99.A N GLN 95.A O no hydrogen 3.440 N/A THR 99.A OG1 GLY 63.A O no hydrogen 3.126 N/A THR 99.A OG1 GLN 95.A O no hydrogen 2.871 N/A ILE 100.A N SER 96.A O no hydrogen 2.990 N/A CYS 101.A N LEU 97.A O no hydrogen 2.881 N/A CYS 101.A SG LEU 97.A O no hydrogen 3.054 N/A LEU 102.A N GLU 98.A O no hydrogen 2.991 N/A LEU 103.A N THR 99.A O no hydrogen 3.207 N/A LEU 104.A N ILE 100.A O no hydrogen 2.794 N/A ALA 105.A N CYS 101.A O no hydrogen 2.826 N/A TYR 106.A N LEU 102.A O no hydrogen 2.932 N/A LYS 107.A N LEU 103.A O no hydrogen 2.872 N/A LYS 107.A NZ GLN 45.A OE1 no hydrogen 2.991 N/A LYS 107.A NZ PRO 111.A O no hydrogen 2.863 N/A LYS 107.A NZ PHE 114.A O no hydrogen 2.966 N/A ILE 108.A N LEU 104.A O no hydrogen 2.926 N/A LYS 109.A N ALA 105.A O no hydrogen 2.860 N/A LYS 109.A NZ TYR 110.A OH no hydrogen 2.975 N/A TYR 110.A N TYR 106.A O no hydrogen 2.858 N/A ASN 113.A N TYR 110.A O no hydrogen 3.140 N/A ASN 113.A ND2 ASN 82.A OD1 no hydrogen 3.171 N/A PHE 115.A N TYR 83.A O no hydrogen 2.801 N/A LEU 117.A N PHE 85.A O no hydrogen 2.841 N/A ARG 118.A N PRO 156.A O no hydrogen 2.939 N/A ARG 118.A NE GLU 122.A O no hydrogen 2.852 N/A ARG 118.A NH1 THR 189.A O no hydrogen 2.912 N/A ARG 118.A NH2 GLU 122.A O no hydrogen 3.091 N/A ARG 118.A NH2 ASN 153.A OD1 no hydrogen 2.966 N/A GLY 119.A N GLU 122.A OE1 no hydrogen 2.825 N/A HIS 121.A N ASP 88.A OD1 no hydrogen 2.897 N/A HIS 121.A ND1 VAL 90.A O no hydrogen 2.829 N/A GLU 122.A N GLY 119.A O no hydrogen 2.940 N/A CYS 123.A SG SER 125.A OG no hydrogen 3.362 N/A ASN 127.A N SER 125.A OG no hydrogen 3.316 N/A ARG 128.A NH1 ASP 193.A OD1 no hydrogen 3.400 N/A ASP 134.A N TYR 130.A O no hydrogen 2.776 N/A GLU 135.A N GLY 131.A O no hydrogen 2.754 N/A CYS 136.A N PHE 132.A O no hydrogen 2.973 N/A CYS 136.A SG PHE 132.A O no hydrogen 3.448 N/A LYS 137.A N TYR 133.A O no hydrogen 3.258 N/A LYS 137.A NZ ASP 134.A OD1 no hydrogen 3.233 N/A ARG 138.A N ASP 134.A O no hydrogen 3.063 N/A ARG 138.A NH1 ASP 134.A OD1 no hydrogen 3.191 N/A ARG 138.A NH1 ASP 134.A OD2 no hydrogen 2.716 N/A ARG 139.A N GLU 135.A O no hydrogen 3.066 N/A ARG 139.A NH1 GLU 98.A OE1 no hydrogen 3.008 N/A ARG 139.A NH1 GLU 98.A OE2 no hydrogen 3.323 N/A ARG 139.A NH1 GLU 135.A OE2 no hydrogen 2.865 N/A ARG 139.A NH2 GLU 98.A OE2 no hydrogen 2.913 N/A TYR 140.A N CYS 136.A O no hydrogen 2.715 N/A TYR 140.A OH LEU 26.A O no hydrogen 2.814 N/A ASN 141.A ND2 GLU 28.A OE2 no hydrogen 3.301 N/A LEU 144.A N ASN 141.A O no hydrogen 3.277 N/A LEU 144.A N ASN 141.A OD1 no hydrogen 3.009 N/A LYS 146.A N ILE 142.A O no hydrogen 3.130 N/A THR 147.A N LYS 143.A O no hydrogen 2.981 N/A THR 147.A OG1 LYS 143.A O no hydrogen 3.493 N/A PHE 148.A N LEU 144.A O no hydrogen 3.089 N/A THR 149.A N TRP 145.A O no hydrogen 3.063 N/A THR 149.A OG1 LYS 146.A O no hydrogen 2.419 N/A ASP 150.A N LYS 146.A O no hydrogen 3.117 N/A CYS 151.A N THR 147.A O no hydrogen 3.193 N/A CYS 151.A SG CYS 35.A O no hydrogen 3.750 N/A CYS 151.A SG SER 38.A OG no hydrogen 3.380 N/A PHE 152.A N PHE 148.A O no hydrogen 2.722 N/A ASN 153.A N THR 149.A O no hydrogen 2.762 N/A CYS 154.A N CYS 151.A O no hydrogen 3.052 N/A CYS 154.A SG ASP 150.A O no hydrogen 3.563 N/A LEU 155.A N PHE 152.A O no hydrogen 3.115 N/A ILE 157.A N ILE 47.A O no hydrogen 3.008 N/A ALA 159.A N CYS 167.A O no hydrogen 2.816 N/A ILE 160.A N LEU 49.A O no hydrogen 2.832 N/A VAL 161.A N ILE 165.A O no hydrogen 2.800 N/A ASP 162.A N LEU 51.A O no hydrogen 2.831 N/A LYS 164.A N VAL 161.A O no hydrogen 3.042 N/A LYS 164.A NZ GLU 163.A O no hydrogen 3.516 N/A LYS 164.A NZ ASP 236.A O no hydrogen 3.027 N/A ILE 165.A N VAL 161.A O no hydrogen 3.118 N/A PHE 166.A N LEU 239.A O no hydrogen 2.913 N/A CYS 167.A N ALA 159.A O no hydrogen 2.637 N/A CYS 167.A SG ILE 165.A O no hydrogen 3.929 N/A CYS 168.A N CYS 241.A O no hydrogen 3.319 N/A CYS 168.A SG GLY 171.A O no hydrogen 3.519 N/A CYS 168.A SG LEU 200.A O no hydrogen 3.866 N/A HIS 169.A ND1 LEU 86.A O no hydrogen 2.884 N/A HIS 169.A NE2 HIS 244.A ND1 no hydrogen 3.017 N/A GLY 170.A N LEU 200.A O no hydrogen 2.850 N/A SER 173.A OG ASP 199.A OD2 no hydrogen 2.852 N/A ASP 175.A N SER 173.A OG no hydrogen 3.229 N/A LEU 176.A N SER 173.A O no hydrogen 3.172 N/A GLN 177.A N GLN 181.A OE1 no hydrogen 2.664 N/A SER 178.A N GLN 181.A OE1 no hydrogen 3.044 N/A GLU 180.A N SER 178.A OG no hydrogen 3.105 N/A GLN 181.A N SER 178.A O no hydrogen 3.146 N/A GLN 181.A NE2 ASP 175.A O no hydrogen 2.926 N/A ARG 183.A N MET 179.A O no hydrogen 3.169 N/A ARG 183.A NH2 GLU 50.A OE2 no hydrogen 3.503 N/A ARG 184.A N GLU 180.A O no hydrogen 2.975 N/A ILE 185.A N ILE 182.A O no hydrogen 3.216 N/A ARG 187.A NH1 CYS 154.A O no hydrogen 2.924 N/A ARG 187.A NH2 GLN 45.A O no hydrogen 2.534 N/A THR 189.A N ASN 153.A O no hydrogen 3.196 N/A THR 189.A OG1 ASP 190.A O no hydrogen 2.972 N/A ASP 199.A N GLY 195.A O no hydrogen 2.939 N/A LEU 200.A N LEU 196.A O no hydrogen 2.916 N/A LEU 201.A N CYS 198.A O no hydrogen 3.082 N/A TRP 202.A N ASP 199.A O no hydrogen 3.233 N/A SER 203.A N ASP 199.A O no hydrogen 3.079 N/A SER 203.A OG LEU 172.A O no hydrogen 2.883 N/A SER 203.A OG ASP 199.A O no hydrogen 2.984 N/A ASP 204.A N PHE 221.A O no hydrogen 3.325 N/A ASP 206.A N PHE 223.A O no hydrogen 2.806 N/A ASP 208.A N ASP 206.A OD1 no hydrogen 3.378 N/A GLY 213.A N THR 222.A O no hydrogen 2.723 N/A ASN 215.A ND2 ASP 204.A OD2 no hydrogen 3.226 N/A ASN 215.A ND2 PHE 221.A O no hydrogen 2.578 N/A ARG 217.A N ASN 215.A OD1 no hydrogen 2.939 N/A ARG 217.A NH1 ASP 204.A OD2 no hydrogen 2.623 N/A ARG 217.A NH2 HIS 244.A O no hydrogen 2.998 N/A GLY 218.A N ASN 215.A O no hydrogen 3.132 N/A SER 220.A OG ASP 199.A OD1 no hydrogen 2.528 N/A THR 222.A N GLY 213.A O no hydrogen 3.001 N/A THR 222.A OG1 GLU 214.A O no hydrogen 3.346 N/A PHE 223.A N ASP 204.A O no hydrogen 2.933 N/A GLY 224.A N GLY 211.A O no hydrogen 2.938 N/A GLU 226.A N GLU 226.A OE1 no hydrogen 2.856 N/A VAL 228.A N GLY 224.A O no hydrogen 3.225 N/A ALA 229.A N ALA 225.A O no hydrogen 2.947 N/A LYS 230.A N GLU 226.A O no hydrogen 2.907 N/A PHE 231.A N VAL 227.A O no hydrogen 2.951 N/A LEU 232.A N VAL 228.A O no hydrogen 3.020 N/A HIS 233.A N ALA 229.A O no hydrogen 3.140 N/A LYS 234.A N LYS 230.A O no hydrogen 2.959 N/A LYS 234.A NZ GLN 177.A O no hydrogen 2.986 N/A LYS 234.A NZ GLN 177.A OE1 no hydrogen 3.333 N/A HIS 235.A N PHE 231.A O no hydrogen 3.286 N/A ASP 236.A N HIS 233.A O no hydrogen 3.475 N/A LEU 237.A N LEU 232.A O no hydrogen 2.857 N/A ASP 238.A N LYS 164.A O no hydrogen 2.803 N/A LEU 239.A N LYS 164.A O no hydrogen 3.273 N/A ILE 240.A N GLN 258.A O no hydrogen 2.947 N/A CYS 241.A N PHE 166.A O no hydrogen 2.706 N/A ARG 242.A N VAL 260.A O no hydrogen 3.064 N/A ARG 242.A NH1 GLY 170.A O no hydrogen 2.922 N/A ALA 243.A N HIS 169.A O no hydrogen 3.188 N/A HIS 244.A N ASP 60.A OD1 no hydrogen 3.191 N/A GLY 250.A N VAL 247.A O no hydrogen 3.336 N/A GLU 252.A N THR 261.A O no hydrogen 3.099 N/A PHE 254.A N LEU 259.A O no hydrogen 2.895 N/A GLN 258.A N ALA 255.A O no hydrogen 3.111 N/A LEU 259.A N PHE 254.A O no hydrogen 2.985 N/A VAL 260.A N ILE 240.A O no hydrogen 2.985 N/A THR 261.A N GLU 252.A O no hydrogen 2.794 N/A LEU 262.A N ARG 242.A O no hydrogen 2.719 N/A PHE 263.A N GLY 250.A O no hydrogen 2.794 N/A SER 264.A N ASP 60.A O no hydrogen 3.095 N/A SER 264.A OG ALA 277.A O no hydrogen 2.809 N/A ASN 267.A N ASN 274.A O no hydrogen 3.040 N/A TYR 268.A N ASN 274.A OD1 no hydrogen 2.918 N/A TYR 268.A OH ASP 91.A OD2 no hydrogen 2.777 N/A ASN 274.A ND2 ALA 265.A O no hydrogen 2.780 N/A ASN 274.A ND2 ALA 275.A O no hydrogen 2.928 N/A ALA 275.A N GLU 248.A O no hydrogen 2.839 N/A GLY 276.A N LEU 292.A O no hydrogen 2.718 N/A ALA 277.A N PHE 263.A O no hydrogen 2.908 N/A MET 279.A N ILE 57.A O no hydrogen 2.874 N/A SER 280.A N SER 288.A O no hydrogen 2.652 N/A VAL 281.A N LEU 55.A O no hydrogen 2.871 N/A ASP 282.A N MET 286.A O no hydrogen 3.160 N/A THR 284.A OG1 ASP 282.A OD1 no hydrogen 3.217 N/A LEU 285.A N ASP 282.A O no hydrogen 2.667 N/A MET 286.A N ASP 282.A OD1 no hydrogen 2.684 N/A SER 288.A N SER 280.A O no hydrogen 2.900 N/A SER 288.A OG SER 280.A O no hydrogen 3.426 N/A GLN 290.A N MET 278.A O no hydrogen 3.001 N/A LEU 292.A N GLY 276.A O no hydrogen 2.539 N/A LYS 293.A NZ TYR 74.A OH no hydrogen 2.844 N/A