Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 8ie7_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): THR 1.A N GLU 61.A OE1 no hydrogen 3.480 N/A THR 1.A N GLU 61.A OE2 no hydrogen 2.937 N/A PHE 3.A N GLU 83.A OE2 no hydrogen 2.833 N/A ARG 4.A N VAL 81.A O no hydrogen 3.249 N/A ARG 4.A NH1 GLU 6.A OE1 no hydrogen 2.626 N/A ARG 4.A NH2 GLU 80.A OE2 no hydrogen 2.576 N/A GLN 5.A NE2 GLU 83.A OE2 no hydrogen 3.245 N/A ASP 9.A N ASN 7.A OD1 no hydrogen 2.981 N/A ASP 10.A N ASN 7.A O no hydrogen 2.982 N/A TYR 11.A N VAL 8.A O no hydrogen 3.017 N/A TYR 11.A OH GLU 6.A OE1 no hydrogen 2.717 N/A TYR 12.A N VAL 8.A O no hydrogen 2.940 N/A TYR 12.A OH GLU 80.A OE1 no hydrogen 2.676 N/A ASP 13.A N ARG 30.A O no hydrogen 2.944 N/A GLY 15.A N LYS 28.A O no hydrogen 2.700 N/A LEU 18.A N VAL 26.A O no hydrogen 2.764 N/A GLY 19.A N VAL 26.A O no hydrogen 3.388 N/A GLY 21.A N ALA 24.A O no hydrogen 2.761 N/A VAL 25.A N PHE 42.A O no hydrogen 3.096 N/A VAL 26.A N GLY 19.A O no hydrogen 2.764 N/A LYS 27.A N ALA 40.A O no hydrogen 2.936 N/A LYS 27.A NZ GLU 17.A OE1 no hydrogen 2.998 N/A LYS 28.A N GLU 16.A O no hydrogen 2.712 N/A CYS 29.A N TYR 38.A O no hydrogen 2.881 N/A ARG 30.A N ASP 13.A O no hydrogen 2.832 N/A GLU 31.A N LEU 36.A O no hydrogen 2.837 N/A LYS 32.A N TYR 11.A O no hydrogen 2.861 N/A LYS 32.A NZ ASP 9.A O no hydrogen 2.778 N/A THR 34.A OG1 GLU 31.A OE1 no hydrogen 3.463 N/A GLY 35.A N GLU 31.A O no hydrogen 2.852 N/A LEU 36.A N THR 34.A OG1 no hydrogen 3.144 N/A TYR 38.A N CYS 29.A O no hydrogen 2.942 N/A ALA 39.A N LEU 92.A O no hydrogen 2.744 N/A ALA 40.A N LYS 27.A O no hydrogen 2.774 N/A LYS 41.A N LEU 90.A O no hydrogen 2.834 N/A LYS 41.A NZ GLU 63.A OE2 no hydrogen 2.730 N/A LYS 41.A NZ ASP 159.A OD1 no hydrogen 3.504 N/A PHE 42.A N VAL 25.A O no hydrogen 2.774 N/A ILE 43.A N VAL 88.A O no hydrogen 2.773 N/A LYS 44.A N PHE 23.A O no hydrogen 2.873 N/A LYS 44.A NZ LYS 45.A O no hydrogen 2.763 N/A LYS 44.A NZ THR 86.A O no hydrogen 2.834 N/A LYS 44.A NZ THR 86.A OG1 no hydrogen 3.375 N/A LYS 45.A N THR 86.A O no hydrogen 2.961 N/A LYS 45.A NZ GLU 83.A OE1 no hydrogen 2.703 N/A LYS 45.A NZ ASN 84.A O no hydrogen 2.732 N/A ARG 46.A N VAL 55.A O no hydrogen 3.227 N/A ARG 46.A NE ARG 53.A O no hydrogen 3.333 N/A SER 51.A N THR 48.A O no hydrogen 3.457 N/A ARG 53.A N SER 51.A OG no hydrogen 3.078 N/A VAL 55.A N LYS 44.A O no hydrogen 2.707 N/A ARG 57.A NE GLU 61.A OE2 no hydrogen 2.881 N/A ARG 57.A NH1 GLU 83.A OE1 no hydrogen 2.784 N/A ARG 57.A NH2 THR 1.A O no hydrogen 2.625 N/A ARG 57.A NH2 GLU 83.A OE1 no hydrogen 3.131 N/A ARG 57.A NH2 GLU 83.A OE2 no hydrogen 3.162 N/A ASP 59.A N SER 56.A OG no hydrogen 3.148 N/A ILE 60.A N SER 56.A O no hydrogen 3.007 N/A GLU 61.A N ARG 57.A O no hydrogen 2.802 N/A ARG 62.A N GLU 58.A O no hydrogen 2.992 N/A ARG 62.A NH1 ASP 59.A OD1 no hydrogen 2.840 N/A GLU 63.A N ASP 59.A O no hydrogen 3.177 N/A VAL 64.A N ILE 60.A O no hydrogen 2.920 N/A SER 65.A N GLU 61.A O no hydrogen 2.750 N/A ILE 66.A N ARG 62.A O no hydrogen 2.951 N/A LEU 67.A N GLU 63.A O no hydrogen 2.971 N/A LYS 68.A N VAL 64.A O no hydrogen 2.907 N/A GLU 69.A N ILE 66.A O no hydrogen 2.969 N/A ILE 70.A N LEU 67.A O no hydrogen 3.332 N/A GLN 71.A N TYR 127.A OH no hydrogen 2.893 N/A ASN 74.A N HIS 72.A ND1 no hydrogen 2.988 N/A ASN 74.A ND2 GLN 120.A OE1 no hydrogen 3.406 N/A ASN 74.A ND2 ILE 155.A O no hydrogen 3.037 N/A VAL 75.A N HIS 72.A O no hydrogen 3.110 N/A ILE 76.A N ILE 157.A O no hydrogen 3.144 N/A THR 77.A N GLU 93.A OE1 no hydrogen 3.133 N/A THR 77.A OG1 GLU 93.A OE1 no hydrogen 3.155 N/A HIS 79.A N ILE 91.A O no hydrogen 2.751 N/A HIS 79.A NE2 GLU 31.A OE1 no hydrogen 3.189 N/A GLU 80.A N ILE 91.A O no hydrogen 3.309 N/A TYR 82.A N ILE 89.A O no hydrogen 2.796 N/A TYR 82.A OH GLU 80.A OE1 no hydrogen 2.866 N/A GLU 83.A N ARG 4.A O no hydrogen 2.869 N/A ASN 84.A N ASP 87.A O no hydrogen 2.872 N/A THR 86.A N ASN 84.A OD1 no hydrogen 3.010 N/A ASP 87.A N ASN 84.A OD1 no hydrogen 2.872 N/A VAL 88.A N ILE 43.A O no hydrogen 2.952 N/A ILE 89.A N TYR 82.A O no hydrogen 2.726 N/A LEU 90.A N LYS 41.A O no hydrogen 2.922 N/A ILE 91.A N GLU 80.A O no hydrogen 2.720 N/A LEU 92.A N ALA 39.A O no hydrogen 2.685 N/A GLU 93.A N THR 77.A O no hydrogen 2.819 N/A GLY 97.A N LEU 145.A O no hydrogen 2.736 N/A LEU 100.A N ILE 143.A O no hydrogen 2.706 N/A PHE 103.A N GLU 99.A O no hydrogen 2.912 N/A LEU 104.A N LEU 100.A O no hydrogen 2.542 N/A ALA 105.A N PHE 101.A O no hydrogen 3.279 N/A GLU 106.A N PHE 103.A O no hydrogen 3.215 N/A LYS 107.A N LEU 104.A O no hydrogen 3.348 N/A SER 108.A OG LEU 209.A O no hydrogen 3.056 N/A LEU 109.A N LEU 208.A O no hydrogen 3.228 N/A THR 110.A N GLU 113.A OE1 no hydrogen 2.948 N/A GLU 113.A N THR 110.A OG1 no hydrogen 3.123 N/A ALA 114.A N THR 110.A O no hydrogen 2.858 N/A THR 115.A N GLU 111.A O no hydrogen 2.863 N/A THR 115.A OG1 GLU 111.A O no hydrogen 2.881 N/A THR 115.A OG1 GLU 112.A O no hydrogen 3.013 N/A THR 115.A OG1 GLU 116.A OE1 no hydrogen 3.422 N/A GLU 116.A N GLU 112.A O no hydrogen 2.893 N/A PHE 117.A N GLU 113.A O no hydrogen 3.231 N/A LEU 118.A N ALA 114.A O no hydrogen 2.682 N/A LYS 119.A N THR 115.A O no hydrogen 2.709 N/A GLN 120.A NE2 GLU 116.A O no hydrogen 3.454 N/A GLN 120.A NE2 PRO 153.A O no hydrogen 2.791 N/A ILE 121.A N PHE 117.A O no hydrogen 3.044 N/A LEU 122.A N LEU 118.A O no hydrogen 2.783 N/A ASN 123.A N LYS 119.A O no hydrogen 2.884 N/A GLY 124.A N GLN 120.A O no hydrogen 2.991 N/A VAL 125.A N ILE 121.A O no hydrogen 2.864 N/A TYR 126.A N LEU 122.A O no hydrogen 2.708 N/A TYR 127.A N ASN 123.A O no hydrogen 3.090 N/A LEU 128.A N GLY 124.A O no hydrogen 3.042 N/A HIS 129.A N VAL 125.A O no hydrogen 2.749 N/A HIS 129.A NE2 ASP 197.A OD2 no hydrogen 2.792 N/A SER 130.A N TYR 126.A O no hydrogen 2.880 N/A SER 130.A OG TYR 126.A O no hydrogen 2.618 N/A LEU 131.A N TYR 127.A O no hydrogen 3.179 N/A GLN 132.A N HIS 129.A O no hydrogen 2.902 N/A GLN 132.A NE2 ILE 166.A O no hydrogen 3.093 N/A ILE 133.A N LEU 128.A O no hydrogen 2.863 N/A ALA 134.A N HIS 164.A O no hydrogen 2.966 N/A HIS 135.A N ASP 197.A OD2 no hydrogen 2.762 N/A HIS 135.A NE2 ILE 158.A O no hydrogen 3.163 N/A PHE 136.A N ASP 197.A OD1 no hydrogen 2.860 N/A ASP 137.A N HIS 135.A ND1 no hydrogen 2.947 N/A LYS 139.A NZ THR 178.A OG1 no hydrogen 2.683 N/A ASN 142.A N LYS 139.A O no hydrogen 2.829 N/A ASN 142.A ND2 ASP 137.A O no hydrogen 2.729 N/A ASN 142.A ND2 ASP 137.A OD2 no hydrogen 3.046 N/A ILE 143.A N PRO 140.A O no hydrogen 3.081 N/A MET 144.A N LYS 156.A O no hydrogen 3.008 N/A LEU 145.A N GLY 98.A O no hydrogen 2.952 N/A LEU 146.A N ARG 154.A O no hydrogen 2.752 N/A ASN 149.A N ASP 147.A OD1 no hydrogen 2.823 N/A ILE 155.A N GLN 120.A OE1 no hydrogen 2.909 N/A LYS 156.A N MET 144.A O no hydrogen 2.742 N/A LYS 156.A NZ PRO 73.A O no hydrogen 3.253 N/A LYS 156.A NZ VAL 75.A O no hydrogen 3.092 N/A LYS 156.A NZ GLU 93.A OE1 no hydrogen 2.798 N/A LYS 156.A NZ GLU 93.A OE2 no hydrogen 3.033 N/A ILE 157.A N ASN 74.A O no hydrogen 2.809 N/A ILE 158.A N ASN 142.A O no hydrogen 2.866 N/A GLY 161.A N ASP 159.A OD1 no hydrogen 3.082 N/A ALA 163.A N PHE 160.A O no hydrogen 3.191 N/A HIS 164.A N ALA 134.A O no hydrogen 2.961 N/A HIS 164.A ND1 LEU 162.A O no hydrogen 2.739 N/A LYS 165.A NZ GLU 69.A OE1 no hydrogen 2.844 N/A LYS 165.A NZ LEU 131.A O no hydrogen 2.819 N/A ILE 166.A N GLN 132.A O no hydrogen 2.713 N/A GLU 171.A N LEU 192.A O no hydrogen 2.609 N/A LYS 173.A NZ HIS 164.A NE2 no hydrogen 2.996 N/A PHE 181.A N THR 178.A O no hydrogen 2.881 N/A GLU 185.A N GLU 185.A OE1 no hydrogen 2.810 N/A ILE 186.A N ALA 183.A O no hydrogen 2.986 N/A VAL 187.A N ALA 183.A O no hydrogen 3.155 N/A ASN 188.A N PRO 184.A O no hydrogen 2.800 N/A ASN 188.A ND2 PRO 184.A O no hydrogen 2.987 N/A ASN 188.A ND2 SER 228.A OG no hydrogen 2.887 N/A TYR 189.A N ILE 186.A O no hydrogen 3.194 N/A GLU 190.A N GLU 185.A O no hydrogen 2.793 N/A LEU 192.A N GLU 171.A O no hydrogen 2.763 N/A ALA 196.A N GLY 193.A O no hydrogen 3.262 N/A ASP 197.A N LEU 194.A O no hydrogen 3.124 N/A MET 198.A N GLU 195.A O no hydrogen 2.980 N/A TRP 199.A N GLU 195.A O no hydrogen 3.243 N/A SER 200.A N ALA 196.A O no hydrogen 3.203 N/A SER 200.A OG PHE 181.A O no hydrogen 2.854 N/A SER 200.A OG ALA 196.A O no hydrogen 3.290 N/A ILE 201.A N ASP 197.A O no hydrogen 2.984 N/A GLY 202.A N MET 198.A O no hydrogen 3.108 N/A VAL 203.A N TRP 199.A O no hydrogen 3.032 N/A ILE 204.A N SER 200.A O no hydrogen 2.859 N/A THR 205.A N ILE 201.A O no hydrogen 2.796 N/A THR 205.A OG1 ILE 201.A O no hydrogen 2.778 N/A TYR 206.A N GLY 202.A O no hydrogen 3.030 N/A TYR 206.A OH GLU 233.A O no hydrogen 2.536 N/A ILE 207.A N VAL 203.A O no hydrogen 3.041 N/A LEU 208.A N ILE 204.A O no hydrogen 2.869 N/A LEU 209.A N THR 205.A O no hydrogen 3.061 N/A SER 210.A N TYR 206.A O no hydrogen 3.133 N/A SER 210.A N ILE 207.A O no hydrogen 3.243 N/A SER 210.A OG TYR 206.A O no hydrogen 2.781 N/A GLY 211.A N ILE 207.A O no hydrogen 2.695 N/A ALA 212.A N SER 210.A OG no hydrogen 2.967 N/A SER 213.A OG GLU 180.A OE1 no hydrogen 2.742 N/A GLY 217.A N THR 223.A OG1 no hydrogen 2.839 N/A ASP 218.A N GLU 222.A OE1 no hydrogen 2.956 N/A GLN 221.A N GLN 221.A OE1 no hydrogen 2.828 N/A GLU 222.A N THR 219.A OG1 no hydrogen 3.225 N/A THR 223.A N THR 219.A O no hydrogen 3.076 N/A THR 223.A OG1 THR 219.A O no hydrogen 3.288 N/A LEU 224.A N LYS 220.A O no hydrogen 2.950 N/A ALA 225.A N GLN 221.A O no hydrogen 2.851 N/A ASN 226.A N GLU 222.A O no hydrogen 2.837 N/A ASN 226.A ND2 PHE 215.A O no hydrogen 3.005 N/A VAL 227.A N THR 223.A O no hydrogen 2.897 N/A SER 228.A N LEU 224.A O no hydrogen 3.032 N/A ALA 229.A N ALA 225.A O no hydrogen 3.137 N/A VAL 230.A N VAL 227.A O no hydrogen 2.952 N/A ASN 231.A N ASN 226.A O no hydrogen 2.766 N/A TYR 238.A N GLU 235.A O no hydrogen 2.891 N/A PHE 239.A N GLU 235.A O no hydrogen 2.816 N/A THR 242.A N PHE 239.A O no hydrogen 2.982 N/A SER 243.A N GLU 111.A OE2 no hydrogen 2.586 N/A SER 243.A OG GLU 111.A OE1 no hydrogen 2.646 N/A SER 243.A OG GLU 111.A OE2 no hydrogen 3.281 N/A ALA 246.A N SER 243.A OG no hydrogen 3.094 N/A LYS 247.A N SER 243.A O no hydrogen 3.223 N/A ASP 248.A N ALA 244.A O no hydrogen 2.805 N/A PHE 249.A N LEU 245.A O no hydrogen 2.977 N/A ILE 250.A N ALA 246.A O no hydrogen 3.148 N/A ARG 251.A N LYS 247.A O no hydrogen 2.844 N/A ARG 252.A N ASP 248.A O no hydrogen 3.031 N/A ARG 252.A NE ASP 248.A OD1 no hydrogen 2.713 N/A ARG 252.A NE ASP 248.A OD2 no hydrogen 3.315 N/A ARG 252.A NH2 ASP 248.A OD2 no hydrogen 2.953 N/A LEU 253.A N ILE 250.A O no hydrogen 2.943 N/A LEU 254.A N ILE 250.A O no hydrogen 2.949 N/A LYS 256.A NZ SER 228.A O no hydrogen 2.729 N/A LYS 259.A N ASP 257.A OD1 no hydrogen 3.030 N/A LYS 260.A N ASP 257.A O no hydrogen 2.993 N/A LYS 260.A NZ ASP 257.A OD2 no hydrogen 2.997 N/A ARG 261.A N PRO 258.A O no hydrogen 3.262 N/A ARG 261.A NE VAL 255.A O no hydrogen 2.908 N/A ARG 261.A NH1 GLU 185.A OE1 no hydrogen 3.490 N/A ARG 261.A NH1 GLU 185.A OE2 no hydrogen 2.699 N/A ARG 261.A NH1 GLU 195.A O no hydrogen 2.894 N/A ARG 261.A NH2 GLU 185.A OE1 no hydrogen 2.871 N/A ARG 261.A NH2 VAL 255.A O no hydrogen 2.876 N/A MET 262.A N ARG 252.A O no hydrogen 3.020 N/A THR 263.A N ASP 266.A OD2 no hydrogen 3.069 N/A ASP 266.A N THR 263.A OG1 no hydrogen 3.041 N/A SER 267.A N THR 263.A O no hydrogen 2.863 N/A SER 267.A OG ILE 264.A O no hydrogen 2.767 N/A LEU 268.A N ILE 264.A O no hydrogen 3.136 N/A GLN 269.A N GLN 265.A O no hydrogen 3.162 N/A GLN 269.A N ASP 266.A O no hydrogen 3.149 N/A HIS 270.A N SER 267.A O no hydrogen 3.423 N/A HIS 270.A NE2 ASP 248.A OD1 no hydrogen 2.765 N/A TRP 272.A N HIS 270.A ND1 no hydrogen 2.947 N/A TRP 272.A NE1 GLU 111.A OE1 no hydrogen 2.909 N/A ILE 273.A N HIS 270.A O no hydrogen 2.796 N/A LYS 274.A N HIS 270.A O no hydrogen 2.788 N/A LYS 274.A NZ GLN 269.A OE1 no hydrogen 2.875 N/A