Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4o1e_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): HIS 3.A ND1 MET 4.A O no hydrogen 2.582 N/A HIS 3.A NE2 ASP 227.A OD1 no hydrogen 2.770 N/A LEU 5.A N GLU 246.A OE1 no hydrogen 2.780 N/A ILE 6.A N ASP 227.A O no hydrogen 2.933 N/A ILE 7.A N ASP 44.A OD2 no hydrogen 2.858 N/A ILE 8.A N ALA 229.A O no hydrogen 2.844 N/A GLY 9.A N TYR 45.A O no hydrogen 2.777 N/A GLU 10.A N LEU 231.A O no hydrogen 2.946 N/A LYS 11.A N GLN 38.A OE1 no hydrogen 2.989 N/A ASN 13.A N LYS 11.A O no hydrogen 2.956 N/A GLY 14.A N CYS 49.A O no hydrogen 2.919 N/A THR 15.A N.A ASN 13.A OD1 no hydrogen 2.845 N/A THR 15.A N.B ASN 13.A OD1 no hydrogen 2.830 N/A THR 15.A OG1.A ASN 13.A OD1 no hydrogen 3.384 N/A THR 15.A OG1.A SER 51.A OG no hydrogen 2.838 N/A THR 15.A OG1.B ASN 13.A OD1 no hydrogen 3.026 N/A ILE 16.A N ASN 13.A O no hydrogen 2.980 N/A LYS 20.A N ILE 16.A O no hydrogen 2.957 N/A LYS 20.A NZ GLY 14.A O no hydrogen 2.824 N/A LYS 21.A N PRO 17.A O no hydrogen 2.902 N/A ALA 22.A N SER 18.A O no hydrogen 3.070 N/A ILE 23.A N VAL 19.A O no hydrogen 2.932 N/A GLU 24.A N LYS 20.A O no hydrogen 2.992 N/A ALA 25.A N LYS 21.A O no hydrogen 2.767 N/A LYS 26.A N ILE 23.A O no hydrogen 3.256 N/A ASP 27.A N ALA 22.A O no hydrogen 2.787 N/A GLU 28.A N LYS 26.A O no hydrogen 3.051 N/A LEU 30.A N ASP 27.A OD1 no hydrogen 3.284 N/A ARG 32.A N GLU 28.A O no hydrogen 2.817 N/A ASP 33.A N LYS 29.A O no hydrogen 2.880 N/A LEU 34.A N LEU 30.A O no hydrogen 2.960 N/A ALA 35.A N ILE 31.A O no hydrogen 2.920 N/A LEU 36.A N ARG 32.A O no hydrogen 2.961 N/A ARG 37.A N ASP 33.A O no hydrogen 2.870 N/A GLN 38.A N LEU 34.A O no hydrogen 3.050 N/A GLN 38.A NE2 LEU 34.A O no hydrogen 3.067 N/A SER 39.A N ALA 35.A O no hydrogen 3.030 N/A SER 39.A OG.A ALA 35.A O no hydrogen 3.059 N/A SER 39.A OG.A THR 72.A OG1 no hydrogen 3.035 N/A SER 39.A OG.A THR 74.A OG1 no hydrogen 2.948 N/A SER 39.A OG.B ALA 35.A O no hydrogen 3.065 N/A SER 39.A OG.B LEU 36.A O no hydrogen 3.094 N/A SER 39.A OG.B THR 72.A OG1 no hydrogen 3.412 N/A GLU 40.A N LEU 36.A O no hydrogen 2.912 N/A ALA 41.A N ARG 37.A O no hydrogen 2.981 N/A ALA 41.A N GLN 38.A O no hydrogen 3.183 N/A GLY 42.A N SER 39.A O no hydrogen 2.952 N/A ALA 43.A N GLN 38.A O no hydrogen 3.015 N/A ASP 44.A N ILE 7.A O no hydrogen 2.760 N/A TYR 45.A N ILE 7.A O no hydrogen 3.257 N/A ILE 46.A N PRO 75.A O no hydrogen 2.841 N/A ASP 47.A N GLY 9.A O no hydrogen 2.913 N/A VAL 48.A N CYS 77.A O no hydrogen 2.854 N/A CYS 49.A N ILE 12.A O no hydrogen 3.000 N/A CYS 49.A SG ASP 79.A O no hydrogen 3.725 N/A SER 51.A OG THR 15.A OG1.A no hydrogen 2.838 N/A THR 52.A OG1 SER 53.A O no hydrogen 3.077 N/A GLU 55.A N GLU 55.A OE1 no hydrogen 2.687 N/A LEU 56.A N SER 53.A O no hydrogen 3.132 N/A GLU 57.A N PRO 54.A O no hydrogen 3.078 N/A THR 60.A N LEU 56.A O no hydrogen 3.024 N/A THR 60.A OG1 LEU 56.A O no hydrogen 2.637 N/A LEU 61.A N GLU 57.A O no hydrogen 2.794 N/A GLN 62.A N VAL 58.A O no hydrogen 2.920 N/A TRP 63.A N GLU 59.A O no hydrogen 3.032 N/A LEU 64.A N THR 60.A O no hydrogen 2.943 N/A MET 65.A N LEU 61.A O no hydrogen 2.710 N/A ASP 66.A N GLN 62.A O no hydrogen 2.848 N/A ILE 67.A N TRP 63.A O no hydrogen 3.110 N/A VAL 68.A N LEU 64.A O no hydrogen 2.957 N/A GLN 69.A N MET 65.A O no hydrogen 2.923 N/A GLU 70.A N ASP 66.A O no hydrogen 2.966 N/A ALA 71.A N ILE 67.A O no hydrogen 3.281 N/A ALA 71.A N VAL 68.A O no hydrogen 2.969 N/A THR 72.A N VAL 68.A O no hydrogen 2.857 N/A THR 72.A OG1 SER 39.A OG.A no hydrogen 3.035 N/A THR 72.A OG1 SER 39.A OG.B no hydrogen 3.412 N/A THR 72.A OG1 THR 74.A OG1 no hydrogen 3.153 N/A THR 74.A N THR 72.A OG1 no hydrogen 3.066 N/A THR 74.A OG1 SER 39.A OG.A no hydrogen 2.948 N/A THR 74.A OG1 THR 72.A OG1 no hydrogen 3.153 N/A CYS 77.A N ILE 46.A O no hydrogen 2.795 N/A CYS 77.A SG ASP 47.A OD1 no hydrogen 3.251 N/A ILE 78.A N LEU 98.A O no hydrogen 2.898 N/A ASP 79.A N VAL 48.A O no hydrogen 2.917 N/A SER 80.A N ASN 100.A O no hydrogen 2.941 N/A SER 80.A OG GLU 57.A OE1 no hydrogen 3.540 N/A SER 80.A OG GLU 57.A OE2 no hydrogen 2.530 N/A SER 80.A OG ASN 82.A O no hydrogen 3.262 N/A ASN 82.A N SER 80.A OG no hydrogen 2.875 N/A ASN 82.A ND2 GLU 57.A OE1 no hydrogen 2.838 N/A ALA 85.A N ASN 82.A O no hydrogen 2.886 N/A ILE 86.A N ASN 82.A O no hydrogen 3.375 N/A GLN 87.A N PRO 83.A O no hydrogen 2.904 N/A GLN 88.A N ARG 84.A O no hydrogen 3.096 N/A VAL 89.A N ILE 86.A O no hydrogen 3.094 N/A LEU 90.A N ILE 86.A O no hydrogen 2.997 N/A TYR 92.A N VAL 89.A O no hydrogen 2.934 N/A ALA 93.A N LEU 90.A O no hydrogen 3.137 N/A LEU 98.A N LEU 76.A O no hydrogen 2.863 N/A ILE 99.A N GLN 122.A O no hydrogen 2.880 N/A ASN 100.A N ILE 78.A O no hydrogen 2.812 N/A ASN 100.A ND2 ASP 47.A OD1 no hydrogen 3.307 N/A VAL 102.A N ILE 124.A O no hydrogen 2.858 N/A LEU 104.A N CYS 128.A O no hydrogen 3.075 N/A GLU 105.A N SER 103.A OG no hydrogen 3.009 N/A GLY 106.A N ASN 130.A OD1 no hydrogen 2.861 N/A LYS 108.A N GLU 105.A O no hydrogen 3.239 N/A LYS 108.A NZ PRO 81.A O no hydrogen 3.156 N/A CYS 109.A SG SER 103.A O no hydrogen 3.373 N/A VAL 111.A N ASP 107.A O no hydrogen 2.986 N/A ILE 112.A N LYS 108.A O no hydrogen 2.900 N/A PHE 113.A N CYS 109.A O no hydrogen 2.967 N/A LEU 115.A N.A ILE 112.A O no hydrogen 3.036 N/A ILE 116.A N ILE 112.A O no hydrogen 3.203 N/A ILE 116.A N PHE 113.A O no hydrogen 3.205 N/A GLN 117.A N PHE 113.A O no hydrogen 2.920 N/A GLN 117.A NE2 ASP 155.A OD2 no hydrogen 3.388 N/A THR 119.A N ILE 116.A O no hydrogen 3.018 N/A THR 119.A OG1 ILE 116.A O no hydrogen 2.776 N/A TRP 121.A N THR 119.A OG1 no hydrogen 3.131 N/A GLN 122.A N GLY 97.A O no hydrogen 2.979 N/A GLN 122.A NE2 TYR 45.A OH no hydrogen 2.920 N/A VAL 123.A N ARG 160.A O no hydrogen 2.899 N/A ILE 124.A N ILE 99.A O no hydrogen 2.768 N/A ALA 125.A N HIS 162.A O no hydrogen 2.809 N/A LEU 126.A N VAL 102.A O no hydrogen 2.844 N/A THR 127.A N ASP 164.A O no hydrogen 3.019 N/A THR 127.A OG1 ASP 164.A O no hydrogen 3.474 N/A CYS 128.A N LEU 126.A O no hydrogen 2.919 N/A ASP 129.A N GLY 132.A O no hydrogen 3.149 N/A SER 131.A N ASP 129.A OD1 no hydrogen 2.885 N/A GLY 132.A N ASP 129.A O no hydrogen 3.087 N/A SER 139.A N ASP 136.A OD2 no hydrogen 2.967 N/A SER 139.A OG ASP 136.A OD1 no hydrogen 3.314 N/A SER 139.A OG ASP 136.A OD2 no hydrogen 2.750 N/A ARG 140.A NE ASP 136.A O no hydrogen 3.228 N/A ARG 140.A NH1 PRO 165.A O no hydrogen 2.843 N/A ARG 140.A NH2 GLN 135.A O no hydrogen 3.003 N/A VAL 141.A N VAL 137.A O no hydrogen 2.979 N/A GLU 142.A N GLN 138.A O no hydrogen 2.952 N/A ILE 143.A N SER 139.A O no hydrogen 2.934 N/A ALA 144.A N ARG 140.A O no hydrogen 2.882 N/A GLN 145.A N VAL 141.A O no hydrogen 3.026 N/A GLN 145.A NE2 GLU 149.A OE2 no hydrogen 2.685 N/A ALA 146.A N GLU 142.A O no hydrogen 3.076 N/A LEU 147.A N ILE 143.A O no hydrogen 2.964 N/A VAL 148.A N ALA 144.A O no hydrogen 2.910 N/A GLU 149.A N GLN 145.A O no hydrogen 2.899 N/A LYS 150.A N ALA 146.A O no hydrogen 2.869 N/A ALA 151.A N LEU 147.A O no hydrogen 2.862 N/A GLN 152.A N VAL 148.A O no hydrogen 2.904 N/A SER 153.A N GLU 149.A O no hydrogen 3.249 N/A SER 153.A N LYS 150.A O no hydrogen 3.063 N/A SER 153.A OG LYS 150.A O no hydrogen 2.729 N/A TYR 154.A N ALA 151.A O no hydrogen 2.915 N/A ASP 155.A N GLN 152.A O no hydrogen 2.807 N/A ILE 156.A N ALA 151.A O no hydrogen 3.021 N/A ARG 160.A N ALA 157.A O no hydrogen 2.991 N/A ARG 160.A NE TRP 121.A O no hydrogen 2.947 N/A ARG 160.A NH2 ILE 116.A O no hydrogen 2.894 N/A ARG 160.A NH2 TRP 121.A O no hydrogen 2.870 N/A ILE 161.A N GLN 158.A O no hydrogen 2.962 N/A HIS 162.A N VAL 123.A O no hydrogen 2.854 N/A HIS 162.A ND1 SER 228.A OG no hydrogen 2.895 N/A HIS 162.A NE2 GLN 122.A OE1 no hydrogen 3.100 N/A ILE 163.A N ASN 195.A O no hydrogen 2.795 N/A ASP 164.A N ALA 125.A O no hydrogen 2.867 N/A LEU 166.A N ASP 164.A OD1 no hydrogen 2.981 N/A LEU 170.A N ILE 203.A O no hydrogen 2.923 N/A SER 171.A OG PHE 205.A O no hydrogen 2.635 N/A ALA 172.A N ALA 169.A O no hydrogen 2.937 N/A ASP 173.A N ALA 169.A O no hydrogen 2.974 N/A ASN 174.A ND2 LEU 170.A O no hydrogen 2.780 N/A GLY 175.A N ASP 173.A OD1 no hydrogen 2.850 N/A ALA 176.A N ASP 173.A O no hydrogen 2.868 N/A LYS 179.A N GLY 175.A O no hydrogen 2.776 N/A LYS 179.A NZ ASP 173.A OD1 no hydrogen 3.472 N/A LYS 179.A NZ ASP 173.A OD2 no hydrogen 2.700 N/A PHE 180.A N ALA 176.A O no hydrogen 2.934 N/A ALA 181.A N LEU 177.A O no hydrogen 2.876 N/A GLU 182.A N LEU 178.A O no hydrogen 3.068 N/A ALA 183.A N LYS 179.A O no hydrogen 2.828 N/A THR 184.A N PHE 180.A O no hydrogen 2.943 N/A THR 184.A OG1 PHE 180.A O no hydrogen 2.943 N/A ARG 185.A N ALA 181.A O no hydrogen 2.973 N/A ARG 185.A NE GLU 182.A OE1 no hydrogen 2.856 N/A ARG 185.A NH2 GLU 182.A OE1 no hydrogen 3.548 N/A ARG 185.A NH2 GLU 182.A OE2 no hydrogen 2.698 N/A GLN 186.A N GLU 182.A O no hydrogen 3.058 N/A GLN 186.A NE2 GLU 182.A OE2 no hydrogen 2.885 N/A ILE 187.A N ALA 183.A O no hydrogen 2.849 N/A LYS 188.A N THR 184.A O no hydrogen 2.988 N/A LYS 188.A NZ ILE 194.A O no hydrogen 3.176 N/A LYS 188.A NZ ASP 227.A OD2 no hydrogen 3.134 N/A ALA 189.A N ARG 185.A O no hydrogen 2.945 N/A ASN 190.A N GLN 186.A O no hydrogen 3.056 N/A TYR 191.A N ILE 187.A O no hydrogen 2.886 N/A ILE 194.A N TYR 191.A O no hydrogen 2.987 N/A ASN 195.A N ILE 161.A O no hydrogen 3.061 N/A ASN 195.A ND2 GLU 159.A O no hydrogen 3.133 N/A ASN 195.A ND2 ILE 161.A O no hydrogen 3.133 N/A VAL 196.A N ASP 227.A OD2 no hydrogen 2.904 N/A THR 197.A N ILE 163.A O no hydrogen 2.807 N/A THR 197.A OG1 SER 228.A O no hydrogen 3.150 N/A THR 197.A OG1 SER 228.A OG no hydrogen 2.776 N/A SER 198.A OG GLY 199.A O no hydrogen 2.742 N/A SER 204.A N SER 201.A O no hydrogen 3.172 N/A SER 204.A OG SER 201.A O no hydrogen 3.116 N/A PHE 205.A N ASN 202.A O no hydrogen 3.153 N/A MET 207.A N SER 204.A O no hydrogen 3.091 N/A ARG 210.A NE SER 204.A OG no hydrogen 2.837 N/A ARG 210.A NH1 SER 201.A O no hydrogen 2.748 N/A VAL 212.A N LEU 209.A O no hydrogen 2.970 N/A VAL 213.A N LEU 209.A O no hydrogen 3.196 N/A ASN 214.A N ARG 210.A O no hydrogen 2.766 N/A ASN 214.A ND2 SER 204.A OG no hydrogen 2.667 N/A GLN 215.A N LYS 211.A O no hydrogen 3.037 N/A GLN 215.A NE2 GLN 215.A O no hydrogen 3.122 N/A GLN 215.A NE2 THR 219.A OG1 no hydrogen 3.048 N/A ASN 216.A N VAL 212.A O no hydrogen 3.008 N/A ASN 216.A ND2 VAL 212.A O no hydrogen 2.918 N/A PHE 217.A N VAL 213.A O no hydrogen 2.881 N/A LEU 218.A N ASN 214.A O no hydrogen 2.912 N/A THR 219.A N GLN 215.A O no hydrogen 3.118 N/A THR 219.A OG1 GLN 215.A O no hydrogen 3.290 N/A THR 219.A OG1 THR 245.A OG1 no hydrogen 3.213 N/A LEU 220.A N ASN 216.A O no hydrogen 3.030 N/A ALA 221.A N PHE 217.A O no hydrogen 2.732 N/A MET 222.A N LEU 218.A O no hydrogen 2.829 N/A PHE 223.A N THR 219.A O no hydrogen 3.109 N/A ALA 224.A N LEU 220.A O no hydrogen 2.923 N/A GLY 225.A N MET 222.A O no hydrogen 3.070 N/A MET 226.A N ALA 221.A O no hydrogen 2.966 N/A ASP 227.A N VAL 196.A O no hydrogen 2.741 N/A SER 228.A N VAL 196.A O no hydrogen 3.149 N/A SER 228.A OG HIS 162.A ND1 no hydrogen 2.895 N/A SER 228.A OG THR 197.A OG1 no hydrogen 2.776 N/A ALA 229.A N ILE 6.A O no hydrogen 2.902 N/A ILE 230.A N.A SER 198.A O no hydrogen 2.945 N/A ILE 230.A N.B SER 198.A O no hydrogen 2.950 N/A LEU 231.A N ILE 8.A O no hydrogen 2.998 N/A LEU 234.A N ASP 232.A OD1 no hydrogen 2.909 N/A ASN 235.A N ASP 232.A O no hydrogen 3.292 N/A ARG 236.A NH1 ASN 265.A O no hydrogen 2.869 N/A ARG 236.A NH1 GLY 268.A O no hydrogen 2.770 N/A ARG 236.A NH2 ASN 265.A O no hydrogen 2.943 N/A LEU 238.A N ASN 235.A OD1 no hydrogen 2.959 N/A LEU 239.A N ASN 235.A O no hydrogen 2.985 N/A ALA 240.A N ARG 236.A O no hydrogen 3.044 N/A ALA 241.A N ASP 237.A O no hydrogen 2.976 N/A LEU 242.A N LEU 238.A O no hydrogen 2.862 N/A LEU 243.A N LEU 239.A O no hydrogen 2.883 N/A ALA 244.A N ALA 240.A O no hydrogen 2.804 N/A THR 245.A N ALA 241.A O no hydrogen 2.764 N/A THR 245.A OG1 THR 219.A OG1 no hydrogen 3.213 N/A THR 245.A OG1 ALA 241.A O no hydrogen 2.790 N/A GLU 246.A N LEU 242.A O no hydrogen 2.814 N/A ALA 247.A N LEU 243.A O no hydrogen 3.072 N/A LEU 248.A N ALA 244.A O no hydrogen 2.883 N/A LEU 249.A N THR 245.A O no hydrogen 2.828 N/A GLY 250.A N ALA 247.A O no hydrogen 2.999 N/A ARG 251.A N GLU 246.A O no hydrogen 2.947 N/A ARG 251.A NH1 GLU 246.A OE1 no hydrogen 3.254 N/A ARG 251.A NH1 GLU 246.A OE2 no hydrogen 3.428 N/A CYS 255.A N ASP 252.A O no hydrogen 2.837 N/A ARG 256.A N LYS 253.A O no hydrogen 3.207 N/A ASN 257.A N ASP 252.A OD1 no hydrogen 2.858 N/A PHE 258.A N ASP 252.A OD2 no hydrogen 2.948 N/A ALA 259.A N CYS 255.A O no hydrogen 3.031 N/A ASN 260.A N ARG 256.A O no hydrogen 2.748 N/A ALA 261.A N ASN 257.A O no hydrogen 2.969 N/A TYR 262.A N PHE 258.A O no hydrogen 3.117 N/A ARG 263.A N ALA 259.A O no hydrogen 2.896 N/A LYS 264.A N ASN 260.A O no hydrogen 2.841 N/A ASN 265.A N TYR 262.A O no hydrogen 3.051 N/A LYS 266.A N ALA 261.A O no hydrogen 2.943 N/A