Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1rq2_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): VAL 3.A N ASP 82.A OD2 no hydrogen 2.905 N/A LYS 5.A N MET 83.A O no hydrogen 2.899 N/A LYS 5.A NZ LEU 77.A O no hydrogen 2.932 N/A LYS 5.A NZ LEU 78.A O no hydrogen 3.047 N/A LYS 5.A NZ ARG 79.A O no hydrogen 3.154 N/A VAL 6.A N GLU 29.A O no hydrogen 2.796 N/A VAL 7.A N PHE 85.A O no hydrogen 2.735 N/A GLY 8.A N ILE 31.A O no hydrogen 2.800 N/A ILE 9.A N THR 87.A O no hydrogen 3.060 N/A GLY 10.A N ILE 33.A O no hydrogen 2.953 N/A VAL 14.A N GLY 10.A O no hydrogen 2.885 N/A ASN 15.A N GLY 11.A O no hydrogen 2.850 N/A ALA 16.A N GLY 12.A O no hydrogen 2.980 N/A VAL 17.A N GLY 13.A O no hydrogen 2.856 N/A ASN 18.A N VAL 14.A O no hydrogen 2.817 N/A ASN 18.A ND2 SER 43.A OG no hydrogen 2.989 N/A ARG 19.A N ASN 15.A O no hydrogen 2.990 N/A MET 20.A N ALA 16.A O no hydrogen 2.934 N/A ILE 21.A N VAL 17.A O no hydrogen 2.930 N/A GLU 22.A N ASN 18.A O no hydrogen 2.793 N/A GLN 23.A N ARG 19.A O no hydrogen 2.889 N/A GLY 24.A N ILE 21.A O no hydrogen 3.138 N/A LEU 25.A N MET 20.A O no hydrogen 3.027 N/A GLU 29.A N ILE 4.A O no hydrogen 2.949 N/A PHE 30.A N ASP 46.A OD2 no hydrogen 2.781 N/A ILE 31.A N VAL 6.A O no hydrogen 2.842 N/A ALA 32.A N VAL 47.A O no hydrogen 2.784 N/A ILE 33.A N GLY 8.A O no hydrogen 2.920 N/A ASN 34.A N LEU 49.A O no hydrogen 3.119 N/A THR 35.A N ASN 34.A OD1 no hydrogen 2.807 N/A THR 35.A OG1 THR 94.A OG1 no hydrogen 2.630 N/A ALA 39.A N ASP 36.A OD2 no hydrogen 3.256 N/A LEU 40.A N ASP 36.A O no hydrogen 3.310 N/A LEU 41.A N ALA 37.A O no hydrogen 2.852 N/A MET 42.A N.A GLN 38.A O no hydrogen 3.182 N/A MET 42.A N.B GLN 38.A O no hydrogen 3.171 N/A SER 43.A N LEU 40.A O no hydrogen 2.955 N/A ALA 45.A N SER 43.A OG no hydrogen 3.007 N/A VAL 47.A N PHE 30.A O no hydrogen 3.079 N/A LYS 48.A NZ LEU 40.A O no hydrogen 3.203 N/A LYS 48.A NZ SER 43.A O no hydrogen 2.689 N/A LEU 49.A N ALA 32.A O no hydrogen 2.834 N/A VAL 51.A N ASN 34.A O no hydrogen 2.923 N/A SER 55.A OG GLY 52.A O no hydrogen 3.225 N/A THR 56.A N GLY 52.A O no hydrogen 2.782 N/A THR 56.A OG1 THR 35.A O no hydrogen 3.479 N/A THR 56.A OG1 GLY 52.A O no hydrogen 2.912 N/A GLU 61.A N ASP 59.A OD1 no hydrogen 3.010 N/A GLY 63.A N ASP 59.A O no hydrogen 3.196 N/A ARG 64.A N PRO 60.A O no hydrogen 2.766 N/A ARG 64.A NE GLU 61.A OE2 no hydrogen 2.721 N/A ARG 64.A NH1 GLU 68.A OE2 no hydrogen 3.095 N/A ARG 64.A NH2 GLU 61.A OE2 no hydrogen 2.633 N/A LYS 65.A N GLU 61.A O no hydrogen 3.030 N/A LYS 65.A NZ GLU 68.A OE1 no hydrogen 3.389 N/A ALA 66.A N VAL 62.A O no hydrogen 2.897 N/A ALA 67.A N GLY 63.A O no hydrogen 3.096 N/A GLU 68.A N ARG 64.A O no hydrogen 2.847 N/A ASP 69.A N LYS 65.A O no hydrogen 2.866 N/A ALA 70.A N ALA 66.A O no hydrogen 3.279 N/A ALA 70.A N ALA 67.A O no hydrogen 3.020 N/A LYS 71.A N GLU 68.A O no hydrogen 3.158 N/A ILE 74.A N ALA 70.A O no hydrogen 2.884 N/A GLU 75.A N LYS 71.A O no hydrogen 2.845 N/A GLU 76.A N ASP 72.A O no hydrogen 2.965 N/A LEU 77.A N GLU 73.A O no hydrogen 3.047 N/A LEU 78.A N ILE 74.A O no hydrogen 2.904 N/A ARG 79.A N GLU 75.A O no hydrogen 2.888 N/A ALA 81.A N LEU 78.A O no hydrogen 2.995 N/A ASP 82.A N VAL 3.A O no hydrogen 2.764 N/A MET 83.A N VAL 3.A O no hydrogen 3.148 N/A VAL 84.A N LEU 112.A O no hydrogen 2.880 N/A PHE 85.A N LYS 5.A O no hydrogen 2.808 N/A VAL 86.A N VAL 114.A O no hydrogen 2.915 N/A THR 87.A N VAL 7.A O no hydrogen 2.760 N/A THR 87.A OG1.A VAL 7.A O no hydrogen 3.120 N/A THR 87.A OG1.B VAL 116.A O no hydrogen 2.925 N/A ALA 88.A N VAL 116.A O no hydrogen 3.395 N/A GLU 90.A N THR 118.A O no hydrogen 2.919 N/A GLY 91.A N THR 96.A OG1 no hydrogen 2.819 N/A THR 94.A OG1 THR 35.A OG1 no hydrogen 2.630 N/A THR 96.A OG1 GLY 92.A O no hydrogen 2.530 N/A GLY 97.A N GLY 93.A O no hydrogen 3.008 N/A GLY 98.A N THR 94.A O no hydrogen 2.813 N/A ALA 99.A N GLY 95.A O no hydrogen 2.884 N/A VAL 102.A N GLY 98.A O no hydrogen 3.136 N/A ALA 103.A N ALA 99.A O no hydrogen 2.846 N/A SER 104.A N PRO 100.A O no hydrogen 2.914 N/A SER 104.A OG.A PRO 100.A O no hydrogen 3.036 N/A SER 104.A OG.A SER 142.A OG no hydrogen 2.932 N/A SER 104.A OG.B PRO 100.A O no hydrogen 3.309 N/A SER 104.A OG.B VAL 101.A O no hydrogen 2.713 N/A ILE 105.A N VAL 101.A O no hydrogen 3.040 N/A ALA 106.A N VAL 102.A O no hydrogen 3.025 N/A ARG 107.A N ALA 103.A O no hydrogen 2.679 N/A LYS 108.A N SER 104.A O no hydrogen 2.804 N/A LYS 108.A NZ GLU 75.A OE1 no hydrogen 2.658 N/A LEU 109.A N ILE 105.A O no hydrogen 2.992 N/A GLY 110.A N ARG 107.A O no hydrogen 2.830 N/A ALA 111.A N ALA 106.A O no hydrogen 3.035 N/A LEU 112.A N ASP 82.A O no hydrogen 2.855 N/A THR 113.A N ASP 144.A OD2 no hydrogen 2.808 N/A THR 113.A OG1 ALA 111.A O no hydrogen 2.850 N/A VAL 114.A N VAL 84.A O no hydrogen 2.837 N/A GLY 115.A N THR 145.A O no hydrogen 2.864 N/A VAL 116.A N VAL 86.A O no hydrogen 2.857 N/A VAL 117.A N ILE 147.A O no hydrogen 3.005 N/A THR 118.A N ALA 88.A O no hydrogen 3.260 N/A ARG 119.A N ILE 149.A O no hydrogen 2.851 N/A ARG 119.A NH2 GLU 133.A OE1 no hydrogen 3.413 N/A PHE 121.A N GLU 124.A OE1 no hydrogen 3.008 N/A SER 122.A N ASP 152.A OD1 no hydrogen 2.781 N/A SER 122.A OG ASP 152.A OD1 no hydrogen 3.544 N/A SER 122.A OG ASP 152.A OD2 no hydrogen 2.642 N/A GLU 124.A N PHE 121.A O no hydrogen 2.941 N/A GLY 125.A N SER 122.A O no hydrogen 3.148 N/A SER 129.A N GLY 125.A O no hydrogen 3.153 N/A ASN 130.A N LYS 126.A O no hydrogen 2.799 N/A GLN 131.A N ARG 127.A O no hydrogen 2.838 N/A GLN 131.A NE2 ALA 58.A O no hydrogen 3.276 N/A ALA 132.A N ARG 128.A O no hydrogen 2.856 N/A GLU 133.A N SER 129.A O no hydrogen 2.939 N/A ASN 134.A N ASN 130.A O no hydrogen 3.169 N/A GLY 135.A N GLN 131.A O no hydrogen 2.843 N/A ILE 136.A N ALA 132.A O no hydrogen 2.791 N/A ALA 137.A N GLU 133.A O no hydrogen 2.988 N/A ALA 138.A N ASN 134.A O no hydrogen 3.042 N/A LEU 139.A N GLY 135.A O no hydrogen 2.902 N/A ARG 140.A N ILE 136.A O no hydrogen 2.848 N/A GLU 141.A N ALA 138.A O no hydrogen 3.223 N/A SER 142.A N LEU 139.A O no hydrogen 2.920 N/A SER 142.A OG PRO 100.A O no hydrogen 3.316 N/A SER 142.A OG SER 104.A OG.A no hydrogen 2.932 N/A SER 142.A OG ALA 138.A O no hydrogen 3.291 N/A CYS 143.A SG LEU 139.A O no hydrogen 3.376 N/A ASP 144.A N THR 113.A O no hydrogen 2.781 N/A THR 145.A N THR 113.A O no hydrogen 3.352 N/A THR 145.A OG1 MET 203.A O no hydrogen 2.742 N/A LEU 146.A N GLY 207.A O no hydrogen 3.031 N/A ILE 147.A N GLY 115.A O no hydrogen 2.751 N/A VAL 148.A N ALA 209.A O no hydrogen 3.061 N/A ILE 149.A N VAL 117.A O no hydrogen 2.766 N/A ASN 151.A N ARG 119.A O no hydrogen 3.080 N/A ARG 153.A N PRO 150.A O no hydrogen 2.958 N/A ARG 153.A NE GLU 236.A OE2 no hydrogen 3.128 N/A ARG 153.A NH1 GLN 156.A OE1 no hydrogen 3.010 N/A LEU 154.A N ASN 151.A O no hydrogen 2.926 N/A LEU 155.A N ASP 152.A O no hydrogen 3.275 N/A GLN 156.A N ARG 153.A O no hydrogen 3.002 N/A MET 157.A N LEU 154.A O no hydrogen 3.071 N/A VAL 162.A N ASP 159.A O no hydrogen 3.263 N/A SER 163.A N ASP 166.A OD2 no hydrogen 2.830 N/A ASP 166.A N SER 163.A OG no hydrogen 2.953 N/A ALA 167.A N SER 163.A O no hydrogen 2.967 N/A PHE 168.A N LEU 164.A O no hydrogen 3.103 N/A ARG 169.A N MET 165.A O no hydrogen 2.972 N/A SER 170.A N ASP 166.A O no hydrogen 2.911 N/A SER 170.A OG.A ASP 166.A O no hydrogen 2.793 N/A SER 170.A OG.B ALA 167.A O no hydrogen 2.626 N/A ALA 171.A N ALA 167.A O no hydrogen 3.033 N/A ASP 172.A N PHE 168.A O no hydrogen 3.040 N/A GLU 173.A N ARG 169.A O no hydrogen 2.943 N/A VAL 174.A N SER 170.A O no hydrogen 3.005 N/A LEU 175.A N ALA 171.A O no hydrogen 3.168 N/A LEU 176.A N ASP 172.A O no hydrogen 3.001 N/A ASN 177.A N GLU 173.A O no hydrogen 2.786 N/A GLY 178.A N VAL 174.A O no hydrogen 2.879 N/A VAL 179.A N LEU 175.A O no hydrogen 3.039 N/A GLN 180.A N LEU 176.A O no hydrogen 2.736 N/A GLN 180.A NE2 ASP 184.A OD2 no hydrogen 2.913 N/A GLY 181.A N ASN 177.A O no hydrogen 2.917 N/A ILE 182.A N VAL 179.A O no hydrogen 3.008 N/A THR 183.A N VAL 179.A O no hydrogen 2.807 N/A THR 183.A OG1 VAL 179.A O no hydrogen 3.344 N/A ASP 184.A N GLN 180.A O no hydrogen 2.921 N/A LEU 185.A N ILE 182.A O no hydrogen 3.122 N/A ILE 186.A N THR 183.A O no hydrogen 2.927 N/A THR 187.A N THR 183.A O no hydrogen 2.877 N/A THR 187.A OG1 THR 183.A O no hydrogen 3.239 N/A THR 188.A N ASP 184.A O no hydrogen 2.871 N/A THR 188.A OG1 ILE 283.A O no hydrogen 2.730 N/A GLY 190.A N THR 281.A O no hydrogen 2.969 N/A ILE 192.A N THR 281.A OG1 no hydrogen 2.861 N/A ASP 195.A N ASP 198.A OD2 no hydrogen 3.116 N/A ASP 198.A N ASP 195.A OD1 no hydrogen 3.261 N/A VAL 199.A N ASP 195.A O no hydrogen 3.095 N/A LYS 200.A N PHE 196.A O no hydrogen 2.802 N/A GLY 201.A N ALA 197.A O no hydrogen 2.821 N/A ILE 202.A N ASP 198.A O no hydrogen 3.149 N/A ILE 202.A N VAL 199.A O no hydrogen 3.064 N/A MET 203.A N VAL 199.A O no hydrogen 2.822 N/A SER 204.A N LYS 200.A O no hydrogen 2.954 N/A SER 204.A OG LYS 200.A O no hydrogen 2.840 N/A GLY 205.A N ASP 144.A OD1 no hydrogen 3.181 N/A ALA 206.A N MET 203.A O no hydrogen 3.288 N/A GLY 207.A N ASP 144.A O no hydrogen 2.843 N/A ALA 209.A N LEU 146.A O no hydrogen 2.778 N/A LEU 210.A N ALA 297.A O no hydrogen 2.885 N/A GLY 212.A N VAL 295.A O no hydrogen 2.847 N/A GLY 214.A N VAL 293.A O no hydrogen 2.801 N/A SER 215.A OG GLU 290.A OE2 no hydrogen 3.055 N/A ALA 216.A N VAL 291.A O no hydrogen 3.060 N/A ARG 217.A NH1 ASP 289.A OD1 no hydrogen 3.077 N/A ARG 221.A N GLY 218.A O no hydrogen 3.231 N/A ARG 221.A NE GLU 259.A OE1 no hydrogen 2.989 N/A ARG 221.A NH1 ASP 289.A O no hydrogen 2.975 N/A ARG 221.A NH2 GLU 259.A OE2 no hydrogen 2.988 N/A SER 222.A OG.A GLU 259.A OE1 no hydrogen 3.491 N/A SER 222.A OG.B GLU 259.A O no hydrogen 2.685 N/A LYS 224.A N GLY 220.A O no hydrogen 2.859 N/A ALA 225.A N ARG 221.A O no hydrogen 2.774 N/A ALA 226.A N SER 222.A O no hydrogen 3.050 N/A GLU 227.A N LEU 223.A O no hydrogen 2.969 N/A ILE 228.A N LYS 224.A O no hydrogen 2.982 N/A ALA 229.A N ALA 225.A O no hydrogen 2.923 N/A ILE 230.A N ALA 226.A O no hydrogen 2.869 N/A ASN 231.A N GLU 227.A O no hydrogen 3.124 N/A ASN 231.A N ILE 228.A O no hydrogen 3.215 N/A ASN 231.A ND2 GLU 227.A O no hydrogen 2.997 N/A SER 232.A N ALA 229.A O no hydrogen 3.121 N/A LEU 234.A N SER 232.A OG no hydrogen 3.142 N/A LEU 235.A N SER 232.A O no hydrogen 2.947 N/A GLU 236.A N PRO 233.A O no hydrogen 3.026 N/A SER 238.A N LEU 235.A O no hydrogen 3.083 N/A SER 238.A OG GLU 236.A O no hydrogen 2.951 N/A GLY 241.A N SER 238.A O no hydrogen 3.063 N/A ALA 242.A N MET 239.A O no hydrogen 3.112 N/A GLN 243.A N GLY 299.A O no hydrogen 2.931 N/A GLY 244.A N ALA 298.A O no hydrogen 3.016 N/A VAL 245.A N ASN 276.A O no hydrogen 2.870 N/A LEU 246.A N ILE 296.A O no hydrogen 2.956 N/A MET 247.A N.A ILE 278.A O no hydrogen 2.842 N/A MET 247.A N.B ILE 278.A O no hydrogen 2.844 N/A SER 248.A N THR 294.A O no hydrogen 2.874 N/A SER 248.A OG GLY 181.A O no hydrogen 2.805 N/A ILE 249.A N GLY 280.A O no hydrogen 2.943 N/A ALA 250.A N ARG 292.A O no hydrogen 2.715 N/A GLY 251.A N VAL 282.A O no hydrogen 3.210 N/A SER 253.A N ASP 285.A OD1 no hydrogen 3.035 N/A SER 253.A OG ASP 285.A OD2 no hydrogen 3.227 N/A LEU 255.A N GLY 252.A O no hydrogen 3.254 N/A ILE 260.A N GLY 256.A O no hydrogen 3.072 N/A ASN 261.A N LEU 257.A O no hydrogen 2.862 N/A GLU 262.A N PHE 258.A O no hydrogen 2.867 N/A ALA 263.A N GLU 259.A O no hydrogen 3.086 N/A ALA 264.A N ILE 260.A O no hydrogen 2.907 N/A SER 265.A N ASN 261.A O no hydrogen 2.794 N/A LEU 266.A N GLU 262.A O no hydrogen 3.100 N/A VAL 267.A N ALA 263.A O no hydrogen 3.018 N/A GLN 268.A N ALA 264.A O no hydrogen 2.881 N/A ASP 269.A N SER 265.A O no hydrogen 3.038 N/A ALA 270.A N LEU 266.A O no hydrogen 3.128 N/A ALA 270.A N VAL 267.A O no hydrogen 3.171 N/A ALA 271.A N GLN 268.A O no hydrogen 3.079 N/A ASP 274.A N HIS 272.A ND1 no hydrogen 2.838 N/A ALA 275.A N HIS 272.A O no hydrogen 3.001 N/A ASN 276.A N GLN 243.A O no hydrogen 2.820 N/A ILE 278.A N VAL 245.A O no hydrogen 2.866 N/A GLY 280.A N MET 247.A O.A no hydrogen 2.808 N/A GLY 280.A N MET 247.A O.B no hydrogen 2.812 N/A THR 281.A N ILE 192.A O no hydrogen 2.894 N/A THR 281.A OG1 ILE 192.A O no hydrogen 3.246 N/A VAL 282.A N ILE 249.A O no hydrogen 2.972 N/A ILE 283.A N THR 188.A O no hydrogen 2.940 N/A ASP 284.A N GLY 251.A O no hydrogen 2.935 N/A SER 286.A OG ASP 284.A OD1 no hydrogen 2.924 N/A LEU 287.A N ASP 284.A O no hydrogen 3.142 N/A GLY 288.A N ASP 285.A O no hydrogen 3.453 N/A GLU 290.A N LEU 287.A O no hydrogen 3.046 N/A VAL 291.A N ALA 216.A O no hydrogen 2.911 N/A ARG 292.A N ALA 250.A O no hydrogen 2.902 N/A VAL 293.A N GLY 214.A O no hydrogen 2.794 N/A THR 294.A N SER 248.A O no hydrogen 2.910 N/A VAL 295.A N GLY 212.A O no hydrogen 2.857 N/A ILE 296.A N LEU 246.A O no hydrogen 2.817 N/A ALA 297.A N LEU 210.A O no hydrogen 2.790 N/A ALA 298.A N GLY 244.A O no hydrogen 2.786 N/A