Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3e5n_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ILE 3.A N ARG 34.A O no hydrogen 2.632 N/A ARG 4.A N ASP 97.A OD2 no hydrogen 2.688 N/A VAL 5.A N GLU 36.A O no hydrogen 2.845 N/A GLY 6.A N VAL 98.A O no hydrogen 2.814 N/A LEU 7.A N VAL 38.A O no hydrogen 2.843 N/A ILE 8.A N PHE 100.A O no hydrogen 3.208 N/A PHE 9.A N ILE 40.A O no hydrogen 3.192 N/A GLY 10.A N SER 19.A OG no hydrogen 2.681 N/A GLY 11.A N ILE 42.A O no hydrogen 2.674 N/A GLU 15.A N SER 13.A OG no hydrogen 2.881 N/A HIS 16.A N SER 13.A O no hydrogen 3.154 N/A HIS 16.A ND1 GLY 11.A O no hydrogen 2.576 N/A GLU 17.A N GLU 17.A OE1 no hydrogen 2.870 N/A SER 19.A N GLU 15.A O no hydrogen 3.129 N/A SER 19.A OG ILE 102.A O no hydrogen 2.573 N/A LEU 20.A N HIS 16.A O no hydrogen 3.028 N/A GLN 21.A N GLU 17.A O no hydrogen 2.978 N/A SER 22.A N VAL 18.A O no hydrogen 2.839 N/A SER 22.A OG VAL 18.A O no hydrogen 3.217 N/A ALA 23.A N SER 19.A O no hydrogen 2.953 N/A ARG 24.A N LEU 20.A O no hydrogen 3.238 N/A ARG 24.A NH1 GLN 21.A OE1 no hydrogen 2.485 N/A ARG 24.A NH2 GLN 21.A OE1 no hydrogen 2.739 N/A ARG 24.A NH2 ALA 60.A O no hydrogen 2.928 N/A ASN 25.A N GLN 21.A O no hydrogen 3.105 N/A ILE 26.A N SER 22.A O no hydrogen 2.730 N/A LEU 27.A N ALA 23.A O no hydrogen 2.802 N/A ASP 28.A N ARG 24.A O no hydrogen 2.949 N/A ALA 29.A N ILE 26.A O no hydrogen 2.982 N/A LEU 30.A N ILE 26.A O no hydrogen 2.917 N/A GLN 33.A N ASP 31.A OD1 no hydrogen 3.114 N/A ARG 34.A N ASP 31.A O no hydrogen 3.064 N/A ARG 34.A NH1 GLU 328.A OE2 no hydrogen 2.942 N/A ARG 34.A NH2 GLU 328.A OE2 no hydrogen 3.094 N/A PHE 35.A N ASP 31.A O no hydrogen 2.919 N/A GLU 36.A N ILE 3.A O no hydrogen 3.038 N/A VAL 38.A N VAL 5.A O no hydrogen 2.844 N/A ILE 40.A N LEU 7.A O no hydrogen 2.854 N/A GLY 41.A N HIS 49.A O no hydrogen 2.821 N/A ILE 42.A N PHE 9.A O no hydrogen 2.785 N/A ASP 43.A N GLN 47.A O no hydrogen 2.873 N/A LYS 44.A NZ GLU 17.A OE2 no hydrogen 2.899 N/A GLY 46.A N ASP 43.A O no hydrogen 2.980 N/A HIS 49.A N GLY 41.A O no hydrogen 2.798 N/A VAL 50.A N ARG 73.A O no hydrogen 2.899 N/A ASN 51.A N LEU 39.A O no hydrogen 3.073 N/A ASN 51.A ND2 HIS 69.A O no hydrogen 2.664 N/A SER 55.A N ASP 52.A O no hydrogen 2.992 N/A LEU 58.A N ALA 67.A O no hydrogen 2.784 N/A ASP 62.A N HIS 59.A O no hydrogen 2.942 N/A ALA 64.A N ASP 62.A OD1 no hydrogen 3.382 N/A ARG 65.A N ASP 62.A O no hydrogen 2.633 N/A ILE 66.A N ASP 62.A O no hydrogen 2.778 N/A ALA 67.A N LEU 58.A O no hydrogen 3.051 N/A HIS 69.A N PHE 56.A O no hydrogen 2.834 N/A SER 71.A N HIS 69.A O no hydrogen 2.837 N/A SER 71.A OG VAL 50.A O no hydrogen 2.672 N/A ARG 73.A N SER 71.A OG no hydrogen 3.179 N/A ARG 73.A NH1 ASP 52.A OD1 no hydrogen 2.892 N/A ALA 76.A N ARG 87.A O no hydrogen 2.557 N/A LEU 78.A N GLN 85.A O no hydrogen 2.827 N/A GLY 80.A N MET 119.A O no hydrogen 2.796 N/A ALA 81.A N LEU 78.A O no hydrogen 2.971 N/A GLN 84.A N GLN 95.A OE1 no hydrogen 2.710 N/A GLN 84.A NE2 LEU 93.A O no hydrogen 3.432 N/A GLN 85.A N GLN 85.A OE1 no hydrogen 2.604 N/A GLN 85.A NE2 ALA 120.A O no hydrogen 3.013 N/A GLN 85.A NE2 ASN 121.A O no hydrogen 3.656 N/A ARG 87.A N ALA 76.A O no hydrogen 2.670 N/A ARG 87.A NE GLN 84.A O no hydrogen 2.771 N/A ARG 87.A NH2 GLN 83.A O no hydrogen 3.550 N/A ARG 87.A NH2 GLN 84.A O no hydrogen 3.380 N/A ILE 89.A N GLY 74.A O no hydrogen 3.063 N/A GLN 90.A NE2 GLY 72.A O no hydrogen 3.553 N/A GLN 95.A NE2 GLN 85.A OE1 no hydrogen 3.196 N/A GLN 95.A NE2 ILE 96.A O no hydrogen 2.892 N/A ASP 97.A N ARG 4.A O no hydrogen 2.903 N/A VAL 98.A N ARG 4.A O no hydrogen 3.226 N/A VAL 99.A N PRO 123.A O no hydrogen 2.767 N/A PHE 100.A N GLY 6.A O no hydrogen 2.798 N/A ILE 102.A N ILE 8.A O no hydrogen 2.736 N/A GLY 105.A N GLU 109.A OE2 no hydrogen 3.423 N/A GLU 109.A N GLY 105.A O no hydrogen 3.169 N/A GLU 109.A N THR 106.A O no hydrogen 3.314 N/A ASP 110.A N THR 106.A O no hydrogen 3.064 N/A SER 112.A N ASP 110.A OD2 no hydrogen 2.843 N/A SER 112.A OG ASP 110.A OD2 no hydrogen 2.692 N/A LEU 113.A N LEU 107.A O no hydrogen 3.030 N/A GLN 114.A NE2 GLY 108.A O no hydrogen 2.967 N/A GLY 115.A N GLY 111.A O no hydrogen 2.938 N/A LEU 116.A N SER 112.A O no hydrogen 3.096 N/A LEU 117.A N LEU 113.A O no hydrogen 2.875 N/A ARG 118.A N GLN 114.A O no hydrogen 2.833 N/A ARG 118.A NH1 ASP 337.A OD2 no hydrogen 3.054 N/A MET 119.A N GLY 115.A O no hydrogen 2.865 N/A ALA 120.A N LEU 116.A O no hydrogen 3.140 N/A ALA 120.A N LEU 117.A O no hydrogen 3.131 N/A ASN 121.A N ARG 118.A O no hydrogen 3.016 N/A ASN 121.A ND2 ALA 81.A O no hydrogen 2.887 N/A LEU 122.A N LEU 117.A O no hydrogen 2.943 N/A VAL 125.A N VAL 99.A O no hydrogen 2.841 N/A SER 127.A OG ALA 276.A O no hydrogen 3.193 N/A SER 132.A N GLY 128.A O no hydrogen 3.103 N/A SER 132.A OG SER 127.A O no hydrogen 3.161 N/A SER 132.A OG GLY 128.A O no hydrogen 2.743 N/A ALA 133.A N VAL 129.A O no hydrogen 2.935 N/A VAL 134.A N LEU 130.A O no hydrogen 2.908 N/A ALA 135.A N GLY 131.A O no hydrogen 3.064 N/A MET 136.A N SER 132.A O no hydrogen 3.023 N/A ASP 137.A N ALA 133.A O no hydrogen 3.143 N/A LYS 138.A N ALA 184.A O no hydrogen 2.900 N/A LYS 138.A NZ ALA 135.A O no hydrogen 3.048 N/A LYS 138.A NZ GLU 295.A OE1 no hydrogen 3.215 N/A MET 140.A N ASP 137.A OD1 no hydrogen 3.056 N/A ALA 141.A N ASP 137.A O no hydrogen 2.805 N/A LYS 142.A N LYS 138.A O no hydrogen 3.103 N/A LYS 142.A NZ GLU 218.A OE2 no hydrogen 3.234 N/A ARG 143.A N ASP 139.A O no hydrogen 3.074 N/A ARG 143.A NE ASP 139.A OD1 no hydrogen 3.010 N/A ARG 143.A NH2 ASP 139.A OD2 no hydrogen 3.029 N/A VAL 144.A N MET 140.A O no hydrogen 2.882 N/A LEU 145.A N ALA 141.A O no hydrogen 3.033 N/A ARG 146.A N LYS 142.A O no hydrogen 2.828 N/A ASP 147.A N ARG 143.A O no hydrogen 3.021 N/A ALA 148.A N VAL 144.A O no hydrogen 2.971 N/A ARG 149.A N ARG 146.A O no hydrogen 3.038 N/A LEU 150.A N LEU 145.A O no hydrogen 3.018 N/A VAL 156.A N VAL 217.A O no hydrogen 2.802 N/A CYS 157.A SG VAL 215.A O no hydrogen 3.559 N/A PHE 158.A N VAL 215.A O no hydrogen 2.911 N/A ARG 160.A NH1 LEU 209.A O no hydrogen 2.746 N/A ARG 160.A NH2 LEU 209.A O no hydrogen 3.172 N/A THR 162.A N ASP 159.A O no hydrogen 3.195 N/A ALA 163.A N ASP 159.A O no hydrogen 2.856 N/A HIS 165.A N THR 162.A O no hydrogen 2.980 N/A ALA 166.A N ALA 163.A O no hydrogen 3.332 N/A THR 170.A N ASP 167.A OD2 no hydrogen 2.889 N/A THR 170.A OG1 ASP 167.A OD2 no hydrogen 2.309 N/A LEU 171.A N ASP 167.A O no hydrogen 3.059 N/A ILE 172.A N VAL 168.A O no hydrogen 2.639 N/A ALA 173.A N ASP 169.A O no hydrogen 2.919 N/A GLN 174.A N THR 170.A O no hydrogen 3.138 N/A GLN 174.A N LEU 171.A O no hydrogen 3.276 N/A LEU 175.A N LEU 171.A O no hydrogen 2.884 N/A GLY 176.A N ILE 172.A O no hydrogen 2.966 N/A LEU 179.A N VAL 195.A O no hydrogen 2.786 N/A PHE 180.A N GLU 218.A O no hydrogen 2.799 N/A VAL 181.A N SER 193.A O no hydrogen 2.814 N/A LYS 182.A N LEU 216.A O no hydrogen 3.048 N/A ALA 184.A N LYS 214.A O no hydrogen 2.861 N/A ASN 185.A N ASP 212.A OD2 no hydrogen 3.314 N/A SER 188.A OG GLU 295.A OE2 no hydrogen 3.494 N/A VAL 192.A N SER 189.A O no hydrogen 3.250 N/A SER 193.A N VAL 181.A O no hydrogen 2.909 N/A VAL 195.A N LEU 179.A O no hydrogen 2.686 N/A ALA 200.A N THR 197.A O no hydrogen 3.043 N/A PHE 201.A N ALA 198.A O no hydrogen 3.249 N/A ALA 204.A N ALA 200.A O no hydrogen 3.431 N/A LEU 205.A N PHE 201.A O no hydrogen 2.883 N/A ALA 206.A N ALA 202.A O no hydrogen 3.180 N/A LEU 207.A N ALA 203.A O no hydrogen 2.841 N/A ALA 208.A N ALA 204.A O no hydrogen 2.955 N/A LEU 209.A N LEU 205.A O no hydrogen 3.178 N/A ALA 210.A N LEU 207.A O no hydrogen 3.192 N/A TYR 211.A N ALA 208.A O no hydrogen 2.985 N/A ASP 212.A N ALA 208.A O no hydrogen 3.228 N/A LYS 214.A NZ ASP 137.A OD1 no hydrogen 3.316 N/A LYS 214.A NZ ASP 137.A OD2 no hydrogen 2.796 N/A LYS 214.A NZ ASP 139.A OD2 no hydrogen 2.688 N/A VAL 215.A N PHE 158.A O no hydrogen 2.598 N/A LEU 216.A N LYS 182.A O no hydrogen 2.613 N/A VAL 217.A N VAL 156.A O no hydrogen 2.792 N/A GLU 218.A N PHE 180.A O no hydrogen 2.837 N/A ALA 219.A N PRO 154.A O no hydrogen 2.940 N/A ARG 224.A N LEU 285.A O no hydrogen 2.862 N/A ARG 224.A NH1 GLU 243.A OE2 no hydrogen 3.541 N/A ARG 224.A NH1 ASP 253.A O no hydrogen 3.256 N/A ARG 224.A NH2 ASP 253.A O no hydrogen 3.417 N/A ILE 226.A N VAL 283.A O no hydrogen 2.964 N/A GLU 227.A N GLY 242.A O no hydrogen 2.820 N/A CYS 228.A N VAL 281.A O no hydrogen 2.885 N/A CYS 228.A SG ALA 229.A O no hydrogen 3.995 N/A CYS 228.A SG SER 239.A O no hydrogen 3.613 N/A ALA 229.A N SER 239.A OG no hydrogen 3.008 N/A VAL 230.A N ALA 279.A O no hydrogen 2.735 N/A LEU 231.A N HIS 237.A O no hydrogen 2.923 N/A GLY 232.A N GLY 277.A O no hydrogen 2.944 N/A ASN 233.A ND2 LEU 329.A O no hydrogen 2.945 N/A HIS 237.A N LEU 231.A O no hydrogen 2.702 N/A SER 239.A N ALA 229.A O no hydrogen 2.795 N/A SER 239.A OG ALA 229.A O no hydrogen 3.488 N/A SER 239.A OG VAL 240.A O no hydrogen 2.687 N/A VAL 240.A N SER 315.A OG no hydrogen 2.764 N/A GLY 242.A N GLU 227.A O no hydrogen 2.944 N/A GLU 243.A N VAL 249.A O no hydrogen 2.905 N/A VAL 244.A N GLU 225.A O no hydrogen 2.817 N/A VAL 245.A N GLU 247.A O no hydrogen 2.767 N/A VAL 249.A N GLU 243.A O no hydrogen 2.673 N/A ALA 252.A N CYS 241.A O no hydrogen 2.770 N/A THR 258.A OG1 ASP 255.A OD1 no hydrogen 3.397 N/A GLN 259.A N ASP 255.A O no hydrogen 2.986 N/A GLN 260.A N ALA 256.A O no hydrogen 2.923 N/A ARG 261.A N GLN 257.A O no hydrogen 2.955 N/A ARG 261.A NH1 GLY 289.A O no hydrogen 3.379 N/A ARG 261.A NH2 GLY 289.A O no hydrogen 2.403 N/A ILE 262.A N THR 258.A O no hydrogen 3.018 N/A GLN 263.A N GLN 259.A O no hydrogen 2.841 N/A GLN 263.A NE2 SER 239.A O no hydrogen 2.646 N/A GLN 264.A N GLN 260.A O no hydrogen 2.952 N/A ILE 265.A N ARG 261.A O no hydrogen 3.022 N/A ALA 266.A N ILE 262.A O no hydrogen 2.808 N/A VAL 267.A N GLN 263.A O no hydrogen 3.151 N/A GLN 268.A N GLN 264.A O no hydrogen 3.005 N/A ALA 269.A N ILE 265.A O no hydrogen 2.792 N/A TYR 270.A N ALA 266.A O no hydrogen 3.014 N/A TYR 270.A OH GLY 232.A O no hydrogen 2.666 N/A GLN 271.A N VAL 267.A O no hydrogen 2.834 N/A ALA 272.A N GLN 268.A O no hydrogen 2.915 N/A LEU 273.A N ALA 269.A O no hydrogen 3.191 N/A GLY 274.A N GLN 271.A O no hydrogen 3.129 N/A CYS 275.A N TYR 270.A O no hydrogen 3.081 N/A ALA 276.A N SER 127.A OG no hydrogen 2.989 N/A GLY 277.A N GLY 232.A O no hydrogen 3.154 N/A GLY 277.A N ASN 233.A OD1 no hydrogen 3.061 N/A MET 278.A N ALA 276.A O no hydrogen 2.961 N/A ALA 279.A N VAL 230.A O no hydrogen 3.046 N/A ARG 280.A N ASN 297.A O no hydrogen 2.896 N/A ARG 280.A NE ASP 282.A OD1 no hydrogen 2.781 N/A ARG 280.A NH2 ASP 282.A OD2 no hydrogen 2.757 N/A VAL 281.A N CYS 228.A O no hydrogen 2.885 N/A ASP 282.A N GLU 295.A O no hydrogen 2.778 N/A VAL 283.A N ILE 226.A O no hydrogen 2.804 N/A PHE 284.A N VAL 292.A O no hydrogen 2.784 N/A LEU 285.A N ARG 224.A O no hydrogen 2.780 N/A CYS 286.A N ARG 290.A O no hydrogen 2.841 N/A CYS 286.A SG ALA 222.A O no hydrogen 3.349 N/A VAL 292.A N PHE 284.A O no hydrogen 2.876 N/A ILE 293.A N ALA 151.A O no hydrogen 2.894 N/A ASN 294.A N ASP 282.A O no hydrogen 2.812 N/A ASN 294.A ND2 GLU 225.A OE1.A no hydrogen 3.129 N/A GLU 295.A N ASP 282.A O no hydrogen 3.167 N/A ASN 297.A N ARG 280.A O no hydrogen 2.761 N/A ASN 297.A ND2 LEU 299.A O no hydrogen 3.660 N/A LEU 299.A N ASN 297.A OD1 no hydrogen 2.842 N/A PHE 302.A N SER 22.A OG no hydrogen 2.925 N/A THR 303.A N SER 306.A OG no hydrogen 3.153 N/A THR 303.A OG1 SER 306.A OG no hydrogen 2.855 N/A ARG 304.A N ASN 25.A OD1 no hydrogen 2.944 N/A ILE 305.A N THR 303.A OG1 no hydrogen 3.110 N/A SER 306.A N THR 303.A O no hydrogen 3.181 N/A SER 306.A OG THR 303.A OG1 no hydrogen 2.855 N/A TYR 308.A OH VAL 230.A O no hydrogen 2.736 N/A LYS 310.A N SER 306.A O no hydrogen 3.341 N/A LYS 310.A NZ GLN 313.A OE1 no hydrogen 2.955 N/A LEU 311.A N VAL 307.A O no hydrogen 2.846 N/A TRP 312.A N TYR 308.A O no hydrogen 3.315 N/A GLN 313.A N PRO 309.A O no hydrogen 2.772 N/A ALA 314.A N LYS 310.A O no hydrogen 2.969 N/A SER 315.A N TRP 312.A O no hydrogen 2.859 N/A SER 315.A OG LEU 311.A O no hydrogen 2.918 N/A GLY 316.A N GLN 313.A O no hydrogen 2.945 N/A LEU 317.A N TRP 312.A O no hydrogen 2.911 N/A TYR 319.A OH PHE 302.A O no hydrogen 2.278 N/A GLY 321.A N ASP 318.A OD2 no hydrogen 2.864 N/A LEU 322.A N ASP 318.A O no hydrogen 2.802 N/A ILE 323.A N TYR 319.A O no hydrogen 2.982 N/A THR 324.A N ARG 320.A O no hydrogen 2.994 N/A THR 324.A OG1 ARG 320.A O no hydrogen 3.325 N/A ARG 325.A N GLY 321.A O no hydrogen 2.901 N/A ARG 325.A NH1 GLU 328.A OE1 no hydrogen 3.384 N/A ARG 325.A NH1 GLU 332.A OE2 no hydrogen 2.923 N/A LEU 326.A N LEU 322.A O no hydrogen 2.892 N/A ILE 327.A N ILE 323.A O no hydrogen 3.043 N/A GLU 328.A N THR 324.A O no hydrogen 2.892 N/A LEU 329.A N ARG 325.A O no hydrogen 2.915 N/A ALA 330.A N LEU 326.A O no hydrogen 3.079 N/A LEU 331.A N ILE 327.A O no hydrogen 3.086 N/A GLU 332.A N GLU 328.A O no hydrogen 2.908 N/A ARG 333.A N LEU 329.A O no hydrogen 3.023 N/A ARG 333.A NH1 GLY 126.A O no hydrogen 2.920 N/A ARG 333.A NH2 PHE 124.A O no hydrogen 2.743 N/A ARG 333.A NH2 GLY 126.A O no hydrogen 2.766 N/A HIS 334.A N ALA 330.A O no hydrogen 3.049 N/A THR 335.A N LEU 331.A O no hydrogen 2.953 N/A THR 335.A OG1 LEU 331.A O no hydrogen 3.493 N/A THR 335.A OG1 GLU 332.A O no hydrogen 3.101 N/A ASP 336.A N GLU 332.A O no hydrogen 3.126 N/A ASP 337.A N ARG 333.A O no hydrogen 2.814 N/A GLN 338.A N HIS 334.A O no hydrogen 3.051 N/A LEU 339.A N THR 335.A O no hydrogen 3.277 N/A LEU 339.A N ASP 336.A O no hydrogen 3.261 N/A LEU 340.A N ASP 336.A O no hydrogen 3.435 N/A