Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4n9w_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): MET 2.A N HIS 34.A ND1 no hydrogen 3.127 N/A ARG 3.A N ASP 90.A OD2 no hydrogen 2.696 N/A ARG 3.A NE GLY 87.A O no hydrogen 2.971 N/A ARG 3.A NE ASP 88.A O no hydrogen 3.444 N/A ARG 3.A NH1 GLY 87.A O no hydrogen 2.813 N/A ILE 4.A N GLU 35.A O no hydrogen 2.719 N/A GLY 5.A N VAL 91.A O no hydrogen 3.052 N/A MET 6.A N SER 37.A O no hydrogen 2.809 N/A VAL 7.A N HIS 93.A O no hydrogen 2.958 N/A CYS 8.A N LEU 39.A O no hydrogen 3.007 N/A CYS 8.A SG TYR 10.A O no hydrogen 3.426 N/A SER 11.A OG ALA 42.A O no hydrogen 2.906 N/A SER 11.A OG SER 43.A OG no hydrogen 3.261 N/A PHE 12.A N SER 43.A OG no hydrogen 2.873 N/A ASP 13.A N SER 11.A OG no hydrogen 2.979 N/A GLN 19.A N GLN 19.A OE1 no hydrogen 2.736 N/A GLN 19.A NE2 SER 11.A O no hydrogen 3.248 N/A SER 20.A N GLY 16.A O no hydrogen 2.990 N/A SER 20.A OG GLY 16.A O no hydrogen 3.367 N/A HIS 21.A N GLY 17.A O no hydrogen 2.985 N/A VAL 22.A N VAL 18.A O no hydrogen 2.994 N/A LEU 23.A N GLN 19.A O no hydrogen 3.145 N/A GLN 24.A N SER 20.A O no hydrogen 2.960 N/A LEU 25.A N HIS 21.A O no hydrogen 2.863 N/A ALA 26.A N VAL 22.A O no hydrogen 2.940 N/A GLU 27.A N LEU 23.A O no hydrogen 2.961 N/A VAL 28.A N GLN 24.A O no hydrogen 2.926 N/A LEU 29.A N LEU 25.A O no hydrogen 3.012 N/A ARG 30.A N ALA 26.A O no hydrogen 3.028 N/A ASP 31.A N GLU 27.A O no hydrogen 2.966 N/A ALA 32.A N LEU 29.A O no hydrogen 3.075 N/A GLY 33.A N ARG 30.A O no hydrogen 2.985 N/A HIS 34.A N LEU 29.A O no hydrogen 3.067 N/A GLU 35.A N MET 2.A O no hydrogen 2.869 N/A SER 37.A N ILE 4.A O no hydrogen 2.922 N/A SER 37.A OG TYR 51.A O no hydrogen 3.555 N/A VAL 38.A N TYR 51.A O no hydrogen 3.075 N/A LEU 39.A N MET 6.A O no hydrogen 2.790 N/A ALA 40.A N VAL 53.A O no hydrogen 3.165 N/A ALA 42.A N GLY 56.A O no hydrogen 2.848 N/A SER 43.A OG SER 11.A OG no hydrogen 3.261 N/A SER 43.A OG PRO 41.A O no hydrogen 2.887 N/A HIS 45.A N ASP 13.A OD1 no hydrogen 2.972 N/A HIS 45.A ND1 ASP 13.A OD2 no hydrogen 3.147 N/A TYR 51.A OH GLU 27.A OE1 no hydrogen 2.540 N/A VAL 52.A N PRO 49.A O no hydrogen 3.264 N/A VAL 53.A N VAL 38.A O no hydrogen 2.732 N/A GLY 55.A N ALA 40.A O no hydrogen 2.742 N/A GLY 56.A N SER 54.A OG no hydrogen 2.848 N/A VAL 59.A N ARG 71.A O no hydrogen 2.803 N/A ILE 61.A N ARG 69.A O no hydrogen 3.085 N/A SER 66.A OG ALA 68.A O no hydrogen 2.974 N/A ARG 71.A N VAL 59.A O no hydrogen 2.872 N/A ARG 71.A NH1 TYR 63.A OH no hydrogen 2.678 N/A THR 76.A N GLY 73.A O no hydrogen 3.007 N/A THR 76.A OG1 GLY 55.A O no hydrogen 2.688 N/A ARG 78.A N PRO 74.A O no hydrogen 3.094 N/A LYS 79.A N ALA 75.A O no hydrogen 2.880 N/A VAL 80.A N THR 76.A O no hydrogen 2.836 N/A LYS 81.A N HIS 77.A O no hydrogen 3.238 N/A LYS 82.A N ARG 78.A O no hydrogen 3.039 N/A LYS 82.A NZ GLU 86.A OE2 no hydrogen 3.410 N/A TRP 83.A N LYS 79.A O no hydrogen 2.899 N/A TRP 83.A NE1 SER 37.A OG no hydrogen 2.939 N/A ILE 84.A N VAL 80.A O no hydrogen 3.078 N/A ALA 85.A N LYS 81.A O no hydrogen 2.896 N/A GLU 86.A N LYS 82.A O no hydrogen 2.868 N/A GLY 87.A N ILE 84.A O no hydrogen 3.244 N/A ASP 90.A N ARG 3.A O no hydrogen 2.758 N/A VAL 91.A N ARG 3.A O no hydrogen 3.480 N/A LEU 92.A N PRO 113.A O no hydrogen 2.964 N/A HIS 93.A N GLY 5.A O no hydrogen 2.744 N/A HIS 93.A ND1 TYR 347.A OH no hydrogen 2.629 N/A HIS 93.A NE2 THR 117.A OG1 no hydrogen 2.700 N/A ILE 94.A N VAL 115.A O no hydrogen 2.836 N/A HIS 95.A N VAL 7.A O no hydrogen 3.101 N/A HIS 95.A ND1 HIS 119.A NE2 no hydrogen 3.116 N/A GLU 96.A N THR 117.A O no hydrogen 2.948 N/A ASN 98.A N GLU 96.A O no hydrogen 2.652 N/A SER 101.A OG ASN 98.A O no hydrogen 2.582 N/A SER 103.A OG HIS 95.A O no hydrogen 2.616 N/A MET 104.A N SER 101.A OG no hydrogen 3.042 N/A LEU 105.A N SER 101.A O no hydrogen 2.939 N/A ALA 106.A N LEU 102.A O no hydrogen 2.968 N/A LEU 107.A N SER 103.A O no hydrogen 2.954 N/A GLN 108.A N MET 104.A O no hydrogen 2.874 N/A ALA 109.A N LEU 105.A O no hydrogen 3.003 N/A GLU 111.A N GLN 358.A O no hydrogen 3.008 N/A VAL 115.A N LEU 92.A O no hydrogen 2.891 N/A ALA 116.A N GLY 144.A O no hydrogen 2.942 N/A THR 117.A N ILE 94.A O no hydrogen 2.997 N/A THR 117.A OG1 HIS 93.A NE2 no hydrogen 2.700 N/A PHE 118.A N ILE 146.A O no hydrogen 2.800 N/A HIS 119.A N GLU 96.A OE2 no hydrogen 2.675 N/A HIS 119.A NE2 HIS 95.A ND1 no hydrogen 3.116 N/A THR 120.A N THR 123.A OG1 no hydrogen 3.403 N/A THR 120.A OG1 GLU 96.A OE1 no hydrogen 3.073 N/A THR 120.A OG1 THR 123.A OG1 no hydrogen 3.186 N/A THR 122.A N GLU 261.A OE1 no hydrogen 3.010 N/A THR 122.A OG1 GLU 261.A OE1 no hydrogen 2.483 N/A THR 122.A OG1 GLU 261.A OE2 no hydrogen 3.079 N/A THR 123.A N THR 120.A OG1 no hydrogen 3.277 N/A THR 123.A OG1 GLU 96.A OE1 no hydrogen 3.397 N/A THR 123.A OG1 GLU 96.A OE2 no hydrogen 2.706 N/A THR 123.A OG1 THR 120.A O no hydrogen 3.362 N/A THR 123.A OG1 THR 120.A OG1 no hydrogen 3.186 N/A LYS 124.A N THR 120.A O no hydrogen 2.879 N/A LYS 124.A NZ SER 149.A OG no hydrogen 2.849 N/A SER 125.A N SER 121.A O no hydrogen 3.344 N/A SER 125.A OG SER 121.A O no hydrogen 3.476 N/A LEU 126.A N THR 123.A O no hydrogen 3.037 N/A THR 127.A N LYS 124.A O no hydrogen 3.068 N/A THR 127.A OG1 LYS 124.A O no hydrogen 2.729 N/A LEU 128.A N SER 125.A O no hydrogen 2.881 N/A PHE 131.A N LEU 128.A O no hydrogen 2.957 N/A GLN 132.A N SER 129.A O no hydrogen 2.958 N/A GLN 132.A NE2 LEU 126.A O no hydrogen 2.887 N/A LEU 135.A N GLN 132.A O no hydrogen 2.928 N/A ARG 136.A N GLY 133.A O no hydrogen 3.447 N/A TYR 138.A N LEU 135.A O no hydrogen 2.834 N/A HIS 139.A N LEU 135.A O no hydrogen 3.035 N/A GLU 140.A N ARG 136.A O no hydrogen 2.864 N/A LYS 141.A N TYR 138.A O no hydrogen 2.924 N/A LYS 141.A NZ LEU 107.A O no hydrogen 2.793 N/A LYS 141.A NZ ALA 110.A O no hydrogen 2.683 N/A LYS 141.A NZ SER 360.A OG no hydrogen 3.142 N/A ILE 142.A N HIS 139.A O no hydrogen 3.119 N/A ILE 143.A N ILE 114.A O no hydrogen 2.762 N/A GLY 144.A N ILE 114.A O no hydrogen 3.061 N/A ILE 146.A N ALA 116.A O no hydrogen 2.884 N/A ALA 147.A N VAL 151.A O no hydrogen 2.865 N/A VAL 148.A N PHE 118.A O no hydrogen 3.192 N/A VAL 151.A N ARG 145.A O no hydrogen 2.890 N/A ILE 153.A N ALA 147.A O no hydrogen 2.950 N/A ASN 155.A ND2 HIS 119.A ND1 no hydrogen 3.422 N/A VAL 157.A N TYR 334.A O no hydrogen 2.836 N/A VAL 159.A N ASP 335.A OD1 no hydrogen 3.101 N/A SER 161.A N ASP 158.A O no hydrogen 3.057 N/A SER 161.A N ASP 158.A OD1 no hydrogen 3.126 N/A SER 161.A OG ASP 158.A OD1 no hydrogen 2.538 N/A PHE 162.A N VAL 159.A O no hydrogen 3.008 N/A ALA 163.A N VAL 159.A O no hydrogen 2.906 N/A ASP 164.A N ALA 160.A O no hydrogen 2.972 N/A ALA 165.A N PHE 162.A O no hydrogen 3.193 N/A LEU 168.A N SER 249.A OG no hydrogen 2.997 N/A TYR 171.A N LEU 168.A O no hydrogen 3.026 N/A TYR 171.A OH GLU 209.A OE2 no hydrogen 2.528 N/A ARG 173.A NH1 ARG 176.A O no hydrogen 2.835 N/A ARG 173.A NH1 ASP 207.A O no hydrogen 2.864 N/A ARG 173.A NH2 ASP 207.A O no hydrogen 2.988 N/A ARG 173.A NH2 ASP 207.A OD1 no hydrogen 3.386 N/A ARG 176.A N ARG 173.A O no hydrogen 2.977 N/A ARG 176.A NH1 LEU 314.A O no hydrogen 3.137 N/A THR 177.A N ASP 251.A OD2 no hydrogen 2.898 N/A VAL 178.A N GLU 209.A O no hydrogen 2.884 N/A LEU 179.A N VAL 252.A O no hydrogen 2.845 N/A PHE 180.A N LEU 211.A O no hydrogen 2.904 N/A GLY 182.A N VAL 213.A O no hydrogen 2.747 N/A ARG 183.A NH2 GLN 237.A OE1 no hydrogen 2.820 N/A GLU 186.A N ARG 183.A O no hydrogen 2.989 N/A LYS 189.A N GLU 186.A O no hydrogen 3.034 N/A GLY 190.A N PRO 187.A O no hydrogen 2.931 N/A VAL 193.A N GLY 190.A O no hydrogen 2.951 N/A LEU 194.A N GLY 190.A O no hydrogen 3.459 N/A LEU 195.A N MET 191.A O no hydrogen 2.862 N/A ALA 196.A N ALA 192.A O no hydrogen 3.064 N/A ALA 197.A N VAL 193.A O no hydrogen 3.116 N/A ALA 197.A N LEU 194.A O no hydrogen 3.154 N/A LEU 198.A N LEU 195.A O no hydrogen 3.087 N/A LYS 200.A NZ ASP 304.A OD1 no hydrogen 2.627 N/A LEU 201.A N ALA 197.A O no hydrogen 3.217 N/A VAL 202.A N LEU 198.A O no hydrogen 2.906 N/A ALA 203.A N PRO 199.A O no hydrogen 3.019 N/A ARG 204.A N LYS 200.A O no hydrogen 3.297 N/A ARG 204.A N LEU 201.A O no hydrogen 3.159 N/A ARG 204.A NE GLU 315.A OE2 no hydrogen 2.780 N/A ARG 204.A NH1 GLU 315.A OE1 no hydrogen 2.976 N/A ARG 204.A NH1 GLU 315.A OE2 no hydrogen 3.229 N/A PHE 205.A N LEU 201.A O no hydrogen 2.753 N/A VAL 208.A N PHE 205.A O no hydrogen 3.052 N/A GLU 209.A N ARG 176.A O no hydrogen 2.969 N/A ILE 210.A N HIS 231.A O no hydrogen 2.796 N/A LEU 211.A N VAL 178.A O no hydrogen 2.806 N/A ILE 212.A N ARG 233.A O no hydrogen 2.760 N/A VAL 213.A N PHE 180.A O no hydrogen 2.811 N/A GLY 214.A N GLY 236.A O no hydrogen 3.005 N/A ASP 217.A N ASP 185.A OD1 no hydrogen 3.408 N/A ASP 217.A N ASP 185.A OD2 no hydrogen 2.997 N/A GLU 220.A N ASP 217.A OD1 no hydrogen 3.348 N/A LEU 221.A N ASP 217.A O no hydrogen 3.089 N/A ARG 222.A N GLU 218.A O no hydrogen 2.870 N/A GLU 223.A N ASP 219.A O no hydrogen 3.026 N/A GLN 224.A N GLU 220.A O no hydrogen 2.899 N/A ALA 225.A N LEU 221.A O no hydrogen 2.905 N/A GLY 226.A N ARG 222.A O no hydrogen 3.110 N/A GLY 226.A N GLU 223.A O no hydrogen 3.070 N/A LEU 228.A N ALA 225.A O no hydrogen 3.075 N/A ALA 229.A N GLY 226.A O no hydrogen 3.111 N/A HIS 231.A N LEU 228.A O no hydrogen 3.107 N/A HIS 231.A ND1 VAL 208.A O no hydrogen 2.902 N/A LEU 232.A N ALA 229.A O no hydrogen 2.995 N/A ARG 233.A N ILE 210.A O no hydrogen 2.907 N/A ARG 233.A NH1 TYR 171.A OH no hydrogen 2.736 N/A LEU 235.A N ILE 212.A O no hydrogen 3.058 N/A THR 242.A N ASP 239.A OD1 no hydrogen 2.758 N/A THR 242.A OG1 ASP 239.A OD1 no hydrogen 2.692 N/A LYS 243.A N ASP 239.A O no hydrogen 3.027 N/A LYS 243.A NZ GLU 269.A OE2 no hydrogen 3.240 N/A ALA 244.A N ASP 240.A O no hydrogen 3.023 N/A SER 245.A N ALA 241.A O no hydrogen 3.096 N/A SER 245.A OG PRO 166.A O no hydrogen 2.592 N/A SER 245.A OG ALA 241.A O no hydrogen 3.355 N/A ALA 246.A N THR 242.A O no hydrogen 2.849 N/A MET 247.A N LYS 243.A O no hydrogen 2.882 N/A ARG 248.A N ALA 244.A O no hydrogen 2.980 N/A SER 249.A N SER 245.A O no hydrogen 2.870 N/A SER 249.A OG SER 245.A O no hydrogen 2.794 N/A ALA 250.A N ALA 246.A O no hydrogen 3.159 N/A ASP 251.A N THR 177.A O no hydrogen 2.911 N/A VAL 252.A N THR 177.A O no hydrogen 3.277 N/A TYR 253.A N ALA 276.A O no hydrogen 2.818 N/A CYS 254.A N LEU 179.A O no hydrogen 2.941 N/A ALA 255.A N VAL 278.A O no hydrogen 2.888 N/A HIS 257.A N HIS 257.A ND1 no hydrogen 2.904 N/A LEU 258.A N ARG 188.A O no hydrogen 2.954 N/A LEU 267.A N GLY 264.A O no hydrogen 3.158 N/A GLU 269.A N ILE 265.A O no hydrogen 2.958 N/A ALA 270.A N VAL 266.A O no hydrogen 3.072 N/A MET 271.A N LEU 267.A O no hydrogen 2.973 N/A ALA 272.A N VAL 268.A O no hydrogen 2.947 N/A ALA 273.A N GLU 269.A O no hydrogen 3.007 N/A GLY 274.A N MET 271.A O no hydrogen 3.153 N/A THR 275.A N ALA 270.A O no hydrogen 3.116 N/A THR 275.A OG1 MET 247.A O no hydrogen 2.727 N/A VAL 278.A N TYR 253.A O no hydrogen 2.909 N/A ALA 279.A N ARG 296.A O no hydrogen 2.838 N/A SER 280.A N ALA 255.A O no hydrogen 2.974 N/A SER 280.A OG ALA 255.A O no hydrogen 3.429 N/A SER 280.A OG HIS 257.A O no hydrogen 2.736 N/A ASP 281.A N VAL 298.A O no hydrogen 2.723 N/A LEU 282.A N SER 280.A O no hydrogen 2.770 N/A PHE 285.A N LEU 282.A O no hydrogen 2.929 N/A ARG 286.A N LEU 282.A O no hydrogen 2.797 N/A ARG 286.A NE ASP 281.A OD2 no hydrogen 2.885 N/A ARG 286.A NH1 ASP 291.A OD1 no hydrogen 3.464 N/A ARG 286.A NH2 ASP 281.A OD1 no hydrogen 2.786 N/A ARG 287.A N ASP 283.A O no hydrogen 3.079 N/A VAL 288.A N ALA 284.A O no hydrogen 3.412 N/A LEU 289.A N PHE 285.A O no hydrogen 3.030 N/A ALA 290.A N ARG 287.A O no hydrogen 3.193 N/A ASP 291.A N ARG 286.A O no hydrogen 2.848 N/A GLY 292.A N LEU 289.A O no hydrogen 2.939 N/A ASP 293.A N ALA 290.A O no hydrogen 3.008 N/A ALA 294.A N LEU 289.A O no hydrogen 3.028 N/A ARG 296.A N VAL 277.A O no hydrogen 2.925 N/A ARG 296.A NH1 LEU 297.A O no hydrogen 3.461 N/A VAL 298.A N ALA 279.A O no hydrogen 2.725 N/A GLY 305.A N ASP 302.A OD1 no hydrogen 2.729 N/A MET 306.A N ASP 302.A O no hydrogen 2.872 N/A ALA 307.A N ALA 303.A O no hydrogen 2.903 N/A ALA 308.A N ASP 304.A O no hydrogen 3.044 N/A ALA 309.A N GLY 305.A O no hydrogen 3.003 N/A LEU 310.A N MET 306.A O no hydrogen 2.947 N/A ILE 311.A N ALA 307.A O no hydrogen 2.851 N/A GLY 312.A N ALA 308.A O no hydrogen 2.771 N/A ILE 313.A N ALA 309.A O no hydrogen 3.034 N/A LEU 314.A N LEU 310.A O no hydrogen 3.097 N/A GLU 315.A N ILE 311.A O no hydrogen 2.912 N/A ASP 316.A N GLY 312.A O no hydrogen 3.091 N/A LEU 319.A N ASP 316.A OD2 no hydrogen 2.908 N/A ARG 320.A N ASP 316.A O no hydrogen 3.050 N/A ARG 320.A NH1 ILE 313.A O no hydrogen 2.847 N/A ARG 320.A NH1 ASP 317.A OD1 no hydrogen 3.400 N/A ARG 320.A NH2 ASP 317.A OD1 no hydrogen 2.958 N/A ALA 321.A N ASP 317.A O no hydrogen 2.840 N/A GLY 322.A N GLN 318.A O no hydrogen 3.022 N/A TYR 323.A N LEU 319.A O no hydrogen 3.094 N/A VAL 324.A N ARG 320.A O no hydrogen 3.062 N/A ALA 325.A N ALA 321.A O no hydrogen 2.980 N/A ARG 326.A N GLY 322.A O no hydrogen 3.055 N/A ARG 326.A NE GLU 329.A OE2 no hydrogen 3.166 N/A ARG 326.A NH2 GLU 329.A OE1 no hydrogen 2.973 N/A ARG 326.A NH2 GLU 329.A OE2 no hydrogen 3.443 N/A ALA 327.A N TYR 323.A O no hydrogen 2.823 N/A SER 328.A N VAL 324.A O no hydrogen 2.812 N/A SER 328.A OG VAL 324.A O no hydrogen 3.083 N/A GLU 329.A N ALA 325.A O no hydrogen 3.184 N/A ARG 330.A N ARG 326.A O no hydrogen 2.969 N/A ARG 330.A NE VAL 288.A O no hydrogen 2.950 N/A ARG 330.A NH2 ARG 287.A O no hydrogen 3.012 N/A VAL 331.A N ALA 327.A O no hydrogen 2.970 N/A ARG 333.A N ARG 330.A O no hydrogen 3.232 N/A ARG 333.A NE ARG 330.A O no hydrogen 3.506 N/A TYR 334.A N VAL 331.A O no hydrogen 3.021 N/A ASP 335.A N HIS 332.A O no hydrogen 3.146 N/A TRP 336.A N VAL 157.A O no hydrogen 2.989 N/A TRP 336.A NE1 GLN 24.A OE1 no hydrogen 2.729 N/A SER 337.A N ASP 335.A OD2 no hydrogen 2.983 N/A SER 337.A OG ASP 335.A OD2 no hydrogen 2.714 N/A VAL 339.A N ASP 335.A O no hydrogen 3.003 N/A SER 340.A N TRP 336.A O no hydrogen 2.858 N/A SER 340.A OG TRP 336.A O no hydrogen 2.646 N/A SER 340.A OG SER 337.A O no hydrogen 3.537 N/A ILE 343.A N VAL 339.A O no hydrogen 3.145 N/A MET 344.A N SER 340.A O no hydrogen 2.911 N/A ARG 345.A N ALA 341.A O no hydrogen 3.139 N/A TYR 347.A N ILE 343.A O no hydrogen 3.040 N/A TYR 347.A OH HIS 93.A ND1 no hydrogen 2.629 N/A GLU 348.A N MET 344.A O no hydrogen 2.838 N/A THR 349.A N ARG 345.A O no hydrogen 2.990 N/A THR 349.A OG1 ARG 345.A O no hydrogen 2.940 N/A VAL 350.A N VAL 346.A O no hydrogen 3.050 N/A SER 351.A N TYR 347.A O no hydrogen 3.051 N/A SER 351.A OG TYR 347.A O no hydrogen 2.834 N/A SER 351.A OG GLU 348.A O no hydrogen 3.453 N/A ILE 355.A N GLY 352.A O no hydrogen 3.123 N/A LYS 356.A NZ ASP 88.A O no hydrogen 3.047 N/A LYS 356.A NZ ASP 88.A OD2 no hydrogen 3.472 N/A LYS 356.A NZ ASP 90.A OD1 no hydrogen 2.639 N/A VAL 357.A N PHE 89.A O no hydrogen 2.854 N/A GLN 358.A N GLU 111.A O no hydrogen 2.960 N/A GLN 358.A NE2 GLU 111.A OE2 no hydrogen 2.963 N/A SER 360.A N ALA 109.A O no hydrogen 2.606 N/A SER 360.A OG GLU 111.A OE1 no hydrogen 3.103 N/A