Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4a4c_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): VAL 4.A N GLY 63.A O no hydrogen 3.458 N/A MET 8.A N ASP 5.A OD1 no hydrogen 3.096 N/A VAL 9.A N ASP 5.A O no hydrogen 3.054 N/A GLU 10.A N LYS 6.A O no hydrogen 3.043 N/A LYS 11.A N MET 8.A O no hydrogen 2.535 N/A CYS 12.A N MET 8.A O no hydrogen 3.210 N/A TRP 13.A N VAL 9.A O no hydrogen 3.226 N/A LYS 14.A N GLU 10.A O no hydrogen 3.336 N/A LEU 15.A N LYS 11.A O no hydrogen 3.003 N/A MET 16.A N CYS 12.A O no hydrogen 2.864 N/A ASP 17.A N TRP 13.A O no hydrogen 2.903 N/A LYS 18.A N LYS 14.A O no hydrogen 2.794 N/A VAL 19.A N LEU 15.A O no hydrogen 3.128 N/A VAL 20.A N MET 16.A O no hydrogen 2.963 N/A ARG 21.A N ASP 17.A O no hydrogen 3.077 N/A LEU 22.A N LYS 18.A O no hydrogen 2.758 N/A CYS 23.A N VAL 19.A O no hydrogen 2.968 N/A CYS 23.A N VAL 20.A O no hydrogen 2.765 N/A CYS 23.A SG VAL 19.A O no hydrogen 3.385 N/A GLN 24.A N ARG 21.A O no hydrogen 3.260 N/A LYS 27.A N ASN 25.A OD1 no hydrogen 3.055 N/A LEU 28.A N ASN 25.A O no hydrogen 2.899 N/A SER 33.A N LYS 31.A O no hydrogen 3.202 N/A SER 33.A OG ASP 228.A OD2 no hydrogen 2.667 N/A ASP 39.A N TYR 36.A O no hydrogen 3.218 N/A LEU 40.A N TYR 36.A O no hydrogen 2.992 N/A LEU 41.A N ILE 37.A O no hydrogen 2.899 N/A ASP 43.A N ASP 39.A O no hydrogen 3.106 N/A THR 44.A N LEU 40.A O no hydrogen 2.865 N/A THR 44.A OG1 LEU 40.A O no hydrogen 2.839 N/A TYR 45.A N LEU 41.A O no hydrogen 2.933 N/A GLN 46.A N PRO 42.A O no hydrogen 2.799 N/A HIS 47.A N ASP 43.A O no hydrogen 3.096 N/A HIS 47.A NE2 PHE 122.A O no hydrogen 2.612 N/A LEU 48.A N THR 44.A O no hydrogen 2.762 N/A ARG 49.A N TYR 45.A O no hydrogen 2.779 N/A THR 50.A N GLN 46.A O no hydrogen 2.887 N/A THR 50.A OG1 GLN 46.A O no hydrogen 3.446 N/A ILE 51.A N HIS 47.A O no hydrogen 2.908 N/A LEU 52.A N LEU 48.A O no hydrogen 3.068 N/A SER 53.A N ARG 49.A O no hydrogen 3.086 N/A SER 53.A OG THR 50.A O no hydrogen 3.230 N/A ARG 54.A N THR 50.A O no hydrogen 3.324 N/A ARG 54.A N ILE 51.A O no hydrogen 3.184 N/A TYR 55.A N LEU 52.A O no hydrogen 3.055 N/A THR 61.A N LYS 58.A O no hydrogen 3.040 N/A THR 61.A OG1 LYS 58.A O no hydrogen 3.215 N/A GLY 63.A N MET 59.A O no hydrogen 3.463 N/A ASN 65.A N LEU 62.A O no hydrogen 3.398 N/A TYR 67.A OH GLU 117.A OE1 no hydrogen 2.840 N/A PHE 68.A N ASN 65.A OD1 no hydrogen 2.763 N/A ARG 69.A N ASN 65.A O no hydrogen 3.039 N/A VAL 70.A N GLU 66.A O no hydrogen 3.001 N/A PHE 71.A N TYR 67.A O no hydrogen 3.034 N/A MET 72.A N PHE 68.A O no hydrogen 3.012 N/A GLU 73.A N ARG 69.A O no hydrogen 3.125 N/A ASN 74.A N VAL 70.A O no hydrogen 3.062 N/A ASN 74.A ND2 THR 184.A O no hydrogen 2.996 N/A LEU 75.A N PHE 71.A O no hydrogen 2.756 N/A MET 76.A N MET 72.A O no hydrogen 2.791 N/A LYS 77.A N GLU 73.A O no hydrogen 3.056 N/A LYS 78.A N ASN 74.A O no hydrogen 2.918 N/A LYS 78.A NZ ASN 74.A OD1 no hydrogen 3.031 N/A LYS 78.A NZ THR 184.A O no hydrogen 3.304 N/A LYS 78.A NZ CYS 185.A O no hydrogen 2.952 N/A THR 79.A N LEU 75.A O no hydrogen 3.223 N/A THR 79.A OG1 LEU 75.A O no hydrogen 3.352 N/A THR 79.A OG1 MET 76.A O no hydrogen 3.149 N/A LYS 80.A N MET 76.A O no hydrogen 3.031 N/A GLN 81.A N LYS 77.A O no hydrogen 3.237 N/A THR 82.A N LYS 78.A O no hydrogen 3.194 N/A THR 82.A OG1 LYS 78.A O no hydrogen 3.140 N/A ILE 83.A N THR 79.A O no hydrogen 2.743 N/A SER 84.A N LYS 80.A O no hydrogen 2.979 N/A LEU 85.A N THR 82.A O no hydrogen 3.104 N/A PHE 86.A N THR 82.A O no hydrogen 3.284 N/A PHE 86.A N ILE 83.A O no hydrogen 3.285 N/A LYS 87.A N ILE 83.A O no hydrogen 3.379 N/A GLU 88.A N SER 84.A O no hydrogen 3.495 N/A GLY 89.A N PHE 86.A O no hydrogen 3.256 N/A LYS 90.A N PHE 86.A O no hydrogen 3.131 N/A ARG 92.A N GLY 89.A O no hydrogen 2.973 N/A TYR 94.A N GLU 91.A O no hydrogen 3.090 N/A SER 98.A N GLU 95.A O no hydrogen 3.091 N/A SER 98.A OG ARG 92.A O no hydrogen 2.267 N/A SER 98.A OG GLU 95.A O no hydrogen 3.130 N/A GLN 99.A NE2 ASN 103.A OD1 no hydrogen 2.889 N/A ARG 101.A N SER 98.A OG no hydrogen 3.087 N/A ARG 101.A NE MET 93.A O no hydrogen 2.841 N/A ARG 101.A NH2 LEU 28.A O no hydrogen 3.086 N/A ARG 101.A NH2 MET 93.A O no hydrogen 3.166 N/A ARG 102.A N SER 98.A O no hydrogen 2.964 N/A ARG 102.A NH1 PHE 224.A O no hydrogen 2.993 N/A ARG 102.A NH1 GLU 229.A OE2 no hydrogen 2.992 N/A ARG 102.A NH2 PHE 224.A O no hydrogen 3.237 N/A ASN 103.A N GLN 99.A O no hydrogen 3.013 N/A LEU 104.A N PRO 100.A O no hydrogen 3.206 N/A LEU 104.A N ARG 101.A O no hydrogen 2.803 N/A THR 105.A N ARG 101.A O no hydrogen 2.975 N/A THR 105.A OG1 ARG 101.A O no hydrogen 3.413 N/A LYS 106.A N ARG 102.A O no hydrogen 2.993 N/A LEU 107.A N ASN 103.A O no hydrogen 3.200 N/A SER 108.A N LEU 104.A O no hydrogen 2.831 N/A SER 108.A OG LEU 104.A O no hydrogen 3.229 N/A LEU 109.A N THR 105.A O no hydrogen 3.358 N/A ILE 110.A N LYS 106.A O no hydrogen 3.179 N/A PHE 111.A N LEU 107.A O no hydrogen 2.850 N/A SER 112.A N SER 108.A O no hydrogen 2.990 N/A HIS 113.A N LEU 109.A O no hydrogen 2.870 N/A MET 114.A N ILE 110.A O no hydrogen 2.883 N/A LEU 115.A N PHE 111.A O no hydrogen 2.885 N/A ALA 116.A N SER 112.A O no hydrogen 2.917 N/A GLU 117.A N HIS 113.A O no hydrogen 2.937 N/A LEU 118.A N MET 114.A O no hydrogen 2.865 N/A LYS 119.A N LEU 115.A O no hydrogen 3.051 N/A GLY 120.A N ALA 116.A O no hydrogen 2.949 N/A GLY 120.A N GLU 117.A O no hydrogen 2.879 N/A ILE 121.A N GLU 117.A O no hydrogen 2.907 N/A PHE 122.A N LEU 118.A O no hydrogen 2.701 N/A GLY 125.A N PHE 122.A O no hydrogen 3.321 N/A PHE 127.A N TYR 55.A OH no hydrogen 2.571 N/A GLN 128.A N ILE 121.A O no hydrogen 2.788 N/A ASP 130.A N ASP 130.A OD1 no hydrogen 2.526 N/A THR 131.A N GLN 128.A O no hydrogen 3.073 N/A THR 131.A OG1 GLN 128.A O no hydrogen 3.307 N/A THR 135.A N ASP 195.A OD1 no hydrogen 2.925 N/A THR 135.A OG1 ASP 195.A OD1 no hydrogen 2.949 N/A THR 135.A OG1 ASP 195.A OD2 no hydrogen 3.297 N/A LYS 136.A NZ GLN 202.A OE1 no hydrogen 3.085 N/A LYS 136.A NZ GLU 346.A OE1 no hydrogen 2.990 N/A LYS 136.A NZ THR 378.A O no hydrogen 3.510 N/A LYS 136.A NZ GLU 379.A OE2 no hydrogen 3.107 N/A ALA 140.A N LYS 136.A O no hydrogen 2.703 N/A GLU 141.A N ALA 137.A O no hydrogen 2.893 N/A PHE 142.A N ASP 138.A O no hydrogen 3.265 N/A TRP 143.A N ALA 139.A O no hydrogen 3.100 N/A TRP 143.A NE1 LYS 150.A O no hydrogen 3.109 N/A ARG 144.A N ALA 140.A O no hydrogen 3.039 N/A LYS 145.A N GLU 141.A O no hydrogen 3.168 N/A ALA 146.A N PHE 142.A O no hydrogen 3.046 N/A PHE 147.A N TRP 143.A O no hydrogen 2.685 N/A GLY 148.A N ARG 144.A O no hydrogen 2.885 N/A LYS 150.A N PHE 147.A O no hydrogen 3.188 N/A LYS 150.A NZ GLU 66.A OE1 no hydrogen 2.981 N/A LYS 150.A NZ ILE 152.A O no hydrogen 3.360 N/A VAL 153.A N ILE 189.A O no hydrogen 3.207 N/A TRP 155.A N ASP 187.A O no hydrogen 3.171 N/A PHE 158.A N PRO 154.A O no hydrogen 2.987 N/A ARG 159.A N TRP 155.A O no hydrogen 2.918 N/A GLN 160.A N LYS 156.A O no hydrogen 3.046 N/A ALA 161.A N SER 157.A O no hydrogen 3.273 N/A LEU 162.A N PHE 158.A O no hydrogen 3.069 N/A HIS 163.A N ARG 159.A O no hydrogen 2.921 N/A GLU 164.A N GLN 160.A O no hydrogen 3.386 N/A GLU 164.A N ALA 161.A O no hydrogen 2.926 N/A HIS 166.A N LEU 162.A O no hydrogen 2.366 N/A HIS 166.A NE2 SER 205.A O no hydrogen 3.118 N/A ILE 168.A N HIS 163.A ND1 no hydrogen 3.211 N/A SER 169.A N GLU 173.A OE2 no hydrogen 3.475 N/A ALA 174.A N SER 170.A O no hydrogen 3.223 N/A MET 175.A N GLY 171.A O no hydrogen 3.025 N/A ALA 176.A N LEU 172.A O no hydrogen 2.998 N/A LEU 177.A N GLU 173.A O no hydrogen 2.899 N/A LYS 178.A N ALA 174.A O no hydrogen 2.742 N/A LYS 178.A NZ ASP 187.A OD1 no hydrogen 2.624 N/A SER 179.A N MET 175.A O no hydrogen 2.800 N/A SER 179.A OG MET 175.A O no hydrogen 3.290 N/A SER 179.A OG ALA 176.A O no hydrogen 2.719 N/A THR 180.A N ALA 176.A O no hydrogen 3.221 N/A THR 180.A OG1 ALA 176.A O no hydrogen 2.780 N/A ILE 181.A N LEU 177.A O no hydrogen 3.064 N/A ASP 182.A N LYS 178.A O no hydrogen 2.847 N/A THR 184.A N GLU 193.A OE2 no hydrogen 3.001 N/A THR 184.A OG1 GLU 193.A OE2 no hydrogen 2.997 N/A CYS 185.A SG ASP 182.A O no hydrogen 3.764 N/A ASN 186.A N ASP 182.A OD1 no hydrogen 3.183 N/A ASP 187.A N ASP 182.A OD2 no hydrogen 3.001 N/A TYR 188.A N ASN 186.A OD1 no hydrogen 2.861 N/A ILE 189.A N VAL 153.A O no hydrogen 2.795 N/A SER 190.A N GLU 193.A OE1 no hydrogen 3.050 N/A SER 190.A OG GLU 117.A OE2 no hydrogen 2.715 N/A SER 190.A OG GLU 193.A OE1 no hydrogen 3.297 N/A VAL 191.A N THR 151.A O no hydrogen 2.633 N/A GLU 193.A N SER 190.A OG no hydrogen 2.826 N/A PHE 194.A N SER 190.A O no hydrogen 3.010 N/A ASP 195.A N VAL 191.A O no hydrogen 3.112 N/A ILE 196.A N PHE 192.A O no hydrogen 3.096 N/A PHE 197.A N GLU 193.A O no hydrogen 3.010 N/A THR 198.A N PHE 194.A O no hydrogen 2.952 N/A THR 198.A OG1 PHE 194.A O no hydrogen 2.934 N/A THR 198.A OG1 ASP 195.A O no hydrogen 3.333 N/A ARG 199.A N ASP 195.A O no hydrogen 2.850 N/A ARG 199.A NH1 LYS 376.A O no hydrogen 3.400 N/A LEU 200.A N ILE 196.A O no hydrogen 2.821 N/A PHE 201.A N PHE 197.A O no hydrogen 2.795 N/A SER 206.A OG ASN 210.A OD1 no hydrogen 3.543 N/A LEU 207.A N HIS 166.A NE2 no hydrogen 3.282 N/A ASN 210.A ND2 PHE 201.A O no hydrogen 2.895 N/A TRP 211.A N LEU 207.A O no hydrogen 3.178 N/A TRP 211.A NE1 THR 180.A OG1 no hydrogen 3.181 N/A ASN 212.A N LEU 208.A O no hydrogen 2.500 N/A ASN 212.A ND2 LEU 208.A O no hydrogen 3.255 N/A SER 213.A N ARG 209.A O no hydrogen 3.233 N/A SER 213.A OG ARG 209.A O no hydrogen 3.354 N/A LEU 214.A N ASN 210.A O no hydrogen 2.916 N/A ALA 215.A N TRP 211.A O no hydrogen 3.073 N/A VAL 216.A N TRP 211.A O no hydrogen 3.300 N/A THR 217.A N ASN 212.A O no hydrogen 2.867 N/A GLY 220.A N HIS 218.A ND1 no hydrogen 2.770 N/A TYR 221.A N HIS 218.A O no hydrogen 3.270 N/A MET 222.A N PHE 246.A O no hydrogen 2.978 N/A THR 226.A N GLU 229.A OE1 no hydrogen 2.975 N/A VAL 230.A N THR 226.A O no hydrogen 2.947 N/A LYS 231.A N TYR 227.A O no hydrogen 3.054 N/A ALA 232.A N ASP 228.A O no hydrogen 2.862 N/A ARG 233.A N GLU 229.A O no hydrogen 2.900 N/A ARG 233.A NE ASP 294.A OD1 no hydrogen 3.153 N/A ARG 233.A NH2 ASP 294.A OD2 no hydrogen 2.845 N/A LEU 234.A N VAL 230.A O no hydrogen 3.277 N/A GLN 235.A N ALA 232.A O no hydrogen 3.319 N/A PHE 237.A N LEU 234.A O no hydrogen 2.653 N/A ILE 238.A N GLN 235.A O no hydrogen 2.735 N/A LYS 240.A N PHE 237.A O no hydrogen 2.765 N/A LYS 240.A NZ GLY 295.A O no hydrogen 2.569 N/A GLY 242.A N VAL 261.A O no hydrogen 2.899 N/A SER 243.A OG LYS 240.A O no hydrogen 2.932 N/A TYR 244.A N PHE 292.A O no hydrogen 3.214 N/A TYR 244.A OH ASN 299.A OD1 no hydrogen 2.361 N/A ILE 245.A N GLY 259.A O no hydrogen 3.145 N/A PHE 246.A N GLY 220.A O no hydrogen 2.880 N/A ARG 247.A N ALA 257.A O no hydrogen 3.191 N/A ARG 247.A NE GLN 269.A OE1 no hydrogen 3.184 N/A ARG 247.A NH1 LEU 248.A O no hydrogen 3.119 N/A ARG 247.A NH2 GLN 269.A OE1 no hydrogen 2.426 N/A SER 249.A N GLN 255.A O no hydrogen 2.784 N/A SER 249.A OG ARG 252.A O no hydrogen 3.179 N/A ARG 252.A N SER 249.A OG no hydrogen 2.791 N/A GLN 255.A N ARG 252.A O no hydrogen 3.112 N/A TRP 256.A NE1 LEU 200.A O no hydrogen 3.132 N/A ALA 257.A N ARG 247.A O no hydrogen 2.918 N/A ILE 258.A N THR 270.A O no hydrogen 2.822 N/A GLY 259.A N ILE 245.A O no hydrogen 2.868 N/A TYR 260.A N LEU 268.A O no hydrogen 2.682 N/A VAL 261.A N SER 243.A O no hydrogen 3.135 N/A THR 262.A N ASN 266.A O no hydrogen 2.828 N/A THR 262.A OG1 ASP 264.A OD1 no hydrogen 2.663 N/A THR 262.A OG1 ASN 266.A O no hydrogen 3.218 N/A GLY 265.A N THR 262.A O no hydrogen 2.908 N/A ASN 266.A N THR 262.A OG1 no hydrogen 3.036 N/A LEU 268.A N TYR 260.A O no hydrogen 2.924 N/A GLN 269.A NE2 TYR 227.A O no hydrogen 3.056 N/A THR 270.A N ILE 258.A O no hydrogen 2.755 N/A HIS 273.A NE2 GLN 361.A OE1 no hydrogen 3.141 N/A GLN 279.A N PRO 276.A O no hydrogen 3.310 N/A ALA 280.A N PRO 276.A O no hydrogen 3.495 N/A LEU 281.A N LEU 277.A O no hydrogen 3.029 N/A ILE 282.A N PHE 278.A O no hydrogen 2.846 N/A ASP 283.A N GLN 279.A O no hydrogen 2.815 N/A GLY 284.A N ALA 280.A O no hydrogen 2.793 N/A PHE 285.A N LEU 281.A O no hydrogen 2.823 N/A ARG 286.A N ILE 282.A O no hydrogen 2.989 N/A ARG 286.A NH2 ASP 283.A OD1 no hydrogen 3.386 N/A GLU 287.A N ASP 283.A O no hydrogen 2.817 N/A GLY 288.A N PHE 285.A O no hydrogen 2.672 N/A PHE 289.A N GLY 284.A O no hydrogen 2.743 N/A TYR 290.A N GLY 284.A O no hydrogen 3.188 N/A LEU 291.A N GLY 242.A O no hydrogen 2.675 N/A PHE 292.A N GLY 242.A O no hydrogen 2.982 N/A ASP 294.A N TYR 244.A O no hydrogen 2.816 N/A GLY 295.A N PHE 292.A O no hydrogen 2.730 N/A ARG 296.A N PRO 293.A O no hydrogen 2.831 N/A THR 303.A N ASP 301.A OD1 no hydrogen 3.003 N/A THR 303.A OG1 ASP 301.A OD1 no hydrogen 2.673 N/A THR 303.A OG1 ASP 301.A OD2 no hydrogen 3.538 N/A LEU 305.A N LEU 302.A O no hydrogen 3.352 N/A CYS 306.A N THR 303.A O no hydrogen 3.206 N/A HIS 313.A ND1 ASP 384.A OD1 no hydrogen 2.854 N/A ILE 314.A N VAL 382.A O no hydrogen 3.266 N/A VAL 316.A N ASP 384.A O no hydrogen 3.459 N/A TYR 321.A N THR 317.A O no hydrogen 2.871 N/A GLU 322.A N GLN 318.A O no hydrogen 2.920 N/A LEU 323.A N GLN 320.A O no hydrogen 3.089 N/A CYS 324.A SG TYR 321.A O no hydrogen 3.457 N/A CYS 324.A SG GLU 322.A O no hydrogen 3.707 N/A GLU 325.A N GLU 322.A O no hydrogen 3.471 N/A MET 326.A N LEU 323.A O no hydrogen 2.732 N/A GLY 327.A N CYS 324.A O no hydrogen 3.196 N/A THR 329.A OG1 GLN 331.A O no hydrogen 3.085 N/A LEU 332.A N PHE 330.A O no hydrogen 2.962 N/A CYS 333.A N ASN 339.A O no hydrogen 2.620 N/A LYS 334.A NZ THR 329.A O no hydrogen 3.422 N/A LYS 334.A NZ PHE 330.A O no hydrogen 3.066 N/A LYS 334.A NZ LEU 332.A O no hydrogen 2.540 N/A CYS 336.A SG ASN 339.A OD1 no hydrogen 3.874 N/A ALA 337.A N CYS 333.A O no hydrogen 2.610 N/A VAL 343.A N MET 352.A O no hydrogen 3.018 N/A LYS 344.A N GLU 379.A O no hydrogen 2.985 N/A ILE 345.A N HIS 350.A O no hydrogen 2.789 N/A GLU 346.A N GLY 377.A O no hydrogen 3.042 N/A CYS 348.A SG ILE 345.A O no hydrogen 3.909 N/A CYS 348.A SG HIS 350.A ND1 no hydrogen 3.256 N/A GLY 349.A N ILE 345.A O no hydrogen 2.829 N/A MET 352.A N VAL 343.A O no hydrogen 3.171 N/A CYS 353.A SG ASN 339.A OD1 no hydrogen 3.833 N/A THR 354.A N ASP 342.A OD1 no hydrogen 2.800 N/A CYS 356.A N CYS 353.A O no hydrogen 2.868 N/A LEU 357.A N CYS 353.A O no hydrogen 3.019 N/A THR 358.A N THR 354.A O no hydrogen 2.980 N/A THR 358.A OG1 THR 354.A O no hydrogen 2.922 N/A SER 359.A N SER 355.A O no hydrogen 3.347 N/A SER 359.A OG SER 355.A O no hydrogen 2.880 N/A TRP 360.A N CYS 356.A O no hydrogen 2.989 N/A TRP 360.A NE1 GLY 367.A O no hydrogen 2.873 N/A GLN 361.A N LEU 357.A O no hydrogen 3.130 N/A GLU 362.A N THR 358.A O no hydrogen 2.854 N/A GLU 364.A N GLN 361.A O no hydrogen 3.104 N/A GLY 365.A N TRP 360.A O no hydrogen 3.001 N/A GLN 366.A NE2 ARG 372.A O no hydrogen 3.574 N/A CYS 368.A N CYS 373.A O no hydrogen 2.684 N/A CYS 368.A SG HIS 350.A ND1 no hydrogen 3.773 N/A CYS 371.A SG HIS 350.A ND1 no hydrogen 3.973 N/A LYS 376.A N GLU 346.A O no hydrogen 3.050 N/A LYS 376.A NZ ARG 133.A O no hydrogen 2.804 N/A LYS 376.A NZ THR 135.A OG1 no hydrogen 3.384 N/A LYS 376.A NZ ASP 195.A OD2 no hydrogen 3.074 N/A GLU 379.A N LYS 344.A O no hydrogen 3.046 N/A ILE 381.A N ASP 342.A O no hydrogen 2.947 N/A ASP 384.A N ILE 314.A O no hydrogen 2.649 N/A