Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3mvd_K.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LEU 5.A N THR 168.A O no hydrogen 2.785 N/A ARG 10.A NE ALA 101.A O no hydrogen 2.817 N/A ARG 10.A NH2 ALA 101.A O no hydrogen 3.341 N/A ARG 10.A NH2 GLU 116.A OE2 no hydrogen 2.749 N/A GLY 15.A N ALA 49.A O no hydrogen 2.863 N/A ASN 16.A N VAL 388.A O no hydrogen 2.667 N/A LEU 18.A N PHE 386.A O no hydrogen 2.797 N/A VAL 19.A N SER 41.A O no hydrogen 2.855 N/A CYS 20.A N ALA 384.A O no hydrogen 3.202 N/A CYS 20.A SG ASN 348.A O no hydrogen 3.261 N/A CYS 20.A SG GLN 349.A O no hydrogen 3.328 N/A GLY 21.A N ARG 37.A O no hydrogen 3.086 N/A ASN 22.A N GLN 382.A O no hydrogen 2.944 N/A ASN 22.A ND2 GLN 382.A OE1 no hydrogen 3.421 N/A GLY 23.A N LEU 35.A O no hydrogen 2.820 N/A GLY 26.A N GLY 23.A O no hydrogen 2.952 N/A GLN 27.A N GLN 27.A OE1 no hydrogen 2.778 N/A GLY 29.A N GLY 26.A O no hydrogen 3.377 N/A GLY 31.A N SER 90.A O no hydrogen 2.886 N/A ARG 37.A N GLY 21.A O no hydrogen 3.078 N/A LYS 38.A NZ ASP 354.A OD1 no hydrogen 2.948 N/A ARG 39.A NH1 GLY 353.A O no hydrogen 2.762 N/A SER 41.A N VAL 19.A O no hydrogen 2.845 N/A SER 41.A OG ARG 39.A O no hydrogen 3.239 N/A VAL 43.A N VAL 17.A O no hydrogen 2.996 N/A VAL 50.A N LEU 62.A O no hydrogen 2.802 N/A ASP 51.A N LEU 62.A O no hydrogen 3.327 N/A ILE 52.A N ASP 51.A OD1 no hydrogen 2.854 N/A SER 53.A N LEU 60.A O no hydrogen 3.050 N/A GLY 55.A N HIS 58.A O no hydrogen 2.877 N/A GLY 56.A N GLY 107.A O no hydrogen 3.016 N/A HIS 58.A NE2 SER 111.A OG no hydrogen 2.758 N/A ASN 59.A N PHE 71.A O no hydrogen 2.891 N/A LEU 60.A N SER 53.A O no hydrogen 2.836 N/A VAL 61.A N TYR 69.A O no hydrogen 2.844 N/A LEU 62.A N ASP 51.A O no hydrogen 2.803 N/A THR 63.A N ASP 67.A O no hydrogen 2.987 N/A THR 63.A OG1 ASP 67.A O no hydrogen 3.219 N/A LYS 64.A N ASP 48.A O no hydrogen 2.731 N/A LYS 64.A NZ THR 12.A O no hydrogen 3.251 N/A GLY 66.A N THR 63.A O no hydrogen 2.892 N/A ASP 67.A N THR 63.A OG1 no hydrogen 2.987 N/A TYR 69.A N VAL 61.A O no hydrogen 2.965 N/A SER 70.A N ASP 93.A O no hydrogen 3.150 N/A SER 70.A OG LEU 79.A O no hydrogen 2.848 N/A PHE 71.A N ASN 59.A O no hydrogen 3.349 N/A GLY 72.A N GLU 89.A O no hydrogen 2.884 N/A CYS 73.A N MET 57.A O no hydrogen 2.818 N/A ASN 74.A ND2 ARG 81.A O no hydrogen 3.066 N/A GLY 77.A N ASN 74.A O no hydrogen 3.263 N/A LEU 79.A N ASN 74.A OD1 no hydrogen 3.149 N/A GLY 80.A N GLY 77.A O no hydrogen 3.118 N/A ARG 81.A NE SER 70.A O no hydrogen 3.229 N/A ARG 81.A NE SER 70.A OG no hydrogen 3.187 N/A ARG 81.A NH1 SER 88.A O no hydrogen 2.804 N/A ARG 81.A NH2 SER 70.A O no hydrogen 2.841 N/A ARG 81.A NH2 SER 88.A O no hydrogen 2.736 N/A THR 83.A OG1 SER 88.A OG no hydrogen 3.115 N/A SER 84.A OG ASP 82.A OD1 no hydrogen 2.739 N/A SER 84.A OG ASP 82.A OD2 no hydrogen 3.438 N/A SER 88.A N GLU 85.A O no hydrogen 3.326 N/A SER 88.A OG THR 83.A OG1 no hydrogen 3.115 N/A SER 88.A OG GLU 85.A O no hydrogen 2.807 N/A SER 90.A N GLY 87.A O no hydrogen 3.422 N/A SER 90.A OG GLU 89.A OE2 no hydrogen 3.438 N/A ASP 93.A N SER 70.A O no hydrogen 3.356 N/A LEU 94.A N ASP 93.A OD1 no hydrogen 2.722 N/A ILE 95.A N ILE 68.A O no hydrogen 2.829 N/A ALA 101.A N GLY 66.A O no hydrogen 2.833 N/A LEU 102.A N LEU 114.A O no hydrogen 2.642 N/A SER 105.A N ALA 112.A O no hydrogen 2.962 N/A SER 105.A OG SER 158.A OG no hydrogen 2.833 N/A GLY 107.A N HIS 110.A O no hydrogen 2.828 N/A ASP 108.A N ALA 160.A O no hydrogen 2.762 N/A HIS 110.A NE2 SER 158.A OG no hydrogen 3.119 N/A SER 111.A N TRP 123.A O no hydrogen 2.908 N/A SER 111.A OG ALA 78.A O no hydrogen 2.862 N/A ALA 112.A N SER 105.A O no hydrogen 2.941 N/A CYS 113.A N PHE 121.A O no hydrogen 2.773 N/A CYS 113.A SG PHE 121.A O no hydrogen 3.718 N/A LEU 114.A N CYS 103.A O no hydrogen 3.014 N/A LEU 115.A N ARG 119.A O no hydrogen 2.842 N/A GLU 116.A N LYS 100.A O no hydrogen 2.997 N/A GLY 118.A N LEU 115.A O no hydrogen 2.955 N/A ARG 119.A NE ASP 117.A OD1 no hydrogen 3.526 N/A ARG 119.A NE ASP 117.A OD2 no hydrogen 2.757 N/A ARG 119.A NH2 ASP 117.A OD1 no hydrogen 3.290 N/A PHE 121.A N CYS 113.A O no hydrogen 3.122 N/A ALA 122.A N ILE 145.A O no hydrogen 3.215 N/A TRP 123.A N SER 111.A O no hydrogen 3.015 N/A TRP 123.A NE1 ALA 78.A O no hydrogen 2.974 N/A GLY 124.A N LYS 141.A O no hydrogen 3.002 N/A SER 125.A N SER 109.A O no hydrogen 2.867 N/A SER 125.A OG GLU 76.A OE2 no hydrogen 3.532 N/A SER 125.A OG ASN 132.A OD1 no hydrogen 3.100 N/A SER 125.A OG ASN 140.A OD1 no hydrogen 3.450 N/A ARG 127.A NH2 GLU 76.A OE1 no hydrogen 2.848 N/A ASP 128.A N GLY 131.A O no hydrogen 3.023 N/A SER 129.A N GLU 179.A OE1 no hydrogen 2.764 N/A SER 129.A OG GLU 179.A OE1 no hydrogen 3.377 N/A SER 129.A OG GLU 179.A OE2 no hydrogen 2.703 N/A HIS 130.A N ASP 128.A OD1 no hydrogen 3.173 N/A GLY 131.A N ASP 128.A OD1 no hydrogen 2.983 N/A ASN 132.A ND2 ASN 140.A OD1 no hydrogen 2.843 N/A MET 133.A N PHE 126.A O no hydrogen 3.045 N/A LEU 135.A N GLY 139.A O no hydrogen 2.919 N/A THR 136.A N GLY 139.A O no hydrogen 3.344 N/A ASP 138.A N THR 136.A OG1 no hydrogen 3.120 N/A GLY 139.A N THR 136.A O no hydrogen 3.242 N/A ASN 140.A ND2 GLU 76.A OE2 no hydrogen 2.824 N/A LYS 141.A N GLY 124.A O no hydrogen 3.285 N/A ARG 142.A NH1 ASP 75.A O no hydrogen 2.994 N/A ILE 145.A N ALA 122.A O no hydrogen 3.151 N/A LEU 147.A N VAL 120.A O no hydrogen 2.944 N/A MET 148.A N ASP 146.A OD1 no hydrogen 3.177 N/A THR 151.A N MET 148.A O no hydrogen 2.902 N/A CYS 153.A N GLY 118.A O no hydrogen 2.743 N/A CYS 154.A N LEU 166.A O no hydrogen 2.791 N/A CYS 154.A SG LEU 166.A O no hydrogen 3.572 N/A CYS 154.A SG THR 167.A O no hydrogen 3.551 N/A ALA 157.A N VAL 164.A O no hydrogen 2.850 N/A SER 158.A OG SER 105.A OG no hydrogen 2.833 N/A SER 158.A OG HIS 110.A NE2 no hydrogen 3.119 N/A GLY 159.A N HIS 162.A O no hydrogen 2.858 N/A ALA 160.A N ASN 223.A O no hydrogen 2.762 N/A LEU 163.A N VAL 175.A O no hydrogen 2.784 N/A VAL 164.A N ALA 157.A O no hydrogen 2.661 N/A ILE 165.A N PHE 173.A O no hydrogen 2.710 N/A LEU 166.A N SER 155.A O no hydrogen 2.992 N/A THR 167.A N LYS 171.A O no hydrogen 2.855 N/A THR 167.A OG1 LYS 171.A O no hydrogen 3.183 N/A THR 168.A N VAL 152.A O no hydrogen 3.195 N/A ALA 169.A N THR 167.A OG1 no hydrogen 3.395 N/A GLY 170.A N THR 167.A O no hydrogen 2.973 N/A LYS 171.A N THR 167.A OG1 no hydrogen 3.019 N/A PHE 173.A N ILE 165.A O no hydrogen 2.727 N/A THR 174.A N THR 206.A O no hydrogen 3.135 N/A THR 174.A OG1 LEU 183.A O no hydrogen 2.937 N/A VAL 175.A N LEU 163.A O no hydrogen 3.127 N/A GLY 176.A N LEU 202.A O no hydrogen 2.827 N/A CYS 177.A N ASP 161.A O no hydrogen 2.770 N/A CYS 177.A SG GLU 179.A OE1 no hydrogen 3.918 N/A CYS 177.A SG GLN 180.A OE1 no hydrogen 3.701 N/A GLN 180.A N GLN 182.A OE1 no hydrogen 2.787 N/A GLY 181.A N ALA 178.A O no hydrogen 2.977 N/A GLN 182.A N GLN 182.A OE1 no hydrogen 2.737 N/A GLN 182.A NE2 GLN 180.A OE1 no hydrogen 2.806 N/A GLY 184.A N GLY 181.A O no hydrogen 3.129 N/A ARG 185.A NE THR 174.A OG1 no hydrogen 2.717 N/A ARG 185.A NH1 ASP 201.A O no hydrogen 2.954 N/A ARG 185.A NH2 THR 174.A O no hydrogen 2.871 N/A ARG 185.A NH2 ASP 201.A O no hydrogen 3.172 N/A SER 190.A N SER 187.A O no hydrogen 2.905 N/A ILE 191.A N SER 187.A O no hydrogen 3.115 N/A SER 192.A OG GLU 194.A OE1 no hydrogen 3.301 N/A GLY 193.A N SER 190.A O no hydrogen 3.077 N/A ARG 197.A NE ASP 201.A OD1 no hydrogen 3.381 N/A ARG 197.A NE ASP 201.A OD2 no hydrogen 3.352 N/A GLY 198.A N GLY 195.A O no hydrogen 3.168 N/A LYS 199.A NZ ASN 132.A O no hydrogen 3.540 N/A ARG 200.A N ARG 197.A O no hydrogen 3.044 N/A LEU 202.A N LYS 199.A O no hydrogen 3.237 N/A LEU 203.A N LYS 199.A O no hydrogen 3.012 N/A ARG 204.A NH1 ASP 201.A OD1 no hydrogen 2.950 N/A ARG 204.A NH2 ASP 201.A OD1 no hydrogen 3.317 N/A THR 206.A N THR 174.A O no hydrogen 3.256 N/A THR 206.A OG1 ARG 204.A O no hydrogen 2.871 N/A LEU 208.A N VAL 172.A O no hydrogen 2.557 N/A LYS 214.A N GLU 230.A OE2 no hydrogen 3.046 N/A PHE 216.A N GLY 170.A O no hydrogen 2.837 N/A GLU 217.A N ARG 229.A O no hydrogen 2.834 N/A TRP 220.A N PHE 227.A O no hydrogen 2.921 N/A THR 222.A N CYS 225.A O no hydrogen 3.043 N/A CYS 225.A SG LEU 241.A O no hydrogen 3.334 N/A THR 226.A N THR 239.A O no hydrogen 2.857 N/A THR 226.A OG1 HIS 162.A NE2 no hydrogen 3.041 N/A THR 226.A OG1 GLN 182.A O no hydrogen 2.813 N/A PHE 227.A N TRP 220.A O no hydrogen 2.652 N/A MET 228.A N TRP 237.A O no hydrogen 2.768 N/A ARG 229.A N ALA 218.A O no hydrogen 3.013 N/A ARG 229.A NE GLU 217.A OE2 no hydrogen 3.174 N/A ARG 229.A NH1 ILE 268.A O no hydrogen 3.051 N/A GLU 230.A N VAL 235.A O no hydrogen 3.318 N/A SER 231.A N PRO 215.A O no hydrogen 2.820 N/A SER 231.A OG PRO 215.A O no hydrogen 2.840 N/A THR 233.A N SER 231.A O no hydrogen 2.722 N/A GLN 234.A N GLU 230.A O no hydrogen 3.063 N/A GLN 234.A NE2 GLU 217.A OE2 no hydrogen 3.127 N/A TRP 237.A N MET 228.A O no hydrogen 2.705 N/A TRP 237.A NE1 GLU 230.A OE1 no hydrogen 2.755 N/A ALA 238.A N ILE 261.A O no hydrogen 3.023 N/A THR 239.A N THR 226.A O no hydrogen 3.009 N/A THR 239.A OG1 GLY 181.A O no hydrogen 2.824 N/A THR 239.A OG1 ALA 257.A O no hydrogen 2.894 N/A GLY 240.A N ALA 257.A O no hydrogen 3.017 N/A LEU 241.A N TYR 224.A O no hydrogen 2.825 N/A ASN 242.A N GLU 255.A O no hydrogen 3.117 N/A ASN 242.A ND2 HIS 249.A O no hydrogen 3.409 N/A ASN 242.A ND2 THR 251.A OG1 no hydrogen 2.985 N/A PHE 244.A N GLN 246.A OE1 no hydrogen 2.792 N/A LYS 245.A N ASN 242.A O no hydrogen 3.159 N/A GLN 246.A N GLN 246.A OE1 no hydrogen 2.617 N/A GLN 246.A NE2 ASN 243.A OD1 no hydrogen 2.814 N/A GLN 246.A NE2 GLN 275.A O no hydrogen 3.137 N/A LEU 247.A N ASN 242.A OD1 no hydrogen 3.060 N/A ALA 248.A N LYS 245.A O no hydrogen 3.000 N/A THR 251.A OG1 LYS 254.A O no hydrogen 2.925 N/A LYS 254.A N THR 251.A O no hydrogen 3.105 N/A ALA 257.A N GLY 240.A O no hydrogen 2.970 N/A ILE 261.A N ALA 238.A O no hydrogen 2.902 N/A THR 263.A N ILE 236.A O no hydrogen 2.933 N/A THR 263.A OG1 ILE 236.A O no hydrogen 2.741 N/A ARG 269.A N LEU 281.A O no hydrogen 2.737 N/A ARG 269.A NE VAL 321.A O no hydrogen 3.103 N/A ARG 269.A NH2 VAL 321.A O no hydrogen 2.980 N/A HIS 270.A N LEU 281.A O no hydrogen 2.995 N/A ALA 272.A N VAL 279.A O no hydrogen 2.930 N/A GLY 274.A N HIS 277.A O no hydrogen 2.906 N/A GLN 275.A N GLU 327.A O no hydrogen 3.035 N/A HIS 277.A NE2 SER 330.A OG no hydrogen 2.781 N/A THR 278.A N VAL 290.A O no hydrogen 2.864 N/A THR 278.A OG1 GLN 246.A O no hydrogen 2.755 N/A VAL 279.A N ALA 272.A O no hydrogen 2.725 N/A ILE 280.A N SER 288.A O no hydrogen 2.617 N/A LEU 281.A N HIS 270.A O no hydrogen 2.938 N/A THR 282.A N LYS 286.A O no hydrogen 3.204 N/A THR 282.A OG1 ASP 284.A OD1 no hydrogen 2.590 N/A THR 282.A OG1 LYS 286.A O no hydrogen 3.391 N/A THR 283.A N ASP 267.A O no hydrogen 2.937 N/A LEU 285.A N THR 282.A O no hydrogen 3.012 N/A LYS 286.A N THR 282.A OG1 no hydrogen 3.419 N/A SER 288.A N ILE 280.A O no hydrogen 2.745 N/A VAL 289.A N THR 311.A O no hydrogen 2.775 N/A VAL 290.A N THR 278.A O no hydrogen 2.959 N/A GLY 291.A N VAL 307.A O no hydrogen 3.123 N/A ARG 292.A N HIS 276.A O no hydrogen 3.033 N/A ARG 292.A NE GLU 294.A OE2 no hydrogen 3.219 N/A ARG 292.A NH2 GLU 294.A OE2 no hydrogen 2.775 N/A GLU 294.A N GLU 294.A OE1 no hydrogen 2.647 N/A GLY 296.A N PRO 293.A O no hydrogen 3.007 N/A ARG 297.A NE GLU 294.A O no hydrogen 2.943 N/A ARG 297.A NH2 GLU 294.A O no hydrogen 3.262 N/A GLY 299.A N GLY 296.A O no hydrogen 3.106 N/A GLY 301.A N LEU 359.A O no hydrogen 2.884 N/A VAL 303.A N GLY 301.A O no hydrogen 3.122 N/A LYS 304.A NZ ASP 302.A OD1 no hydrogen 3.451 N/A THR 311.A N VAL 289.A O no hydrogen 3.087 N/A THR 311.A OG1 LYS 309.A O no hydrogen 3.135 N/A VAL 313.A N CYS 287.A O no hydrogen 2.802 N/A GLU 318.A N GLU 318.A OE1 no hydrogen 2.911 N/A ILE 320.A N LEU 285.A O no hydrogen 2.990 N/A VAL 321.A N VAL 333.A O no hydrogen 2.875 N/A GLY 324.A N TYR 331.A O no hydrogen 2.983 N/A CYS 325.A SG HIS 277.A NE2 no hydrogen 3.642 N/A GLY 326.A N CYS 329.A O no hydrogen 2.863 N/A GLU 327.A N GLY 380.A O no hydrogen 3.316 N/A CYS 329.A SG TYR 331.A OH no hydrogen 3.499 N/A SER 330.A N TRP 342.A O no hydrogen 2.898 N/A SER 330.A OG HIS 277.A NE2 no hydrogen 2.781 N/A SER 330.A OG ARG 297.A O no hydrogen 3.148 N/A TYR 331.A N GLY 324.A O no hydrogen 2.765 N/A TYR 331.A OH GLN 349.A O no hydrogen 2.845 N/A ALA 332.A N TYR 340.A O no hydrogen 2.900 N/A VAL 333.A N SER 322.A O no hydrogen 2.772 N/A THR 334.A N LYS 338.A O no hydrogen 3.101 N/A THR 334.A OG1 ASP 336.A OD1 no hydrogen 2.719 N/A ILE 335.A N LYS 319.A O no hydrogen 2.844 N/A GLY 337.A N THR 334.A O no hydrogen 3.150 N/A LYS 338.A N THR 334.A OG1 no hydrogen 2.838 N/A LYS 338.A NZ GLU 318.A OE2 no hydrogen 2.903 N/A TYR 340.A N ALA 332.A O no hydrogen 2.840 N/A TYR 340.A OH GLU 318.A OE1 no hydrogen 3.195 N/A TYR 340.A OH GLU 318.A OE2 no hydrogen 2.749 N/A SER 341.A N ILE 362.A O no hydrogen 3.124 N/A SER 341.A OG LEU 350.A O no hydrogen 2.932 N/A TRP 342.A N SER 330.A O no hydrogen 3.162 N/A TRP 342.A NE1 ARG 297.A O no hydrogen 2.991 N/A GLY 343.A N GLU 358.A O no hydrogen 2.917 N/A SER 344.A N VAL 328.A O no hydrogen 2.982 N/A GLY 345.A N ASP 357.A OD1 no hydrogen 3.237 N/A ASN 348.A N GLY 345.A O no hydrogen 2.838 N/A GLN 349.A NE2 GLY 380.A O no hydrogen 3.317 N/A GLN 349.A NE2 GLY 381.A O no hydrogen 3.106 N/A GLN 349.A NE2 HIS 383.A O no hydrogen 3.124 N/A GLU 358.A N GLY 343.A O no hydrogen 3.026 N/A ILE 362.A N SER 341.A O no hydrogen 2.914 N/A VAL 364.A N LEU 339.A O no hydrogen 2.903 N/A SER 366.A N THR 369.A OG1 no hydrogen 2.808 N/A ASN 368.A N SER 366.A OG no hydrogen 3.422 N/A THR 369.A N SER 366.A O no hydrogen 3.218 N/A THR 369.A OG1 VAL 364.A O no hydrogen 2.724 N/A GLN 370.A N SER 366.A O no hydrogen 3.095 N/A LYS 372.A N THR 369.A O no hydrogen 2.823 N/A HIS 373.A NE2 ILE 335.A O no hydrogen 3.257 N/A MET 374.A N GLY 337.A O no hydrogen 2.820 N/A LEU 375.A N LEU 387.A O no hydrogen 2.851 N/A LEU 376.A N LEU 387.A O no hydrogen 3.245 N/A SER 378.A N ILE 385.A O no hydrogen 2.971 N/A GLY 379.A N CYS 325.A O no hydrogen 3.201 N/A GLY 380.A N HIS 383.A O no hydrogen 2.897 N/A GLY 381.A N GLY 56.A O no hydrogen 2.905 N/A HIS 383.A NE2 ASN 59.A OD1 no hydrogen 2.694 N/A ALA 384.A N CYS 20.A O no hydrogen 2.929 N/A ILE 385.A N SER 378.A O no hydrogen 2.772 N/A PHE 386.A N LEU 18.A O no hydrogen 2.697 N/A LEU 387.A N LEU 376.A O no hydrogen 3.069 N/A VAL 388.A N ASN 16.A O no hydrogen 2.921 N/A LYS 389.A N HIS 373.A O no hydrogen 2.828 N/A ALA 390.A N LEU 14.A O no hydrogen 2.976 N/A