Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3vvm_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): PHE 4.A N CYS 97.A O no hydrogen 2.904 N/A SER 9.A N PRO 6.A O no hydrogen 3.092 N/A SER 9.A OG PRO 6.A O no hydrogen 2.573 N/A ARG 10.A N TYR 33.A O no hydrogen 2.975 N/A ILE 12.A N ILE 31.A O no hydrogen 2.963 N/A LEU 14.A N ALA 29.A O no hydrogen 2.904 N/A GLY 17.A N LEU 26.A O no hydrogen 2.866 N/A PHE 18.A N PRO 15.A O no hydrogen 3.000 N/A MET 20.A N GLY 24.A O no hydrogen 3.075 N/A ARG 21.A N ASP 125.A OD1 no hydrogen 2.789 N/A ARG 22.A NH1 GLU 120.A OE2 no hydrogen 2.621 N/A ARG 22.A NH1 GLN 280.A OE1 no hydrogen 3.048 N/A ARG 22.A NH2 GLN 280.A OE1 no hydrogen 2.593 N/A GLY 23.A N MET 20.A O no hydrogen 3.024 N/A LEU 26.A N PHE 18.A O no hydrogen 2.903 N/A GLY 28.A N ASP 16.A OD2 no hydrogen 2.920 N/A ARG 30.A N THR 101.A OG1 no hydrogen 2.804 N/A ARG 30.A NE GLY 99.A O no hydrogen 3.217 N/A ILE 31.A N ILE 12.A O no hydrogen 2.807 N/A ALA 32.A N SER 100.A OG no hydrogen 2.826 N/A TYR 33.A N ARG 10.A O no hydrogen 2.911 N/A GLU 34.A N CYS 90.A O no hydrogen 3.003 N/A PHE 36.A N VAL 88.A O no hydrogen 2.850 N/A ASN 40.A N ASN 45.A OD1 no hydrogen 2.833 N/A ASN 40.A ND2 ASP 44.A OD2 no hydrogen 2.657 N/A ARG 43.A N ASN 40.A O no hydrogen 2.930 N/A ARG 43.A NH1 GLY 138.A O no hydrogen 2.976 N/A ASP 44.A N ASN 40.A OD1 no hydrogen 3.004 N/A ASN 45.A ND2 SER 38.A O no hydrogen 3.080 N/A ASN 45.A ND2 LEU 85.A O no hydrogen 2.974 N/A VAL 47.A N HIS 87.A O no hydrogen 2.887 N/A LEU 48.A N CYS 144.A O no hydrogen 2.990 N/A VAL 49.A N ILE 89.A O no hydrogen 2.811 N/A LEU 50.A N VAL 146.A O no hydrogen 2.847 N/A THR 51.A OG1 ALA 52.A O no hydrogen 2.908 N/A GLY 55.A N ALA 52.A O no hydrogen 3.171 N/A HIS 58.A N ASP 56.A OD1 no hydrogen 2.846 N/A HIS 58.A ND1 GLU 34.A OE1 no hydrogen 2.696 N/A HIS 58.A NE2 THR 67.A O no hydrogen 2.706 N/A ALA 59.A N ALA 57.A O no hydrogen 2.969 N/A SER 61.A N GLU 72.A OE2 no hydrogen 2.856 N/A SER 61.A OG GLU 72.A OE1 no hydrogen 2.748 N/A ARG 62.A N ASP 65.A O no hydrogen 3.016 N/A ARG 62.A NH1 ASP 64.A OD2 no hydrogen 2.536 N/A ARG 62.A NH2 THR 35.A O no hydrogen 2.530 N/A ASP 65.A N ARG 62.A O no hydrogen 2.894 N/A THR 67.A N ASP 65.A OD2 no hydrogen 3.310 N/A THR 67.A OG1 ASP 65.A OD2 no hydrogen 3.096 N/A GLY 69.A N GLU 72.A OE2 no hydrogen 2.902 N/A TRP 70.A N HIS 58.A O no hydrogen 3.164 N/A TRP 71.A N ALA 59.A O no hydrogen 2.884 N/A TRP 71.A NE1 PHE 349.A O no hydrogen 2.842 N/A GLU 72.A N GLY 69.A O no hydrogen 3.227 N/A MET 74.A N TRP 71.A O no hydrogen 2.913 N/A VAL 75.A N TRP 71.A O no hydrogen 3.088 N/A GLY 76.A N VAL 81.A O no hydrogen 3.290 N/A GLY 78.A N ASP 82.A OD2 no hydrogen 2.779 N/A LYS 79.A N GLY 76.A O no hydrogen 3.080 N/A LYS 79.A NZ GLU 72.A O no hydrogen 2.799 N/A VAL 81.A N MET 74.A O no hydrogen 2.862 N/A THR 83.A N GLY 76.A O no hydrogen 3.137 N/A ASP 84.A N ASP 82.A OD2 no hydrogen 2.826 N/A LEU 85.A N ASP 82.A O no hydrogen 2.936 N/A TRP 86.A N ASP 82.A O no hydrogen 2.887 N/A HIS 87.A N ASN 45.A O no hydrogen 2.887 N/A HIS 87.A ND1 GLY 37.A O no hydrogen 2.881 N/A VAL 88.A N PHE 36.A O no hydrogen 2.767 N/A ILE 89.A N VAL 47.A O no hydrogen 2.719 N/A CYS 90.A N GLU 34.A O no hydrogen 2.928 N/A CYS 90.A SG VAL 49.A O no hydrogen 3.761 N/A CYS 90.A SG ASP 56.A O no hydrogen 3.749 N/A VAL 91.A N VAL 49.A O no hydrogen 3.381 N/A ASN 92.A N ALA 32.A O no hydrogen 2.917 N/A ASN 92.A ND2 SER 96.A OG no hydrogen 2.981 N/A GLY 95.A N THR 101.A O no hydrogen 2.848 N/A SER 96.A N SER 93.A O no hydrogen 3.055 N/A CYS 97.A N SER 96.A OG no hydrogen 2.651 N/A LYS 98.A N ASN 92.A OD1 no hydrogen 3.124 N/A LYS 98.A NZ ARG 265.A O no hydrogen 2.545 N/A SER 100.A N ASN 92.A OD1 no hydrogen 3.046 N/A SER 100.A OG ASN 92.A O no hydrogen 2.624 N/A THR 101.A N ARG 30.A O no hydrogen 3.009 N/A THR 101.A OG1 ARG 30.A O no hydrogen 3.344 N/A GLY 102.A N SER 105.A OG no hydrogen 2.927 N/A SER 105.A N GLY 102.A O no hydrogen 2.938 N/A SER 105.A OG GLU 3.A OE2 no hydrogen 2.722 N/A SER 105.A OG GLY 102.A O no hydrogen 3.340 N/A ASP 107.A N GLU 112.A O no hydrogen 2.762 N/A ARG 109.A N ASP 107.A OD2 no hydrogen 2.980 N/A THR 110.A N ASP 107.A O no hydrogen 3.003 N/A THR 110.A OG1 ASP 107.A O no hydrogen 3.390 N/A GLY 111.A N ASP 107.A O no hydrogen 2.725 N/A GLU 112.A N THR 110.A OG1 no hydrogen 3.034 N/A TYR 114.A N SER 105.A O no hydrogen 2.942 N/A ARG 115.A N PRO 103.A O no hydrogen 2.732 N/A SER 117.A N TYR 114.A O no hydrogen 2.945 N/A SER 117.A OG TYR 114.A O no hydrogen 2.604 N/A PHE 118.A N ARG 115.A O no hydrogen 3.397 N/A SER 122.A N ASP 125.A OD2 no hydrogen 2.918 N/A GLU 124.A N GLU 124.A OE1 no hydrogen 2.769 N/A ASP 125.A N SER 122.A O no hydrogen 2.885 N/A ILE 126.A N SER 122.A O no hydrogen 3.347 N/A ALA 127.A N ILE 123.A O no hydrogen 3.015 N/A ASP 128.A N GLU 124.A O no hydrogen 2.883 N/A ALA 129.A N ASP 125.A O no hydrogen 2.874 N/A ALA 130.A N ILE 126.A O no hydrogen 2.995 N/A ALA 131.A N ALA 127.A O no hydrogen 2.897 N/A HIS 132.A N ASP 128.A O no hydrogen 3.007 N/A THR 133.A N ALA 129.A O no hydrogen 3.047 N/A THR 133.A OG1 ALA 129.A O no hydrogen 2.913 N/A VAL 134.A N ALA 130.A O no hydrogen 3.012 N/A ARG 135.A N ALA 131.A O no hydrogen 3.075 N/A ARG 135.A NH1 HIS 162.A ND1 no hydrogen 3.139 N/A ALA 136.A N HIS 132.A O no hydrogen 2.783 N/A LEU 137.A N THR 133.A O no hydrogen 3.183 N/A LEU 137.A N VAL 134.A O no hydrogen 3.104 N/A GLY 138.A N ARG 135.A O no hydrogen 2.938 N/A ILE 139.A N VAL 134.A O no hydrogen 3.344 N/A LEU 142.A N LEU 165.A O no hydrogen 2.702 N/A ALA 143.A N ALA 46.A O no hydrogen 2.790 N/A CYS 144.A N ALA 46.A O no hydrogen 3.459 N/A VAL 145.A N THR 168.A O no hydrogen 3.083 N/A VAL 146.A N LEU 48.A O no hydrogen 2.653 N/A GLY 147.A N ILE 170.A O no hydrogen 2.982 N/A ALA 148.A N LEU 50.A O no hydrogen 3.438 N/A SER 149.A N LEU 172.A O no hydrogen 2.954 N/A SER 149.A OG HIS 346.A NE2 no hydrogen 2.657 N/A GLY 151.A N ALA 148.A O no hydrogen 2.737 N/A GLY 152.A N SER 149.A O no hydrogen 2.694 N/A SER 154.A N MET 150.A O no hydrogen 3.030 N/A SER 154.A OG MET 150.A O no hydrogen 3.308 N/A ALA 155.A N GLY 151.A O no hydrogen 2.816 N/A LEU 156.A N GLY 152.A O no hydrogen 3.195 N/A ALA 157.A N MET 153.A O no hydrogen 3.004 N/A LEU 158.A N SER 154.A O no hydrogen 2.942 N/A LEU 159.A N ALA 155.A O no hydrogen 2.885 N/A ALA 160.A N LEU 156.A O no hydrogen 2.948 N/A ARG 161.A N ALA 157.A O no hydrogen 2.970 N/A ARG 161.A NE ASP 128.A OD1 no hydrogen 2.897 N/A ARG 161.A NE ASP 128.A OD2 no hydrogen 3.400 N/A ARG 161.A NH2 ASP 128.A OD2 no hydrogen 2.903 N/A HIS 162.A N LEU 158.A O no hydrogen 2.821 N/A HIS 162.A NE2 ASP 128.A OD1 no hydrogen 2.788 N/A LEU 165.A N HIS 162.A O no hydrogen 3.069 N/A ARG 167.A N LEU 142.A O no hydrogen 2.916 N/A THR 168.A OG1 ALA 143.A O no hydrogen 2.693 N/A HIS 169.A N ARG 304.A O no hydrogen 3.108 N/A HIS 169.A ND1 VAL 145.A O no hydrogen 2.780 N/A ILE 170.A N VAL 145.A O no hydrogen 3.035 N/A SER 171.A N LEU 306.A O no hydrogen 2.804 N/A LEU 172.A N GLY 147.A O no hydrogen 2.886 N/A SER 173.A N MET 308.A O no hydrogen 2.888 N/A HIS 177.A ND1 ASP 282.A OD2 no hydrogen 3.032 N/A SER 182.A OG LEU 179.A O no hydrogen 2.727 N/A ILE 183.A N LEU 179.A O no hydrogen 3.179 N/A ALA 184.A N PRO 180.A O no hydrogen 2.869 N/A VAL 185.A N PHE 181.A O no hydrogen 2.936 N/A ARG 186.A N SER 182.A O no hydrogen 2.989 N/A ARG 186.A NE ASP 279.A OD2 no hydrogen 2.702 N/A ARG 186.A NH2 ASP 279.A OD2 no hydrogen 2.876 N/A SER 187.A N ILE 183.A O no hydrogen 2.857 N/A LEU 188.A N ALA 184.A O no hydrogen 3.004 N/A GLN 189.A N VAL 185.A O no hydrogen 2.952 N/A GLN 189.A NE2 ALA 217.A O no hydrogen 2.869 N/A ARG 190.A N ARG 186.A O no hydrogen 2.905 N/A ARG 190.A NH1 SER 275.A OG no hydrogen 2.881 N/A ARG 190.A NH1 ASP 279.A OD1 no hydrogen 2.856 N/A ARG 190.A NH2 ASP 279.A OD1 no hydrogen 2.848 N/A GLU 191.A N SER 187.A O no hydrogen 2.931 N/A ALA 192.A N LEU 188.A O no hydrogen 2.874 N/A ILE 193.A N ARG 190.A O no hydrogen 3.183 N/A ARG 194.A N ARG 190.A O no hydrogen 2.961 N/A SER 195.A N GLU 191.A O no hydrogen 2.817 N/A SER 195.A OG GLU 191.A O no hydrogen 3.006 N/A SER 195.A OG ALA 192.A O no hydrogen 3.246 N/A ASP 196.A N ILE 193.A O no hydrogen 3.171 N/A GLY 198.A N ASP 196.A OD2 no hydrogen 2.760 N/A TRP 199.A N ASP 196.A O no hydrogen 2.928 N/A TRP 199.A NE1 ASN 269.A OD1 no hydrogen 2.997 N/A GLY 202.A N TRP 199.A O no hydrogen 2.862 N/A HIS 203.A N LEU 200.A O no hydrogen 2.809 N/A HIS 203.A ND1 GLN 201.A O no hydrogen 3.028 N/A TYR 204.A OH ASP 267.A OD1 no hydrogen 2.588 N/A ARG 211.A NH1 ASP 264.A OD1 no hydrogen 2.551 N/A ARG 211.A NH2 ASP 264.A OD2 no hydrogen 3.549 N/A GLY 213.A N ASP 196.A OD1 no hydrogen 2.774 N/A MET 214.A N PRO 210.A O no hydrogen 2.981 N/A LEU 215.A N ARG 211.A O no hydrogen 2.891 N/A THR 216.A N ARG 212.A O no hydrogen 3.052 N/A THR 216.A OG1 ARG 212.A O no hydrogen 3.243 N/A ALA 217.A N GLY 213.A O no hydrogen 2.965 N/A ARG 218.A N MET 214.A O no hydrogen 3.093 N/A LYS 219.A N LEU 215.A O no hydrogen 2.925 N/A LYS 219.A NZ ASP 256.A OD1 no hydrogen 3.500 N/A LEU 220.A N THR 216.A O no hydrogen 2.929 N/A GLY 221.A N ALA 217.A O no hydrogen 3.060 N/A MET 222.A N ARG 218.A O no hydrogen 2.816 N/A MET 223.A N LYS 219.A O no hydrogen 2.922 N/A THR 224.A N GLY 221.A O no hydrogen 2.852 N/A THR 224.A OG1 LEU 220.A O no hydrogen 3.300 N/A THR 224.A OG1 GLY 221.A O no hydrogen 2.922 N/A TYR 225.A N GLY 221.A O no hydrogen 2.761 N/A SER 227.A N PRO 343.A O no hydrogen 3.427 N/A GLN 229.A N SER 227.A OG no hydrogen 3.221 N/A TRP 231.A N SER 227.A O no hydrogen 3.148 N/A ASP 232.A N ALA 228.A O no hydrogen 3.272 N/A CYS 233.A N GLN 229.A O no hydrogen 3.407 N/A CYS 233.A SG GLN 229.A O no hydrogen 3.270 N/A CYS 233.A SG GLU 230.A O no hydrogen 3.083 N/A ARG 234.A N TRP 231.A O no hydrogen 3.089 N/A THR 238.A N PHE 235.A O no hydrogen 3.430 N/A THR 238.A OG1 PHE 235.A O no hydrogen 3.257 N/A ARG 239.A NH1 ARG 237.A O no hydrogen 3.311 N/A ILE 240.A N GLU 248.A O no hydrogen 2.831 N/A GLU 248.A N GLU 252.A OE1 no hydrogen 2.853 N/A PHE 249.A N GLU 252.A OE1 no hydrogen 2.849 N/A GLU 250.A N THR 238.A O no hydrogen 2.875 N/A GLU 252.A N PHE 249.A O no hydrogen 2.828 N/A SER 253.A N PHE 249.A O no hydrogen 3.239 N/A TYR 254.A N GLU 250.A O no hydrogen 2.838 N/A LEU 255.A N VAL 251.A O no hydrogen 3.117 N/A ASP 256.A N GLU 252.A O no hydrogen 2.985 N/A PHE 257.A N SER 253.A O no hydrogen 2.916 N/A HIS 258.A N TYR 254.A O no hydrogen 3.228 N/A ALA 259.A N LEU 255.A O no hydrogen 2.914 N/A GLN 260.A N ASP 256.A O no hydrogen 3.016 N/A PHE 262.A N HIS 258.A O no hydrogen 3.326 N/A ALA 263.A N ALA 259.A O no hydrogen 2.944 N/A ASP 264.A N GLN 260.A O no hydrogen 2.936 N/A ARG 265.A N PHE 262.A O no hydrogen 3.013 N/A ASN 269.A N TYR 204.A OH no hydrogen 2.946 N/A ASN 269.A ND2 GLY 202.A O no hydrogen 3.011 N/A SER 270.A N ASP 267.A OD2 no hydrogen 2.967 N/A SER 270.A OG GLY 95.A O no hydrogen 2.705 N/A TYR 271.A N ASP 267.A O no hydrogen 2.998 N/A LEU 272.A N PRO 268.A O no hydrogen 3.021 N/A TYR 273.A N ASN 269.A O no hydrogen 3.015 N/A TYR 273.A OH PHE 118.A O no hydrogen 2.650 N/A LEU 274.A N SER 270.A O no hydrogen 3.024 N/A SER 275.A N TYR 271.A O no hydrogen 2.922 N/A HIS 276.A N LEU 272.A O no hydrogen 2.975 N/A HIS 276.A NE2 GLU 120.A OE2 no hydrogen 2.952 N/A ALA 277.A N TYR 273.A O no hydrogen 3.015 N/A MET 278.A N LEU 274.A O no hydrogen 3.161 N/A ASP 279.A N HIS 276.A O no hydrogen 3.068 N/A GLN 280.A N HIS 276.A O no hydrogen 3.150 N/A GLN 280.A N ALA 277.A O no hydrogen 3.241 N/A PHE 281.A N ALA 277.A O no hydrogen 3.232 N/A LEU 283.A N VAL 176.A O no hydrogen 2.941 N/A GLY 284.A N ASP 282.A OD2 no hydrogen 3.184 N/A ASP 285.A N ASP 282.A O no hydrogen 3.079 N/A GLY 286.A N LEU 283.A O no hydrogen 3.326 N/A GLY 289.A N GLY 286.A O no hydrogen 2.803 N/A GLY 292.A N GLY 289.A O no hydrogen 3.115 N/A GLY 295.A N GLY 291.A O no hydrogen 2.946 N/A ALA 296.A N GLY 292.A O no hydrogen 3.173 N/A LEU 297.A N ALA 293.A O no hydrogen 3.009 N/A SER 298.A N PRO 294.A O no hydrogen 3.032 N/A SER 298.A OG PRO 294.A O no hydrogen 3.488 N/A SER 298.A OG GLY 295.A O no hydrogen 2.592 N/A ARG 299.A N GLY 295.A O no hydrogen 3.008 N/A ARG 299.A N ALA 296.A O no hydrogen 3.232 N/A ARG 299.A NH1 GLY 290.A O no hydrogen 2.798 N/A MET 300.A N LEU 297.A O no hydrogen 3.215 N/A GLU 303.A N ARG 167.A O no hydrogen 2.876 N/A ALA 305.A N ASP 334.A O no hydrogen 3.104 N/A LEU 306.A N HIS 169.A O no hydrogen 2.863 N/A VAL 307.A N SER 336.A O no hydrogen 2.802 N/A MET 308.A N SER 171.A O no hydrogen 2.901 N/A GLY 309.A N LEU 338.A O no hydrogen 3.474 N/A ARG 311.A N VAL 340.A O no hydrogen 2.989 N/A THR 312.A OG1 THR 342.A O no hydrogen 2.696 N/A ASP 313.A N ALA 310.A O no hydrogen 3.126 N/A LEU 315.A N ASP 313.A OD2 no hydrogen 2.935 N/A PHE 316.A N ASP 313.A OD2 no hydrogen 2.983 N/A GLN 320.A N PRO 317.A O no hydrogen 2.810 N/A GLN 320.A NE2 HIS 177.A O no hydrogen 2.827 N/A GLN 321.A N LEU 318.A O no hydrogen 2.844 N/A GLN 321.A NE2 GLY 174.A O no hydrogen 2.939 N/A GLN 321.A NE2 PHE 316.A O no hydrogen 2.989 N/A GLN 322.A N LEU 318.A O no hydrogen 2.933 N/A GLN 322.A NE2 GLN 322.A O no hydrogen 3.321 N/A GLN 322.A NE2 ASP 326.A OD1 no hydrogen 3.506 N/A GLN 322.A NE2 ASP 326.A OD2 no hydrogen 2.772 N/A GLU 323.A N SER 319.A O no hydrogen 2.984 N/A ILE 324.A N GLN 320.A O no hydrogen 3.230 N/A ALA 325.A N GLN 321.A O no hydrogen 3.007 N/A ASP 326.A N GLN 322.A O no hydrogen 2.898 N/A GLY 327.A N GLU 323.A O no hydrogen 2.975 N/A LEU 328.A N ILE 324.A O no hydrogen 3.017 N/A SER 329.A N ALA 325.A O no hydrogen 2.888 N/A ALA 330.A N ASP 326.A O no hydrogen 2.809 N/A GLY 331.A N GLY 327.A O no hydrogen 3.263 N/A GLY 331.A N LEU 328.A O no hydrogen 3.062 N/A GLY 332.A N SER 329.A O no hydrogen 3.004 N/A ALA 333.A N LEU 328.A O no hydrogen 3.183 N/A ASP 334.A N GLU 303.A O no hydrogen 2.827 N/A SER 336.A N ALA 305.A O no hydrogen 2.886 N/A LEU 338.A N VAL 307.A O no hydrogen 2.895 N/A VAL 340.A N GLY 309.A O no hydrogen 2.738 N/A THR 342.A OG1 ASP 352.A OD1 no hydrogen 2.731 N/A ALA 344.A N THR 342.A OG1 no hydrogen 3.216 N/A GLY 345.A N THR 312.A OG1 no hydrogen 2.991 N/A HIS 346.A ND1 ASP 313.A OD1 no hydrogen 2.769 N/A HIS 346.A NE2 SER 149.A OG no hydrogen 2.657 N/A ASP 347.A N TYR 225.A O no hydrogen 3.103 N/A ALA 348.A N GLY 345.A O no hydrogen 2.961 N/A LEU 350.A N ASP 347.A O no hydrogen 2.862 N/A VAL 351.A N ASP 347.A O no hydrogen 2.902 N/A ASP 352.A N ALA 348.A O no hydrogen 2.824 N/A ARG 355.A N ASP 352.A O no hydrogen 3.067 N/A ARG 355.A N ASP 352.A OD2 no hydrogen 3.299 N/A ARG 355.A NH1 ASP 352.A OD1 no hydrogen 2.998 N/A PHE 356.A N ASP 352.A O no hydrogen 3.119 N/A GLY 357.A N ILE 353.A O no hydrogen 2.743 N/A ALA 361.A N GLY 357.A O no hydrogen 2.928 N/A LYS 362.A N PRO 358.A O no hydrogen 2.898 N/A PHE 363.A N PRO 359.A O no hydrogen 2.972 N/A LEU 364.A N VAL 360.A O no hydrogen 3.019 N/A ALA 365.A N ALA 361.A O no hydrogen 3.031 N/A ILE 366.A N LYS 362.A O no hydrogen 3.281 N/A ILE 366.A N PHE 363.A O no hydrogen 2.992 N/A VAL 367.A N PHE 363.A O no hydrogen 3.052 N/A ALA 368.A N LEU 364.A O no hydrogen 2.844 N/A