Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3ab4_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): VAL 3.A N ASP 34.A O no hydrogen 3.074 N/A VAL 4.A N VAL 133.A O no hydrogen 2.969 N/A GLN 5.A N VAL 36.A O no hydrogen 2.885 N/A LYS 6.A N GLU 135.A O no hydrogen 2.784 N/A LYS 6.A NZ ASP 119.A OD2 no hydrogen 2.947 N/A TYR 7.A N VAL 38.A O no hydrogen 2.841 N/A GLY 8.A N TYR 137.A O no hydrogen 2.894 N/A SER 11.A N GLY 8.A O no hydrogen 3.247 N/A SER 11.A OG SER 196.A OG no hydrogen 2.825 N/A LEU 12.A N GLY 9.A O no hydrogen 3.340 N/A ILE 18.A N SER 14.A O no hydrogen 2.856 N/A ARG 19.A N ALA 15.A O no hydrogen 2.903 N/A ARG 19.A NH1 SER 86.A OG no hydrogen 2.803 N/A ASN 20.A N GLU 16.A O no hydrogen 2.964 N/A VAL 21.A N ARG 17.A O no hydrogen 2.824 N/A ALA 22.A N ILE 18.A O no hydrogen 2.891 N/A GLU 23.A N ARG 19.A O no hydrogen 3.058 N/A ARG 24.A N ASN 20.A O no hydrogen 3.452 N/A ARG 24.A NH1 SER 198.A O no hydrogen 3.202 N/A ARG 24.A NH2 SER 198.A O no hydrogen 2.655 N/A ILE 25.A N VAL 21.A O no hydrogen 2.900 N/A VAL 26.A N ALA 22.A O no hydrogen 2.804 N/A ALA 27.A N GLU 23.A O no hydrogen 2.696 N/A THR 28.A N ARG 24.A O no hydrogen 2.964 N/A THR 28.A OG1 GLN 5.A OE1 no hydrogen 3.094 N/A THR 28.A OG1 ARG 24.A O no hydrogen 2.580 N/A LYS 29.A N ILE 25.A O no hydrogen 3.173 N/A LYS 30.A N VAL 26.A O no hydrogen 3.106 N/A ALA 31.A N ALA 27.A O no hydrogen 3.143 N/A GLY 32.A N LYS 29.A O no hydrogen 2.668 N/A ASN 33.A N LYS 29.A O no hydrogen 3.142 N/A ASN 33.A ND2 THR 28.A O no hydrogen 3.124 N/A ASP 34.A N ALA 1.A O no hydrogen 3.005 N/A VAL 36.A N VAL 3.A O no hydrogen 3.246 N/A VAL 37.A N CYS 113.A O no hydrogen 2.772 N/A VAL 38.A N GLN 5.A O no hydrogen 2.806 N/A SER 40.A N TYR 7.A O no hydrogen 3.073 N/A SER 40.A OG SER 118.A OG no hydrogen 3.338 N/A GLY 43.A N GLY 9.A O no hydrogen 2.683 N/A THR 45.A N MET 42.A O no hydrogen 2.962 N/A THR 45.A OG1 MET 42.A O no hydrogen 2.741 N/A GLU 48.A N ASP 44.A O no hydrogen 3.178 N/A LEU 49.A N THR 45.A O no hydrogen 2.766 N/A LEU 50.A N THR 46.A O no hydrogen 2.681 N/A GLU 51.A N ASP 47.A O no hydrogen 2.761 N/A LEU 52.A N GLU 48.A O no hydrogen 3.028 N/A ALA 53.A N LEU 49.A O no hydrogen 2.913 N/A ALA 54.A N LEU 50.A O no hydrogen 2.895 N/A ALA 55.A N GLU 51.A O no hydrogen 3.001 N/A VAL 56.A N ALA 53.A O no hydrogen 2.927 N/A ASN 57.A N ALA 53.A O no hydrogen 3.014 N/A ASN 57.A ND2 PRO 58.A O no hydrogen 2.596 N/A MET 65.A N PRO 61.A O no hydrogen 3.007 N/A ASP 66.A N ALA 62.A O no hydrogen 2.736 N/A LEU 68.A N GLU 64.A O no hydrogen 3.134 N/A LEU 69.A N MET 65.A O no hydrogen 3.070 N/A THR 70.A N ASP 66.A O no hydrogen 3.148 N/A THR 70.A OG1 ASP 66.A O no hydrogen 2.585 N/A GLY 72.A N LEU 68.A O no hydrogen 3.340 N/A GLU 73.A N LEU 69.A O no hydrogen 3.178 N/A ARG 74.A N THR 70.A O no hydrogen 2.801 N/A ILE 75.A N ALA 71.A O no hydrogen 3.167 N/A SER 76.A OG SER 40.A O no hydrogen 2.839 N/A ASN 77.A N GLU 73.A O no hydrogen 3.154 N/A ASN 77.A ND2 ILE 114.A O no hydrogen 3.410 N/A ALA 78.A N ARG 74.A O no hydrogen 2.932 N/A LEU 79.A N ILE 75.A O no hydrogen 3.006 N/A VAL 80.A N SER 76.A O no hydrogen 2.707 N/A ALA 81.A N ASN 77.A O no hydrogen 3.040 N/A MET 82.A N ALA 78.A O no hydrogen 2.947 N/A ALA 83.A N LEU 79.A O no hydrogen 2.882 N/A ILE 84.A N VAL 80.A O no hydrogen 2.856 N/A GLU 85.A N ALA 81.A O no hydrogen 3.107 N/A SER 86.A N MET 82.A O no hydrogen 3.100 N/A SER 86.A OG ALA 83.A O no hydrogen 2.529 N/A LEU 87.A N ALA 83.A O no hydrogen 3.333 N/A LEU 87.A N ILE 84.A O no hydrogen 2.925 N/A GLY 88.A N GLU 85.A O no hydrogen 3.135 N/A ALA 89.A N ILE 84.A O no hydrogen 3.483 N/A GLN 92.A N ILE 112.A O no hydrogen 3.275 N/A SER 93.A OG ASN 77.A OD1 no hydrogen 2.684 N/A ARG 104.A N PRO 100.A O no hydrogen 2.742 N/A ARG 104.A NE ARG 104.A O no hydrogen 3.305 N/A ARG 104.A NE ASP 108.A OD1 no hydrogen 3.167 N/A ARG 104.A NH2 ASP 34.A OD1 no hydrogen 2.843 N/A ARG 104.A NH2 ASP 108.A OD1 no hydrogen 3.017 N/A GLU 105.A N GLY 101.A O no hydrogen 3.088 N/A ALA 106.A N ARG 102.A O no hydrogen 3.326 N/A LEU 107.A N VAL 103.A O no hydrogen 2.829 N/A ASP 108.A N ARG 104.A O no hydrogen 3.073 N/A GLU 109.A N GLU 105.A O no hydrogen 3.387 N/A GLY 110.A N LEU 107.A O no hydrogen 2.811 N/A LYS 111.A N ALA 106.A O no hydrogen 2.939 N/A LYS 111.A NZ GLU 90.A OE2 no hydrogen 2.731 N/A ILE 112.A N GLU 90.A O no hydrogen 2.832 N/A CYS 113.A N VAL 35.A O no hydrogen 3.290 N/A CYS 113.A SG VAL 103.A O no hydrogen 3.929 N/A CYS 113.A SG LYS 111.A O no hydrogen 3.580 N/A ILE 114.A N GLN 92.A O no hydrogen 3.247 N/A VAL 115.A N VAL 37.A O no hydrogen 3.071 N/A SER 118.A OG SER 40.A OG no hydrogen 3.338 N/A THR 121.A N GLY 117.A O no hydrogen 2.749 N/A THR 121.A OG1 GLY 117.A O no hydrogen 3.247 N/A ALA 122.A N SER 118.A O no hydrogen 3.022 N/A VAL 123.A N ASP 119.A O no hydrogen 3.181 N/A ALA 124.A N THR 120.A O no hydrogen 2.786 N/A LEU 125.A N THR 121.A O no hydrogen 2.840 N/A ALA 126.A N ALA 122.A O no hydrogen 3.037 N/A ALA 127.A N VAL 123.A O no hydrogen 2.972 N/A ALA 128.A N ALA 124.A O no hydrogen 2.886 N/A LEU 129.A N LEU 125.A O no hydrogen 2.717 N/A ASN 130.A N ALA 127.A O no hydrogen 3.007 N/A ALA 131.A N ALA 126.A O no hydrogen 2.837 N/A ASP 132.A N LEU 2.A O no hydrogen 2.987 N/A CYS 134.A N PRO 190.A O no hydrogen 2.854 N/A GLU 135.A N VAL 4.A O no hydrogen 2.677 N/A ILE 136.A N ARG 192.A O no hydrogen 2.762 N/A TYR 137.A N LYS 6.A O no hydrogen 2.740 N/A TYR 137.A OH GLU 135.A OE1 no hydrogen 2.815 N/A SER 138.A N ARG 194.A O no hydrogen 3.314 N/A SER 138.A OG VAL 140.A O no hydrogen 3.482 N/A VAL 140.A N SER 138.A OG no hydrogen 3.165 N/A VAL 143.A N THR 203.A OG1 no hydrogen 3.193 N/A TYR 144.A OH ASP 141.A OD1 no hydrogen 2.746 N/A THR 145.A N GLN 155.A O no hydrogen 2.834 N/A THR 145.A OG1 GLN 155.A O no hydrogen 3.418 N/A ARG 149.A N ASP 147.A OD2 no hydrogen 3.049 N/A ILE 150.A N ASP 147.A O no hydrogen 2.968 N/A VAL 151.A N ASP 147.A O no hydrogen 2.860 N/A GLN 155.A N THR 145.A OG1 no hydrogen 2.884 N/A LYS 156.A NZ ASP 200.A OD1 no hydrogen 3.521 N/A LYS 156.A NZ ASP 200.A OD2 no hydrogen 2.410 N/A LYS 156.A NZ GLY 202.A O no hydrogen 3.266 N/A LEU 157.A N VAL 143.A O no hydrogen 2.795 N/A GLU 158.A N GLU 158.A OE1 no hydrogen 2.930 N/A LYS 159.A N GLU 158.A OE1 no hydrogen 3.143 N/A LYS 159.A NZ GLU 158.A OE2 no hydrogen 3.371 N/A LEU 160.A N LEU 204.A O no hydrogen 2.729 N/A SER 161.A N GLU 164.A OE1 no hydrogen 3.074 N/A SER 161.A OG GLU 164.A OE1 no hydrogen 2.764 N/A PHE 162.A N GLY 207.A O no hydrogen 2.894 N/A GLU 163.A N GLU 163.A OE1 no hydrogen 2.669 N/A GLU 164.A N SER 161.A OG no hydrogen 3.144 N/A MET 165.A N SER 161.A O no hydrogen 2.932 N/A LEU 166.A N PHE 162.A O no hydrogen 2.815 N/A GLU 167.A N GLU 163.A O no hydrogen 2.731 N/A LEU 168.A N GLU 164.A O no hydrogen 3.106 N/A ALA 169.A N MET 165.A O no hydrogen 3.004 N/A ALA 170.A N LEU 166.A O no hydrogen 3.060 N/A ALA 170.A N GLU 167.A O no hydrogen 3.022 N/A VAL 171.A N LEU 168.A O no hydrogen 3.151 N/A SER 173.A N LEU 168.A O no hydrogen 3.302 N/A VAL 177.A N ASP 119.A OD1 no hydrogen 3.395 N/A SER 180.A N VAL 177.A O no hydrogen 3.120 N/A SER 180.A OG VAL 177.A O no hydrogen 2.626 N/A VAL 181.A N VAL 177.A O no hydrogen 3.434 N/A GLU 182.A N LEU 178.A O no hydrogen 3.024 N/A TYR 183.A N ARG 179.A O no hydrogen 2.955 N/A ALA 184.A N SER 180.A O no hydrogen 2.950 N/A ARG 185.A N VAL 181.A O no hydrogen 2.923 N/A ALA 186.A N GLU 182.A O no hydrogen 3.068 N/A PHE 187.A N TYR 183.A O no hydrogen 2.995 N/A ASN 188.A N ARG 185.A O no hydrogen 3.415 N/A VAL 189.A N ALA 184.A O no hydrogen 2.834 N/A LEU 191.A N ILE 205.A O no hydrogen 2.862 N/A ARG 192.A N CYS 134.A O no hydrogen 3.129 N/A ARG 192.A NE PRO 201.A O no hydrogen 2.755 N/A ARG 192.A NH1 PRO 201.A O no hydrogen 3.484 N/A VAL 193.A N THR 203.A O no hydrogen 2.907 N/A ARG 194.A N ILE 136.A O no hydrogen 3.171 N/A ARG 194.A NH1 GLU 135.A OE2 no hydrogen 3.072 N/A SER 196.A N SER 138.A O no hydrogen 3.019 N/A SER 196.A OG SER 11.A OG no hydrogen 2.825 N/A TYR 197.A N SER 195.A OG no hydrogen 2.955 N/A TYR 197.A OH SER 10.A O no hydrogen 2.824 N/A TYR 197.A OH GLU 13.A OE2 no hydrogen 2.913 N/A ASP 200.A N SER 198.A OG no hydrogen 2.761 N/A GLY 202.A N ASP 200.A OD2 no hydrogen 2.857 N/A THR 203.A N VAL 193.A O no hydrogen 2.845 N/A THR 203.A OG1 LEU 157.A O no hydrogen 2.526 N/A LEU 204.A N GLU 158.A O no hydrogen 2.988 N/A ILE 205.A N LEU 191.A O no hydrogen 2.749 N/A ALA 206.A N LEU 160.A O no hydrogen 2.966 N/A SER 208.A OG GLU 163.A OE2 no hydrogen 3.110 N/A MET 209.A N GLU 163.A OE1 no hydrogen 2.937 N/A GLU 210.A N SER 208.A OG no hydrogen 3.085 N/A ASP 211.A N SER 208.A O no hydrogen 2.811 N/A ILE 212.A N MET 209.A O no hydrogen 3.435 N/A GLU 216.A N PRO 213.A O no hydrogen 2.757 N/A ALA 217.A N VAL 214.A O no hydrogen 3.351 N/A THR 220.A N VAL 312.A O no hydrogen 2.862 N/A THR 220.A OG1 GLU 164.A OE2 no hydrogen 2.798 N/A GLY 221.A N VAL 312.A O no hydrogen 3.239 N/A VAL 222.A N THR 145.A O no hydrogen 2.800 N/A ALA 223.A N SER 310.A O no hydrogen 3.052 N/A ASP 225.A N LYS 308.A O no hydrogen 2.831 N/A LYS 226.A NZ ASP 357.A OD1 no hydrogen 2.531 N/A SER 227.A N ASP 225.A OD1 no hydrogen 2.643 N/A SER 227.A OG ASP 225.A OD1 no hydrogen 2.527 N/A ALA 229.A N CYS 276.A O no hydrogen 2.694 N/A LYS 230.A N ASP 303.A O no hydrogen 2.765 N/A LYS 230.A NZ ASP 303.A OD1 no hydrogen 3.440 N/A VAL 231.A N PHE 274.A O no hydrogen 2.821 N/A THR 232.A N LEU 301.A O no hydrogen 3.068 N/A VAL 233.A N ILE 272.A O no hydrogen 2.671 N/A LEU 234.A N ASN 299.A O no hydrogen 3.083 N/A GLY 235.A N ASP 271.A OD1 no hydrogen 3.211 N/A ILE 236.A N THR 270.A O no hydrogen 2.748 N/A LYS 239.A N SER 237.A O no hydrogen 2.881 N/A GLU 242.A N LYS 239.A O no hydrogen 3.346 N/A LYS 245.A N GLY 241.A O no hydrogen 3.411 N/A LYS 245.A N GLU 242.A O no hydrogen 3.234 N/A LYS 245.A NZ GLU 242.A OE1 no hydrogen 3.302 N/A LYS 245.A NZ GLU 242.A OE2 no hydrogen 2.801 N/A PHE 247.A N ALA 243.A O no hydrogen 3.440 N/A ARG 248.A N ALA 244.A O no hydrogen 2.887 N/A ARG 248.A NE ASP 252.A OD1 no hydrogen 2.662 N/A ALA 249.A N LYS 245.A O no hydrogen 3.304 N/A LEU 250.A N VAL 246.A O no hydrogen 3.141 N/A ALA 251.A N PHE 247.A O no hydrogen 2.713 N/A ASP 252.A N ARG 248.A O no hydrogen 2.636 N/A ALA 253.A N LEU 250.A O no hydrogen 3.149 N/A GLU 254.A N ALA 251.A O no hydrogen 2.703 N/A ILE 255.A N LEU 250.A O no hydrogen 2.943 N/A ASN 256.A N ASP 280.A OD2 no hydrogen 3.104 N/A ASP 258.A N THR 275.A O no hydrogen 3.133 N/A LEU 261.A N THR 273.A O no hydrogen 2.934 N/A VAL 264.A N ASN 263.A OD1 no hydrogen 2.619 N/A SER 266.A OG VAL 264.A O no hydrogen 3.212 N/A THR 269.A N ASP 267.A O no hydrogen 2.748 N/A THR 270.A N ILE 236.A O no hydrogen 2.796 N/A ILE 272.A N VAL 233.A O no hydrogen 2.839 N/A THR 273.A N LEU 261.A O no hydrogen 3.028 N/A PHE 274.A N VAL 231.A O no hydrogen 2.780 N/A THR 275.A N MET 259.A O no hydrogen 3.107 N/A THR 275.A OG1 ASP 258.A O no hydrogen 3.410 N/A THR 275.A OG1 MET 259.A O no hydrogen 3.487 N/A CYS 276.A N ALA 229.A O no hydrogen 2.908 N/A CYS 276.A SG PRO 277.A O no hydrogen 3.614 N/A ARG 278.A N SER 227.A O no hydrogen 2.937 N/A ARG 278.A NE GLU 228.A O no hydrogen 3.001 N/A ARG 278.A NH1 GLU 353.A OE1 no hydrogen 2.816 N/A ARG 278.A NH2 VAL 306.A O no hydrogen 2.909 N/A ARG 278.A NH2 GLU 353.A OE1 no hydrogen 2.835 N/A ASP 280.A N PRO 277.A O no hydrogen 2.893 N/A GLY 281.A N ARG 278.A O no hydrogen 3.313 N/A ALA 284.A N ASP 280.A O no hydrogen 2.928 N/A MET 285.A N GLY 281.A O no hydrogen 3.124 N/A GLU 286.A N ARG 282.A O no hydrogen 3.100 N/A ILE 287.A N ARG 283.A O no hydrogen 3.079 N/A LEU 288.A N ALA 284.A O no hydrogen 3.089 N/A LYS 289.A N MET 285.A O no hydrogen 2.746 N/A LYS 289.A NZ GLN 292.A OE1 no hydrogen 3.006 N/A LYS 290.A N GLU 286.A O no hydrogen 3.106 N/A LEU 291.A N ILE 287.A O no hydrogen 3.313 N/A LEU 291.A N LEU 288.A O no hydrogen 3.236 N/A GLN 292.A N LYS 289.A O no hydrogen 3.333 N/A GLY 295.A N GLN 292.A O no hydrogen 3.207 N/A ASN 296.A ND2 LEU 291.A O no hydrogen 3.079 N/A TRP 297.A NE1 LEU 288.A O no hydrogen 3.057 N/A THR 298.A N LEU 234.A O no hydrogen 3.180 N/A VAL 300.A N ASN 299.A OD1 no hydrogen 2.675 N/A LEU 301.A N THR 232.A O no hydrogen 2.717 N/A ASP 303.A N LYS 230.A O no hydrogen 3.011 N/A GLN 305.A N ASP 303.A OD2 no hydrogen 2.957 N/A GLY 307.A N ILE 351.A O no hydrogen 2.901 N/A LYS 308.A N ASP 225.A O no hydrogen 2.738 N/A LYS 308.A NZ ASP 258.A OD1 no hydrogen 2.644 N/A VAL 309.A N VAL 349.A O no hydrogen 3.053 N/A SER 310.A N ALA 223.A O no hydrogen 2.849 N/A SER 310.A OG SER 348.A OG no hydrogen 2.469 N/A LEU 311.A N ILE 347.A O no hydrogen 2.861 N/A VAL 312.A N GLY 221.A O no hydrogen 3.027 N/A GLY 313.A N ILE 345.A O no hydrogen 3.009 N/A ALA 314.A N GLU 164.A OE2 no hydrogen 2.884 N/A GLY 315.A N VAL 218.A O no hydrogen 2.909 N/A MET 316.A N GLY 313.A O no hydrogen 3.068 N/A LYS 317.A N ALA 314.A O no hydrogen 3.050 N/A HIS 319.A ND1 GLY 315.A O no hydrogen 2.566 N/A GLU 325.A N GLY 321.A O no hydrogen 3.216 N/A PHE 326.A N VAL 322.A O no hydrogen 2.908 N/A MET 327.A N THR 323.A O no hydrogen 2.853 N/A GLU 328.A N ALA 324.A O no hydrogen 2.868 N/A ALA 329.A N GLU 325.A O no hydrogen 2.676 N/A LEU 330.A N PHE 326.A O no hydrogen 3.304 N/A ARG 331.A N MET 327.A O no hydrogen 2.937 N/A ARG 331.A NH1 ASP 332.A OD1 no hydrogen 2.804 N/A ASP 332.A N GLU 328.A O no hydrogen 3.090 N/A ASP 332.A N ALA 329.A O no hydrogen 3.245 N/A VAL 333.A N ALA 329.A O no hydrogen 3.402 N/A VAL 335.A N LEU 330.A O no hydrogen 3.188 N/A GLU 338.A N LEU 350.A O no hydrogen 3.047 N/A SER 341.A N SER 348.A O no hydrogen 3.005 N/A SER 343.A N ARG 346.A O no hydrogen 3.032 N/A ILE 345.A N SER 343.A OG no hydrogen 3.295 N/A ARG 346.A N SER 343.A O no hydrogen 3.174 N/A ARG 346.A NE GLU 167.A OE2 no hydrogen 2.782 N/A ARG 346.A NH1 SER 348.A OG no hydrogen 2.998 N/A ARG 346.A NH2 GLU 167.A OE2 no hydrogen 3.119 N/A ILE 347.A N LEU 311.A O no hydrogen 3.000 N/A SER 348.A N SER 341.A O no hydrogen 2.964 N/A SER 348.A OG SER 310.A OG no hydrogen 2.469 N/A VAL 349.A N VAL 309.A O no hydrogen 3.062 N/A LEU 350.A N LEU 339.A O no hydrogen 3.149 N/A ILE 351.A N GLY 307.A O no hydrogen 2.897 N/A ARG 352.A NH1 ASP 303.A OD2 no hydrogen 3.349 N/A ARG 352.A NH2 ASP 303.A OD1 no hydrogen 3.185 N/A ARG 352.A NH2 GLU 338.A OE1 no hydrogen 3.148 N/A ARG 352.A NH2 GLU 338.A OE2 no hydrogen 3.141 N/A GLU 353.A N GLN 305.A O no hydrogen 3.006 N/A ASP 355.A N ARG 352.A O no hydrogen 2.873 N/A LEU 356.A N GLU 353.A O no hydrogen 3.139 N/A ALA 359.A N ASP 355.A O no hydrogen 2.974 N/A ALA 360.A N LEU 356.A O no hydrogen 3.012 N/A ARG 361.A N ASP 357.A O no hydrogen 2.994 N/A ARG 361.A NH1 ILE 150.A O no hydrogen 2.861 N/A ALA 362.A N ALA 358.A O no hydrogen 2.815 N/A LEU 363.A N ALA 359.A O no hydrogen 2.856 N/A HIS 364.A N ALA 360.A O no hydrogen 2.849 N/A GLU 365.A N ARG 361.A O no hydrogen 3.156 N/A GLN 366.A N ALA 362.A O no hydrogen 3.043 N/A PHE 367.A N LEU 363.A O no hydrogen 3.109 N/A GLN 368.A N GLU 365.A O no hydrogen 2.984 N/A LEU 369.A N HIS 364.A O no hydrogen 2.915 N/A