Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3bq0_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ILE 2.A N THR 109.A OG1 no hydrogen 2.950 N/A VAL 3.A N ALA 143.A O no hydrogen 3.007 N/A ILE 4.A N LEU 106.A O no hydrogen 2.763 N/A PHE 5.A N GLY 141.A O no hydrogen 2.842 N/A VAL 6.A N ALA 104.A O no hydrogen 2.781 N/A ASP 7.A N THR 139.A O no hydrogen 2.801 N/A PHE 8.A N ASP 102.A O no hydrogen 2.744 N/A ASP 9.A N THR 137.A O no hydrogen 3.262 N/A GLN 14.A N TYR 10.A O no hydrogen 3.050 N/A VAL 15.A N PHE 11.A O no hydrogen 2.842 N/A GLU 16.A N PHE 12.A O no hydrogen 3.040 N/A GLU 17.A N ALA 13.A O no hydrogen 3.090 N/A VAL 18.A N GLN 14.A O no hydrogen 3.156 N/A VAL 18.A N VAL 15.A O no hydrogen 3.015 N/A LEU 19.A N VAL 15.A O no hydrogen 3.075 N/A ASN 20.A N GLU 16.A O no hydrogen 2.916 N/A ASN 20.A ND2 GLU 16.A O no hydrogen 2.671 N/A TYR 23.A N ASN 20.A O no hydrogen 2.857 N/A LYS 26.A N TYR 23.A O no hydrogen 3.108 N/A LYS 26.A NZ GLN 22.A O no hydrogen 3.190 N/A LEU 28.A N ASN 44.A OD1 no hydrogen 2.756 N/A VAL 29.A N ILE 69.A O no hydrogen 2.734 N/A VAL 30.A N THR 42.A O no hydrogen 2.794 N/A CYS 31.A N VAL 71.A O no hydrogen 2.814 N/A CYS 31.A SG VAL 29.A O no hydrogen 3.720 N/A CYS 31.A SG VAL 71.A O no hydrogen 3.816 N/A VAL 32.A N ALA 39.A O no hydrogen 2.981 N/A ALA 39.A N VAL 32.A O no hydrogen 3.034 N/A VAL 40.A N MET 56.A O no hydrogen 2.767 N/A ALA 41.A N VAL 30.A O no hydrogen 2.753 N/A ASN 44.A N LEU 28.A O no hydrogen 2.899 N/A ASN 44.A ND2 GLU 17.A OE2 no hydrogen 2.889 N/A ASN 44.A ND2 LYS 26.A O no hydrogen 2.665 N/A ALA 47.A N ASN 44.A OD1 no hydrogen 3.086 N/A ARG 48.A N ASN 44.A O no hydrogen 2.913 N/A ARG 48.A NH1 ALA 43.A O no hydrogen 2.726 N/A LYS 49.A N TYR 45.A O no hydrogen 2.985 N/A LEU 50.A N ALA 47.A O no hydrogen 3.025 N/A GLY 51.A N ARG 48.A O no hydrogen 2.910 N/A VAL 52.A N ALA 47.A O no hydrogen 3.265 N/A GLY 55.A N VAL 40.A O no hydrogen 3.039 N/A MET 56.A N LYS 53.A O no hydrogen 3.205 N/A ILE 58.A N GLY 38.A O no hydrogen 3.004 N/A ALA 61.A N PRO 57.A O no hydrogen 3.172 N/A MET 62.A N ILE 58.A O no hydrogen 3.003 N/A GLN 63.A N ILE 59.A O no hydrogen 3.011 N/A ILE 64.A N LYS 60.A O no hydrogen 3.450 N/A ALA 65.A N ALA 61.A O no hydrogen 2.825 N/A ALA 68.A N ALA 65.A O no hydrogen 3.051 N/A ILE 69.A N PRO 27.A O no hydrogen 3.052 N/A TYR 70.A OH ALA 65.A O no hydrogen 2.808 N/A VAL 71.A N VAL 29.A O no hydrogen 2.990 N/A MET 73.A N CYS 31.A O no hydrogen 2.872 N/A ARG 74.A N TYR 78.A OH no hydrogen 3.243 N/A ARG 74.A NE GLU 16.A OE1 no hydrogen 3.149 N/A ARG 74.A NH2 GLU 16.A OE1 no hydrogen 2.878 N/A ARG 74.A NH2 GLU 16.A OE2 no hydrogen 2.848 N/A ILE 77.A N ARG 74.A O no hydrogen 3.085 N/A TYR 78.A N ARG 74.A O no hydrogen 3.245 N/A TYR 78.A OH GLU 16.A OE1 no hydrogen 2.663 N/A GLU 79.A N LYS 75.A O no hydrogen 2.886 N/A ALA 80.A N PRO 76.A O no hydrogen 3.016 N/A PHE 81.A N ILE 77.A O no hydrogen 2.967 N/A SER 82.A N TYR 78.A O no hydrogen 2.950 N/A SER 82.A OG ILE 101.A O no hydrogen 2.407 N/A ASN 83.A N GLU 79.A O no hydrogen 2.983 N/A ASN 83.A ND2 GLU 79.A O no hydrogen 2.863 N/A ARG 84.A N ALA 80.A O no hydrogen 3.235 N/A ARG 84.A NE GLU 134.A OE2 no hydrogen 3.389 N/A ARG 84.A NH2 GLU 134.A OE1 no hydrogen 2.876 N/A ILE 85.A N PHE 81.A O no hydrogen 3.361 N/A MET 86.A N SER 82.A O no hydrogen 2.763 N/A ASN 87.A N ASN 83.A O no hydrogen 2.955 N/A LEU 88.A N ARG 84.A O no hydrogen 3.085 N/A LEU 89.A N ILE 85.A O no hydrogen 2.943 N/A ASN 90.A N MET 86.A O no hydrogen 3.092 N/A HIS 92.A N LEU 89.A O no hydrogen 2.777 N/A HIS 92.A NE2 GLU 129.A OE2 no hydrogen 2.631 N/A ALA 93.A N ASN 90.A O no hydrogen 3.426 N/A ASP 94.A N ASP 107.A O no hydrogen 2.820 N/A LYS 95.A N ASP 107.A O no hydrogen 3.368 N/A GLU 97.A N TYR 105.A O no hydrogen 2.912 N/A VAL 98.A N LYS 238.A O no hydrogen 3.114 N/A ALA 99.A N GLU 103.A O no hydrogen 3.040 N/A SER 100.A N GLU 103.A O no hydrogen 3.369 N/A SER 100.A OG ASP 102.A OD2 no hydrogen 3.347 N/A SER 100.A OG GLU 103.A OE1 no hydrogen 3.259 N/A GLU 103.A N SER 100.A O no hydrogen 3.360 N/A ALA 104.A N VAL 6.A O no hydrogen 2.878 N/A TYR 105.A N GLU 97.A O no hydrogen 2.945 N/A LEU 106.A N ILE 4.A O no hydrogen 2.790 N/A ASP 107.A N LYS 95.A O no hydrogen 2.819 N/A VAL 108.A N ILE 2.A O no hydrogen 2.893 N/A THR 109.A N ASP 107.A OD1 no hydrogen 3.037 N/A THR 109.A OG1 ASP 107.A OD1 no hydrogen 2.594 N/A ASN 110.A N ASP 94.A OD2 no hydrogen 2.707 N/A LYS 111.A N ASP 94.A OD1 no hydrogen 3.154 N/A VAL 112.A N VAL 108.A O no hydrogen 3.077 N/A GLU 113.A N ASN 110.A O no hydrogen 3.088 N/A GLY 114.A N THR 109.A O no hydrogen 2.842 N/A ASN 115.A N VAL 112.A O no hydrogen 3.052 N/A ASN 118.A N ASN 115.A OD1 no hydrogen 2.833 N/A GLY 119.A N ASN 115.A O no hydrogen 2.933 N/A ILE 120.A N PHE 116.A O no hydrogen 3.004 N/A GLU 121.A N GLU 117.A O no hydrogen 3.112 N/A LEU 122.A N ASN 118.A O no hydrogen 3.013 N/A ALA 123.A N GLY 119.A O no hydrogen 3.085 N/A ARG 124.A N ILE 120.A O no hydrogen 3.051 N/A LYS 125.A N GLU 121.A O no hydrogen 2.853 N/A ILE 126.A N LEU 122.A O no hydrogen 2.863 N/A LYS 127.A N ALA 123.A O no hydrogen 3.205 N/A LYS 127.A NZ ASN 159.A O no hydrogen 2.746 N/A LYS 127.A NZ ASN 159.A OD1 no hydrogen 3.198 N/A LYS 127.A NZ GLY 160.A O no hydrogen 2.912 N/A GLN 128.A N ARG 124.A O no hydrogen 3.170 N/A GLU 129.A N LYS 125.A O no hydrogen 3.026 N/A ILE 130.A N ILE 126.A O no hydrogen 2.969 N/A LEU 131.A N LYS 127.A O no hydrogen 2.927 N/A GLU 132.A N GLN 128.A O no hydrogen 2.941 N/A LYS 133.A N GLU 129.A O no hydrogen 2.731 N/A GLU 134.A N ILE 130.A O no hydrogen 2.823 N/A LYS 135.A N LEU 131.A O no hydrogen 2.917 N/A LYS 135.A NZ GLU 132.A O no hydrogen 2.573 N/A THR 137.A OG1 ASP 9.A OD1 no hydrogen 3.207 N/A THR 139.A N ASP 7.A O no hydrogen 2.902 N/A THR 139.A OG1 ASP 9.A OD2 no hydrogen 3.046 N/A VAL 140.A N GLY 160.A O no hydrogen 3.116 N/A GLY 141.A N PHE 5.A O no hydrogen 2.886 N/A VAL 142.A N GLY 162.A O no hydrogen 2.877 N/A ALA 143.A N VAL 3.A O no hydrogen 3.012 N/A LYS 146.A NZ GLU 97.A OE1 no hydrogen 3.518 N/A LYS 146.A NZ GLU 97.A OE2 no hydrogen 3.158 N/A LYS 146.A NZ PRO 234.A O no hydrogen 3.284 N/A LEU 148.A N ASN 145.A OD1 no hydrogen 2.827 N/A ALA 149.A N ASN 145.A O no hydrogen 2.981 N/A LYS 150.A N LYS 146.A O no hydrogen 2.969 N/A ILE 151.A N ILE 147.A O no hydrogen 2.966 N/A ILE 152.A N LEU 148.A O no hydrogen 2.934 N/A ALA 153.A N ALA 149.A O no hydrogen 3.182 N/A ASP 154.A N LYS 150.A O no hydrogen 2.875 N/A LYS 155.A N ILE 151.A O no hydrogen 3.054 N/A SER 156.A N ALA 153.A O no hydrogen 2.654 N/A SER 156.A OG ILE 152.A O no hydrogen 2.529 N/A LYS 157.A NZ ASP 154.A OD1 no hydrogen 2.902 N/A ASN 159.A N ASP 9.A OD1 no hydrogen 2.759 N/A GLY 160.A N THR 139.A OG1 no hydrogen 3.237 N/A GLY 162.A N VAL 140.A O no hydrogen 2.952 N/A ILE 164.A N VAL 142.A O no hydrogen 3.069 N/A ARG 165.A NE GLU 117.A OE1 no hydrogen 3.232 N/A ARG 165.A NH1 GLU 168.A OE2 no hydrogen 3.030 N/A GLU 168.A N ARG 165.A O no hydrogen 2.854 N/A ASP 171.A N GLU 168.A O no hydrogen 3.239 N/A LEU 173.A N VAL 169.A O no hydrogen 2.853 N/A GLU 175.A N PHE 172.A O no hydrogen 3.278 N/A ASP 177.A N GLU 180.A OE1 no hydrogen 3.272 N/A ILE 178.A N GLN 198.A O no hydrogen 2.718 N/A ILE 184.A N ILE 181.A O no hydrogen 2.938 N/A ALA 189.A N GLY 185.A O no hydrogen 3.213 N/A ARG 191.A N VAL 187.A O no hydrogen 3.407 N/A LEU 192.A N LEU 188.A O no hydrogen 3.197 N/A ASN 193.A N ALA 189.A O no hydrogen 2.909 N/A GLU 194.A N ARG 191.A O no hydrogen 3.110 N/A LEU 195.A N LEU 192.A O no hydrogen 3.313 N/A ILE 197.A N LEU 192.A O no hydrogen 2.985 N/A GLN 198.A N ASP 202.A OD2 no hydrogen 3.116 N/A LYS 199.A N ASP 202.A OD2 no hydrogen 3.138 N/A LEU 200.A N LEU 176.A O no hydrogen 3.006 N/A ILE 203.A N LEU 200.A O no hydrogen 3.196 N/A LEU 204.A N ARG 201.A O no hydrogen 3.147 N/A SER 205.A N ASP 202.A O no hydrogen 3.024 N/A SER 205.A OG ASP 202.A O no hydrogen 2.666 N/A LYS 206.A N ILE 203.A O no hydrogen 2.952 N/A GLU 210.A N ASN 207.A O no hydrogen 3.367 N/A GLU 212.A N TYR 208.A O no hydrogen 3.444 N/A LYS 213.A N ASN 209.A O no hydrogen 3.043 N/A ILE 214.A N GLU 210.A O no hydrogen 3.221 N/A ILE 214.A N LEU 211.A O no hydrogen 3.179 N/A THR 215.A N LEU 211.A O no hydrogen 2.931 N/A THR 215.A OG1 LEU 211.A O no hydrogen 2.675 N/A GLY 216.A N GLU 212.A O no hydrogen 2.729 N/A ALA 220.A N GLY 216.A O no hydrogen 3.031 N/A LEU 221.A N LYS 217.A O no hydrogen 3.136 N/A TYR 222.A OH PRO 182.A O no hydrogen 2.696 N/A LEU 223.A N LYS 219.A O no hydrogen 2.853 N/A LEU 224.A N ALA 220.A O no hydrogen 3.027 N/A LYS 225.A N LEU 221.A O no hydrogen 3.085 N/A LEU 226.A N TYR 222.A O no hydrogen 3.352 N/A ALA 227.A N LEU 223.A O no hydrogen 2.942 N/A GLN 228.A N LEU 224.A O no hydrogen 2.816 N/A ASN 229.A N LEU 226.A O no hydrogen 2.949 N/A LYS 230.A N LYS 225.A O no hydrogen 2.655 N/A LYS 230.A NZ GLN 228.A OE1 no hydrogen 2.842 N/A TYR 231.A N LYS 225.A O no hydrogen 2.998 N/A GLU 236.A N GLU 97.A OE2 no hydrogen 3.326 N/A GLU 236.A N GLU 236.A OE2 no hydrogen 2.878 N/A ASN 237.A ND2 ILE 96.A O no hydrogen 3.463 N/A SER 239.A N ILE 338.A O no hydrogen 2.767 N/A LYS 240.A N VAL 98.A O no hydrogen 2.613 N/A LYS 240.A NZ GLU 97.A OE1 no hydrogen 3.297 N/A ILE 241.A N SER 239.A OG no hydrogen 3.402 N/A HIS 243.A N LEU 335.A O no hydrogen 2.933 N/A ARG 245.A N VAL 333.A O no hydrogen 3.030 N/A LEU 247.A N ILE 331.A O no hydrogen 2.892 N/A LEU 249.A N ARG 329.A O no hydrogen 2.953 N/A THR 253.A N VAL 328.A O no hydrogen 2.986 N/A ARG 254.A NH1 LEU 320.A O no hydrogen 3.421 N/A ASP 255.A N THR 253.A OG1 no hydrogen 3.080 N/A LYS 257.A N ASP 255.A OD1 no hydrogen 3.297 N/A VAL 258.A N ASP 255.A O no hydrogen 2.843 N/A ILE 259.A N ASP 255.A O no hydrogen 3.009 N/A LEU 260.A N VAL 256.A O no hydrogen 2.886 N/A TYR 262.A N ILE 259.A O no hydrogen 3.139 N/A LEU 263.A N ILE 259.A O no hydrogen 2.927 N/A LYS 264.A N LEU 260.A O no hydrogen 2.848 N/A ALA 266.A N TYR 262.A O no hydrogen 3.046 N/A ILE 267.A N LEU 263.A O no hydrogen 2.887 N/A ASN 268.A N LYS 264.A O no hydrogen 2.832 N/A GLU 269.A N LYS 265.A O no hydrogen 3.056 N/A ALA 270.A N ALA 266.A O no hydrogen 3.214 N/A ALA 270.A N ILE 267.A O no hydrogen 3.149 N/A TYR 271.A N ILE 267.A O no hydrogen 2.748 N/A TYR 271.A OH ILE 303.A O no hydrogen 2.554 N/A ASN 272.A N ASN 268.A O no hydrogen 2.964 N/A ASN 272.A ND2 ASN 268.A O no hydrogen 2.675 N/A LYS 273.A N ALA 270.A O no hydrogen 2.907 N/A VAL 274.A N TYR 271.A O no hydrogen 3.161 N/A ILE 277.A N ILE 339.A O no hydrogen 3.180 N/A MET 279.A N ASP 336.A O no hydrogen 3.008 N/A MET 279.A N ASN 337.A O no hydrogen 3.044 N/A ARG 280.A N ASP 336.A O no hydrogen 3.117 N/A ARG 280.A NE ASP 336.A OD1 no hydrogen 3.178 N/A ARG 280.A NE ASP 336.A OD2 no hydrogen 2.892 N/A ARG 280.A NH2 ASP 336.A OD2 no hydrogen 2.557 N/A THR 282.A N LYS 334.A O no hydrogen 2.809 N/A VAL 283.A N LYS 295.A O no hydrogen 3.167 N/A ILE 284.A N GLY 332.A O no hydrogen 2.705 N/A ALA 285.A N LEU 293.A O no hydrogen 3.175 N/A ILE 286.A N ARG 330.A O no hydrogen 2.706 N/A MET 287.A N ASP 291.A O no hydrogen 2.750 N/A GLU 288.A N ASN 327.A O no hydrogen 2.870 N/A LEU 290.A N MET 287.A O no hydrogen 3.019 N/A LEU 293.A N ALA 285.A O no hydrogen 2.994 N/A LYS 295.A N VAL 283.A O no hydrogen 3.336 N/A LYS 295.A NZ GLU 318.A OE1 no hydrogen 2.776 N/A PHE 299.A N MET 279.A O no hydrogen 3.013 N/A ILE 303.A N PRO 278.A O no hydrogen 2.931 N/A SER 304.A N ASN 307.A OD1 no hydrogen 2.970 N/A ASN 307.A N SER 304.A O no hydrogen 3.154 N/A ALA 308.A N ILE 305.A O no hydrogen 2.967 N/A TYR 309.A N ILE 305.A O no hydrogen 3.302 N/A ALA 312.A N ALA 308.A O no hydrogen 2.631 N/A GLU 313.A N TYR 309.A O no hydrogen 2.848 N/A ASP 314.A N LYS 310.A O no hydrogen 3.207 N/A LEU 316.A N ALA 312.A O no hydrogen 3.302 N/A ARG 317.A N GLU 313.A O no hydrogen 2.639 N/A ARG 317.A NH1 ASP 314.A OD1 no hydrogen 3.310 N/A GLU 318.A N LEU 315.A O no hydrogen 3.262 N/A LEU 319.A N LEU 315.A O no hydrogen 2.902 N/A LEU 320.A N LEU 316.A O no hydrogen 2.883 N/A ARG 322.A N GLU 318.A O no hydrogen 2.698 N/A ARG 322.A NH2 SER 294.A O no hydrogen 3.051 N/A ASP 323.A N LEU 320.A O no hydrogen 3.192 N/A LYS 324.A NZ VAL 321.A O no hydrogen 3.071 N/A ARG 326.A N ASP 323.A OD1 no hydrogen 2.847 N/A ARG 326.A NE ASP 323.A OD2 no hydrogen 3.172 N/A ARG 326.A NH1 ASP 289.A OD1 no hydrogen 3.363 N/A ARG 326.A NH1 ASP 289.A OD2 no hydrogen 3.247 N/A ARG 326.A NH2 ASP 323.A OD2 no hydrogen 2.661 N/A ASN 327.A ND2 ASN 252.A O no hydrogen 3.367 N/A VAL 328.A N THR 253.A O no hydrogen 2.802 N/A ARG 329.A N ILE 286.A O no hydrogen 2.697 N/A ARG 330.A N ILE 286.A O no hydrogen 2.990 N/A ILE 331.A N LEU 247.A O no hydrogen 3.062 N/A GLY 332.A N ILE 284.A O no hydrogen 2.698 N/A VAL 333.A N ARG 245.A O no hydrogen 2.943 N/A LYS 334.A N THR 282.A O no hydrogen 2.773 N/A LEU 335.A N HIS 243.A O no hydrogen 2.760 N/A ASP 336.A N ARG 280.A O no hydrogen 3.002 N/A ILE 338.A N SER 239.A O no hydrogen 3.039 N/A ILE 339.A N ILE 277.A O no hydrogen 3.043 N/A ILE 340.A N ASN 237.A O no hydrogen 2.849 N/A