Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 2fr8_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): MET 1.A N GLY 30.A O no hydrogen 3.236 N/A LYS 2.A N ASP 69.A OD2 no hydrogen 2.795 N/A LYS 2.A NZ GLU 32.A OE1 no hydrogen 3.310 N/A ILE 3.A N GLU 32.A O no hydrogen 2.754 N/A ALA 4.A N VAL 70.A O no hydrogen 2.971 N/A ILE 5.A N ILE 34.A O no hydrogen 2.939 N/A LYS 7.A N GLU 36.A OE1 no hydrogen 2.887 N/A LYS 7.A NZ GLU 8.A O no hydrogen 3.211 N/A ARG 9.A NH2 GLU 36.A OE2 no hydrogen 2.937 N/A ARG 10.A NH1 ARG 76.A O no hydrogen 2.857 N/A GLU 13.A N ARG 10.A O no hydrogen 3.070 N/A ASP 14.A N SER 300.A OG no hydrogen 2.855 N/A ARG 15.A N GLU 13.A OE2 no hydrogen 2.685 N/A ARG 15.A NE GLU 13.A OE1 no hydrogen 3.490 N/A ARG 15.A NE GLU 13.A OE2 no hydrogen 3.163 N/A ARG 15.A NH1 GLN 140.A OE1 no hydrogen 3.000 N/A ARG 15.A NH2 GLU 13.A OE1 no hydrogen 2.973 N/A VAL 16.A N SER 307.A OG no hydrogen 2.797 N/A VAL 23.A N SER 19.A O no hydrogen 3.133 N/A LYS 24.A N PRO 20.A O no hydrogen 3.376 N/A LYS 25.A N GLU 21.A O no hydrogen 3.257 N/A LEU 26.A N VAL 22.A O no hydrogen 2.959 N/A VAL 27.A N VAL 23.A O no hydrogen 2.983 N/A GLY 28.A N LYS 24.A O no hydrogen 3.272 N/A LEU 29.A N LYS 25.A O no hydrogen 3.139 N/A GLY 30.A N VAL 27.A O no hydrogen 2.893 N/A PHE 31.A N LEU 26.A O no hydrogen 3.164 N/A GLU 32.A N MET 1.A O no hydrogen 2.942 N/A ILE 34.A N ILE 3.A O no hydrogen 2.576 N/A VAL 35.A N THR 56.A O no hydrogen 2.884 N/A GLU 36.A N ILE 5.A O no hydrogen 3.116 N/A GLN 37.A N ALA 58.A O no hydrogen 2.820 N/A GLY 38.A N ASP 47.A OD1 no hydrogen 3.025 N/A GLY 38.A N ASP 47.A OD2 no hydrogen 3.181 N/A ALA 39.A N GLU 36.A O no hydrogen 3.159 N/A VAL 41.A N GLY 38.A O no hydrogen 3.305 N/A SER 44.A N VAL 41.A O no hydrogen 3.166 N/A ILE 45.A N GLY 40.A O no hydrogen 2.659 N/A ALA 49.A N THR 46.A OG1 no hydrogen 2.966 N/A LEU 50.A N THR 46.A O no hydrogen 3.305 N/A LEU 50.A N ASP 47.A O no hydrogen 3.199 N/A THR 51.A N ASP 47.A O no hydrogen 3.013 N/A THR 51.A OG1 ASP 47.A O no hydrogen 3.429 N/A THR 51.A OG1 ASP 48.A O no hydrogen 2.723 N/A ALA 52.A N ASP 48.A O no hydrogen 2.935 N/A ALA 53.A N ALA 49.A O no hydrogen 3.304 N/A GLY 54.A N LEU 50.A O no hydrogen 3.008 N/A GLY 54.A N THR 51.A O no hydrogen 2.916 N/A ALA 55.A N LEU 50.A O no hydrogen 2.875 N/A THR 56.A N VAL 33.A O no hydrogen 2.527 N/A ALA 58.A N VAL 35.A O no hydrogen 3.014 N/A SER 59.A N GLN 63.A OE1 no hydrogen 2.754 N/A ALA 64.A N THR 60.A O no hydrogen 3.207 N/A LEU 65.A N ALA 61.A O no hydrogen 3.023 N/A SER 66.A N ALA 62.A O no hydrogen 2.677 N/A SER 66.A OG GLN 63.A O no hydrogen 2.757 N/A ALA 68.A N LEU 65.A O no hydrogen 3.141 N/A ASP 69.A N LYS 2.A O no hydrogen 2.883 N/A VAL 70.A N LYS 2.A O no hydrogen 3.160 N/A VAL 71.A N VAL 95.A O no hydrogen 2.881 N/A TRP 72.A N ALA 4.A O no hydrogen 2.857 N/A LYS 73.A N MET 97.A O no hydrogen 3.201 N/A LYS 73.A NZ GLU 8.A OE2 no hydrogen 3.283 N/A LYS 73.A NZ GLU 86.A OE2 no hydrogen 3.315 N/A VAL 74.A N GLU 8.A OE2 no hydrogen 2.869 N/A GLN 75.A N GLU 8.A OE1 no hydrogen 3.089 N/A ARG 76.A NH1 GLU 82.A OE2 no hydrogen 3.276 N/A MET 78.A N GLU 86.A OE1 no hydrogen 2.642 N/A THR 79.A N GLU 82.A OE1 no hydrogen 2.704 N/A THR 79.A OG1 GLU 82.A OE1 no hydrogen 2.811 N/A GLU 82.A N THR 79.A O no hydrogen 3.098 N/A GLY 83.A N ALA 80.A O no hydrogen 3.247 N/A GLU 86.A N MET 78.A O no hydrogen 2.676 N/A VAL 87.A N MET 78.A O no hydrogen 3.441 N/A ALA 88.A N ASP 85.A OD1 no hydrogen 2.976 N/A LEU 89.A N GLU 86.A O no hydrogen 3.056 N/A ILE 90.A N VAL 87.A O no hydrogen 3.306 N/A LYS 91.A NZ GLN 67.A O no hydrogen 2.961 N/A LYS 91.A NZ ASP 69.A OD1 no hydrogen 2.959 N/A GLY 93.A N ARG 115.A O no hydrogen 3.469 N/A ALA 94.A N LYS 91.A O no hydrogen 3.231 N/A VAL 95.A N ASP 69.A O no hydrogen 2.927 N/A LEU 96.A N THR 118.A O no hydrogen 2.876 N/A MET 97.A N VAL 71.A O no hydrogen 3.017 N/A CYS 98.A N TYR 120.A O no hydrogen 3.477 N/A CYS 98.A SG GLN 75.A O no hydrogen 3.989 N/A HIS 99.A N VAL 74.A O no hydrogen 2.799 N/A LEU 100.A N GLU 123.A OE1 no hydrogen 3.007 N/A ALA 102.A N GLU 123.A OE2 no hydrogen 2.860 N/A THR 104.A N GLY 101.A O no hydrogen 3.139 N/A THR 104.A OG1 GLY 101.A O no hydrogen 3.251 N/A ASN 105.A N ALA 102.A O no hydrogen 3.251 N/A ASN 105.A ND2 LEU 100.A O no hydrogen 3.630 N/A ASN 105.A ND2 GLY 101.A O no hydrogen 2.625 N/A ARG 106.A NH1 GLU 110.A OE2 no hydrogen 3.205 N/A ARG 106.A NH2 ALA 353.A O no hydrogen 3.566 N/A GLU 110.A N ARG 106.A O no hydrogen 3.105 N/A ALA 111.A N PRO 107.A O no hydrogen 3.131 N/A LEU 112.A N VAL 108.A O no hydrogen 3.083 N/A THR 113.A N VAL 109.A O no hydrogen 2.933 N/A THR 113.A OG1 VAL 109.A O no hydrogen 2.682 N/A THR 113.A OG1 THR 344.A OG1 no hydrogen 2.652 N/A LYS 114.A N GLU 110.A O no hydrogen 2.622 N/A ARG 115.A N LEU 112.A O no hydrogen 3.033 N/A ARG 115.A NE ILE 90.A O no hydrogen 3.284 N/A ARG 115.A NH2 ILE 90.A O no hydrogen 3.116 N/A LYS 116.A N THR 113.A O no hydrogen 2.873 N/A ILE 117.A N LEU 112.A O no hydrogen 3.019 N/A THR 118.A N ALA 94.A O no hydrogen 3.185 N/A TYR 120.A N LEU 96.A O no hydrogen 2.690 N/A ALA 121.A N THR 341.A O no hydrogen 2.755 N/A MET 122.A N CYS 98.A O no hydrogen 3.068 N/A GLU 123.A N GLU 123.A OE1 no hydrogen 2.834 N/A LEU 124.A N ALA 121.A O no hydrogen 3.029 N/A MET 125.A N MET 122.A O no hydrogen 3.273 N/A ILE 128.A N PRO 126.A O no hydrogen 2.943 N/A GLN 132.A N SER 129.A O no hydrogen 3.389 N/A GLN 132.A NE2 ILE 128.A O no hydrogen 2.591 N/A SER 133.A OG ARG 130.A O no hydrogen 3.259 N/A MET 134.A N ALA 131.A O no hydrogen 3.227 N/A ASP 135.A N GLN 132.A O no hydrogen 3.080 N/A SER 138.A N ASP 135.A OD2 no hydrogen 2.933 N/A SER 138.A OG ASP 135.A O no hydrogen 3.245 N/A SER 138.A OG ASP 135.A OD2 no hydrogen 3.033 N/A SER 139.A N ASP 135.A O no hydrogen 3.370 N/A SER 139.A OG ASP 135.A O no hydrogen 3.338 N/A SER 139.A OG ILE 136.A O no hydrogen 2.870 N/A GLN 140.A N ILE 136.A O no hydrogen 2.978 N/A GLN 140.A NE2 ALA 306.A O no hydrogen 2.601 N/A SER 141.A N LEU 137.A O no hydrogen 2.725 N/A SER 141.A OG LEU 137.A O no hydrogen 2.524 N/A SER 141.A OG SER 138.A O no hydrogen 3.179 N/A ASN 142.A N SER 138.A O no hydrogen 2.692 N/A ALA 144.A N GLN 140.A O no hydrogen 3.128 N/A GLY 145.A N SER 141.A O no hydrogen 3.034 N/A TYR 146.A N ASN 142.A O no hydrogen 3.352 N/A ARG 147.A N LEU 143.A O no hydrogen 2.786 N/A ARG 147.A NE ASP 151.A OD1 no hydrogen 3.105 N/A ARG 147.A NH2 ASP 151.A OD1 no hydrogen 3.371 N/A ALA 148.A N ALA 144.A O no hydrogen 2.796 N/A VAL 149.A N TYR 146.A O no hydrogen 3.138 N/A ILE 150.A N TYR 146.A O no hydrogen 3.267 N/A ASP 151.A N ARG 147.A O no hydrogen 2.838 N/A GLY 152.A N ALA 148.A O no hydrogen 3.313 N/A ALA 153.A N VAL 149.A O no hydrogen 2.912 N/A TYR 154.A N ILE 150.A O no hydrogen 3.131 N/A GLU 155.A N ASP 151.A O no hydrogen 3.065 N/A PHE 156.A N GLY 152.A O no hydrogen 2.843 N/A MET 163.A N VAL 170.A O no hydrogen 2.841 N/A THR 165.A OG1 MET 163.A O no hydrogen 3.411 N/A GLY 168.A N THR 165.A O no hydrogen 2.834 N/A VAL 170.A N MET 163.A O no hydrogen 2.629 N/A ALA 173.A N PHE 160.A O no hydrogen 2.762 N/A ARG 174.A N ASP 234.A OD2 no hydrogen 2.760 N/A ARG 174.A NH1 GLU 229.A OE2 no hydrogen 3.356 N/A VAL 175.A N VAL 197.A O no hydrogen 2.884 N/A LEU 176.A N ILE 235.A O no hydrogen 2.858 N/A VAL 177.A N MET 199.A O no hydrogen 2.862 N/A PHE 178.A N ILE 237.A O no hydrogen 2.625 N/A GLY 179.A N THR 201.A O no hydrogen 2.820 N/A LEU 185.A N GLY 181.A O no hydrogen 3.220 N/A GLN 186.A N VAL 182.A O no hydrogen 3.059 N/A GLN 186.A NE2 THR 190.A OG1 no hydrogen 2.679 N/A ALA 187.A N ALA 183.A O no hydrogen 2.859 N/A ILE 188.A N GLY 184.A O no hydrogen 2.993 N/A ALA 189.A N LEU 185.A O no hydrogen 3.228 N/A THR 190.A N GLN 186.A O no hydrogen 3.151 N/A THR 190.A OG1 GLN 186.A O no hydrogen 2.855 N/A ALA 191.A N ALA 187.A O no hydrogen 2.926 N/A LYS 192.A N ILE 188.A O no hydrogen 2.994 N/A LYS 192.A NZ ALA 196.A O no hydrogen 3.570 N/A ARG 193.A N ALA 189.A O no hydrogen 2.900 N/A LEU 194.A N THR 190.A O no hydrogen 3.071 N/A GLY 195.A N ALA 191.A O no hydrogen 3.189 N/A GLY 195.A N LYS 192.A O no hydrogen 3.098 N/A ALA 196.A N ALA 191.A O no hydrogen 3.160 N/A VAL 197.A N ALA 173.A O no hydrogen 2.931 N/A MET 199.A N VAL 175.A O no hydrogen 2.787 N/A ALA 200.A N LYS 217.A O no hydrogen 3.026 N/A THR 201.A N VAL 177.A O no hydrogen 3.234 N/A THR 207.A N ARG 204.A O no hydrogen 3.370 N/A THR 207.A OG1 ARG 204.A O no hydrogen 2.629 N/A VAL 211.A N THR 207.A O no hydrogen 3.199 N/A GLU 212.A N LYS 208.A O no hydrogen 2.714 N/A SER 213.A N GLU 209.A O no hydrogen 2.596 N/A SER 213.A OG GLU 209.A O no hydrogen 2.511 N/A LEU 214.A N GLN 210.A O no hydrogen 3.204 N/A GLY 215.A N GLU 212.A O no hydrogen 2.900 N/A GLY 216.A N VAL 211.A O no hydrogen 2.908 N/A LYS 217.A N VAL 198.A O no hydrogen 3.044 N/A ILE 219.A N ALA 200.A O no hydrogen 2.760 N/A THR 220.A OG1 THR 220.A O no hydrogen 2.629 N/A ALA 225.A N GLN 222.A O no hydrogen 3.133 N/A VAL 226.A N ALA 223.A O no hydrogen 3.185 N/A LYS 228.A N GLU 224.A O no hydrogen 3.366 N/A GLU 229.A N VAL 226.A O no hydrogen 2.792 N/A LEU 230.A N VAL 226.A O no hydrogen 2.528 N/A LYS 232.A N GLU 229.A O no hydrogen 2.853 N/A THR 233.A N LEU 230.A O no hydrogen 3.119 N/A THR 233.A OG1 GLU 229.A O no hydrogen 2.990 N/A THR 233.A OG1 GLU 229.A OE1 no hydrogen 2.920 N/A ASP 234.A N ARG 174.A O no hydrogen 2.724 N/A ILE 235.A N ARG 174.A O no hydrogen 3.128 N/A ALA 236.A N VAL 264.A O no hydrogen 2.960 N/A ILE 237.A N LEU 176.A O no hydrogen 2.973 N/A THR 238.A N ILE 266.A O no hydrogen 3.042 N/A THR 238.A OG1 ASN 275.A OD1 no hydrogen 2.761 N/A THR 239.A N PHE 178.A O no hydrogen 3.021 N/A THR 239.A OG1 PHE 178.A O no hydrogen 3.318 N/A THR 239.A OG1 GLY 179.A O no hydrogen 2.769 N/A ALA 240.A N ASN 275.A OD1 no hydrogen 3.245 N/A ALA 247.A N ALA 272.A O no hydrogen 2.631 N/A LEU 250.A N ASN 275.A O no hydrogen 3.131 N/A ILE 251.A N ASN 275.A O no hydrogen 3.087 N/A MET 255.A N THR 252.A O no hydrogen 3.184 N/A VAL 256.A N THR 252.A O no hydrogen 3.304 N/A THR 257.A N GLU 253.A O no hydrogen 3.228 N/A THR 257.A OG1 GLU 253.A O no hydrogen 3.381 N/A LYS 258.A N MET 255.A O no hydrogen 3.009 N/A MET 259.A N VAL 256.A O no hydrogen 3.151 N/A LYS 260.A NZ LYS 232.A O no hydrogen 3.567 N/A LYS 260.A NZ ASP 234.A OD1 no hydrogen 2.785 N/A GLY 262.A N GLY 289.A O no hydrogen 3.129 N/A SER 263.A OG THR 233.A O no hydrogen 3.131 N/A SER 263.A OG ASP 234.A O no hydrogen 2.996 N/A VAL 264.A N ASP 234.A O no hydrogen 2.814 N/A ILE 265.A N LYS 291.A O no hydrogen 2.762 N/A ILE 266.A N ALA 236.A O no hydrogen 2.923 N/A ASP 267.A N VAL 293.A O no hydrogen 2.949 N/A LEU 268.A N THR 238.A O no hydrogen 2.997 N/A ALA 269.A N ASP 267.A OD1 no hydrogen 3.114 N/A VAL 270.A N ASP 267.A O no hydrogen 3.238 N/A ALA 272.A N ALA 269.A O no hydrogen 2.748 N/A GLY 274.A N ALA 269.A O no hydrogen 2.828 N/A ASN 275.A N ASP 267.A OD1 no hydrogen 3.060 N/A ASN 275.A ND2 ALA 240.A O no hydrogen 3.066 N/A ASN 275.A ND2 PRO 248.A O no hydrogen 2.796 N/A CYS 276.A N ASP 267.A OD2 no hydrogen 3.137 N/A CYS 276.A SG ILE 251.A O no hydrogen 3.783 N/A SER 279.A N CYS 276.A O no hydrogen 3.153 N/A SER 279.A OG ASP 267.A OD2 no hydrogen 2.554 N/A SER 279.A OG CYS 276.A O no hydrogen 2.752 N/A GLY 282.A N GLY 294.A O no hydrogen 2.689 N/A LYS 283.A N GLU 280.A O no hydrogen 3.329 N/A VAL 285.A N ILE 292.A O no hydrogen 2.907 N/A LYS 287.A N VAL 290.A O no hydrogen 2.786 N/A VAL 290.A N LYS 287.A O no hydrogen 2.772 N/A LYS 291.A N SER 263.A O no hydrogen 3.195 N/A LYS 291.A NZ GLU 155.A O no hydrogen 3.208 N/A LYS 291.A NZ GLU 155.A OE1 no hydrogen 2.796 N/A ILE 292.A N VAL 285.A O no hydrogen 2.624 N/A VAL 293.A N ILE 265.A O no hydrogen 2.642 N/A GLY 294.A N LYS 283.A O no hydrogen 3.110 N/A ASN 297.A N GLU 271.A OE1 no hydrogen 3.145 N/A ASN 297.A ND2 GLU 13.A OE1 no hydrogen 2.559 N/A SER 300.A OG GLY 12.A O no hydrogen 2.898 N/A ARG 301.A N VAL 298.A O no hydrogen 2.820 N/A ARG 301.A NE ASP 151.A OD2 no hydrogen 3.368 N/A VAL 302.A N PRO 299.A O no hydrogen 3.130 N/A ASP 305.A N VAL 302.A O no hydrogen 2.863 N/A ALA 306.A N VAL 302.A O no hydrogen 2.669 N/A SER 307.A N ALA 303.A O no hydrogen 2.858 N/A SER 307.A OG VAL 16.A O no hydrogen 3.255 N/A SER 307.A OG ALA 303.A O no hydrogen 3.087 N/A PHE 310.A N ALA 306.A O no hydrogen 3.087 N/A ALA 311.A N SER 307.A O no hydrogen 2.962 N/A LYS 312.A N PRO 308.A O no hydrogen 3.265 N/A LYS 312.A NZ GLU 21.A OE1 no hydrogen 3.009 N/A LYS 312.A NZ GLU 21.A OE2 no hydrogen 3.519 N/A ASN 313.A N LEU 309.A O no hydrogen 2.940 N/A ASN 313.A ND2 SER 139.A OG no hydrogen 2.760 N/A LEU 314.A N PHE 310.A O no hydrogen 3.304 N/A LEU 315.A N ALA 311.A O no hydrogen 3.018 N/A ASN 316.A N LYS 312.A O no hydrogen 2.674 N/A ASN 316.A ND2 SER 133.A O no hydrogen 2.595 N/A PHE 317.A N ASN 313.A O no hydrogen 2.873 N/A LEU 318.A N LEU 314.A O no hydrogen 2.821 N/A THR 319.A N LEU 315.A O no hydrogen 2.867 N/A THR 319.A OG1 LEU 315.A O no hydrogen 2.678 N/A HIS 321.A N LEU 318.A O no hydrogen 2.814 N/A HIS 321.A ND1 PHE 317.A O no hydrogen 3.173 N/A VAL 322.A N THR 319.A O no hydrogen 3.024 N/A ASP 323.A N THR 328.A O no hydrogen 3.508 N/A THR 326.A OG1 LYS 324.A O no hydrogen 3.431 N/A VAL 330.A N HIS 321.A O no hydrogen 3.227 N/A LYS 332.A NZ PRO 320.A O no hydrogen 3.205 N/A GLU 334.A N GLU 334.A OE1 no hydrogen 2.731 N/A ASP 335.A N LYS 332.A O no hydrogen 3.305 N/A THR 337.A N ASP 335.A OD1 no hydrogen 2.775 N/A THR 337.A OG1 ASP 335.A OD1 no hydrogen 2.680 N/A SER 339.A N ASP 335.A O no hydrogen 2.953 N/A GLY 340.A N GLU 336.A O no hydrogen 3.050 N/A THR 341.A N VAL 338.A O no hydrogen 3.117 N/A THR 341.A OG1 THR 337.A O no hydrogen 3.065 N/A THR 341.A OG1 VAL 338.A O no hydrogen 3.529 N/A CYS 342.A N VAL 338.A O no hydrogen 2.996 N/A CYS 342.A SG THR 344.A O no hydrogen 3.302 N/A VAL 343.A N ALA 119.A O no hydrogen 3.133 N/A THR 344.A OG1 THR 113.A OG1 no hydrogen 2.652 N/A THR 344.A OG1 ALA 348.A O no hydrogen 3.172 N/A ARG 345.A N ALA 348.A O no hydrogen 2.768 N/A ALA 348.A N ARG 345.A O no hydrogen 2.790 N/A