Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3qbx_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): PRO 1.A N GLN 22.A O no hydrogen 2.946 N/A TYR 3.A N ILE 20.A O no hydrogen 3.087 N/A LEU 4.A N ALA 89.A O no hydrogen 2.986 N/A GLY 5.A N VAL 18.A O no hydrogen 2.824 N/A LEU 6.A N GLY 91.A O no hydrogen 2.769 N/A MET 7.A N ASP 16.A O no hydrogen 2.927 N/A SER 8.A OG GLN 95.A OE1 no hydrogen 2.765 N/A SER 11.A OG ASP 13.A OD1 no hydrogen 2.721 N/A MET 15.A N LEU 34.A O no hydrogen 2.848 N/A ASP 16.A N MET 7.A O no hydrogen 2.709 N/A ILE 17.A N HIS 32.A O no hydrogen 2.833 N/A VAL 18.A N GLY 5.A O no hydrogen 2.937 N/A LEU 19.A N ALA 30.A O no hydrogen 2.726 N/A ILE 20.A N TYR 3.A O no hydrogen 2.908 N/A GLU 21.A N THR 27.A O no hydrogen 2.749 N/A GLN 22.A N PRO 1.A O no hydrogen 3.004 N/A GLN 22.A NE2 GLY 23.A O no hydrogen 3.403 N/A GLY 23.A N ARG 25.A O no hydrogen 3.170 N/A THR 26.A OG1 GLN 22.A OE1 no hydrogen 2.652 N/A THR 27.A N GLU 21.A O no hydrogen 2.951 N/A LEU 29.A N LEU 19.A O no hydrogen 2.764 N/A ALA 30.A N LEU 19.A O no hydrogen 3.238 N/A HIS 32.A N ILE 17.A O no hydrogen 2.738 N/A HIS 32.A NE2 GLU 75.A OE1 no hydrogen 2.721 N/A TYR 33.A OH ASP 13.A OD2 no hydrogen 2.786 N/A LEU 34.A N MET 15.A O no hydrogen 3.169 N/A MET 36.A N ASP 13.A O no hydrogen 2.712 N/A ARG 41.A N PRO 37.A O no hydrogen 3.095 N/A GLU 42.A N ALA 38.A O no hydrogen 2.947 N/A ASP 43.A N GLY 39.A O no hydrogen 2.973 N/A ILE 44.A N LEU 40.A O no hydrogen 2.884 N/A LEU 45.A N ARG 41.A O no hydrogen 2.970 N/A ALA 46.A N GLU 42.A O no hydrogen 2.942 N/A LEU 47.A N ILE 44.A O no hydrogen 2.921 N/A CYS 48.A N LEU 45.A O no hydrogen 3.047 N/A CYS 48.A SG ILE 44.A O no hydrogen 3.451 N/A CYS 48.A SG THR 96.A O no hydrogen 4.040 N/A CYS 48.A SG ILE 97.A O no hydrogen 3.774 N/A GLY 51.A N GLU 54.A OE2 no hydrogen 2.758 N/A ARG 57.A N ASP 53.A O no hydrogen 3.141 N/A ARG 57.A NH1 PRO 52.A O no hydrogen 2.767 N/A ALA 58.A N GLU 54.A O no hydrogen 2.814 N/A ALA 59.A N ILE 55.A O no hydrogen 3.017 N/A GLU 60.A N ALA 56.A O no hydrogen 3.106 N/A VAL 61.A N ARG 57.A O no hydrogen 2.996 N/A GLU 62.A N ALA 58.A O no hydrogen 2.917 N/A GLN 63.A N ALA 59.A O no hydrogen 3.344 N/A ARG 64.A N GLU 60.A O no hydrogen 3.346 N/A ARG 64.A NH1 ASP 43.A OD2 no hydrogen 3.379 N/A ARG 64.A NH2 ASP 43.A OD2 no hydrogen 2.533 N/A TRP 65.A N VAL 61.A O no hydrogen 2.932 N/A VAL 66.A N GLU 62.A O no hydrogen 2.851 N/A ALA 67.A N GLN 63.A O no hydrogen 3.018 N/A LEU 68.A N ARG 64.A O no hydrogen 2.985 N/A ALA 69.A N TRP 65.A O no hydrogen 2.984 N/A ALA 70.A N VAL 66.A O no hydrogen 2.828 N/A GLN 71.A N ALA 67.A O no hydrogen 3.001 N/A GLN 71.A NE2 GLU 75.A OE2 no hydrogen 3.475 N/A GLY 72.A N LEU 68.A O no hydrogen 2.989 N/A VAL 73.A N ALA 69.A O no hydrogen 2.858 N/A ARG 74.A N ALA 70.A O no hydrogen 2.940 N/A GLU 75.A N GLN 71.A O no hydrogen 3.083 N/A LEU 76.A N GLY 72.A O no hydrogen 3.052 N/A LEU 77.A N VAL 73.A O no hydrogen 3.077 N/A LEU 78.A N ARG 74.A O no hydrogen 3.071 N/A GLN 79.A N GLU 75.A O no hydrogen 3.036 N/A GLN 80.A N LEU 76.A O no hydrogen 2.960 N/A GLN 81.A N LEU 78.A O no hydrogen 3.119 N/A MET 82.A N LEU 77.A O no hydrogen 2.903 N/A SER 83.A N GLU 86.A OE2 no hydrogen 3.489 N/A SER 83.A OG ASP 85.A OD2 no hydrogen 3.137 N/A ASP 85.A N SER 83.A OG no hydrogen 3.215 N/A GLU 86.A N SER 83.A O no hydrogen 3.039 N/A VAL 87.A N PRO 84.A O no hydrogen 3.220 N/A ARG 88.A N ARG 2.A O no hydrogen 2.859 N/A ARG 88.A NH1 TYR 3.A OH no hydrogen 2.612 N/A ARG 88.A NH1 GLU 329.A OE2 no hydrogen 3.064 N/A ILE 90.A N ASP 122.A O no hydrogen 2.826 N/A GLY 91.A N LEU 4.A O no hydrogen 2.743 N/A SER 92.A N VAL 124.A O no hydrogen 2.833 N/A HIS 93.A N LEU 6.A O no hydrogen 3.086 N/A HIS 93.A NE2 THR 96.A OG1 no hydrogen 3.178 N/A GLN 95.A N ILE 109.A O no hydrogen 2.766 N/A GLN 95.A NE2 GLY 9.A O no hydrogen 3.342 N/A THR 96.A OG1 HIS 93.A NE2 no hydrogen 3.178 N/A THR 96.A OG1 GLN 108.A OE1 no hydrogen 3.153 N/A ILE 97.A N VAL 107.A O no hydrogen 2.880 N/A ARG 98.A NE LEU 47.A O no hydrogen 3.382 N/A ARG 98.A NE ILE 97.A O no hydrogen 3.050 N/A ARG 98.A NH2 LEU 47.A O no hydrogen 2.758 N/A ARG 98.A NH2 GLU 54.A OE2 no hydrogen 2.949 N/A HIS 99.A N GLU 234.A OE2 no hydrogen 2.768 N/A HIS 99.A ND1 THR 106.A OG1 no hydrogen 2.791 N/A HIS 99.A NE2 SER 230.A OG no hydrogen 2.749 N/A GLU 100.A N PHE 105.A O no hydrogen 2.884 N/A ARG 103.A N GLU 100.A O no hydrogen 2.763 N/A HIS 104.A N PRO 101.A O no hydrogen 2.899 N/A PHE 105.A N GLU 100.A O no hydrogen 3.315 N/A THR 106.A OG1 ARG 98.A O no hydrogen 3.540 N/A THR 106.A OG1 HIS 99.A ND1 no hydrogen 2.791 N/A THR 106.A OG1 GLN 108.A OE1 no hydrogen 2.873 N/A VAL 107.A N ARG 98.A O no hydrogen 2.750 N/A ILE 109.A N GLN 95.A O no hydrogen 2.822 N/A GLY 110.A N GLU 62.A OE2 no hydrogen 2.709 N/A ASN 111.A N GLU 62.A OE2 no hydrogen 2.651 N/A LEU 114.A N ASN 111.A OD1 no hydrogen 3.315 N/A LEU 115.A N ASN 111.A O no hydrogen 3.017 N/A ALA 116.A N PRO 112.A O no hydrogen 2.924 N/A GLU 117.A N ALA 113.A O no hydrogen 3.035 N/A LEU 118.A N LEU 114.A O no hydrogen 2.872 N/A THR 119.A N LEU 115.A O no hydrogen 2.928 N/A THR 119.A OG1 LEU 115.A O no hydrogen 2.761 N/A THR 119.A OG1 ILE 121.A O no hydrogen 3.344 N/A GLY 120.A N ALA 116.A O no hydrogen 2.809 N/A ILE 121.A N THR 119.A OG1 no hydrogen 3.164 N/A VAL 123.A N TYR 351.A O no hydrogen 2.901 N/A VAL 124.A N ILE 90.A O no hydrogen 2.742 N/A ALA 125.A N ALA 349.A O no hydrogen 3.032 N/A ARG 128.A NH1 GLY 138.A O no hydrogen 2.888 N/A VAL 132.A N ARG 128.A O no hydrogen 3.169 N/A ALA 133.A N ARG 129.A O no hydrogen 2.818 N/A ALA 134.A N ARG 130.A O no hydrogen 2.965 N/A ALA 134.A N ASP 131.A O no hydrogen 3.196 N/A GLY 135.A N VAL 132.A O no hydrogen 2.930 N/A GLY 136.A N ASP 131.A O no hydrogen 2.765 N/A GLN 137.A N THR 339.A O no hydrogen 2.881 N/A GLN 137.A NE2 SER 230.A OG no hydrogen 2.795 N/A GLY 138.A N ASP 131.A OD2 no hydrogen 2.804 N/A PHE 145.A N VAL 142.A O no hydrogen 2.701 N/A HIS 146.A N VAL 142.A O no hydrogen 2.867 N/A HIS 146.A ND1 SER 165.A OG no hydrogen 2.705 N/A GLN 147.A N PRO 143.A O no hydrogen 2.761 N/A ALA 148.A N ALA 144.A O no hydrogen 3.025 N/A LEU 149.A N PHE 145.A O no hydrogen 3.004 N/A PHE 150.A N HIS 146.A O no hydrogen 2.891 N/A GLY 151.A N GLN 147.A O no hydrogen 3.028 N/A ARG 153.A N LEU 167.A O no hydrogen 3.338 N/A ARG 153.A NH1 PHE 150.A O no hydrogen 3.055 N/A ARG 153.A NH2 GLU 276.A OE2 no hydrogen 2.631 N/A ALA 154.A N GLU 276.A O no hydrogen 2.810 N/A VAL 155.A N SER 165.A O no hydrogen 2.815 N/A LEU 156.A N LEU 278.A O no hydrogen 2.820 N/A ASN 157.A N ASN 163.A O no hydrogen 2.824 N/A ILE 158.A N CYS 280.A O no hydrogen 2.820 N/A GLY 159.A N PHE 161.A O no hydrogen 3.147 N/A SER 162.A N GLY 179.A O no hydrogen 2.779 N/A ASN 163.A N ASN 157.A O no hydrogen 3.006 N/A VAL 164.A N PHE 176.A O no hydrogen 2.943 N/A SER 165.A N VAL 155.A O no hydrogen 2.795 N/A SER 165.A OG HIS 146.A ND1 no hydrogen 2.705 N/A LEU 166.A N ARG 174.A O no hydrogen 2.854 N/A LEU 167.A N ARG 153.A O no hydrogen 2.907 N/A LYS 171.A N SER 168.A O no hydrogen 3.168 N/A ARG 174.A N LEU 166.A O no hydrogen 3.342 N/A ARG 174.A NH1 ALA 270.A O no hydrogen 3.053 N/A ARG 174.A NH2 SER 168.A OG no hydrogen 3.320 N/A ARG 174.A NH2 ALA 270.A O no hydrogen 3.484 N/A PHE 176.A N VAL 164.A O no hydrogen 3.262 N/A ASP 177.A N LYS 229.A O no hydrogen 2.969 N/A CYS 178.A N SER 162.A O no hydrogen 2.870 N/A CYS 178.A SG SER 266.A OG no hydrogen 3.558 N/A GLY 181.A N GLY 160.A O no hydrogen 2.836 N/A ASN 182.A N GLY 159.A O no hydrogen 2.785 N/A VAL 183.A N GLY 160.A O no hydrogen 2.880 N/A ASP 186.A N ASN 182.A O no hydrogen 2.825 N/A ALA 187.A N VAL 183.A O no hydrogen 3.025 N/A TRP 188.A N LEU 184.A O no hydrogen 2.831 N/A TRP 188.A NE1 ALA 248.A O no hydrogen 2.904 N/A ILE 189.A N MET 185.A O no hydrogen 3.200 N/A HIS 190.A N ASP 186.A O no hydrogen 2.942 N/A HIS 191.A N ALA 187.A O no hydrogen 3.036 N/A GLN 192.A N TRP 188.A O no hydrogen 3.005 N/A ARG 193.A N ILE 189.A O no hydrogen 2.828 N/A GLY 194.A N HIS 190.A O no hydrogen 3.200 N/A GLY 201.A N ASP 198.A O no hydrogen 2.919 N/A ALA 202.A N ARG 199.A O no hydrogen 3.130 N/A TRP 203.A N ASP 198.A OD1 no hydrogen 2.853 N/A ALA 204.A N ASP 198.A OD2 no hydrogen 3.039 N/A ALA 205.A N GLY 201.A O no hydrogen 2.844 N/A SER 206.A N ALA 202.A O no hydrogen 3.010 N/A SER 206.A N TRP 203.A O no hydrogen 3.218 N/A SER 206.A OG TRP 203.A O no hydrogen 2.707 N/A GLY 207.A N ALA 204.A O no hydrogen 3.204 N/A GLN 208.A N ASP 250.A OD1 no hydrogen 2.582 N/A ASN 210.A N THR 254.A OG1 no hydrogen 3.102 N/A LEU 213.A N ASN 210.A OD1 no hydrogen 2.868 N/A LEU 214.A N ASN 210.A O no hydrogen 2.952 N/A ALA 215.A N HIS 211.A O no hydrogen 2.986 N/A SER 216.A N ALA 212.A O no hydrogen 3.254 N/A SER 216.A OG ALA 212.A O no hydrogen 3.369 N/A SER 216.A OG LEU 213.A O no hydrogen 2.752 N/A LEU 217.A N LEU 213.A O no hydrogen 2.967 N/A LEU 218.A N LEU 214.A O no hydrogen 2.933 N/A ASP 220.A N LEU 217.A O no hydrogen 3.365 N/A PHE 222.A N ASP 220.A OD2 no hydrogen 3.069 N/A PHE 223.A N ASP 220.A O no hydrogen 3.003 N/A ALA 224.A N GLU 221.A O no hydrogen 3.220 N/A LYS 229.A NZ PHE 222.A O no hydrogen 2.733 N/A LYS 229.A NZ ALA 225.A O no hydrogen 2.783 N/A SER 230.A OG HIS 99.A NE2 no hydrogen 2.749 N/A THR 231.A N ASP 177.A OD2 no hydrogen 2.801 N/A ARG 233.A NH1 THR 10.A O no hydrogen 2.990 N/A ARG 233.A NH2 THR 10.A O no hydrogen 3.002 N/A GLU 234.A N GLU 234.A OE1 no hydrogen 2.900 N/A ARG 235.A N GLY 232.A O no hydrogen 3.224 N/A ARG 235.A NE ASP 220.A OD2 no hydrogen 3.137 N/A PHE 236.A N GLY 232.A O no hydrogen 3.251 N/A ASN 237.A ND2 ARG 233.A O no hydrogen 2.793 N/A ASN 237.A ND2 GLU 234.A O no hydrogen 3.517 N/A TRP 240.A N ASN 237.A OD1 no hydrogen 2.829 N/A TRP 240.A NE1 ASP 220.A OD1 no hydrogen 3.077 N/A LEU 241.A N ASN 237.A O no hydrogen 3.249 N/A GLN 242.A N LEU 238.A O no hydrogen 3.026 N/A GLU 243.A N PRO 239.A O no hydrogen 3.132 N/A HIS 244.A ND1 TRP 240.A O no hydrogen 3.047 N/A LEU 245.A N LEU 241.A O no hydrogen 3.066 N/A ASP 250.A N PRO 247.A O no hydrogen 2.911 N/A ILE 251.A N PRO 247.A O no hydrogen 3.211 N/A GLN 252.A N ALA 248.A O no hydrogen 3.088 N/A GLN 252.A NE2 MET 185.A O no hydrogen 3.107 N/A GLN 252.A NE2 ASP 198.A OD2 no hydrogen 3.459 N/A ALA 253.A N ALA 249.A O no hydrogen 2.933 N/A THR 254.A N ASP 250.A O no hydrogen 2.994 N/A THR 254.A OG1 ASP 250.A O no hydrogen 2.614 N/A LEU 255.A N ILE 251.A O no hydrogen 2.931 N/A LEU 256.A N GLN 252.A O no hydrogen 3.060 N/A GLU 257.A N ALA 253.A O no hydrogen 3.212 N/A LEU 258.A N THR 254.A O no hydrogen 2.784 N/A SER 259.A N LEU 255.A O no hydrogen 3.246 N/A SER 259.A OG PRO 180.A O no hydrogen 3.038 N/A SER 259.A OG GLY 181.A O no hydrogen 2.888 N/A SER 259.A OG LEU 255.A O no hydrogen 3.397 N/A ALA 260.A N LEU 256.A O no hydrogen 2.990 N/A ARG 261.A N GLU 257.A O no hydrogen 2.708 N/A ARG 261.A NE GLU 265.A OE2 no hydrogen 2.694 N/A SER 262.A N LEU 258.A O no hydrogen 2.929 N/A SER 262.A OG LEU 258.A O no hydrogen 2.741 N/A SER 262.A OG SER 259.A O no hydrogen 3.365 N/A ILE 263.A N SER 259.A O no hydrogen 3.136 N/A SER 264.A N ALA 260.A O no hydrogen 2.947 N/A SER 264.A OG ALA 260.A O no hydrogen 2.889 N/A GLU 265.A N ARG 261.A O no hydrogen 2.841 N/A SER 266.A N SER 262.A O no hydrogen 3.219 N/A SER 266.A OG SER 262.A O no hydrogen 3.003 N/A SER 266.A OG ILE 263.A O no hydrogen 3.344 N/A LEU 267.A N ILE 263.A O no hydrogen 2.886 N/A LEU 268.A N SER 264.A O no hydrogen 2.833 N/A ASP 269.A N GLU 265.A O no hydrogen 2.987 N/A ALA 270.A N LEU 267.A O no hydrogen 3.132 N/A GLN 271.A N LEU 267.A O no hydrogen 2.819 N/A GLN 271.A NE2 ARG 153.A O no hydrogen 3.470 N/A GLN 271.A NE2 SER 168.A OG no hydrogen 2.904 N/A CYS 274.A N GLN 271.A O no hydrogen 3.110 N/A CYS 274.A SG GLN 271.A OE1 no hydrogen 3.558 N/A CYS 274.A SG GLU 276.A O no hydrogen 3.471 N/A GLU 275.A N SER 152.A O no hydrogen 3.083 N/A VAL 277.A N ARG 301.A O no hydrogen 2.893 N/A LEU 278.A N ALA 154.A O no hydrogen 2.817 N/A VAL 279.A N ALA 303.A O no hydrogen 2.857 N/A CYS 280.A N LEU 156.A O no hydrogen 2.771 N/A CYS 280.A SG HIS 146.A NE2 no hydrogen 4.012 N/A CYS 280.A SG LEU 156.A O no hydrogen 3.684 N/A GLY 281.A N PRO 312.A O no hydrogen 2.897 N/A GLY 283.A N ILE 158.A O no hydrogen 2.863 N/A ALA 284.A N GLY 281.A O no hydrogen 3.174 N/A PHE 285.A N GLY 282.A O no hydrogen 3.171 N/A ASN 286.A N GLY 283.A O no hydrogen 3.047 N/A LEU 289.A N ASN 286.A OD1 no hydrogen 3.169 N/A MET 290.A N ASN 286.A O no hydrogen 2.841 N/A LYS 291.A N THR 287.A O no hydrogen 2.934 N/A ARG 292.A N ALA 288.A O no hydrogen 3.055 N/A ARG 292.A NE GLU 257.A OE1 no hydrogen 2.982 N/A ARG 292.A NE GLU 257.A OE2 no hydrogen 3.183 N/A ARG 292.A NH2 GLU 257.A OE2 no hydrogen 2.700 N/A LEU 293.A N LEU 289.A O no hydrogen 2.829 N/A ALA 294.A N MET 290.A O no hydrogen 3.365 N/A MET 295.A N LYS 291.A O no hydrogen 2.975 N/A LEU 296.A N ARG 292.A O no hydrogen 3.073 N/A ALA 300.A N MET 297.A O no hydrogen 3.177 N/A ARG 301.A N GLU 275.A O no hydrogen 2.850 N/A ALA 303.A N VAL 277.A O no hydrogen 2.998 N/A SER 304.A OG ASP 306.A OD2 no hydrogen 2.307 N/A THR 305.A N VAL 279.A O no hydrogen 2.792 N/A ASP 306.A N SER 304.A OG no hydrogen 3.321 N/A TYR 308.A N THR 305.A O no hydrogen 2.984 N/A TYR 308.A OH GLU 276.A OE2 no hydrogen 2.749 N/A GLY 309.A N ASP 306.A O no hydrogen 3.084 N/A ILE 310.A N THR 305.A O no hydrogen 3.238 N/A TRP 314.A N PRO 311.A O no hydrogen 3.016 N/A MET 318.A N TRP 314.A O no hydrogen 3.015 N/A ALA 319.A N MET 315.A O no hydrogen 2.988 N/A PHE 320.A N GLU 316.A O no hydrogen 3.180 N/A PHE 320.A N GLY 317.A O no hydrogen 3.206 N/A ALA 321.A N GLY 317.A O no hydrogen 3.136 N/A TRP 322.A N MET 318.A O no hydrogen 2.914 N/A LEU 323.A N ALA 319.A O no hydrogen 2.847 N/A ALA 324.A N PHE 320.A O no hydrogen 3.220 N/A ALA 324.A N ALA 321.A O no hydrogen 3.139 N/A HIS 325.A N ALA 321.A O no hydrogen 3.237 N/A ARG 326.A N TRP 322.A O no hydrogen 2.919 N/A ARG 326.A NE PRO 332.A O no hydrogen 3.033 N/A ARG 326.A NH2 PRO 332.A O no hydrogen 2.928 N/A PHE 327.A N LEU 323.A O no hydrogen 2.973 N/A LEU 328.A N ALA 324.A O no hydrogen 3.186 N/A GLU 329.A N HIS 325.A O no hydrogen 3.074 N/A ARG 330.A N PHE 327.A O no hydrogen 2.933 N/A ARG 330.A NH1 PHE 327.A O no hydrogen 2.950 N/A LEU 331.A N ARG 326.A O no hydrogen 2.867 N/A GLY 333.A N ARG 345.A O no hydrogen 3.030 N/A ASN 334.A ND2 ASP 131.A OD1 no hydrogen 2.802 N/A ASN 334.A ND2 GLY 343.A O no hydrogen 3.208 N/A VAL 338.A N CYS 335.A O no hydrogen 2.825 N/A THR 339.A N CYS 335.A O no hydrogen 2.985 N/A THR 339.A OG1 ASP 131.A OD1 no hydrogen 2.808 N/A THR 339.A OG1 ASP 131.A OD2 no hydrogen 3.218 N/A THR 339.A OG1 CYS 335.A O no hydrogen 3.525 N/A GLY 340.A N PRO 336.A O no hydrogen 2.809 N/A ALA 341.A N THR 339.A OG1 no hydrogen 3.238 N/A LEU 342.A N ALA 134.A O no hydrogen 2.918 N/A ARG 345.A N ASN 334.A OD1 no hydrogen 2.746 N/A ARG 345.A NH1 PRO 344.A O no hydrogen 2.910 N/A ALA 349.A N ALA 125.A O no hydrogen 2.819 N/A TYR 351.A N VAL 123.A O no hydrogen 2.713 N/A ALA 353.A N ASP 122.A OD1 no hydrogen 2.668 N/A