Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4o0x_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLN 5.A N GLY 1.A O no hydrogen 2.721 N/A PHE 6.A N SER 2.A O no hydrogen 3.169 N/A ARG 7.A N HIS 3.A O no hydrogen 3.055 N/A ALA 8.A N GLU 4.A O no hydrogen 2.950 N/A ALA 9.A N GLN 5.A O no hydrogen 2.958 N/A LEU 10.A N PHE 6.A O no hydrogen 2.938 N/A GLN 11.A N ARG 7.A O no hydrogen 2.800 N/A LEU 12.A N ALA 9.A O no hydrogen 3.080 N/A VAL 13.A N LEU 10.A O no hydrogen 2.876 N/A VAL 14.A N LEU 10.A O no hydrogen 3.009 N/A ASP 15.A N SER 86.A O no hydrogen 2.748 N/A ARG 20.A N ASP 18.A OD1 no hydrogen 2.873 N/A ARG 20.A NE ASP 18.A OD1 no hydrogen 3.163 N/A ARG 20.A NE ASP 18.A OD2 no hydrogen 3.346 N/A ARG 20.A NH2 ASP 18.A OD2 no hydrogen 2.822 N/A SER 21.A N ASP 18.A O no hydrogen 3.422 N/A SER 21.A OG ASP 18.A O no hydrogen 2.749 N/A TYR 22.A N PRO 19.A O no hydrogen 3.121 N/A TYR 22.A OH TYR 87.A OH no hydrogen 2.714 N/A ASP 24.A N THR 41.A O no hydrogen 2.867 N/A ILE 27.A N ILE 39.A O no hydrogen 3.010 N/A LYS 28.A NZ GLU 31.A OE1 no hydrogen 2.600 N/A ILE 29.A N VAL 37.A O no hydrogen 2.776 N/A GLY 32.A N GLY 35.A O no hydrogen 2.576 N/A SER 33.A OG THR 34.A OG1 no hydrogen 3.339 N/A SER 33.A OG ASP 160.A OD2 no hydrogen 3.425 N/A THR 34.A OG1 SER 33.A OG no hydrogen 3.339 N/A ILE 36.A N LYS 53.A O no hydrogen 3.080 N/A VAL 37.A N GLY 30.A O no hydrogen 3.076 N/A CYS 38.A N VAL 51.A O no hydrogen 2.873 N/A ILE 39.A N ILE 27.A O no hydrogen 2.894 N/A ALA 40.A N VAL 49.A O no hydrogen 2.947 N/A THR 41.A N ASP 24.A O no hydrogen 2.769 N/A VAL 42.A N LYS 47.A O no hydrogen 2.746 N/A ARG 43.A N TYR 22.A O no hydrogen 3.062 N/A ARG 43.A NH1 SER 21.A O no hydrogen 2.345 N/A SER 45.A N VAL 42.A O no hydrogen 3.201 N/A GLY 46.A N VAL 42.A O no hydrogen 2.745 N/A LYS 47.A N SER 45.A OG no hydrogen 3.298 N/A VAL 49.A N ALA 40.A O no hydrogen 2.961 N/A ALA 50.A N MET 97.A O no hydrogen 2.775 N/A VAL 51.A N CYS 38.A O no hydrogen 2.559 N/A LYS 52.A N VAL 95.A O no hydrogen 2.915 N/A LYS 52.A NZ THR 34.A OG1 no hydrogen 3.286 N/A LYS 52.A NZ GLU 68.A OE1 no hydrogen 3.147 N/A LYS 52.A NZ GLU 68.A OE2 no hydrogen 2.524 N/A LYS 52.A NZ ASP 160.A OD2 no hydrogen 3.495 N/A LYS 53.A N ILE 36.A O no hydrogen 2.819 N/A MET 54.A N LEU 93.A O no hydrogen 2.880 N/A LEU 56.A N ASP 91.A O no hydrogen 2.820 N/A ARG 57.A N ASP 55.A OD1 no hydrogen 3.286 N/A ARG 57.A NH2 ASP 91.A OD2 no hydrogen 3.212 N/A LYS 58.A N ASP 55.A O no hydrogen 3.300 N/A GLN 59.A NE2 THR 34.A O no hydrogen 2.794 N/A GLN 59.A NE2 ASP 55.A O no hydrogen 2.738 N/A ARG 61.A NE GLU 63.A OE1 no hydrogen 3.449 N/A ARG 62.A NH1 SER 2.A OG no hydrogen 3.338 N/A ARG 62.A NH2 SER 2.A OG no hydrogen 2.640 N/A GLU 63.A N GLU 63.A OE2 no hydrogen 2.909 N/A LEU 64.A N ARG 61.A O no hydrogen 2.965 N/A LEU 65.A N ARG 62.A O no hydrogen 3.043 N/A PHE 66.A N GLU 63.A O no hydrogen 3.245 N/A ASN 67.A N LEU 64.A O no hydrogen 3.129 N/A VAL 70.A N PHE 66.A O no hydrogen 2.647 N/A ILE 71.A N ASN 67.A O no hydrogen 2.724 N/A MET 72.A N GLU 68.A O no hydrogen 2.869 N/A ARG 73.A NE VAL 69.A O no hydrogen 3.369 N/A TYR 75.A N MET 72.A O no hydrogen 3.069 N/A ASN 79.A N HIS 77.A ND1 no hydrogen 3.102 N/A ASN 79.A ND2 VAL 156.A O no hydrogen 3.053 N/A VAL 80.A N HIS 77.A O no hydrogen 3.160 N/A VAL 81.A N LEU 158.A O no hydrogen 2.972 N/A GLU 82.A N GLU 98.A OE1 no hydrogen 2.904 N/A TYR 84.A N VAL 96.A O no hydrogen 2.799 N/A ASN 85.A N VAL 96.A O no hydrogen 3.276 N/A ASN 85.A ND2 ASP 15.A OD2 no hydrogen 3.070 N/A SER 86.A N ASP 15.A OD2 no hydrogen 2.625 N/A TYR 87.A N TRP 94.A O no hydrogen 2.892 N/A TYR 87.A OH TYR 22.A OH no hydrogen 2.714 N/A VAL 89.A N GLU 92.A O no hydrogen 2.695 N/A GLU 92.A N VAL 89.A O no hydrogen 2.868 N/A LEU 93.A N MET 54.A O no hydrogen 2.841 N/A TRP 94.A N TYR 87.A O no hydrogen 2.811 N/A TRP 94.A NE1 GLU 92.A OE1 no hydrogen 2.877 N/A VAL 95.A N LYS 52.A O no hydrogen 2.864 N/A VAL 96.A N ASN 85.A O no hydrogen 2.784 N/A MET 97.A N ALA 50.A O no hydrogen 2.856 N/A GLU 98.A N GLU 82.A O no hydrogen 3.036 N/A GLU 101.A N GLU 101.A OE1 no hydrogen 2.680 N/A GLY 102.A N LEU 150.A O no hydrogen 2.778 N/A GLY 103.A N LEU 100.A O no hydrogen 3.375 N/A LEU 105.A N ILE 148.A O no hydrogen 2.784 N/A THR 106.A OG1 SER 145.A OG no hydrogen 2.560 N/A ILE 108.A N LEU 105.A O no hydrogen 2.926 N/A VAL 109.A N LEU 105.A O no hydrogen 3.048 N/A THR 110.A N THR 106.A O no hydrogen 3.253 N/A THR 110.A OG1 THR 106.A O no hydrogen 3.039 N/A THR 110.A OG1 ASP 107.A O no hydrogen 3.553 N/A THR 110.A OG1 HIS 111.A ND1 no hydrogen 2.937 N/A HIS 111.A N ILE 108.A O no hydrogen 3.239 N/A HIS 111.A ND1 THR 110.A OG1 no hydrogen 2.937 N/A THR 112.A N ILE 108.A O no hydrogen 2.971 N/A THR 112.A OG1 ILE 108.A O no hydrogen 3.088 N/A ARG 113.A NE MET 114.A O no hydrogen 3.327 N/A ASN 115.A N GLN 118.A OE1 no hydrogen 2.800 N/A GLN 118.A N ASN 115.A OD1 no hydrogen 2.829 N/A GLN 118.A NE2 SER 281.A O no hydrogen 2.805 N/A ILE 119.A N ASN 115.A O no hydrogen 3.161 N/A ALA 120.A N GLU 116.A O no hydrogen 2.990 N/A ALA 121.A N GLU 117.A O no hydrogen 3.152 N/A VAL 122.A N GLN 118.A O no hydrogen 3.077 N/A CYS 123.A N ILE 119.A O no hydrogen 2.895 N/A CYS 123.A SG ILE 119.A O no hydrogen 3.312 N/A LEU 124.A N ALA 120.A O no hydrogen 2.735 N/A ALA 125.A N ALA 121.A O no hydrogen 3.252 N/A VAL 126.A N VAL 122.A O no hydrogen 3.099 N/A LEU 127.A N CYS 123.A O no hydrogen 3.048 N/A GLN 128.A N LEU 124.A O no hydrogen 2.890 N/A ALA 129.A N ALA 125.A O no hydrogen 3.145 N/A LEU 130.A N VAL 126.A O no hydrogen 2.860 N/A SER 131.A N LEU 127.A O no hydrogen 2.815 N/A SER 131.A OG LEU 127.A O no hydrogen 3.431 N/A SER 131.A OG GLN 128.A O no hydrogen 2.593 N/A VAL 132.A N GLN 128.A O no hydrogen 3.419 N/A LEU 133.A N ALA 129.A O no hydrogen 2.984 N/A HIS 134.A N LEU 130.A O no hydrogen 2.843 N/A HIS 134.A NE2 ASP 198.A OD2 no hydrogen 2.924 N/A ALA 135.A N SER 131.A O no hydrogen 3.027 N/A GLN 136.A N VAL 132.A O no hydrogen 3.065 N/A GLY 137.A N HIS 134.A O no hydrogen 3.106 N/A VAL 138.A N LEU 133.A O no hydrogen 2.909 N/A ILE 139.A N ALA 165.A O no hydrogen 3.127 N/A HIS 140.A N ASP 198.A OD2 no hydrogen 2.838 N/A HIS 140.A NE2 SER 159.A O no hydrogen 2.700 N/A ARG 141.A N ASP 198.A OD1 no hydrogen 2.885 N/A ARG 141.A NE PHE 163.A O no hydrogen 2.891 N/A ARG 141.A NH1 PHE 163.A O no hydrogen 2.982 N/A ARG 141.A NH2 TYR 193.A OH no hydrogen 2.799 N/A ASP 142.A N HIS 140.A ND1 no hydrogen 3.000 N/A LYS 144.A NZ THR 179.A OG1 no hydrogen 2.681 N/A SER 145.A N GLU 208.A OE2 no hydrogen 3.027 N/A SER 145.A OG THR 106.A OG1 no hydrogen 2.560 N/A SER 145.A OG GLU 208.A OE1 no hydrogen 2.706 N/A SER 145.A OG GLU 208.A OE2 no hydrogen 3.399 N/A SER 147.A N LYS 144.A O no hydrogen 3.026 N/A SER 147.A OG ASP 142.A O no hydrogen 2.927 N/A ILE 148.A N SER 145.A O no hydrogen 3.069 N/A LEU 149.A N LYS 157.A O no hydrogen 2.859 N/A LEU 150.A N GLY 103.A O no hydrogen 2.993 N/A THR 151.A N ARG 155.A O no hydrogen 2.926 N/A THR 151.A OG1 ASP 153.A OD1 no hydrogen 2.518 N/A HIS 152.A N GLU 101.A OE2 no hydrogen 2.920 N/A HIS 152.A ND1 GLU 101.A OE2 no hydrogen 3.099 N/A ASP 153.A N ASP 153.A OD1 no hydrogen 2.537 N/A GLY 154.A N THR 151.A O no hydrogen 3.244 N/A ARG 155.A N THR 151.A OG1 no hydrogen 2.824 N/A ARG 155.A NE ASP 153.A OD1 no hydrogen 3.352 N/A ARG 155.A NE ASP 153.A OD2 no hydrogen 2.815 N/A ARG 155.A NH2 ASP 153.A OD1 no hydrogen 3.120 N/A ARG 155.A NH2 ASP 153.A OD2 no hydrogen 3.458 N/A LYS 157.A N LEU 149.A O no hydrogen 2.777 N/A LYS 157.A NZ GLU 98.A OE1 no hydrogen 3.331 N/A LYS 157.A NZ GLU 98.A OE2 no hydrogen 2.989 N/A LEU 158.A N ASN 79.A O no hydrogen 2.668 N/A SER 159.A N SER 147.A O no hydrogen 2.827 N/A GLY 162.A N ASP 160.A OD2 no hydrogen 3.339 N/A CYS 164.A N PHE 161.A O no hydrogen 3.160 N/A CYS 164.A SG PHE 161.A O no hydrogen 3.259 N/A ALA 165.A N ILE 139.A O no hydrogen 3.044 N/A VAL 167.A N GLY 137.A O no hydrogen 3.030 N/A SER 168.A N VAL 171.A O no hydrogen 2.580 N/A ARG 174.A N TYR 193.A O no hydrogen 2.859 N/A ARG 174.A NH1 GLN 166.A O no hydrogen 3.370 N/A THR 179.A OG1 ASP 142.A OD1 no hydrogen 2.692 N/A TYR 181.A OH GLU 219.A O no hydrogen 2.987 N/A TRP 182.A N THR 179.A O no hydrogen 2.850 N/A TRP 182.A NE1 GLU 208.A OE2 no hydrogen 3.164 N/A MET 183.A N PRO 180.A O no hydrogen 2.950 N/A GLU 186.A N GLU 186.A OE1 no hydrogen 2.842 N/A LEU 187.A N ALA 184.A O no hydrogen 3.147 N/A ILE 188.A N ALA 184.A O no hydrogen 3.215 N/A SER 189.A N PRO 185.A O no hydrogen 2.872 N/A SER 189.A OG PRO 185.A O no hydrogen 3.170 N/A ARG 190.A N LEU 187.A O no hydrogen 3.041 N/A LEU 191.A N GLU 186.A O no hydrogen 2.855 N/A TYR 193.A N ARG 174.A O no hydrogen 2.986 N/A GLY 194.A N GLU 196.A OE1 no hydrogen 3.188 N/A VAL 197.A N GLY 194.A O no hydrogen 3.290 N/A ASP 198.A N PRO 195.A O no hydrogen 3.025 N/A ILE 199.A N GLU 196.A O no hydrogen 3.069 N/A TRP 200.A N GLU 196.A O no hydrogen 3.375 N/A SER 201.A N VAL 197.A O no hydrogen 3.214 N/A SER 201.A OG TRP 182.A O no hydrogen 2.590 N/A SER 201.A OG VAL 197.A O no hydrogen 3.308 N/A LEU 202.A N ASP 198.A O no hydrogen 2.889 N/A GLY 203.A N ILE 199.A O no hydrogen 3.040 N/A ILE 204.A N TRP 200.A O no hydrogen 2.946 N/A MET 205.A N SER 201.A O no hydrogen 2.966 N/A VAL 206.A N LEU 202.A O no hydrogen 2.913 N/A VAL 206.A N GLY 203.A O no hydrogen 2.943 N/A ILE 207.A N GLY 203.A O no hydrogen 3.200 N/A GLU 208.A N ILE 204.A O no hydrogen 3.111 N/A MET 209.A N MET 205.A O no hydrogen 3.040 N/A VAL 210.A N VAL 206.A O no hydrogen 2.960 N/A VAL 210.A N ILE 207.A O no hydrogen 3.216 N/A ASP 211.A N ILE 207.A O no hydrogen 2.548 N/A GLY 212.A N GLU 208.A O no hydrogen 2.736 N/A GLU 219.A N TYR 216.A O no hydrogen 2.808 N/A ALA 224.A N PRO 220.A O no hydrogen 2.907 N/A MET 225.A N PRO 221.A O no hydrogen 3.077 N/A LYS 226.A N LYS 223.A O no hydrogen 3.042 N/A MET 227.A N LYS 223.A O no hydrogen 3.040 N/A ILE 228.A N ALA 224.A O no hydrogen 2.919 N/A ARG 229.A N MET 225.A O no hydrogen 2.946 N/A ARG 229.A NE ASP 230.A OD1 no hydrogen 3.134 N/A ASP 230.A N LYS 226.A O no hydrogen 2.681 N/A ASN 231.A N MET 227.A O no hydrogen 2.870 N/A ASN 231.A ND2 TYR 216.A OH no hydrogen 3.447 N/A LYS 237.A N ASP 211.A OD2 no hydrogen 2.845 N/A ASN 238.A N ASP 211.A OD1 no hydrogen 3.216 N/A ASN 238.A ND2 ASP 211.A OD1 no hydrogen 3.234 N/A LYS 241.A N ASN 238.A O no hydrogen 3.024 N/A VAL 242.A N LEU 239.A O no hydrogen 3.316 N/A SER 243.A N GLU 116.A OE2 no hydrogen 2.754 N/A SER 243.A OG GLU 116.A OE1 no hydrogen 2.803 N/A LYS 247.A N SER 243.A O no hydrogen 3.151 N/A LYS 247.A NZ ASP 251.A OD1 no hydrogen 3.006 N/A LYS 247.A NZ ASP 251.A OD2 no hydrogen 2.607 N/A GLY 248.A N PRO 244.A O no hydrogen 2.833 N/A PHE 249.A N SER 245.A O no hydrogen 2.736 N/A LEU 250.A N LEU 246.A O no hydrogen 2.777 N/A ASP 251.A N LYS 247.A O no hydrogen 2.888 N/A ARG 252.A N PHE 249.A O no hydrogen 3.023 N/A ARG 252.A NH2 GLU 266.A OE1 no hydrogen 3.179 N/A LEU 253.A N LEU 250.A O no hydrogen 2.974 N/A LEU 254.A N LEU 250.A O no hydrogen 3.097 N/A ARG 256.A NE ASN 231.A O no hydrogen 2.695 N/A ARG 256.A NH1 ILE 228.A O no hydrogen 3.359 N/A ALA 259.A N ASP 257.A OD1 no hydrogen 3.107 N/A GLN 260.A N ASP 257.A O no hydrogen 2.752 N/A ARG 261.A N ASP 257.A O no hydrogen 2.818 N/A ARG 261.A NE VAL 255.A O no hydrogen 2.922 N/A ARG 261.A NH1 GLU 186.A OE2 no hydrogen 3.411 N/A ARG 261.A NH1 GLU 196.A O no hydrogen 3.022 N/A ARG 261.A NH2 GLU 186.A OE1 no hydrogen 3.278 N/A ARG 261.A NH2 VAL 255.A O no hydrogen 2.914 N/A ALA 262.A N ARG 252.A O no hydrogen 3.039 N/A THR 263.A N GLU 266.A OE1 no hydrogen 3.296 N/A GLU 266.A N THR 263.A OG1 no hydrogen 3.002 N/A LEU 267.A N THR 263.A O no hydrogen 2.815 N/A LEU 268.A N ALA 264.A O no hydrogen 3.212 N/A LYS 269.A N GLU 266.A O no hydrogen 2.888 N/A HIS 270.A N LEU 267.A O no hydrogen 3.143 N/A PHE 272.A N HIS 270.A ND1 no hydrogen 2.937 N/A LEU 273.A N HIS 270.A O no hydrogen 3.213 N/A ALA 274.A N PRO 271.A O no hydrogen 2.831 N/A LYS 275.A N PHE 272.A O no hydrogen 3.073 N/A ALA 276.A N LEU 273.A O no hydrogen 3.134 N/A GLY 277.A N GLU 117.A O no hydrogen 3.290 N/A SER 281.A N PRO 278.A O no hydrogen 2.810 N/A SER 281.A OG PRO 278.A O no hydrogen 2.586 N/A ILE 282.A N PRO 279.A O no hydrogen 3.197 N/A LEU 285.A N ILE 282.A O no hydrogen 2.830 N/A MET 286.A N VAL 283.A O no hydrogen 3.155 N/A ARG 287.A NH2 ASP 107.A OD1 no hydrogen 2.882 N/A ASN 289.A N MET 286.A O no hydrogen 2.810 N/A ARG 290.A N ARG 287.A O no hydrogen 3.228 N/A ARG 290.A NH1 ASP 107.A OD2 no hydrogen 3.412 N/A ARG 290.A NH1 LEU 285.A O no hydrogen 2.656 N/A ARG 290.A NH2 ASP 107.A OD2 no hydrogen 2.832 N/A