Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 5ng3_B.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ALA 1.A N GLU 60.A OE1 no hydrogen 3.448 N/A ILE 5.A N ILE 76.A O no hydrogen 3.039 N/A TYR 7.A N GLU 79.A OE2 no hydrogen 3.087 N/A LYS 9.A N PRO 6.A O no hydrogen 3.028 N/A LYS 9.A NZ ASP 31.A OD1 no hydrogen 3.507 N/A LYS 9.A NZ ASP 31.A OD2 no hydrogen 3.327 N/A LEU 10.A N TYR 7.A O no hydrogen 3.046 N/A ALA 11.A N ARG 28.A O no hydrogen 2.905 N/A ARG 14.A N SER 26.A O no hydrogen 3.019 N/A LEU 16.A N VAL 24.A O no hydrogen 2.810 N/A SER 17.A N VAL 24.A O no hydrogen 3.187 N/A GLY 19.A N GLY 22.A O no hydrogen 2.957 N/A GLY 22.A N GLY 19.A O no hydrogen 3.278 N/A THR 23.A N HIS 40.A O no hydrogen 2.946 N/A VAL 24.A N SER 17.A O no hydrogen 2.627 N/A SER 25.A N VAL 38.A O no hydrogen 2.910 N/A SER 25.A OG HIS 40.A NE2 no hydrogen 2.631 N/A SER 26.A N ARG 14.A O no hydrogen 2.855 N/A ALA 27.A N VAL 36.A O no hydrogen 2.869 N/A ARG 28.A N ALA 11.A O no hydrogen 2.894 N/A HIS 29.A N VAL 34.A O no hydrogen 3.093 N/A ALA 30.A N LYS 9.A O no hydrogen 2.844 N/A ASP 31.A N HIS 29.A ND1 no hydrogen 3.306 N/A TRP 32.A N HIS 29.A ND1 no hydrogen 3.133 N/A ARG 33.A N HIS 29.A O no hydrogen 2.991 N/A VAL 36.A N ALA 27.A O no hydrogen 2.764 N/A ALA 37.A N THR 87.A O no hydrogen 2.923 N/A VAL 38.A N SER 25.A O no hydrogen 2.737 N/A ARG 39.A N ILE 85.A O no hydrogen 2.966 N/A ARG 39.A NE ASP 156.A OD1 no hydrogen 3.348 N/A ARG 39.A NH2 ASP 156.A OD2 no hydrogen 3.490 N/A HIS 40.A N THR 23.A O no hydrogen 2.839 N/A HIS 40.A NE2 SER 25.A OG no hydrogen 2.631 N/A LEU 41.A N LEU 83.A O no hydrogen 2.799 N/A ILE 43.A N GLU 81.A O no hydrogen 3.065 N/A THR 45.A N GLN 169.A OE1 no hydrogen 3.247 N/A ARG 52.A N LEU 48.A O no hydrogen 2.948 N/A ARG 52.A NH2 GLU 79.A O no hydrogen 3.453 N/A ARG 52.A NH2 PRO 80.A O no hydrogen 3.266 N/A LYS 53.A N ASP 49.A O no hydrogen 3.361 N/A ASP 54.A N SER 50.A O no hydrogen 3.296 N/A LEU 56.A N ARG 52.A O no hydrogen 3.153 N/A ARG 57.A N LYS 53.A O no hydrogen 3.026 N/A GLU 58.A N ASP 54.A O no hydrogen 3.029 N/A ALA 59.A N VAL 55.A O no hydrogen 2.986 N/A GLU 60.A N LEU 56.A O no hydrogen 2.869 N/A ILE 61.A N ARG 57.A O no hydrogen 2.998 N/A LEU 62.A N GLU 58.A O no hydrogen 2.849 N/A HIS 63.A N ALA 59.A O no hydrogen 2.802 N/A LYS 64.A N ILE 61.A O no hydrogen 2.936 N/A ALA 65.A N LEU 62.A O no hydrogen 3.245 N/A ARG 66.A N TYR 126.A OH no hydrogen 2.910 N/A ILE 70.A N PHE 67.A O no hydrogen 2.920 N/A LEU 71.A N ILE 154.A O no hydrogen 2.946 N/A LEU 74.A N VAL 86.A O no hydrogen 2.741 N/A GLY 75.A N VAL 86.A O no hydrogen 3.260 N/A ILE 76.A N PRO 3.A O no hydrogen 3.062 N/A CYS 77.A N GLY 84.A O no hydrogen 2.725 N/A CYS 77.A SG ILE 5.A O no hydrogen 3.624 N/A GLU 79.A N PHE 82.A O no hydrogen 2.796 N/A PHE 82.A N GLU 79.A O no hydrogen 3.133 N/A LEU 83.A N LEU 41.A O no hydrogen 3.199 N/A GLY 84.A N CYS 77.A O no hydrogen 2.859 N/A ILE 85.A N ARG 39.A O no hydrogen 2.700 N/A VAL 86.A N GLY 75.A O no hydrogen 2.776 N/A THR 87.A N ALA 37.A O no hydrogen 2.887 N/A THR 87.A OG1 GLU 88.A O no hydrogen 3.459 N/A ASN 92.A N LEU 146.A O no hydrogen 3.236 N/A ASN 92.A ND2 ASP 147.A O no hydrogen 2.790 N/A ASN 92.A ND2 ASN 148.A O no hydrogen 3.073 N/A GLY 93.A N MET 90.A O no hydrogen 3.479 N/A SER 94.A N GLU 97.A OE1 no hydrogen 3.158 N/A SER 94.A OG GLU 97.A OE2 no hydrogen 3.221 N/A LEU 95.A N ILE 144.A O no hydrogen 2.779 N/A ASN 96.A N THR 141.A O no hydrogen 3.270 N/A LEU 98.A N SER 94.A O no hydrogen 3.214 N/A LEU 99.A N LEU 95.A O no hydrogen 3.039 N/A HIS 100.A N ASN 96.A O no hydrogen 3.037 N/A HIS 100.A NE2 GLU 199.A OE2 no hydrogen 2.718 N/A ARG 101.A N GLU 97.A O no hydrogen 3.167 N/A ARG 101.A NH1 GLU 104.A OE1 no hydrogen 2.749 N/A LYS 102.A N HIS 100.A O no hydrogen 2.815 N/A LYS 102.A NZ ARG 203.A O no hydrogen 3.140 N/A TYR 105.A N ARG 101.A O no hydrogen 3.170 N/A ARG 113.A N ALA 109.A O no hydrogen 3.188 N/A ARG 113.A NE VAL 108.A O no hydrogen 2.920 N/A ARG 113.A NH1 VAL 200.A O no hydrogen 2.867 N/A PHE 114.A N TRP 110.A O no hydrogen 3.030 N/A ARG 115.A N PRO 111.A O no hydrogen 2.978 N/A ARG 115.A NH2 GLU 149.A O no hydrogen 3.082 N/A ARG 115.A NH2 PHE 150.A O no hydrogen 2.980 N/A ILE 116.A N LEU 112.A O no hydrogen 2.868 N/A LEU 117.A N ARG 113.A O no hydrogen 3.108 N/A HIS 118.A N PHE 114.A O no hydrogen 2.953 N/A GLU 119.A N ARG 115.A O no hydrogen 2.922 N/A ILE 120.A N ILE 116.A O no hydrogen 2.915 N/A ALA 121.A N LEU 117.A O no hydrogen 3.175 N/A LEU 122.A N HIS 118.A O no hydrogen 2.815 N/A GLY 123.A N GLU 119.A O no hydrogen 2.852 N/A VAL 124.A N ILE 120.A O no hydrogen 2.958 N/A ASN 125.A N ALA 121.A O no hydrogen 2.974 N/A TYR 126.A N LEU 122.A O no hydrogen 3.006 N/A LEU 127.A N GLY 123.A O no hydrogen 3.106 N/A HIS 128.A N VAL 124.A O no hydrogen 2.933 N/A HIS 128.A NE2 ASP 189.A OD2 no hydrogen 2.799 N/A ASN 129.A N ASN 125.A O no hydrogen 3.057 N/A ASN 129.A N TYR 126.A O no hydrogen 3.093 N/A ASN 129.A ND2 ASN 125.A O no hydrogen 3.068 N/A MET 130.A N LEU 127.A O no hydrogen 3.480 N/A LEU 134.A N LEU 127.A O no hydrogen 2.861 N/A HIS 136.A N ASP 189.A OD2 no hydrogen 3.039 N/A HIS 136.A NE2 ALA 155.A O no hydrogen 2.806 N/A HIS 137.A N ASP 189.A OD1 no hydrogen 2.827 N/A ASP 138.A N HIS 136.A ND1 no hydrogen 3.079 N/A LYS 140.A NZ ASP 138.A OD1 no hydrogen 3.367 N/A LYS 140.A NZ ASP 138.A OD2 no hydrogen 2.699 N/A THR 141.A OG1 TYR 176.A OH no hydrogen 2.873 N/A GLN 142.A N GLN 142.A OE1 no hydrogen 3.282 N/A ASN 143.A N LYS 140.A O no hydrogen 2.967 N/A LEU 145.A N LYS 153.A O no hydrogen 2.835 N/A LEU 146.A N GLY 93.A O no hydrogen 2.872 N/A ASP 147.A N HIS 151.A O no hydrogen 2.967 N/A ASN 148.A ND2 GLU 149.A OE2 no hydrogen 3.464 N/A GLU 149.A N ASP 147.A OD1 no hydrogen 2.877 N/A PHE 150.A N ASP 147.A O no hydrogen 3.115 N/A HIS 151.A N ASP 147.A OD1 no hydrogen 3.094 N/A HIS 151.A ND1 GLU 119.A OE2 no hydrogen 2.733 N/A VAL 152.A N GLU 119.A OE1 no hydrogen 2.875 N/A LYS 153.A N LEU 145.A O no hydrogen 2.714 N/A LYS 153.A NZ SER 68.A O no hydrogen 3.425 N/A ILE 154.A N TYR 69.A O no hydrogen 2.879 N/A ALA 155.A N ASN 143.A O no hydrogen 2.899 N/A GLY 158.A N HIS 136.A O no hydrogen 3.442 N/A SER 160.A N GLY 158.A O no hydrogen 2.753 N/A LYS 161.A N GLU 58.A OE1 no hydrogen 2.752 N/A TRP 162.A N GLU 58.A OE2 no hydrogen 2.823 N/A TRP 162.A NE1 SER 21.A O no hydrogen 2.609 N/A ARG 163.A N SER 160.A O no hydrogen 3.130 N/A ARG 163.A NE SER 21.A OG no hydrogen 2.977 N/A MET 164.A N SER 160.A O no hydrogen 3.187 N/A MET 165.A N LYS 161.A O no hydrogen 3.265 N/A MET 165.A N TRP 162.A O no hydrogen 3.186 N/A SER 166.A N TRP 162.A O no hydrogen 3.263 N/A SER 166.A OG ALA 20.A O no hydrogen 2.903 N/A SER 166.A OG TRP 162.A O no hydrogen 3.292 N/A SER 166.A OG ARG 163.A O no hydrogen 3.420 N/A LEU 167.A N ARG 163.A O no hydrogen 3.020 N/A SER 168.A N MET 164.A O no hydrogen 3.138 N/A SER 168.A OG MET 165.A O no hydrogen 2.455 N/A GLN 169.A N MET 165.A O no hydrogen 3.118 N/A TYR 176.A OH GLU 199.A OE1 no hydrogen 2.436 N/A MET 177.A N ILE 174.A O no hydrogen 3.030 N/A ASN 181.A N PRO 178.A O no hydrogen 3.135 N/A TYR 182.A N PRO 179.A O no hydrogen 3.203 N/A LYS 187.A NZ ARG 258.A O no hydrogen 2.674 N/A HIS 188.A N SER 185.A O no hydrogen 3.275 N/A TYR 191.A N HIS 188.A O no hydrogen 3.115 N/A SER 192.A N HIS 188.A O no hydrogen 3.463 N/A SER 192.A OG TYR 176.A O no hydrogen 2.677 N/A SER 192.A OG HIS 188.A O no hydrogen 3.503 N/A TYR 193.A N ASP 189.A O no hydrogen 2.841 N/A TYR 193.A OH LEU 117.A O no hydrogen 2.684 N/A ALA 194.A N ILE 190.A O no hydrogen 2.939 N/A VAL 195.A N TYR 191.A O no hydrogen 3.117 N/A ILE 196.A N SER 192.A O no hydrogen 2.849 N/A THR 197.A N TYR 193.A O no hydrogen 2.744 N/A THR 197.A OG1 TYR 193.A O no hydrogen 2.651 N/A TRP 198.A N ALA 194.A O no hydrogen 2.949 N/A TRP 198.A NE1 VAL 227.A O no hydrogen 3.215 N/A GLU 199.A N VAL 195.A O no hydrogen 2.977 N/A VAL 200.A N ILE 196.A O no hydrogen 2.788 N/A LEU 201.A N THR 197.A O no hydrogen 3.209 N/A SER 202.A N TRP 198.A O no hydrogen 2.873 N/A SER 202.A OG TRP 198.A O no hydrogen 2.932 N/A SER 202.A OG GLU 199.A O no hydrogen 3.463 N/A ARG 203.A N GLU 199.A O no hydrogen 2.860 N/A ARG 203.A NE LEU 99.A O no hydrogen 2.668 N/A ARG 203.A NH1 LEU 99.A O no hydrogen 3.122 N/A ARG 203.A NH1 TYR 105.A O no hydrogen 2.816 N/A ARG 203.A NH2 TYR 105.A O no hydrogen 3.399 N/A LYS 204.A N SER 202.A OG no hydrogen 3.012 N/A LYS 204.A NZ GLU 231.A O no hydrogen 3.459 N/A VAL 210.A N PHE 207.A O no hydrogen 3.047 N/A ASN 212.A N GLN 215.A OE1 no hydrogen 3.387 N/A LEU 214.A N ASN 212.A OD1 no hydrogen 2.932 N/A MET 217.A N PRO 213.A O no hydrogen 3.024 N/A TYR 218.A N LEU 214.A O no hydrogen 2.981 N/A SER 219.A N GLN 215.A O no hydrogen 3.000 N/A SER 219.A OG GLN 215.A O no hydrogen 3.150 N/A VAL 220.A N ILE 216.A O no hydrogen 2.996 N/A SER 221.A N MET 217.A O no hydrogen 3.198 N/A SER 221.A OG MET 217.A O no hydrogen 3.487 N/A SER 221.A OG TYR 218.A O no hydrogen 2.859 N/A SER 221.A OG GLN 222.A OE1 no hydrogen 3.449 N/A GLN 222.A N TYR 218.A O no hydrogen 3.034 N/A GLY 223.A N VAL 220.A O no hydrogen 2.869 N/A HIS 224.A N SER 219.A O no hydrogen 2.853 N/A ARG 225.A NE TRP 251.A O no hydrogen 2.686 N/A ARG 225.A NH1 VAL 220.A O no hydrogen 3.054 N/A ARG 225.A NH1 HIS 224.A O no hydrogen 2.680 N/A ARG 225.A NH2 TRP 251.A O no hydrogen 3.014 N/A ARG 225.A NH2 GLN 253.A OE1 no hydrogen 2.906 N/A ASN 229.A N SER 232.A OG no hydrogen 3.226 N/A GLU 231.A N ASN 229.A OD1 no hydrogen 2.805 N/A SER 232.A N ASN 229.A OD1 no hydrogen 3.137 N/A SER 232.A OG VAL 227.A O no hydrogen 2.715 N/A SER 232.A OG ASN 229.A O no hydrogen 3.486 N/A LEU 233.A N ASN 229.A O no hydrogen 2.904 N/A ILE 237.A N PRO 234.A O no hydrogen 3.354 N/A HIS 239.A NE2 THR 274.A OG1 no hydrogen 2.797 N/A ARG 240.A NH1 LEU 233.A O no hydrogen 2.497 N/A ARG 242.A NH1 GLU 267.A O no hydrogen 3.417 N/A MET 243.A N HIS 239.A O no hydrogen 2.994 N/A ILE 244.A N ARG 240.A O no hydrogen 3.017 N/A SER 245.A N ALA 241.A O no hydrogen 3.093 N/A LEU 246.A N ARG 242.A O no hydrogen 3.030 N/A ILE 247.A N MET 243.A O no hydrogen 2.829 N/A GLU 248.A N ILE 244.A O no hydrogen 2.937 N/A SER 249.A N SER 245.A O no hydrogen 2.980 N/A SER 249.A OG SER 245.A O no hydrogen 2.911 N/A SER 249.A OG LEU 246.A O no hydrogen 2.773 N/A GLY 250.A N LEU 246.A O no hydrogen 2.842 N/A TRP 251.A N ILE 247.A O no hydrogen 2.890 N/A GLN 253.A NE2 SER 221.A O no hydrogen 2.947 N/A ASP 256.A N ASN 254.A OD1 no hydrogen 3.235 N/A GLU 257.A N ASN 254.A O no hydrogen 3.096 N/A ARG 258.A N PRO 255.A O no hydrogen 2.938 N/A ARG 258.A NE ALA 252.A O no hydrogen 2.823 N/A ARG 258.A NH1 GLU 180.A OE1 no hydrogen 2.893 N/A ARG 258.A NH1 GLU 180.A OE2 no hydrogen 3.426 N/A ARG 258.A NH1 LYS 187.A O no hydrogen 3.130 N/A ARG 258.A NH2 GLU 180.A OE2 no hydrogen 2.604 N/A ARG 258.A NH2 ALA 252.A O no hydrogen 3.060 N/A LYS 263.A N SER 260.A OG no hydrogen 3.047 N/A LYS 263.A NZ GLU 267.A OE1 no hydrogen 3.204 N/A CYS 264.A N SER 260.A O no hydrogen 3.143 N/A CYS 264.A SG SER 260.A O no hydrogen 3.874 N/A LEU 265.A N PHE 261.A O no hydrogen 2.914 N/A ILE 266.A N LEU 262.A O no hydrogen 2.981 N/A GLU 267.A N LYS 263.A O no hydrogen 3.022 N/A LEU 268.A N CYS 264.A O no hydrogen 2.730 N/A GLU 269.A N LEU 265.A O no hydrogen 2.823 N/A LEU 272.A N LEU 268.A O no hydrogen 3.138 N/A ARG 273.A N GLU 269.A O no hydrogen 3.377 N/A THR 274.A OG1 HIS 239.A NE2 no hydrogen 2.797 N/A THR 274.A OG1 VAL 271.A O no hydrogen 3.034 N/A PHE 275.A N LEU 272.A O no hydrogen 3.006 N/A