Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3qrw_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): SER 2.A OG GLY 26.A O no hydrogen 3.527 N/A VAL 4.A N ASP 81.A OD2 no hydrogen 3.073 N/A ALA 5.A N ARG 28.A O no hydrogen 2.867 N/A LEU 6.A N VAL 82.A O no hydrogen 2.825 N/A VAL 7.A N PHE 30.A O no hydrogen 2.940 N/A THR 8.A N VAL 84.A O no hydrogen 3.145 N/A ALA 10.A N CYS 32.A O no hydrogen 2.989 N/A LEU 16.A N SER 12.A O no hydrogen 3.056 N/A GLU 17.A N GLY 13.A O no hydrogen 3.064 N/A ILE 18.A N ILE 14.A O no hydrogen 2.791 N/A ALA 19.A N GLY 15.A O no hydrogen 2.965 N/A ARG 20.A N LEU 16.A O no hydrogen 2.818 N/A ARG 20.A NE GLU 45.A OE1 no hydrogen 2.575 N/A ARG 20.A NH1 GLU 17.A OE1 no hydrogen 2.852 N/A ARG 20.A NH2 GLU 45.A OE1 no hydrogen 2.950 N/A ARG 20.A NH2 GLU 45.A OE2 no hydrogen 3.111 N/A ARG 21.A N GLU 17.A O no hydrogen 2.929 N/A ARG 21.A NE GLU 25.A OE2 no hydrogen 2.820 N/A ARG 21.A NH1 GLU 230.A OE1 no hydrogen 2.731 N/A ARG 21.A NH2 GLU 25.A OE2 no hydrogen 3.495 N/A ARG 21.A NH2 GLU 230.A OE1 no hydrogen 3.076 N/A ARG 21.A NH2 GLU 230.A OE2 no hydrogen 3.186 N/A LEU 22.A N ILE 18.A O no hydrogen 2.826 N/A GLY 23.A N ALA 19.A O no hydrogen 2.969 N/A LYS 24.A N ARG 20.A O no hydrogen 3.000 N/A LYS 24.A NZ ALA 49.A O no hydrogen 2.917 N/A GLU 25.A N ARG 21.A O no hydrogen 3.030 N/A GLU 25.A N LEU 22.A O no hydrogen 3.205 N/A GLY 26.A N GLY 23.A O no hydrogen 2.921 N/A LEU 27.A N LEU 22.A O no hydrogen 3.117 N/A ARG 28.A N GLU 3.A O no hydrogen 2.868 N/A ARG 28.A NE SER 2.A O no hydrogen 3.328 N/A ARG 28.A NE SER 2.A OG no hydrogen 3.408 N/A ARG 28.A NH1 TYR 77.A O no hydrogen 2.936 N/A ARG 28.A NH2 SER 2.A O no hydrogen 2.872 N/A VAL 29.A N GLU 52.A O no hydrogen 2.923 N/A PHE 30.A N ALA 5.A O no hydrogen 2.774 N/A VAL 31.A N ASP 54.A O no hydrogen 3.159 N/A CYS 32.A N VAL 7.A O no hydrogen 3.176 N/A CYS 32.A SG CYS 58.A O no hydrogen 4.018 N/A LEU 39.A N GLY 35.A O no hydrogen 3.119 N/A ARG 40.A N GLU 36.A O no hydrogen 3.091 N/A THR 41.A N GLU 37.A O no hydrogen 2.952 N/A THR 41.A OG1 GLU 37.A O no hydrogen 2.788 N/A THR 42.A N GLY 38.A O no hydrogen 2.921 N/A THR 42.A OG1 THR 11.A O no hydrogen 3.553 N/A THR 42.A OG1 GLY 38.A O no hydrogen 3.268 N/A LEU 43.A N LEU 39.A O no hydrogen 2.902 N/A LYS 44.A N ARG 40.A O no hydrogen 3.077 N/A GLU 45.A N THR 41.A O no hydrogen 3.164 N/A LEU 46.A N THR 42.A O no hydrogen 3.048 N/A ARG 47.A N LEU 43.A O no hydrogen 3.126 N/A ARG 47.A NE ALA 53.A O no hydrogen 3.120 N/A ARG 47.A NH2 ALA 53.A O no hydrogen 3.374 N/A GLU 48.A N LYS 44.A O no hydrogen 2.848 N/A ALA 49.A N LEU 46.A O no hydrogen 3.105 N/A GLY 50.A N ARG 47.A O no hydrogen 2.813 N/A VAL 51.A N LEU 46.A O no hydrogen 3.014 N/A ASP 54.A N VAL 29.A O no hydrogen 3.185 N/A ARG 56.A N VAL 31.A O no hydrogen 3.309 N/A CYS 58.A N ALA 33.A O no hydrogen 2.909 N/A ASP 59.A N GLU 65.A OE1 no hydrogen 2.918 N/A ARG 61.A N ASP 59.A OD1 no hydrogen 2.924 N/A ARG 61.A NE ASP 59.A OD1 no hydrogen 2.915 N/A ARG 61.A NH1 ASP 105.A OD2 no hydrogen 3.049 N/A ARG 61.A NH2 ASP 59.A OD2 no hydrogen 2.653 N/A SER 62.A N ASP 59.A O no hydrogen 2.972 N/A GLU 65.A N SER 62.A OG no hydrogen 3.418 N/A ILE 66.A N SER 62.A O no hydrogen 3.014 N/A GLU 67.A N VAL 63.A O no hydrogen 2.867 N/A ALA 68.A N PRO 64.A O no hydrogen 2.803 N/A LEU 69.A N GLU 65.A O no hydrogen 2.830 N/A VAL 70.A N ILE 66.A O no hydrogen 2.873 N/A ALA 71.A N GLU 67.A O no hydrogen 3.256 N/A ALA 72.A N ALA 68.A O no hydrogen 2.939 N/A VAL 73.A N LEU 69.A O no hydrogen 3.238 N/A VAL 74.A N VAL 70.A O no hydrogen 3.173 N/A GLU 75.A N ALA 71.A O no hydrogen 3.123 N/A ARG 76.A N ALA 72.A O no hydrogen 2.898 N/A ARG 76.A NE ASP 54.A OD2 no hydrogen 3.133 N/A ARG 76.A NH1 ARG 76.A O no hydrogen 3.057 N/A ARG 76.A NH2 GLU 52.A OE2 no hydrogen 3.442 N/A TYR 77.A N VAL 73.A O no hydrogen 2.781 N/A TYR 77.A OH GLU 52.A OE1 no hydrogen 2.989 N/A GLY 78.A N VAL 73.A O no hydrogen 3.156 N/A VAL 80.A N GLY 125.A O no hydrogen 2.953 N/A ASP 81.A N VAL 4.A O no hydrogen 2.964 N/A VAL 82.A N VAL 4.A O no hydrogen 3.130 N/A LEU 83.A N ARG 134.A O no hydrogen 2.759 N/A VAL 84.A N LEU 6.A O no hydrogen 2.940 N/A ASN 85.A N VAL 136.A O no hydrogen 2.958 N/A ASN 86.A N THR 8.A OG1 no hydrogen 2.921 N/A ASN 86.A ND2 THR 8.A O no hydrogen 3.410 N/A ASN 86.A ND2 GLY 9.A O no hydrogen 2.910 N/A ALA 87.A N THR 8.A OG1 no hydrogen 3.158 N/A ARG 89.A NE LEU 90.A O no hydrogen 3.127 N/A ARG 89.A NH1 ASP 105.A OD1 no hydrogen 2.214 N/A GLY 93.A N HIS 149.A O no hydrogen 2.844 N/A GLU 97.A N ALA 94.A O no hydrogen 2.936 N/A LEU 98.A N THR 95.A O no hydrogen 3.338 N/A TRP 103.A N ALA 99.A O no hydrogen 3.122 N/A LEU 104.A N ASP 100.A O no hydrogen 2.949 N/A ASP 105.A N GLU 101.A O no hydrogen 2.819 N/A VAL 106.A N LEU 102.A O no hydrogen 3.048 N/A VAL 107.A N TRP 103.A O no hydrogen 3.040 N/A GLU 108.A N LEU 104.A O no hydrogen 2.763 N/A THR 109.A N ASP 105.A O no hydrogen 2.789 N/A THR 109.A OG1 ASP 105.A O no hydrogen 3.059 N/A ASN 110.A N VAL 106.A O no hydrogen 2.797 N/A ASN 110.A ND2 SER 156.A OG no hydrogen 3.342 N/A LEU 111.A N VAL 107.A O no hydrogen 2.941 N/A THR 112.A N VAL 107.A O no hydrogen 3.072 N/A GLY 113.A N GLU 108.A O no hydrogen 2.894 N/A PHE 115.A N LEU 111.A O no hydrogen 3.232 N/A ARG 116.A N THR 112.A O no hydrogen 2.831 N/A ARG 116.A NH1 GLU 108.A OE2 no hydrogen 3.337 N/A VAL 117.A N GLY 113.A O no hydrogen 3.063 N/A THR 118.A N VAL 114.A O no hydrogen 3.132 N/A THR 118.A OG1 ASN 85.A OD1 no hydrogen 2.965 N/A THR 118.A OG1 VAL 114.A O no hydrogen 2.606 N/A LYS 119.A N PHE 115.A O no hydrogen 2.952 N/A GLN 120.A N ARG 116.A O no hydrogen 3.101 N/A VAL 121.A N VAL 117.A O no hydrogen 2.868 N/A LEU 122.A N THR 118.A O no hydrogen 2.912 N/A LYS 123.A N LYS 119.A O no hydrogen 3.127 N/A GLY 125.A N GLN 120.A O no hydrogen 3.122 N/A GLY 126.A N LYS 123.A O no hydrogen 2.975 N/A LEU 128.A N LEU 122.A O no hydrogen 2.993 N/A ARG 130.A N GLY 126.A O no hydrogen 3.178 N/A ARG 130.A NE THR 132.A O no hydrogen 3.511 N/A ARG 130.A NH2 VAL 80.A O no hydrogen 2.655 N/A ARG 130.A NH2 THR 132.A O no hydrogen 3.447 N/A GLY 131.A N MET 127.A O no hydrogen 2.938 N/A ARG 134.A N ASP 81.A O no hydrogen 2.836 N/A ARG 134.A NE GLY 133.A O no hydrogen 3.211 N/A ARG 134.A NH2 GLY 175.A O no hydrogen 3.453 N/A ILE 135.A N THR 177.A O no hydrogen 2.971 N/A VAL 136.A N LEU 83.A O no hydrogen 2.841 N/A ASN 137.A N ASN 179.A O no hydrogen 2.922 N/A ASN 137.A ND2 THR 164.A OG1 no hydrogen 2.822 N/A ILE 138.A N ASN 85.A O no hydrogen 2.891 N/A ALA 139.A N VAL 181.A O no hydrogen 2.744 N/A SER 140.A OG TYR 153.A OH no hydrogen 2.742 N/A THR 141.A N PRO 183.A O no hydrogen 3.029 N/A GLY 142.A N SER 140.A OG no hydrogen 2.812 N/A GLY 143.A N SER 140.A O no hydrogen 2.940 N/A LYS 144.A N THR 141.A O no hydrogen 3.056 N/A LYS 144.A NZ ALA 247.A O no hydrogen 2.568 N/A LYS 144.A NZ ASN 249.A OD1 no hydrogen 2.565 N/A LYS 144.A NZ TYR 257.A O no hydrogen 3.002 N/A GLN 145.A N THR 141.A O no hydrogen 3.015 N/A GLN 145.A NE2 LEU 254.A O no hydrogen 3.273 N/A VAL 147.A N SER 154.A OG no hydrogen 2.975 N/A ALA 150.A N VAL 147.A O no hydrogen 2.970 N/A TYR 153.A OH SER 140.A OG no hydrogen 2.742 N/A SER 154.A N ALA 150.A O no hydrogen 2.890 N/A SER 154.A OG ALA 150.A O no hydrogen 3.366 N/A ALA 155.A N ALA 151.A O no hydrogen 2.935 N/A SER 156.A N PRO 152.A O no hydrogen 2.822 N/A SER 156.A OG PRO 152.A O no hydrogen 2.988 N/A SER 156.A OG TYR 153.A O no hydrogen 2.869 N/A LYS 157.A N TYR 153.A O no hydrogen 2.883 N/A LYS 157.A NZ ILE 138.A O no hydrogen 3.378 N/A LYS 157.A NZ ALA 139.A O no hydrogen 3.185 N/A HIS 158.A N SER 154.A O no hydrogen 2.883 N/A GLY 159.A N ALA 155.A O no hydrogen 2.991 N/A VAL 160.A N SER 156.A O no hydrogen 2.978 N/A VAL 161.A N LYS 157.A O no hydrogen 3.212 N/A GLY 162.A N HIS 158.A O no hydrogen 2.962 N/A PHE 163.A N GLY 159.A O no hydrogen 2.826 N/A THR 164.A N VAL 160.A O no hydrogen 2.854 N/A THR 164.A OG1 VAL 160.A O no hydrogen 2.582 N/A LYS 165.A N VAL 161.A O no hydrogen 3.003 N/A ALA 166.A N GLY 162.A O no hydrogen 3.048 N/A LEU 167.A N PHE 163.A O no hydrogen 2.870 N/A GLY 168.A N THR 164.A O no hydrogen 2.955 N/A LEU 169.A N LYS 165.A O no hydrogen 3.044 N/A GLU 170.A N ALA 166.A O no hydrogen 2.974 N/A LEU 171.A N LEU 167.A O no hydrogen 3.021 N/A ALA 172.A N LEU 169.A O no hydrogen 3.110 N/A THR 174.A N LEU 171.A O no hydrogen 2.959 N/A THR 174.A OG1 LEU 171.A O no hydrogen 3.017 N/A ILE 176.A N THR 174.A OG1 no hydrogen 2.913 N/A THR 177.A N GLY 133.A O no hydrogen 3.105 N/A VAL 178.A N THR 244.A OG1 no hydrogen 3.034 N/A ASN 179.A N ILE 135.A O no hydrogen 2.981 N/A ASN 179.A ND2 GLN 246.A O no hydrogen 3.632 N/A ALA 180.A N GLN 246.A O no hydrogen 2.802 N/A VAL 181.A N ASN 137.A O no hydrogen 2.880 N/A CYS 182.A N LEU 248.A O no hydrogen 2.649 N/A GLY 184.A N VAL 250.A O no hydrogen 2.951 N/A GLU 187.A N VAL 223.A O no hydrogen 2.961 N/A MET 190.A N THR 188.A OG1 no hydrogen 3.134 N/A ALA 192.A N THR 188.A O no hydrogen 2.957 N/A SER 193.A N PRO 189.A O no hydrogen 2.832 N/A SER 193.A OG MET 190.A O no hydrogen 3.198 N/A VAL 194.A N MET 190.A O no hydrogen 3.067 N/A ARG 195.A N ALA 191.A O no hydrogen 3.067 N/A ARG 195.A NH1 GLU 187.A OE1 no hydrogen 3.263 N/A ARG 195.A NH1 GLU 187.A OE2 no hydrogen 3.373 N/A ARG 195.A NH2 GLU 187.A OE2 no hydrogen 3.055 N/A GLU 196.A N ALA 192.A O no hydrogen 2.915 N/A HIS 197.A N SER 193.A O no hydrogen 2.934 N/A TYR 198.A N VAL 194.A O no hydrogen 3.027 N/A SER 199.A N ARG 195.A O no hydrogen 2.929 N/A SER 199.A OG VAL 204.A O no hydrogen 2.744 N/A ASP 200.A N GLU 196.A O no hydrogen 3.230 N/A ILE 201.A N HIS 197.A O no hydrogen 2.975 N/A TRP 202.A N TYR 198.A O no hydrogen 2.962 N/A ALA 209.A N SER 205.A O no hydrogen 3.299 N/A PHE 210.A N THR 206.A O no hydrogen 3.026 N/A ASP 211.A N GLU 207.A O no hydrogen 3.128 N/A ARG 212.A N GLU 208.A O no hydrogen 2.881 N/A ARG 212.A NE GLU 208.A OE1 no hydrogen 2.750 N/A ARG 212.A NH2 GLU 208.A OE1 no hydrogen 2.824 N/A ILE 213.A N ALA 209.A O no hydrogen 2.839 N/A THR 214.A N PHE 210.A O no hydrogen 3.040 N/A ALA 215.A N ASP 211.A O no hydrogen 3.179 N/A ARG 216.A N ILE 213.A O no hydrogen 2.866 N/A VAL 217.A N THR 214.A O no hydrogen 3.286 N/A ILE 219.A N GLY 252.A O no hydrogen 3.147 N/A GLY 220.A N VAL 217.A O no hydrogen 2.744 N/A ARG 221.A NH1 TYR 222.A O no hydrogen 2.953 N/A ARG 221.A NH1 GLU 227.A OE1 no hydrogen 2.992 N/A ARG 221.A NH1 GLU 227.A OE2 no hydrogen 3.558 N/A ARG 221.A NH2 GLU 227.A OE1 no hydrogen 3.566 N/A ARG 221.A NH2 GLU 227.A OE2 no hydrogen 2.733 N/A VAL 223.A N PHE 185.A O no hydrogen 2.746 N/A GLN 224.A N GLU 227.A OE1 no hydrogen 2.827 N/A GLU 227.A N GLN 224.A O no hydrogen 2.825 N/A ALA 229.A N PRO 225.A O no hydrogen 3.057 N/A GLU 230.A N SER 226.A O no hydrogen 2.780 N/A MET 231.A N GLU 227.A O no hydrogen 3.367 N/A VAL 232.A N VAL 228.A O no hydrogen 3.223 N/A ALA 233.A N ALA 229.A O no hydrogen 2.897 N/A TYR 234.A N GLU 230.A O no hydrogen 3.138 N/A LEU 235.A N MET 231.A O no hydrogen 3.081 N/A ILE 236.A N VAL 232.A O no hydrogen 2.927 N/A GLY 237.A N ALA 233.A O no hydrogen 3.363 N/A GLY 237.A N TYR 234.A O no hydrogen 3.327 N/A ALA 240.A N GLY 237.A O no hydrogen 3.362 N/A ALA 241.A N PRO 238.A O no hydrogen 3.355 N/A VAL 243.A N ALA 240.A O no hydrogen 3.121 N/A ALA 245.A N VAL 178.A O no hydrogen 2.766 N/A GLN 246.A NE2 THR 244.A O no hydrogen 3.070 N/A LEU 248.A N ALA 180.A O no hydrogen 2.831 N/A VAL 250.A N CYS 182.A O no hydrogen 3.191 N/A LEU 254.A N CYS 251.A O no hydrogen 3.352 N/A TYR 257.A OH LYS 144.A O no hydrogen 3.090 N/A