Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3v17_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): SER 1.A OG GLY 17.A O no hydrogen 3.211 N/A THR 3.A N SER 16.A O no hydrogen 2.795 N/A THR 3.A OG1 SER 1.A O no hydrogen 3.207 N/A THR 5.A N GLN 14.A O no hydrogen 2.742 N/A LEU 7.A N GLY 12.A O no hydrogen 2.803 N/A SER 8.A OG LEU 11.A O no hydrogen 3.088 N/A GLY 12.A N HIS 39.A O no hydrogen 2.873 N/A ALA 13.A N VAL 41.A O no hydrogen 3.077 N/A GLN 14.A N THR 5.A O no hydrogen 2.710 N/A ILE 15.A N PHE 43.A O no hydrogen 2.739 N/A SER 16.A N THR 3.A O no hydrogen 3.047 N/A SER 21.A N ASP 19.A OD1 no hydrogen 2.833 N/A SER 21.A OG ASP 19.A OD1 no hydrogen 2.468 N/A SER 21.A OG ASP 19.A OD2 no hydrogen 3.380 N/A ARG 22.A N ASP 19.A O no hydrogen 3.207 N/A SER 25.A N GLU 28.A OE1 no hydrogen 3.320 N/A GLU 27.A N GLU 27.A OE1 no hydrogen 2.687 N/A GLU 28.A N SER 25.A OG no hydrogen 3.185 N/A ARG 29.A N SER 25.A O no hydrogen 2.976 N/A ARG 29.A NE ARG 60.A O no hydrogen 2.881 N/A ARG 29.A NH1 ASP 30.A OD1 no hydrogen 2.867 N/A ARG 29.A NH2 ARG 60.A O no hydrogen 3.156 N/A ASP 30.A N ALA 26.A O no hydrogen 2.884 N/A ALA 31.A N GLU 27.A O no hydrogen 2.869 N/A ILE 32.A N GLU 28.A O no hydrogen 3.007 N/A GLU 33.A N ARG 29.A O no hydrogen 2.947 N/A GLN 34.A N ASP 30.A O no hydrogen 3.085 N/A GLN 34.A NE2 ASP 30.A O no hydrogen 3.218 N/A ALA 35.A N ALA 31.A O no hydrogen 3.189 N/A LEU 36.A N ILE 32.A O no hydrogen 2.863 N/A LEU 37.A N GLU 33.A O no hydrogen 2.943 N/A GLN 38.A N GLN 34.A O no hydrogen 2.878 N/A HIS 39.A N ALA 35.A O no hydrogen 2.645 N/A GLN 40.A N LEU 36.A O no hydrogen 2.733 N/A GLN 40.A NE2 SER 127.A OG no hydrogen 2.722 N/A VAL 41.A N HIS 39.A O no hydrogen 2.725 N/A LEU 42.A N PHE 244.A O no hydrogen 2.766 N/A PHE 43.A N ALA 13.A O no hydrogen 2.880 N/A LEU 44.A N VAL 242.A O no hydrogen 2.847 N/A ARG 45.A NE ASP 241.A OD1 no hydrogen 2.947 N/A ARG 45.A NH2 ARG 236.A O no hydrogen 2.730 N/A ARG 45.A NH2 ASP 241.A OD2 no hydrogen 2.886 N/A GLN 47.A N ASN 240.A O no hydrogen 2.877 N/A GLN 47.A NE2 ASP 19.A OD1 no hydrogen 2.970 N/A GLN 47.A NE2 PRO 48.A O no hydrogen 3.587 N/A ASN 50.A N GLN 53.A OE1 no hydrogen 2.944 N/A GLN 53.A N ASN 50.A OD1 no hydrogen 2.729 N/A GLN 54.A N ASN 50.A O no hydrogen 2.795 N/A GLN 54.A NE2 VAL 110.A O no hydrogen 2.893 N/A GLN 54.A NE2 HIS 266.A O no hydrogen 3.005 N/A ALA 55.A N PRO 51.A O no hydrogen 2.920 N/A ARG 56.A N GLU 52.A O no hydrogen 3.066 N/A ARG 56.A NE ASP 23.A OD1 no hydrogen 2.762 N/A ARG 56.A NH1 SER 21.A O no hydrogen 3.425 N/A ARG 56.A NH2 GLU 52.A OE2 no hydrogen 2.856 N/A PHE 57.A N GLN 53.A O no hydrogen 3.091 N/A ALA 58.A N GLN 54.A O no hydrogen 3.080 N/A ALA 59.A N ALA 55.A O no hydrogen 2.971 N/A ARG 60.A N PHE 57.A O no hydrogen 3.146 N/A ARG 60.A NH1 ILE 24.A O no hydrogen 2.841 N/A ARG 60.A NH2 ILE 24.A O no hydrogen 3.146 N/A PHE 61.A N ALA 58.A O no hydrogen 2.945 N/A HIS 65.A N THR 269.A O no hydrogen 2.927 N/A HIS 67.A N PRO 77.A O no hydrogen 3.078 N/A ASN 72.A ND2 TYR 70.A O no hydrogen 3.124 N/A VAL 73.A N VAL 79.A O no hydrogen 3.363 N/A GLN 78.A N THR 76.A OG1 no hydrogen 3.393 N/A VAL 79.A N THR 76.A O no hydrogen 3.244 N/A LEU 80.A N ARG 267.A O no hydrogen 2.573 N/A VAL 81.A N PRO 71.A O no hydrogen 2.721 N/A LEU 82.A N MET 265.A O no hydrogen 2.706 N/A THR 84.A N ARG 263.A O no hydrogen 3.159 N/A THR 84.A OG1 ARG 263.A O no hydrogen 3.555 N/A ALA 85.A N ASP 83.A OD1 no hydrogen 2.846 N/A VAL 86.A N ASP 83.A O no hydrogen 2.892 N/A THR 87.A N ASP 83.A O no hydrogen 2.683 N/A ARG 90.A N ASP 88.A OD1 no hydrogen 2.901 N/A ASN 92.A N VAL 89.A O no hydrogen 3.235 N/A ALA 93.A N ARG 90.A O no hydrogen 3.084 N/A HIS 96.A N HIS 252.A O no hydrogen 3.222 N/A HIS 96.A ND1 VAL 94.A O no hydrogen 2.616 N/A THR 97.A OG1 THR 250.A O no hydrogen 2.792 N/A ASP 98.A N ASN 247.A OD1 no hydrogen 2.934 N/A THR 100.A OG1 HIS 150.A ND1 no hydrogen 2.848 N/A THR 100.A OG1 ASN 200.A OD1 no hydrogen 3.167 N/A LEU 102.A N VAL 99.A O no hydrogen 3.094 N/A THR 104.A OG1 THR 104.A O no hydrogen 2.664 N/A LEU 107.A N ILE 270.A O no hydrogen 2.657 N/A GLY 108.A N ILE 270.A O no hydrogen 3.430 N/A ALA 109.A N TRP 245.A O no hydrogen 3.418 N/A VAL 110.A N ALA 268.A O no hydrogen 2.903 N/A LEU 111.A N ALA 243.A O no hydrogen 2.681 N/A SER 112.A N HIS 266.A O no hydrogen 2.838 N/A ALA 113.A N ASP 241.A O no hydrogen 3.059 N/A LYS 114.A N VAL 264.A O no hydrogen 3.039 N/A LYS 114.A NZ ILE 49.A O no hydrogen 2.445 N/A GLN 115.A N VAL 264.A O no hydrogen 3.119 N/A LEU 116.A N GLU 239.A OE2 no hydrogen 3.331 N/A GLY 121.A N ASP 257.A OD1 no hydrogen 2.710 N/A THR 123.A N TRP 235.A O no hydrogen 3.194 N/A LEU 124.A N PHE 253.A O no hydrogen 2.887 N/A TRP 125.A N ILE 233.A O no hydrogen 3.066 N/A ALA 126.A N GLN 251.A O no hydrogen 2.878 N/A SER 127.A N PHE 231.A O no hydrogen 2.739 N/A GLY 128.A N VAL 249.A O no hydrogen 2.850 N/A ALA 130.A N SER 127.A OG no hydrogen 2.929 N/A ALA 131.A N SER 127.A O no hydrogen 3.004 N/A PHE 132.A N GLY 128.A O no hydrogen 2.908 N/A GLU 133.A N ILE 129.A O no hydrogen 2.964 N/A ALA 134.A N ALA 130.A O no hydrogen 3.107 N/A ALA 134.A N ALA 131.A O no hydrogen 3.342 N/A LEU 135.A N PHE 132.A O no hydrogen 3.204 N/A ARG 140.A N SER 136.A O no hydrogen 2.905 N/A ARG 140.A NH1 LEU 135.A O no hydrogen 2.758 N/A GLU 141.A N ALA 137.A O no hydrogen 2.780 N/A MET 142.A N PRO 138.A O no hydrogen 3.084 N/A LEU 143.A N LEU 139.A O no hydrogen 3.043 N/A ASP 144.A N ARG 140.A O no hydrogen 2.986 N/A LEU 146.A N LEU 143.A O no hydrogen 2.948 N/A THR 147.A N GLU 209.A OE1 no hydrogen 2.866 N/A THR 147.A N GLU 209.A OE2 no hydrogen 3.253 N/A THR 147.A OG1 GLU 209.A OE2 no hydrogen 2.624 N/A ALA 148.A N HIS 183.A O no hydrogen 2.839 N/A THR 149.A N ARG 206.A O no hydrogen 2.763 N/A THR 149.A OG1 ASN 208.A OD1 no hydrogen 2.624 N/A HIS 150.A N LEU 181.A O no hydrogen 2.724 N/A HIS 150.A ND1 THR 100.A OG1 no hydrogen 2.848 N/A ASP 151.A N PHE 203.A O no hydrogen 2.875 N/A THR 153.A N ASP 151.A OD1 no hydrogen 2.953 N/A THR 153.A OG1 ASP 151.A OD1 no hydrogen 2.858 N/A THR 153.A OG1 ASP 151.A OD2 no hydrogen 2.874 N/A LYS 154.A N ASP 151.A O no hydrogen 3.078 N/A LYS 154.A NZ GLU 201.A O no hydrogen 2.844 N/A LYS 154.A NZ THR 204.A O no hydrogen 2.786 N/A SER 155.A N PHE 152.A O no hydrogen 3.143 N/A SER 155.A OG GLY 202.A O no hydrogen 2.685 N/A PHE 156.A N PHE 152.A O no hydrogen 2.843 N/A GLU 159.A N GLU 159.A OE1 no hydrogen 2.875 N/A ARG 160.A N PRO 157.A O no hydrogen 3.108 N/A ARG 160.A NH2 SER 155.A O no hydrogen 3.129 N/A PHE 161.A N LEU 158.A O no hydrogen 3.250 N/A GLY 162.A N LEU 158.A O no hydrogen 3.501 N/A GLN 166.A N GLN 166.A OE1 no hydrogen 2.722 N/A ASP 167.A N THR 164.A OG1 no hydrogen 3.401 N/A LEU 168.A N THR 164.A O no hydrogen 3.063 N/A ALA 169.A N PRO 165.A O no hydrogen 3.164 N/A ARG 170.A N GLN 166.A O no hydrogen 3.064 N/A ARG 170.A NH2 ASP 167.A OD1 no hydrogen 2.595 N/A TRP 171.A N ASP 167.A O no hydrogen 3.209 N/A TRP 171.A NE1 PHE 156.A O no hydrogen 2.960 N/A GLU 172.A N LEU 168.A O no hydrogen 3.109 N/A ALA 173.A N ALA 169.A O no hydrogen 2.925 N/A THR 174.A N ARG 170.A O no hydrogen 3.043 N/A THR 174.A OG1 ARG 170.A O no hydrogen 2.857 N/A THR 174.A OG1 TRP 171.A O no hydrogen 3.283 N/A ARG 175.A N TRP 171.A O no hydrogen 3.155 N/A ARG 175.A NE GLU 172.A OE1 no hydrogen 2.813 N/A ARG 176.A N GLU 172.A O no hydrogen 3.109 N/A ASN 177.A N ALA 173.A O no hydrogen 3.361 N/A ASN 178.A N THR 174.A O no hydrogen 3.031 N/A ASN 178.A ND2 THR 174.A O no hydrogen 3.021 N/A LEU 181.A N HIS 150.A O no hydrogen 3.238 N/A HIS 183.A N ALA 148.A O no hydrogen 2.968 N/A VAL 185.A N LEU 146.A O no hydrogen 2.853 N/A ARG 187.A N ALA 196.A O no hydrogen 2.790 N/A THR 188.A N PHE 276.A O no hydrogen 2.797 N/A HIS 189.A N ARG 194.A O no hydrogen 2.846 N/A HIS 189.A NE2 ASP 246.A OD2 no hydrogen 2.667 N/A VAL 191.A N HIS 189.A ND1 no hydrogen 3.013 N/A SER 192.A N HIS 189.A ND1 no hydrogen 3.249 N/A GLY 193.A N HIS 189.A O no hydrogen 2.919 N/A ARG 194.A N SER 192.A OG no hydrogen 3.245 N/A ARG 194.A NH1 LEU 37.A O no hydrogen 3.003 N/A ARG 194.A NH1 GLN 38.A O no hydrogen 3.087 N/A LYS 195.A NZ ASP 144.A OD2 no hydrogen 3.067 N/A ALA 196.A N ARG 187.A O no hydrogen 2.913 N/A LEU 197.A N GLY 128.A O no hydrogen 3.058 N/A PHE 198.A N VAL 185.A O no hydrogen 2.855 N/A ASN 200.A N THR 204.A OG1 no hydrogen 2.956 N/A GLY 202.A N TRP 95.A O no hydrogen 3.043 N/A PHE 203.A N ASN 200.A O no hydrogen 3.218 N/A THR 204.A N ASN 200.A O no hydrogen 2.905 N/A THR 204.A OG1 ASN 200.A O no hydrogen 3.238 N/A THR 205.A N THR 149.A O no hydrogen 3.047 N/A ARG 206.A NE ILE 207.A O no hydrogen 3.219 N/A ARG 206.A NE LEU 210.A O no hydrogen 3.082 N/A ARG 206.A NH2 LEU 210.A O no hydrogen 2.818 N/A ILE 207.A N SER 215.A OG no hydrogen 2.760 N/A ASN 208.A N THR 147.A O no hydrogen 2.860 N/A ASN 208.A ND2 THR 147.A OG1 no hydrogen 2.920 N/A ASN 208.A ND2 SER 182.A OG no hydrogen 2.875 N/A GLU 209.A N GLU 209.A OE1 no hydrogen 2.718 N/A LEU 210.A N ILE 207.A O no hydrogen 3.102 N/A SER 211.A N GLU 214.A OE1 no hydrogen 2.767 N/A GLU 214.A N SER 211.A OG no hydrogen 3.192 N/A SER 215.A N SER 211.A O no hydrogen 2.776 N/A ASP 216.A N GLU 212.A O no hydrogen 3.025 N/A ALA 217.A N LEU 213.A O no hydrogen 3.298 N/A LEU 218.A N GLU 214.A O no hydrogen 2.973 N/A LEU 219.A N SER 215.A O no hydrogen 2.771 N/A ARG 220.A N ASP 216.A O no hydrogen 3.102 N/A ARG 220.A NE ASP 216.A OD2 no hydrogen 3.036 N/A ARG 220.A NH2 ASP 216.A OD2 no hydrogen 3.318 N/A LEU 221.A N ALA 217.A O no hydrogen 3.026 N/A LEU 222.A N LEU 218.A O no hydrogen 2.779 N/A PHE 223.A N LEU 219.A O no hydrogen 2.794 N/A ALA 224.A N ARG 220.A O no hydrogen 3.209 N/A HIS 225.A N LEU 221.A O no hydrogen 2.854 N/A HIS 225.A NE2 ALA 131.A O no hydrogen 2.783 N/A ALA 226.A N LEU 222.A O no hydrogen 2.948 N/A THR 227.A OG1 PHE 223.A O no hydrogen 2.988 N/A THR 227.A OG1 ALA 224.A O no hydrogen 3.305 N/A ARG 228.A N HIS 225.A O no hydrogen 3.168 N/A ARG 228.A NH1 HIS 225.A ND1 no hydrogen 3.233 N/A ARG 228.A NH2 GLU 230.A OE2 no hydrogen 3.478 N/A GLU 230.A N GLU 230.A OE1 no hydrogen 2.602 N/A PHE 231.A N ARG 228.A O no hydrogen 2.934 N/A SER 232.A N PRO 229.A O no hydrogen 3.322 N/A SER 232.A OG ARG 228.A O no hydrogen 3.330 N/A ILE 233.A N TRP 125.A O no hydrogen 2.937 N/A ARG 234.A NE ASP 122.A OD2 no hydrogen 2.843 N/A ARG 234.A NH2 ASP 122.A OD2 no hydrogen 3.427 N/A TRP 235.A N THR 123.A O no hydrogen 2.820 N/A TRP 235.A NE1 ASP 241.A OD2 no hydrogen 3.126 N/A TRP 237.A NE1 THR 123.A OG1 no hydrogen 2.827 N/A GLN 238.A N ASP 241.A OD2 no hydrogen 2.582 N/A ASN 240.A N ALA 113.A O no hydrogen 2.806 N/A ASP 241.A N GLN 238.A O no hydrogen 3.080 N/A VAL 242.A N LEU 44.A O no hydrogen 2.722 N/A ALA 243.A N LEU 111.A O no hydrogen 2.888 N/A PHE 244.A N LEU 42.A O no hydrogen 2.897 N/A TRP 245.A N ALA 109.A O no hydrogen 3.254 N/A ASP 246.A N GLN 40.A O no hydrogen 2.701 N/A ASN 247.A N LEU 107.A O no hydrogen 2.815 N/A ASN 247.A ND2 ASP 98.A O no hydrogen 3.258 N/A ASN 247.A ND2 ALA 106.A O no hydrogen 2.984 N/A ARG 248.A N ASP 246.A OD1 no hydrogen 3.063 N/A ARG 248.A NE ASP 246.A OD1 no hydrogen 2.777 N/A ARG 248.A NH2 ASP 246.A OD1 no hydrogen 3.496 N/A ARG 248.A NH2 ASP 246.A OD2 no hydrogen 2.974 N/A THR 250.A OG1 ASP 246.A O no hydrogen 2.809 N/A GLN 251.A N ALA 126.A O no hydrogen 3.103 N/A HIS 252.A N HIS 96.A O no hydrogen 2.906 N/A PHE 253.A N LEU 124.A O no hydrogen 2.934 N/A ALA 254.A N ASN 92.A O no hydrogen 3.008 N/A VAL 255.A N ASP 122.A O no hydrogen 2.933 N/A ASN 261.A N TYR 258.A O no hydrogen 2.805 N/A ASN 261.A ND2 TYR 258.A O no hydrogen 2.729 N/A ARG 262.A NE ASP 83.A OD1 no hydrogen 3.240 N/A ARG 262.A NH2 ASP 83.A OD2 no hydrogen 2.744 N/A ARG 263.A N THR 84.A OG1 no hydrogen 2.855 N/A VAL 264.A N GLN 115.A O no hydrogen 2.771 N/A MET 265.A N LEU 82.A O no hydrogen 2.833 N/A HIS 266.A N SER 112.A O no hydrogen 2.981 N/A ARG 267.A N LEU 80.A O no hydrogen 2.686 N/A ALA 268.A N VAL 110.A O no hydrogen 3.038 N/A ILE 270.A N GLY 108.A O no hydrogen 2.834 N/A LEU 271.A N ASP 63.A O no hydrogen 2.798 N/A