Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3cnn_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ASP 5.A N ARG 1.A O no hydrogen 2.999 N/A LEU 6.A N GLN 2.A O no hydrogen 3.210 N/A LEU 7.A N ILE 3.A O no hydrogen 2.917 N/A ARG 8.A N ASP 5.A O no hydrogen 3.342 N/A LEU 9.A N LEU 6.A O no hydrogen 3.367 N/A VAL 10.A N LEU 7.A O no hydrogen 3.462 N/A ASN 11.A N ARG 89.A O no hydrogen 3.014 N/A ASN 11.A ND2 LEU 87.A O no hydrogen 2.880 N/A THR 12.A N ARG 89.A O no hydrogen 2.924 N/A THR 12.A OG1 ASN 11.A OD1 no hydrogen 2.862 N/A VAL 13.A N GLU 36.A O no hydrogen 2.658 N/A VAL 14.A N LEU 91.A O no hydrogen 2.816 N/A GLU 15.A N ILE 38.A O no hydrogen 2.929 N/A VAL 16.A N VAL 93.A O no hydrogen 2.809 N/A ARG 17.A N LEU 40.A O no hydrogen 2.812 N/A ARG 17.A NH1 PRO 22.A O no hydrogen 3.014 N/A ARG 17.A NH2 GLU 15.A OE1 no hydrogen 3.115 N/A ARG 17.A NH2 GLU 15.A OE2 no hydrogen 2.610 N/A ASP 18.A N THR 25.A OG1 no hydrogen 3.030 N/A ALA 19.A N ASN 42.A O no hydrogen 2.920 N/A ARG 20.A N ASP 18.A OD1 no hydrogen 3.121 N/A ARG 20.A NE ASP 18.A OD1 no hydrogen 2.902 N/A ARG 20.A NE ASP 18.A OD2 no hydrogen 3.344 N/A ARG 20.A NH1 VAL 212.A O no hydrogen 2.876 N/A ARG 20.A NH1 ALA 213.A O no hydrogen 3.170 N/A ARG 20.A NH2 ASP 18.A OD2 no hydrogen 2.853 N/A ARG 20.A NH2 ALA 213.A O no hydrogen 2.733 N/A ALA 21.A N ASP 18.A O no hydrogen 3.110 N/A PHE 23.A N GLU 223.A OE2 no hydrogen 2.946 N/A ALA 24.A N GLU 223.A OE2 no hydrogen 2.871 N/A THR 25.A N ALA 21.A O no hydrogen 3.125 N/A THR 25.A OG1 ASP 18.A O no hydrogen 3.518 N/A THR 25.A OG1 ALA 21.A O no hydrogen 2.580 N/A SER 26.A N PHE 23.A O no hydrogen 2.908 N/A SER 26.A OG PHE 23.A O no hydrogen 2.939 N/A ALA 27.A N GLU 15.A OE1 no hydrogen 2.435 N/A SER 33.A N ASP 31.A OD1 no hydrogen 3.250 N/A SER 33.A OG ASP 31.A OD1 no hydrogen 2.370 N/A SER 33.A OG ASP 31.A OD2 no hydrogen 3.395 N/A LYS 35.A N PHE 32.A O no hydrogen 3.331 N/A LYS 35.A NZ LEU 7.A O no hydrogen 2.428 N/A LYS 35.A NZ VAL 10.A O no hydrogen 2.749 N/A GLU 36.A N ASN 11.A O no hydrogen 2.906 N/A THR 37.A OG1 PHE 32.A O no hydrogen 3.057 N/A ILE 38.A N VAL 13.A O no hydrogen 2.855 N/A ILE 39.A N ARG 65.A O no hydrogen 2.736 N/A LEU 40.A N GLU 15.A O no hydrogen 2.910 N/A LEU 41.A N ILE 67.A O no hydrogen 2.750 N/A ASN 42.A N ARG 17.A O no hydrogen 2.813 N/A ASN 42.A ND2 THR 98.A O no hydrogen 2.745 N/A LYS 43.A NZ ASN 97.A O no hydrogen 2.946 N/A VAL 44.A N THR 69.A O no hydrogen 3.384 N/A ILE 46.A N LYS 43.A O no hydrogen 3.203 N/A ALA 47.A N VAL 44.A O no hydrogen 3.328 N/A ASP 48.A N SER 221.A OG no hydrogen 2.908 N/A THR 51.A N ASP 48.A OD1 no hydrogen 2.925 N/A THR 51.A OG1 ASP 48.A OD1 no hydrogen 2.502 N/A THR 52.A N ASP 48.A O no hydrogen 2.884 N/A THR 52.A OG1 ASP 48.A O no hydrogen 3.400 N/A LYS 53.A N GLU 49.A O no hydrogen 3.047 N/A LYS 54.A N LYS 50.A O no hydrogen 3.157 N/A TRP 55.A N THR 51.A O no hydrogen 2.996 N/A TRP 55.A NE1 GLU 223.A O no hydrogen 2.785 N/A VAL 56.A N THR 52.A O no hydrogen 2.970 N/A GLU 57.A N LYS 53.A O no hydrogen 3.116 N/A PHE 58.A N LYS 54.A O no hydrogen 3.099 N/A PHE 59.A N TRP 55.A O no hydrogen 3.004 N/A LYS 60.A N VAL 56.A O no hydrogen 2.957 N/A LYS 61.A N GLU 57.A O no hydrogen 2.940 N/A GLN 62.A N PHE 58.A O no hydrogen 3.348 N/A GLY 63.A N LYS 60.A O no hydrogen 2.809 N/A LYS 64.A N PHE 59.A O no hydrogen 3.037 N/A ARG 65.A NH1 GLU 36.A OE2 no hydrogen 3.083 N/A ARG 65.A NH2 LEU 82.A O no hydrogen 2.615 N/A ILE 67.A N ILE 39.A O no hydrogen 2.811 N/A THR 69.A N LEU 41.A O no hydrogen 3.133 N/A THR 69.A OG1 HIS 70.A O no hydrogen 3.536 N/A THR 69.A OG1 GLU 73.A OE2 no hydrogen 3.087 N/A GLY 72.A N HIS 70.A ND1 no hydrogen 3.151 N/A GLU 73.A N HIS 70.A O no hydrogen 2.971 N/A ARG 75.A NE LYS 106.A O no hydrogen 3.239 N/A ARG 75.A NE LEU 107.A O no hydrogen 3.286 N/A ARG 75.A NH2 LEU 107.A O no hydrogen 3.032 N/A VAL 77.A N PRO 74.A O no hydrogen 2.879 N/A LEU 78.A N PRO 74.A O no hydrogen 3.190 N/A LEU 79.A N ARG 75.A O no hydrogen 2.915 N/A LYS 80.A N LYS 76.A O no hydrogen 3.095 N/A LYS 81.A N VAL 77.A O no hydrogen 2.992 N/A LYS 81.A NZ THR 68.A O no hydrogen 2.833 N/A LYS 81.A NZ GLU 73.A OE1 no hydrogen 3.374 N/A LYS 81.A NZ GLU 73.A OE2 no hydrogen 2.605 N/A LEU 82.A N LEU 78.A O no hydrogen 2.831 N/A SER 83.A N LEU 79.A O no hydrogen 2.840 N/A SER 83.A OG LYS 80.A O no hydrogen 2.965 N/A LEU 87.A N ASP 85.A OD2 no hydrogen 3.075 N/A ALA 88.A N ASP 85.A O no hydrogen 3.234 N/A ARG 89.A N ASN 11.A OD1 no hydrogen 2.735 N/A VAL 90.A N LYS 124.A O no hydrogen 2.872 N/A LEU 91.A N THR 12.A O no hydrogen 2.856 N/A VAL 93.A N VAL 14.A O no hydrogen 2.758 N/A GLY 94.A N GLY 130.A O no hydrogen 3.193 N/A ASN 97.A ND2 VAL 148.A O no hydrogen 2.845 N/A THR 98.A OG1 VAL 16.A O no hydrogen 2.832 N/A THR 98.A OG1 VAL 95.A O no hydrogen 3.413 N/A LYS 100.A NZ GLY 94.A O no hydrogen 3.568 N/A LYS 100.A NZ VAL 95.A O no hydrogen 2.718 N/A ILE 103.A N GLY 99.A O no hydrogen 3.138 N/A ILE 104.A N LYS 100.A O no hydrogen 3.093 N/A ASN 105.A N SER 101.A O no hydrogen 2.895 N/A LYS 106.A N THR 102.A O no hydrogen 3.099 N/A LYS 106.A NZ HIS 70.A O no hydrogen 2.995 N/A LYS 106.A NZ LYS 71.A O no hydrogen 2.869 N/A LYS 106.A NZ GLU 73.A O no hydrogen 2.581 N/A LEU 107.A N ILE 103.A O no hydrogen 2.859 N/A LYS 108.A N ILE 104.A O no hydrogen 2.677 N/A LYS 108.A NZ ARG 111.A O no hydrogen 2.916 N/A GLY 109.A N ASN 105.A O no hydrogen 2.819 N/A ARG 111.A N GLY 109.A O no hydrogen 2.853 N/A GLN 115.A N ASP 127.A OD2 no hydrogen 3.438 N/A PHE 117.A N ILE 125.A O no hydrogen 3.025 N/A LEU 119.A N VAL 123.A O no hydrogen 2.756 N/A GLY 122.A N LEU 119.A O no hydrogen 3.108 N/A LYS 124.A N ALA 88.A O no hydrogen 3.171 N/A ILE 125.A N PHE 117.A O no hydrogen 2.917 N/A LEU 126.A N VAL 90.A O no hydrogen 3.028 N/A ASP 127.A N GLN 115.A O no hydrogen 2.991 N/A THR 128.A OG1 ASP 127.A OD2 no hydrogen 3.174 N/A GLY 130.A N ILE 92.A O no hydrogen 2.973 N/A LEU 132.A N GLY 94.A O no hydrogen 2.917 N/A LYS 134.A NZ PHE 23.A O no hydrogen 3.477 N/A LYS 134.A NZ ALA 24.A O no hydrogen 3.051 N/A LYS 134.A NZ SER 26.A O no hydrogen 2.882 N/A LYS 134.A NZ SER 26.A OG no hydrogen 3.190 N/A LEU 141.A N SER 138.A OG no hydrogen 3.090 N/A ALA 142.A N SER 138.A O no hydrogen 3.364 N/A ALA 143.A N GLU 139.A O no hydrogen 3.016 N/A LYS 144.A N ASP 140.A O no hydrogen 3.007 N/A LYS 144.A NZ ASP 140.A OD2 no hydrogen 2.811 N/A LYS 144.A NZ GLU 223.A OE1 no hydrogen 3.021 N/A LEU 145.A N LEU 141.A O no hydrogen 2.916 N/A LEU 146.A N ALA 142.A O no hydrogen 2.877 N/A LEU 147.A N ALA 143.A O no hydrogen 2.966 N/A VAL 148.A N LYS 144.A O no hydrogen 3.083 N/A GLY 149.A N LEU 146.A O no hydrogen 3.003 N/A SER 150.A N LEU 145.A O no hydrogen 2.710 N/A SER 150.A OG PRO 96.A O no hydrogen 3.023 N/A LEU 151.A N LEU 145.A O no hydrogen 2.900 N/A GLU 154.A N GLU 154.A OE1 no hydrogen 2.347 N/A ARG 155.A N PRO 152.A O no hydrogen 3.318 N/A ILE 156.A N VAL 153.A O no hydrogen 2.800 N/A ARG 160.A N ASP 158.A OD1 no hydrogen 2.782 N/A ARG 160.A NE ASP 158.A OD1 no hydrogen 3.333 N/A ARG 160.A NE ASP 158.A OD2 no hydrogen 3.236 N/A ARG 160.A NH2 ASP 158.A OD2 no hydrogen 2.827 N/A ILE 161.A N ASP 158.A O no hydrogen 3.055 N/A GLU 163.A N GLN 159.A O no hydrogen 3.127 N/A ARG 164.A N ARG 160.A O no hydrogen 2.983 N/A ARG 164.A NE GLU 167.A OE1 no hydrogen 3.193 N/A ARG 164.A NH1 GLU 167.A OE1 no hydrogen 2.953 N/A ARG 164.A NH2 ASP 140.A OD1 no hydrogen 2.322 N/A ALA 165.A N ILE 161.A O no hydrogen 2.915 N/A PHE 166.A N PHE 162.A O no hydrogen 3.036 N/A GLU 167.A N GLU 163.A O no hydrogen 2.758 N/A ILE 168.A N ARG 164.A O no hydrogen 2.871 N/A PHE 169.A N ALA 165.A O no hydrogen 2.942 N/A ALA 170.A N PHE 166.A O no hydrogen 2.770 N/A ARG 171.A N GLU 167.A O no hydrogen 2.974 N/A SER 172.A N ILE 168.A O no hydrogen 3.048 N/A SER 172.A OG ILE 168.A O no hydrogen 3.075 N/A SER 172.A OG PHE 169.A O no hydrogen 3.501 N/A SER 172.A OG SER 221.A O no hydrogen 3.018 N/A ILE 173.A N ALA 170.A O no hydrogen 3.086 N/A GLY 174.A N ALA 170.A O no hydrogen 2.642 N/A SER 178.A OG GLU 181.A OE2 no hydrogen 3.063 N/A GLU 181.A N SER 178.A OG no hydrogen 3.330 N/A PHE 182.A N SER 178.A O no hydrogen 2.999 N/A PHE 183.A N PHE 179.A O no hydrogen 3.148 N/A GLU 184.A N SER 180.A O no hydrogen 3.089 N/A ASP 185.A N GLU 181.A O no hydrogen 2.959 N/A PHE 186.A N PHE 182.A O no hydrogen 2.844 N/A ALA 187.A N PHE 183.A O no hydrogen 2.979 N/A ARG 188.A N GLU 184.A O no hydrogen 3.176 N/A ARG 188.A NE GLU 184.A OE1 no hydrogen 3.197 N/A ARG 188.A NE GLU 184.A OE2 no hydrogen 3.121 N/A ARG 188.A NH2 GLU 184.A OE1 no hydrogen 3.130 N/A LYS 189.A N ASP 185.A O no hydrogen 2.877 N/A ARG 190.A NH1 GLU 211.A OE1 no hydrogen 2.624 N/A ARG 190.A NH1 GLU 211.A OE2 no hydrogen 3.232 N/A ARG 190.A NH2 GLU 211.A OE2 no hydrogen 2.823 N/A GLY 191.A N ARG 188.A O no hydrogen 2.871 N/A LEU 192.A N ALA 187.A O no hydrogen 2.606 N/A LYS 194.A N VAL 198.A O no hydrogen 2.605 N/A GLY 197.A N LYS 194.A O no hydrogen 2.895 N/A ASP 200.A N LEU 192.A O no hydrogen 2.682 N/A ARG 203.A N ASP 200.A OD1 no hydrogen 3.302 N/A ALA 204.A N ASP 200.A O no hydrogen 3.057 N/A LEU 205.A N ILE 201.A O no hydrogen 2.831 N/A MET 206.A N GLU 202.A O no hydrogen 3.046 N/A LEU 207.A N ARG 203.A O no hydrogen 2.856 N/A PHE 208.A N ALA 204.A O no hydrogen 2.831 N/A PHE 209.A N LEU 205.A O no hydrogen 3.028 N/A THR 210.A N MET 206.A O no hydrogen 3.074 N/A THR 210.A OG1 MET 206.A O no hydrogen 2.633 N/A GLU 211.A N LEU 207.A O no hydrogen 2.908 N/A VAL 212.A N PHE 208.A O no hydrogen 2.860 N/A ALA 213.A N PHE 209.A O no hydrogen 2.935 N/A GLN 214.A N THR 210.A O no hydrogen 3.031 N/A GLY 215.A N VAL 212.A O no hydrogen 2.927 N/A LYS 216.A N GLU 211.A O no hydrogen 2.765 N/A LYS 216.A NZ GLN 214.A OE1 no hydrogen 2.836 N/A ARG 219.A NH1 VAL 44.A O no hydrogen 2.776 N/A ARG 219.A NH1 ALA 47.A O no hydrogen 2.536 N/A VAL 220.A N ILE 46.A O no hydrogen 3.391 N/A PHE 222.A N ARG 20.A O no hydrogen 2.796 N/A GLU 223.A N ARG 20.A O no hydrogen 3.152 N/A ARG 224.A N ASP 227.A OD2 no hydrogen 3.131 N/A ARG 224.A NH1 SER 221.A O no hydrogen 3.236 N/A ARG 224.A NH2 SER 221.A O no hydrogen 3.546 N/A ASP 227.A N ARG 224.A O no hydrogen 3.059 N/A