Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4wcz_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ARG 3.A N LEU 14.A O no hydrogen 3.069 N/A ARG 3.A NH1 GLU 5.A OE2 no hydrogen 3.144 N/A ARG 3.A NH2 ASP 16.A OD2 no hydrogen 3.381 N/A GLU 5.A N ARG 12.A O no hydrogen 2.834 N/A ARG 6.A NH1 ASP 41.A OD2 no hydrogen 2.954 N/A ASP 7.A N VAL 10.A O no hydrogen 2.749 N/A VAL 10.A N ASP 7.A O no hydrogen 3.376 N/A ALA 11.A N VAL 46.A O no hydrogen 3.023 N/A ARG 12.A N GLU 5.A O no hydrogen 2.753 N/A ARG 12.A NH2 ASP 7.A OD2 no hydrogen 3.503 N/A LEU 13.A N VAL 48.A O no hydrogen 2.731 N/A LEU 14.A N ARG 3.A O no hydrogen 2.811 N/A ILE 15.A N LYS 50.A O no hydrogen 2.963 N/A ASP 16.A N SER 1.A O no hydrogen 2.772 N/A ARG 17.A N ASN 22.A OD1 no hydrogen 2.898 N/A ARG 17.A NH1 ALA 23.A O no hydrogen 2.817 N/A ARG 17.A NH1 ASP 62.A OD2 no hydrogen 2.908 N/A ARG 17.A NH2 ASP 62.A OD2 no hydrogen 2.659 N/A ARG 20.A N ARG 17.A O no hydrogen 3.051 N/A ARG 20.A NH1 ASP 19.A O no hydrogen 3.091 N/A ARG 21.A N ALA 18.A O no hydrogen 3.168 N/A ARG 21.A NH2 ASP 103.A OD2 no hydrogen 2.781 N/A ASN 22.A N ARG 17.A O no hydrogen 2.936 N/A ASN 22.A ND2 ILE 15.A O no hydrogen 3.314 N/A ASN 22.A ND2 SER 51.A OG no hydrogen 3.079 N/A ASN 22.A ND2 PHE 57.A O no hydrogen 3.119 N/A ALA 23.A N ARG 20.A O no hydrogen 3.077 N/A PHE 24.A N GLY 60.A O no hydrogen 2.909 N/A SER 25.A OG ASP 27.A OD1 no hydrogen 2.363 N/A LEU 26.A N GLU 65.A OE1 no hydrogen 3.233 N/A LEU 26.A N GLU 65.A OE2 no hydrogen 3.005 N/A GLN 29.A N LEU 26.A O no hydrogen 3.040 N/A ARG 30.A N ASP 27.A O no hydrogen 2.956 N/A ARG 30.A NE LEU 2.A O no hydrogen 2.776 N/A ARG 30.A NH2 LEU 2.A O no hydrogen 2.805 N/A LEU 34.A N ARG 30.A O no hydrogen 3.267 N/A LEU 35.A N LEU 31.A O no hydrogen 3.004 N/A ALA 36.A N PRO 32.A O no hydrogen 2.982 N/A GLU 37.A N GLU 33.A O no hydrogen 3.063 N/A ALA 38.A N LEU 34.A O no hydrogen 3.009 N/A SER 39.A N LEU 35.A O no hydrogen 2.836 N/A GLY 40.A N ALA 36.A O no hydrogen 3.115 N/A ASP 41.A N ALA 38.A O no hydrogen 3.147 N/A ALA 43.A N ASP 41.A OD1 no hydrogen 2.941 N/A LEU 44.A N ASP 41.A O no hydrogen 3.183 N/A ARG 45.A N ALA 9.A O no hydrogen 2.700 N/A ARG 45.A NH1 ASP 42.A O no hydrogen 3.044 N/A ARG 45.A NH1 LEU 44.A O no hydrogen 2.906 N/A ARG 45.A NH2 PHE 244.A O no hydrogen 3.198 N/A VAL 46.A N ALA 9.A O no hydrogen 3.192 N/A LEU 47.A N PRO 96.A O no hydrogen 2.998 N/A VAL 48.A N ALA 11.A O no hydrogen 2.810 N/A VAL 49.A N VAL 98.A O no hydrogen 2.798 N/A LYS 50.A N LEU 13.A O no hydrogen 3.091 N/A LYS 50.A NZ GLU 180.A OE2 no hydrogen 2.859 N/A SER 51.A OG GLY 54.A O no hydrogen 2.633 N/A ALA 52.A N ILE 15.A O no hydrogen 2.858 N/A ASN 53.A N SER 51.A OG no hydrogen 3.150 N/A ASN 53.A ND2 ASP 16.A OD1 no hydrogen 2.912 N/A PHE 57.A N ASP 103.A O no hydrogen 2.836 N/A CYS 58.A N ASP 103.A O no hydrogen 3.052 N/A CYS 58.A SG ASN 22.A O no hydrogen 3.325 N/A CYS 58.A SG GLY 60.A O no hydrogen 3.986 N/A ALA 59.A N ARG 21.A O no hydrogen 2.976 N/A ASP 62.A N PHE 24.A O no hydrogen 3.123 N/A GLU 65.A N ASP 62.A OD1 no hydrogen 3.009 N/A LEU 66.A N ASP 62.A O no hydrogen 2.887 N/A LEU 67.A N ILE 63.A O no hydrogen 2.947 N/A ALA 68.A N ALA 64.A O no hydrogen 3.032 N/A ASN 69.A N GLU 65.A O no hydrogen 3.182 N/A ASN 69.A ND2 GLU 65.A O no hydrogen 2.853 N/A LYS 70.A N LEU 67.A O no hydrogen 3.410 N/A LYS 70.A NZ ASP 71.A OD2 no hydrogen 3.396 N/A ASP 72.A N ASN 69.A O no hydrogen 2.907 N/A PHE 75.A N ASP 72.A OD1 no hydrogen 3.146 N/A HIS 76.A N ASP 72.A O no hydrogen 3.131 N/A ALA 77.A N ALA 73.A O no hydrogen 3.070 N/A ALA 78.A N ALA 74.A O no hydrogen 3.050 N/A ASN 79.A N PHE 75.A O no hydrogen 2.790 N/A GLN 80.A N HIS 76.A O no hydrogen 2.937 N/A GLN 81.A N ALA 77.A O no hydrogen 3.101 N/A ALA 82.A N ALA 78.A O no hydrogen 2.966 N/A ILE 83.A N ASN 79.A O no hydrogen 3.020 N/A ASN 84.A N GLN 80.A O no hydrogen 3.018 N/A ARG 85.A N GLN 81.A O no hydrogen 2.901 N/A ARG 85.A NE GLU 89.A OE2 no hydrogen 3.061 N/A ALA 86.A N ALA 82.A O no hydrogen 3.015 N/A GLN 87.A N ILE 83.A O no hydrogen 2.896 N/A GLN 87.A NE2 GLY 110.A O no hydrogen 2.748 N/A GLN 87.A NE2 ASP 140.A OD1 no hydrogen 2.973 N/A TYR 88.A N ASN 84.A O no hydrogen 2.961 N/A GLU 89.A N ARG 85.A O no hydrogen 3.001 N/A LEU 90.A N ALA 86.A O no hydrogen 2.956 N/A ALA 91.A N GLN 87.A O no hydrogen 3.191 N/A ARG 92.A N GLU 89.A O no hydrogen 3.165 N/A ARG 92.A NH1 TYR 88.A O no hydrogen 2.973 N/A ARG 92.A NH1 HIS 139.A NE2 no hydrogen 3.113 N/A PHE 93.A N LEU 90.A O no hydrogen 3.220 N/A ARG 94.A NE SER 39.A O no hydrogen 2.935 N/A ARG 94.A NE SER 39.A OG no hydrogen 3.110 N/A ARG 94.A NH1 GLN 196.A OE1 no hydrogen 2.874 N/A ARG 94.A NH2 SER 39.A O no hydrogen 2.836 N/A THR 97.A N ASP 116.A OD2 no hydrogen 2.929 N/A VAL 98.A N LEU 47.A O no hydrogen 2.925 N/A CYS 104.A N ARG 124.A O no hydrogen 2.758 N/A CYS 104.A SG GLY 108.A O no hydrogen 3.497 N/A ILE 105.A N CYS 58.A O no hydrogen 2.930 N/A GLY 106.A N GLY 126.A O no hydrogen 2.792 N/A GLY 108.A N ILE 105.A O no hydrogen 2.901 N/A GLY 110.A N GLY 106.A O no hydrogen 3.042 N/A ILE 111.A N GLY 107.A O no hydrogen 3.141 N/A ALA 112.A N GLY 108.A O no hydrogen 3.175 N/A LEU 113.A N CYS 109.A O no hydrogen 2.808 N/A ALA 114.A N GLY 110.A O no hydrogen 3.005 N/A ALA 114.A N ILE 111.A O no hydrogen 3.149 N/A CYS 115.A N ALA 112.A O no hydrogen 3.205 N/A CYS 115.A SG ILE 111.A O no hydrogen 3.630 N/A ASP 116.A N THR 97.A O no hydrogen 3.165 N/A ASP 116.A N THR 97.A OG1 no hydrogen 2.807 N/A ARG 117.A NE LEU 172.A O no hydrogen 2.824 N/A ARG 117.A NH1 ALA 112.A O no hydrogen 2.809 N/A ARG 117.A NH1 CYS 115.A O no hydrogen 2.780 N/A ARG 117.A NH2 GLU 174.A OE2 no hydrogen 2.836 N/A ILE 118.A N ALA 99.A O no hydrogen 2.897 N/A ALA 119.A N LEU 175.A O no hydrogen 2.959 N/A ALA 120.A N VAL 100.A O no hydrogen 2.905 N/A ALA 123.A N ALA 120.A O no hydrogen 2.951 N/A ARG 124.A N GLY 102.A O no hydrogen 3.194 N/A ARG 124.A NE ASP 103.A OD1 no hydrogen 3.004 N/A ARG 124.A NH2 ASP 103.A OD1 no hydrogen 3.134 N/A ARG 124.A NH2 ASP 103.A OD2 no hydrogen 3.305 N/A PHE 125.A N ILE 162.A O no hydrogen 2.972 N/A GLY 126.A N CYS 104.A O no hydrogen 3.301 N/A LYS 131.A N THR 128.A O no hydrogen 3.064 N/A LEU 132.A N PRO 129.A O no hydrogen 2.941 N/A LEU 134.A N PRO 129.A O no hydrogen 2.984 N/A TYR 136.A OH GLY 106.A O no hydrogen 3.357 N/A HIS 139.A ND1 ASP 140.A OD1 no hydrogen 2.879 N/A ASP 140.A N PRO 137.A O no hydrogen 2.942 N/A VAL 141.A N PRO 137.A O no hydrogen 2.902 N/A LYS 142.A N LEU 138.A O no hydrogen 2.897 N/A LYS 142.A NZ ASP 146.A OD1 no hydrogen 3.230 N/A LYS 142.A NZ ASP 146.A OD2 no hydrogen 3.502 N/A LYS 142.A NZ LEU 206.A O no hydrogen 2.725 N/A LEU 143.A N HIS 139.A O no hydrogen 3.173 N/A LEU 144.A N ASP 140.A O no hydrogen 3.044 N/A VAL 145.A N VAL 141.A O no hydrogen 2.874 N/A ASP 146.A N LYS 142.A O no hydrogen 2.842 N/A LEU 147.A N LEU 144.A O no hydrogen 3.077 N/A VAL 148.A N LEU 144.A O no hydrogen 3.018 N/A GLY 149.A N VAL 145.A O no hydrogen 2.891 N/A ALA 153.A N GLY 149.A O no hydrogen 3.097 N/A ARG 154.A N PRO 150.A O no hydrogen 2.985 N/A ARG 155.A N GLY 151.A O no hydrogen 2.991 N/A ARG 155.A NH1 GLN 152.A OE1 no hydrogen 2.858 N/A ARG 155.A NH1 GLU 166.A OE2 no hydrogen 2.778 N/A ARG 155.A NH2 GLU 166.A OE2 no hydrogen 3.459 N/A LEU 156.A N GLN 152.A O no hydrogen 2.952 N/A THR 158.A N ARG 155.A O no hydrogen 3.419 N/A THR 158.A OG1 ARG 155.A O no hydrogen 2.704 N/A GLY 159.A N LEU 156.A O no hydrogen 2.886 N/A GLY 160.A N THR 158.A OG1 no hydrogen 3.104 N/A ILE 162.A N PHE 125.A O no hydrogen 2.850 N/A GLU 166.A N ASP 163.A OD1 no hydrogen 2.942 N/A ALA 167.A N ASP 163.A O no hydrogen 2.979 N/A HIS 168.A N ALA 164.A O no hydrogen 2.940 N/A ARG 169.A N ASN 165.A O no hydrogen 2.897 N/A ARG 169.A NE GLU 166.A OE1 no hydrogen 2.988 N/A ARG 169.A NH2 GLU 166.A OE2 no hydrogen 3.236 N/A ILE 170.A N GLU 166.A O no hydrogen 2.995 N/A GLY 171.A N HIS 168.A O no hydrogen 3.373 N/A LEU 172.A N ALA 167.A O no hydrogen 2.854 N/A VAL 173.A N ALA 167.A O no hydrogen 3.248 N/A GLU 174.A N ARG 117.A O no hydrogen 3.172 N/A LEU 175.A N ARG 117.A O no hydrogen 3.333 N/A GLY 177.A N ALA 119.A O no hydrogen 3.105 N/A GLU 180.A N GLU 180.A OE1 no hydrogen 2.700 N/A ASP 181.A N SER 179.A OG no hydrogen 3.077 N/A VAL 184.A N GLU 180.A O no hydrogen 2.887 N/A GLY 185.A N ASP 181.A O no hydrogen 2.942 N/A GLN 186.A N ALA 182.A O no hydrogen 3.187 N/A LEU 187.A N LEU 183.A O no hydrogen 2.924 N/A ALA 188.A N VAL 184.A O no hydrogen 2.893 N/A THR 189.A N GLN 186.A O no hydrogen 3.410 N/A THR 189.A OG1 GLY 185.A O no hydrogen 3.553 N/A THR 189.A OG1 GLN 186.A O no hydrogen 3.097 N/A SER 191.A OG SER 194.A OG no hydrogen 3.340 N/A SER 191.A OG ASP 228.A OD2 no hydrogen 2.524 N/A PHE 193.A N ASP 228.A OD2 no hydrogen 3.503 N/A SER 194.A N SER 191.A OG no hydrogen 3.089 N/A SER 194.A OG SER 191.A OG no hydrogen 3.340 N/A THR 195.A N SER 191.A O no hydrogen 3.072 N/A THR 195.A OG1 SER 192.A O no hydrogen 3.495 N/A GLN 196.A N SER 192.A O no hydrogen 3.338 N/A GLN 196.A NE2 SER 192.A O no hydrogen 2.907 N/A ALA 197.A N PHE 193.A O no hydrogen 3.133 N/A ILE 198.A N SER 194.A O no hydrogen 2.852 N/A LYS 199.A N THR 195.A O no hydrogen 2.837 N/A LYS 199.A NZ PHE 93.A O no hydrogen 2.896 N/A LYS 199.A NZ LEU 95.A O no hydrogen 2.836 N/A LYS 199.A NZ ASP 116.A OD1 no hydrogen 3.119 N/A LYS 199.A NZ ASP 116.A OD2 no hydrogen 2.677 N/A SER 200.A N GLN 196.A O no hydrogen 3.131 N/A SER 200.A OG GLN 196.A O no hydrogen 3.201 N/A PHE 201.A N ALA 197.A O no hydrogen 3.011 N/A VAL 202.A N ILE 198.A O no hydrogen 2.937 N/A ARG 203.A N LYS 199.A O no hydrogen 3.069 N/A ARG 203.A NH1 ASP 207.A OD1 no hydrogen 3.115 N/A ARG 204.A N SER 200.A O no hydrogen 2.905 N/A ARG 204.A NH1 ASP 213.A OD1 no hydrogen 3.029 N/A ARG 204.A NH1 ASP 213.A OD2 no hydrogen 3.520 N/A ARG 204.A NH2 ASP 213.A OD2 no hydrogen 2.698 N/A VAL 205.A N PHE 201.A O no hydrogen 3.035 N/A LEU 206.A N VAL 202.A O no hydrogen 2.893 N/A ASP 207.A N ARG 203.A O no hydrogen 2.841 N/A GLY 208.A N VAL 205.A O no hydrogen 3.024 N/A GLN 209.A N ARG 204.A O no hydrogen 2.939 N/A GLN 209.A NE2 ALA 211.A O no hydrogen 2.797 N/A ASP 213.A N SER 216.A OG no hydrogen 2.945 N/A SER 216.A N ASP 213.A OD1 no hydrogen 3.026 N/A SER 216.A OG ASP 212.A OD1 no hydrogen 2.708 N/A SER 216.A OG ASP 213.A O no hydrogen 3.184 N/A SER 216.A OG ASP 213.A OD1 no hydrogen 3.379 N/A LEU 217.A N ASP 213.A O no hydrogen 3.046 N/A ARG 218.A N ALA 214.A O no hydrogen 3.031 N/A VAL 219.A N ASP 215.A O no hydrogen 2.938 N/A PHE 220.A N SER 216.A O no hydrogen 3.171 N/A ALA 221.A N LEU 217.A O no hydrogen 3.012 N/A SER 222.A N ARG 218.A O no hydrogen 2.807 N/A SER 222.A OG VAL 219.A O no hydrogen 2.636 N/A ALA 223.A N PHE 220.A O no hydrogen 3.271 N/A PHE 224.A N ALA 221.A O no hydrogen 3.230 N/A GLU 225.A N SER 222.A O no hydrogen 3.143 N/A GLY 226.A N ALA 223.A O no hydrogen 3.063 N/A ARG 230.A N GLY 226.A O no hydrogen 3.284 N/A ARG 230.A NH1 GLU 225.A O no hydrogen 2.859 N/A GLU 231.A N ALA 227.A O no hydrogen 2.945 N/A GLY 232.A N ASP 228.A O no hydrogen 2.819 N/A THR 233.A N PHE 229.A O no hydrogen 2.955 N/A THR 233.A OG1 PHE 229.A O no hydrogen 3.121 N/A THR 233.A OG1 ARG 230.A O no hydrogen 3.228 N/A GLY 234.A N ARG 230.A O no hydrogen 2.987 N/A ALA 235.A N GLU 231.A O no hydrogen 2.913 N/A PHE 236.A N GLY 232.A O no hydrogen 2.995 N/A LEU 237.A N THR 233.A O no hydrogen 3.011 N/A GLU 238.A N GLY 234.A O no hydrogen 3.114 N/A LYS 239.A N PHE 236.A O no hydrogen 3.173 N/A ARG 240.A N ALA 235.A O no hydrogen 3.047 N/A ARG 240.A NE GLU 238.A OE1 no hydrogen 2.668 N/A ARG 240.A NH1 GLU 231.A OE2 no hydrogen 2.901 N/A ARG 240.A NH1 PRO 241.A O no hydrogen 3.297 N/A ARG 240.A NH2 GLU 231.A OE1 no hydrogen 3.333 N/A ARG 240.A NH2 GLU 231.A OE2 no hydrogen 3.483 N/A VAL 243.A N GLU 231.A OE2 no hydrogen 2.797 N/A