Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4rur_B.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): TYR 5.A N SER 2.A O no hydrogen 3.001 N/A ASP 6.A N ARG 3.A O no hydrogen 3.060 N/A ARG 8.A N ASP 6.A OD1 no hydrogen 2.977 N/A THR 9.A OG1 LEU 127.A O no hydrogen 2.767 N/A SER 13.A N ARG 17.A O no hydrogen 2.701 N/A SER 13.A OG ARG 17.A O no hydrogen 3.277 N/A GLY 16.A N SER 13.A O no hydrogen 2.963 N/A ARG 17.A N SER 13.A OG no hydrogen 3.043 N/A GLU 22.A N LEU 18.A O no hydrogen 3.039 N/A TYR 23.A N TYR 19.A O no hydrogen 2.960 N/A ALA 24.A N GLN 20.A O no hydrogen 2.916 N/A LEU 25.A N VAL 21.A O no hydrogen 2.977 N/A GLU 26.A N GLU 22.A O no hydrogen 3.097 N/A SER 27.A N TYR 23.A O no hydrogen 3.121 N/A ILE 28.A N ALA 24.A O no hydrogen 3.059 N/A SER 29.A N LEU 25.A O no hydrogen 3.188 N/A SER 29.A OG GLU 26.A O no hydrogen 2.665 N/A HIS 30.A N SER 27.A O no hydrogen 3.196 N/A ALA 31.A N ILE 28.A O no hydrogen 3.033 N/A THR 33.A OG1 ALA 166.A O no hydrogen 2.680 N/A ALA 34.A N VAL 164.A O no hydrogen 2.934 N/A ILE 35.A N ALA 46.A O no hydrogen 2.633 N/A GLY 36.A N ILE 162.A O no hydrogen 2.867 N/A ILE 37.A N VAL 44.A O no hydrogen 3.055 N/A MET 38.A N LYS 160.A O no hydrogen 2.754 N/A ALA 39.A N GLY 42.A O no hydrogen 2.730 N/A SER 40.A N MET 183.A O no hydrogen 3.369 N/A SER 40.A OG MET 183.A O no hydrogen 3.336 N/A ILE 43.A N ILE 215.A O no hydrogen 2.851 N/A VAL 44.A N ILE 37.A O no hydrogen 2.891 N/A LEU 45.A N ALA 213.A O no hydrogen 2.709 N/A ALA 46.A N ILE 35.A O no hydrogen 2.879 N/A ALA 47.A N GLU 211.A O no hydrogen 2.934 N/A GLU 48.A N THR 33.A O no hydrogen 2.878 N/A ARG 49.A N ARG 209.A O no hydrogen 2.892 N/A ARG 49.A NE LEU 210.A O no hydrogen 3.572 N/A ARG 49.A NH1 SER 61.A OG no hydrogen 2.888 N/A ARG 49.A NH2 SER 61.A O no hydrogen 3.145 N/A LYS 50.A N GLU 63.A OE1 no hydrogen 3.376 N/A LYS 50.A NZ HIS 30.A O no hydrogen 2.638 N/A THR 52.A OG1 SER 53.A O no hydrogen 3.522 N/A LEU 55.A N SER 53.A OG no hydrogen 3.304 N/A LEU 56.A N SER 53.A O no hydrogen 3.371 N/A THR 60.A OG1 GLU 57.A O no hydrogen 3.488 N/A SER 61.A N GLN 58.A O no hydrogen 2.912 N/A GLU 63.A N GLU 211.A OE1 no hydrogen 3.049 N/A LYS 64.A N GLU 211.A OE1 no hydrogen 3.132 N/A LYS 64.A NZ GLY 32.A O no hydrogen 2.754 N/A LYS 64.A NZ VAL 76.A O no hydrogen 2.983 N/A LEU 65.A N GLU 211.A OE2 no hydrogen 3.219 N/A TYR 66.A N VAL 74.A O no hydrogen 2.917 N/A TYR 66.A OH GLU 84.A OE1 no hydrogen 3.391 N/A LEU 68.A N ILE 72.A O no hydrogen 3.029 N/A ASN 69.A N ILE 72.A O no hydrogen 3.218 N/A LYS 71.A N ASN 69.A OD1 no hydrogen 2.924 N/A LYS 71.A NZ ASP 104.A OD2 no hydrogen 2.914 N/A ILE 72.A N ASN 69.A OD1 no hydrogen 2.680 N/A ALA 73.A N ALA 137.A O no hydrogen 2.779 N/A VAL 74.A N TYR 66.A O no hydrogen 2.851 N/A ALA 75.A N ILE 135.A O no hydrogen 2.865 N/A VAL 76.A N LYS 64.A O no hydrogen 2.797 N/A ALA 77.A N SER 133.A O no hydrogen 3.035 N/A LEU 79.A N GLY 131.A O no hydrogen 2.940 N/A ALA 83.A N LEU 79.A O no hydrogen 3.080 N/A GLU 84.A N THR 80.A O no hydrogen 3.038 N/A ILE 85.A N ALA 81.A O no hydrogen 3.401 N/A LEU 86.A N ASP 82.A O no hydrogen 3.400 N/A ILE 87.A N ALA 83.A O no hydrogen 2.758 N/A ASN 88.A N GLU 84.A O no hydrogen 3.081 N/A THR 89.A N ILE 85.A O no hydrogen 3.310 N/A THR 89.A OG1 ILE 85.A O no hydrogen 3.008 N/A ALA 90.A N LEU 86.A O no hydrogen 2.887 N/A ARG 91.A N ILE 87.A O no hydrogen 2.923 N/A ARG 91.A NE LYS 67.A O no hydrogen 2.787 N/A ARG 91.A NH2 LYS 67.A O no hydrogen 2.852 N/A ILE 92.A N ASN 88.A O no hydrogen 3.137 N/A HIS 93.A N THR 89.A O no hydrogen 2.987 N/A ALA 94.A N ALA 90.A O no hydrogen 3.038 N/A GLN 95.A N ARG 91.A O no hydrogen 3.234 N/A ASN 96.A N ILE 92.A O no hydrogen 2.804 N/A TYR 97.A N HIS 93.A O no hydrogen 2.985 N/A LEU 98.A N ALA 94.A O no hydrogen 3.026 N/A LYS 99.A N GLN 95.A O no hydrogen 2.887 N/A THR 100.A N ASN 96.A O no hydrogen 3.010 N/A THR 100.A OG1 ASN 96.A O no hydrogen 2.847 N/A TYR 101.A N TYR 97.A O no hydrogen 2.937 N/A ASN 102.A N LEU 98.A O no hydrogen 2.879 N/A VAL 107.A N ASP 140.A OD2 no hydrogen 2.953 N/A ILE 109.A N PRO 106.A O no hydrogen 3.221 N/A LEU 110.A N PRO 106.A O no hydrogen 3.414 N/A VAL 111.A N VAL 107.A O no hydrogen 3.070 N/A ARG 112.A N GLU 108.A O no hydrogen 2.758 N/A ARG 113.A N ILE 109.A O no hydrogen 3.151 N/A ARG 113.A NE HIS 93.A ND1 no hydrogen 3.368 N/A LEU 114.A N LEU 110.A O no hydrogen 3.185 N/A SER 115.A N VAL 111.A O no hydrogen 3.001 N/A SER 115.A OG VAL 111.A O no hydrogen 2.767 N/A ASP 116.A N ARG 112.A O no hydrogen 2.937 N/A ILE 117.A N ARG 113.A O no hydrogen 3.163 N/A LYS 118.A N LEU 114.A O no hydrogen 3.139 N/A LYS 118.A NZ VAL 132.A O no hydrogen 3.317 N/A LYS 118.A NZ SER 150.A OG no hydrogen 2.930 N/A GLN 119.A N SER 115.A O no hydrogen 2.993 N/A GLY 120.A N ASP 116.A O no hydrogen 3.112 N/A THR 122.A N GLN 119.A O no hydrogen 2.897 N/A THR 122.A OG1 GLN 119.A O no hydrogen 2.623 N/A GLN 123.A N GLY 120.A O no hydrogen 3.175 N/A HIS 124.A N GLY 120.A O no hydrogen 3.025 N/A ARG 128.A NH1 ASP 82.A OD2 no hydrogen 2.828 N/A ARG 128.A NH2 ASP 82.A OD1 no hydrogen 2.844 N/A ARG 128.A NH2 ASP 82.A OD2 no hydrogen 2.948 N/A GLY 131.A N ASP 82.A OD2 no hydrogen 3.185 N/A SER 133.A N ALA 77.A O no hydrogen 2.933 N/A PHE 134.A N SER 150.A O no hydrogen 2.975 N/A ILE 135.A N ALA 75.A O no hydrogen 2.970 N/A TYR 136.A N TYR 148.A O no hydrogen 2.690 N/A TYR 136.A OH SER 150.A OG no hydrogen 2.803 N/A ALA 137.A N ALA 73.A O no hydrogen 2.864 N/A GLY 138.A N GLN 146.A O no hydrogen 3.178 N/A TYR 139.A N LYS 71.A O no hydrogen 3.179 N/A ASP 140.A N GLY 144.A O no hydrogen 3.362 N/A ARG 142.A N ASP 140.A OD1 no hydrogen 2.994 N/A TYR 143.A N ASP 140.A OD1 no hydrogen 3.044 N/A GLY 144.A N ASP 140.A O no hydrogen 2.956 N/A GLN 146.A N GLY 138.A O no hydrogen 2.952 N/A GLN 146.A NE2 ASP 140.A OD2 no hydrogen 2.848 N/A GLN 146.A NE2 GLY 144.A O no hydrogen 3.142 N/A TYR 148.A N TYR 136.A O no hydrogen 2.975 N/A TYR 148.A OH GLN 146.A OE1 no hydrogen 2.599 N/A THR 149.A N THR 157.A O no hydrogen 3.050 N/A SER 150.A N PHE 134.A O no hydrogen 3.144 N/A SER 150.A OG TYR 136.A OH no hydrogen 2.803 N/A ASN 151.A N ASN 155.A O no hydrogen 3.431 N/A SER 153.A N ASN 151.A OD1 no hydrogen 2.966 N/A SER 153.A OG ASN 151.A OD1 no hydrogen 2.552 N/A GLY 154.A N ASN 151.A O no hydrogen 2.790 N/A ASN 155.A N SER 153.A OG no hydrogen 3.205 N/A TYR 156.A OH GLU 108.A OE2 no hydrogen 2.783 N/A THR 157.A N THR 149.A O no hydrogen 3.163 N/A TRP 159.A N LEU 147.A O no hydrogen 2.902 N/A TRP 159.A NE1 THR 149.A OG1 no hydrogen 2.880 N/A TRP 159.A NE1 THR 157.A OG1 no hydrogen 2.935 N/A ILE 162.A N GLY 36.A O no hydrogen 2.904 N/A SER 163.A N GLN 172.A OE1 no hydrogen 3.268 N/A SER 163.A OG THR 168.A O no hydrogen 3.545 N/A SER 163.A OG GLN 172.A OE1 no hydrogen 3.227 N/A VAL 164.A N ALA 34.A O no hydrogen 2.891 N/A ALA 166.A N ALA 31.A O no hydrogen 2.906 N/A ASN 167.A ND2 ASP 201.A OD1 no hydrogen 3.555 N/A ALA 171.A N ASN 167.A O no hydrogen 3.008 N/A GLN 172.A N THR 168.A O no hydrogen 2.777 N/A GLN 172.A NE2 ALA 161.A O no hydrogen 3.124 N/A THR 173.A N SER 169.A O no hydrogen 3.286 N/A THR 173.A OG1 SER 169.A O no hydrogen 2.882 N/A LEU 174.A N ALA 170.A O no hydrogen 3.219 N/A LEU 175.A N ALA 171.A O no hydrogen 3.022 N/A GLN 176.A N GLN 172.A O no hydrogen 2.933 N/A MET 177.A N THR 173.A O no hydrogen 3.159 N/A ASP 178.A N LEU 174.A O no hydrogen 3.380 N/A TYR 179.A N LEU 175.A O no hydrogen 2.981 N/A TYR 179.A OH MET 38.A O no hydrogen 2.699 N/A MET 183.A N LYS 180.A O no hydrogen 3.342 N/A VAL 185.A N ASP 41.A OD1 no hydrogen 2.922 N/A ALA 188.A N LYS 184.A O no hydrogen 2.889 N/A ILE 189.A N VAL 185.A O no hydrogen 2.761 N/A GLU 190.A N ASP 186.A O no hydrogen 3.437 N/A LEU 191.A N ASP 187.A O no hydrogen 2.995 N/A ALA 192.A N ALA 188.A O no hydrogen 2.997 N/A LEU 193.A N ILE 189.A O no hydrogen 3.239 N/A LYS 194.A N GLU 190.A O no hydrogen 2.941 N/A LYS 194.A NZ GLU 190.A OE2 no hydrogen 3.536 N/A THR 195.A N LEU 191.A O no hydrogen 2.908 N/A THR 195.A OG1 LEU 191.A O no hydrogen 2.641 N/A LEU 196.A N ALA 192.A O no hydrogen 3.090 N/A SER 197.A N LEU 193.A O no hydrogen 2.955 N/A LYS 198.A N LYS 194.A O no hydrogen 3.232 N/A LYS 198.A N THR 195.A O no hydrogen 3.315 N/A THR 199.A N THR 195.A O no hydrogen 3.052 N/A THR 199.A OG1 THR 195.A O no hydrogen 2.771 N/A THR 199.A OG1 LEU 196.A O no hydrogen 3.491 N/A THR 200.A N LEU 196.A O no hydrogen 2.946 N/A THR 200.A OG1 GLU 48.A OE1 no hydrogen 3.346 N/A THR 200.A OG1 GLU 48.A OE2 no hydrogen 2.615 N/A SER 202.A N THR 200.A OG1 no hydrogen 3.069 N/A THR 206.A OG1 ASP 208.A OD1 no hydrogen 2.650 N/A ARG 209.A N THR 206.A O no hydrogen 3.207 N/A ARG 209.A NH2 ALA 204.A O no hydrogen 2.928 N/A LEU 210.A N TYR 207.A O no hydrogen 3.285 N/A GLU 211.A N ALA 47.A O no hydrogen 2.852 N/A ALA 213.A N LEU 45.A O no hydrogen 2.782 N/A THR 214.A N LYS 227.A O no hydrogen 3.130 N/A ILE 215.A N ILE 43.A O no hydrogen 2.846 N/A ARG 216.A N TYR 225.A O no hydrogen 3.079 N/A ARG 216.A NH1 ASP 186.A OD1 no hydrogen 3.121 N/A ARG 216.A NH2 ASP 186.A OD1 no hydrogen 2.870 N/A LYS 217.A NZ TYR 139.A OH no hydrogen 2.949 N/A TYR 225.A N ARG 216.A O no hydrogen 2.860 N/A GLN 226.A NE2 ASN 69.A O no hydrogen 3.164 N/A LYS 227.A N THR 214.A O no hydrogen 2.970 N/A LYS 227.A NZ GLU 233.A OE1 no hydrogen 3.174 N/A LYS 227.A NZ GLU 233.A OE2 no hydrogen 3.079 N/A PHE 229.A N PHE 212.A O no hydrogen 2.911 N/A LYS 230.A N GLU 233.A OE1 no hydrogen 2.690 N/A ILE 234.A N LYS 230.A O no hydrogen 2.905 N/A LYS 235.A N PRO 231.A O no hydrogen 3.112 N/A ASP 236.A N GLN 232.A O no hydrogen 3.020 N/A ILE 237.A N GLU 233.A O no hydrogen 3.182 N/A LEU 238.A N ILE 234.A O no hydrogen 3.129 N/A VAL 239.A N LYS 235.A O no hydrogen 3.340 N/A LYS 240.A N ASP 236.A O no hydrogen 2.872 N/A THR 241.A N ILE 237.A O no hydrogen 3.090 N/A THR 241.A OG1 ILE 237.A O no hydrogen 2.743 N/A THR 241.A OG1 LEU 238.A O no hydrogen 3.486 N/A GLY 242.A N VAL 239.A O no hydrogen 3.099 N/A ILE 243.A N LEU 238.A O no hydrogen 2.935 N/A THR 244.A N LEU 238.A O no hydrogen 3.390 N/A