Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1juk_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): PRO 1.A N GLU 140.A OE2 no hydrogen 2.786 N/A ARG 2.A N ILE 135.A O no hydrogen 2.849 N/A ARG 2.A NE VAL 133.A O no hydrogen 3.312 N/A ARG 2.A NE LEU 136.A O no hydrogen 2.745 N/A ARG 2.A NH2 VAL 133.A O no hydrogen 2.714 N/A TRP 7.A NE1 LEU 183.A O no hydrogen 2.854 N/A LYS 9.A N GLY 6.A O no hydrogen 3.121 N/A ASP 10.A N GLY 6.A O no hydrogen 3.271 N/A VAL 11.A N TRP 7.A O no hydrogen 2.824 N/A VAL 12.A N LEU 8.A O no hydrogen 3.285 N/A GLN 13.A N LYS 9.A O no hydrogen 3.221 N/A LEU 14.A N ASP 10.A O no hydrogen 2.968 N/A SER 15.A N VAL 11.A O no hydrogen 2.961 N/A SER 15.A OG VAL 11.A O no hydrogen 2.883 N/A SER 15.A OG PHE 111.A O no hydrogen 3.210 N/A LEU 16.A N VAL 12.A O no hydrogen 3.036 N/A ARG 17.A N GLN 13.A O no hydrogen 3.384 N/A ARG 17.A N LEU 14.A O no hydrogen 3.060 N/A ARG 18.A N SER 15.A O no hydrogen 3.184 N/A ARG 18.A NH1 THR 83.A O no hydrogen 3.044 N/A ARG 18.A NH2 THR 83.A O no hydrogen 2.755 N/A PHE 21.A N ASP 120.A OD1 no hydrogen 2.864 N/A ARG 25.A NE ARG 27.A O no hydrogen 2.706 N/A ARG 25.A NH1 TYR 122.A O no hydrogen 2.862 N/A ARG 25.A NH1 ALA 126.A O no hydrogen 2.736 N/A ARG 25.A NH2 PRO 28.A O no hydrogen 3.042 N/A ARG 25.A NH2 GLY 125.A O no hydrogen 3.433 N/A ARG 25.A NH2 ALA 126.A O no hydrogen 3.417 N/A GLN 26.A N GLN 26.A OE1 no hydrogen 2.688 N/A ARG 27.A NH1 GLY 125.A O no hydrogen 3.163 N/A ARG 27.A NH2 VAL 102.A O no hydrogen 2.792 N/A ARG 27.A NH2 ILE 104.A O no hydrogen 3.363 N/A ILE 30.A N ASP 127.A OD1 no hydrogen 2.879 N/A ARG 35.A N SER 31.A O no hydrogen 3.138 N/A ARG 35.A NH1 ALA 76.A O no hydrogen 3.265 N/A ARG 35.A NH1 VAL 77.A O no hydrogen 2.638 N/A ILE 36.A N LEU 32.A O no hydrogen 3.002 N/A LEU 37.A N ASN 33.A O no hydrogen 3.079 N/A GLU 38.A N GLU 34.A O no hydrogen 3.087 N/A PHE 39.A N ARG 35.A O no hydrogen 3.048 N/A ASN 40.A N ILE 36.A O no hydrogen 3.012 N/A LYS 41.A N LEU 37.A O no hydrogen 3.031 N/A ARG 42.A N GLU 38.A O no hydrogen 2.919 N/A ASN 43.A N ASN 40.A O no hydrogen 2.894 N/A ILE 44.A N PHE 39.A O no hydrogen 2.875 N/A ILE 48.A N PHE 229.A O no hydrogen 2.876 N/A ALA 49.A N GLY 78.A O no hydrogen 3.202 N/A GLU 50.A N ILE 231.A O no hydrogen 2.962 N/A TYR 51.A N SER 80.A O no hydrogen 2.893 N/A TYR 51.A OH ARG 63.A O no hydrogen 2.766 N/A LYS 52.A NZ GLU 50.A OE2 no hydrogen 2.930 N/A ARG 53.A NH2 THR 94.A OG1 no hydrogen 3.306 N/A LYS 54.A NZ LYS 86.A O no hydrogen 2.990 N/A VAL 61.A N ARG 53.A O no hydrogen 2.984 N/A ARG 63.A NE MET 236.A O no hydrogen 2.692 N/A ARG 63.A NH2 MET 236.A O no hydrogen 2.933 N/A GLU 67.A N ASP 64.A OD2 no hydrogen 3.207 N/A TYR 68.A N ASP 64.A O no hydrogen 3.189 N/A TYR 68.A OH GLU 50.A O no hydrogen 2.855 N/A SER 69.A N PRO 65.A O no hydrogen 2.990 N/A SER 69.A OG PRO 65.A O no hydrogen 2.732 N/A LYS 70.A N ILE 66.A O no hydrogen 2.966 N/A PHE 71.A N GLU 67.A O no hydrogen 3.207 N/A MET 72.A N TYR 68.A O no hydrogen 2.941 N/A GLU 73.A N SER 69.A O no hydrogen 2.813 N/A ARG 74.A N PHE 71.A O no hydrogen 3.268 N/A TYR 75.A N MET 72.A O no hydrogen 2.977 N/A ALA 76.A N MET 72.A O no hydrogen 2.811 N/A VAL 77.A N ILE 47.A O no hydrogen 2.785 N/A LEU 79.A N PRO 105.A O no hydrogen 2.815 N/A SER 80.A N ALA 49.A O no hydrogen 2.901 N/A SER 80.A OG GLU 50.A OE1 no hydrogen 2.816 N/A ILE 81.A N LEU 107.A O no hydrogen 2.992 N/A LEU 82.A N TYR 51.A O no hydrogen 3.347 N/A THR 83.A N LYS 109.A O no hydrogen 2.986 N/A THR 83.A OG1 ASP 110.A OD2 no hydrogen 2.633 N/A LYS 86.A N GLU 84.A OE2 no hydrogen 3.101 N/A LYS 86.A NZ ASP 10.A OD2 no hydrogen 3.043 N/A TYR 87.A N GLU 84.A OE1 no hydrogen 2.756 N/A TYR 87.A OH ASP 10.A OD2 no hydrogen 2.511 N/A PHE 88.A N GLU 84.A OE1 no hydrogen 3.234 N/A GLY 90.A N GLU 84.A O no hydrogen 2.760 N/A SER 91.A OG THR 94.A OG1 no hydrogen 2.952 N/A TYR 92.A OH ASP 120.A OD2 no hydrogen 2.755 N/A THR 94.A N SER 91.A OG no hydrogen 3.355 N/A THR 94.A OG1 SER 91.A OG no hydrogen 2.952 N/A ARG 96.A N TYR 92.A O no hydrogen 2.797 N/A ARG 96.A NH1 GLU 93.A OE2 no hydrogen 3.438 N/A LYS 97.A N GLU 93.A O no hydrogen 2.806 N/A LYS 97.A NZ GLU 93.A OE1 no hydrogen 3.474 N/A ILE 98.A N THR 94.A O no hydrogen 3.140 N/A ALA 99.A N LEU 95.A O no hydrogen 2.845 N/A SER 100.A N ARG 96.A O no hydrogen 3.226 N/A SER 100.A OG ARG 96.A O no hydrogen 3.025 N/A SER 101.A N ILE 98.A O no hydrogen 2.916 N/A SER 101.A OG LYS 97.A O no hydrogen 2.624 N/A VAL 102.A N ILE 98.A O no hydrogen 3.054 N/A SER 103.A N GLU 73.A OE2 no hydrogen 3.166 N/A SER 103.A OG GLU 73.A OE2 no hydrogen 2.984 N/A ILE 106.A N ASP 127.A OD2 no hydrogen 2.801 N/A LEU 107.A N LEU 79.A O no hydrogen 2.715 N/A MET 108.A N THR 128.A O no hydrogen 2.938 N/A LYS 109.A N ILE 81.A O no hydrogen 2.913 N/A LYS 109.A NZ GLU 50.A OE1 no hydrogen 2.936 N/A PHE 111.A N ASP 110.A OD1 no hydrogen 2.655 N/A LYS 114.A NZ LEU 16.A O no hydrogen 2.809 N/A LYS 114.A NZ ARG 18.A O no hydrogen 3.049 N/A GLN 117.A N LYS 114.A O no hydrogen 3.403 N/A ILE 118.A N GLU 115.A O no hydrogen 2.905 N/A ASP 119.A N GLU 115.A O no hydrogen 3.161 N/A ASP 120.A N SER 116.A O no hydrogen 2.870 N/A ALA 121.A N GLN 117.A O no hydrogen 3.237 N/A TYR 122.A N ILE 118.A O no hydrogen 2.983 N/A ASN 123.A N ASP 119.A O no hydrogen 2.850 N/A LEU 124.A N ASP 120.A O no hydrogen 2.722 N/A GLY 125.A N ALA 121.A O no hydrogen 3.115 N/A ALA 126.A N ALA 121.A O no hydrogen 2.868 N/A ASP 127.A N ILE 106.A O no hydrogen 2.892 N/A THR 128.A N ILE 106.A O no hydrogen 3.301 N/A THR 128.A OG1 VAL 129.A O no hydrogen 3.487 N/A THR 128.A OG1 GLU 154.A O no hydrogen 2.824 N/A VAL 129.A N THR 128.A OG1 no hydrogen 2.610 N/A LEU 130.A N MET 108.A O no hydrogen 3.301 N/A LEU 131.A N LEU 156.A O no hydrogen 2.902 N/A VAL 133.A N GLU 158.A O no hydrogen 3.221 N/A LYS 134.A NZ ASP 182.A OD1 no hydrogen 3.062 N/A ILE 135.A N ILE 132.A O no hydrogen 3.323 N/A LEU 136.A N VAL 133.A O no hydrogen 3.195 N/A THR 137.A N GLU 140.A OE1 no hydrogen 2.777 N/A GLU 140.A N THR 137.A OG1 no hydrogen 3.177 N/A LEU 141.A N THR 137.A O no hydrogen 2.753 N/A GLU 142.A N GLU 138.A O no hydrogen 3.026 N/A SER 143.A N ARG 139.A O no hydrogen 3.086 N/A SER 143.A OG ARG 139.A O no hydrogen 2.971 N/A LEU 144.A N GLU 140.A O no hydrogen 3.007 N/A LEU 145.A N LEU 141.A O no hydrogen 3.078 N/A GLU 146.A N GLU 142.A O no hydrogen 3.071 N/A TYR 147.A N SER 143.A O no hydrogen 2.758 N/A TYR 147.A OH ASP 119.A OD1 no hydrogen 2.499 N/A TYR 147.A OH ASP 119.A OD2 no hydrogen 3.127 N/A ALA 148.A N LEU 144.A O no hydrogen 2.826 N/A ARG 149.A N LEU 145.A O no hydrogen 2.826 N/A ARG 149.A NE GLU 154.A OE1 no hydrogen 2.872 N/A ARG 149.A NH2 GLU 154.A OE1 no hydrogen 3.569 N/A ARG 149.A NH2 GLU 154.A OE2 no hydrogen 2.802 N/A ARG 149.A NH2 GLY 172.A O no hydrogen 3.081 N/A SER 150.A N GLU 146.A O no hydrogen 3.037 N/A SER 150.A OG TYR 147.A O no hydrogen 2.655 N/A TYR 151.A N ALA 148.A O no hydrogen 3.004 N/A TYR 151.A OH ASP 119.A OD1 no hydrogen 2.450 N/A GLY 152.A N ARG 149.A O no hydrogen 2.723 N/A MET 153.A N ALA 148.A O no hydrogen 3.065 N/A LEU 156.A N VAL 129.A O no hydrogen 2.855 N/A ILE 157.A N PHE 175.A O no hydrogen 2.807 N/A GLU 158.A N LEU 131.A O no hydrogen 2.869 N/A ILE 159.A N GLY 177.A O no hydrogen 2.828 N/A ASN 160.A N ASP 164.A OD2 no hydrogen 3.126 N/A ASN 160.A ND2 ASN 179.A O no hydrogen 2.859 N/A ASP 164.A N ASP 161.A OD1 no hydrogen 2.856 N/A LEU 165.A N ASP 161.A O no hydrogen 2.920 N/A ASP 166.A N GLU 162.A O no hydrogen 2.915 N/A ILE 167.A N ASN 163.A O no hydrogen 3.232 N/A ALA 168.A N ASP 164.A O no hydrogen 2.961 N/A LEU 169.A N LEU 165.A O no hydrogen 2.996 N/A ARG 170.A N ASP 166.A O no hydrogen 2.871 N/A ARG 170.A NH2 ASP 166.A OD2 no hydrogen 2.670 N/A ILE 171.A N ILE 167.A O no hydrogen 2.913 N/A GLY 172.A N LEU 169.A O no hydrogen 3.026 N/A ALA 173.A N ALA 168.A O no hydrogen 3.099 N/A ILE 176.A N VAL 205.A O no hydrogen 3.031 N/A GLY 177.A N ILE 157.A O no hydrogen 2.961 N/A ILE 178.A N VAL 207.A O no hydrogen 2.903 N/A ASN 179.A N ILE 159.A O no hydrogen 3.055 N/A ASN 179.A ND2 GLU 158.A OE2 no hydrogen 3.080 N/A SER 180.A N GLU 209.A O no hydrogen 2.970 N/A SER 180.A OG GLU 209.A O no hydrogen 3.354 N/A SER 180.A OG SER 210.A O no hydrogen 2.830 N/A ARG 181.A N ASN 179.A OD1 no hydrogen 3.192 N/A ASP 182.A N GLU 187.A O no hydrogen 2.763 N/A THR 185.A OG1 ASP 182.A OD2 no hydrogen 2.836 N/A LEU 186.A N ASP 182.A O no hydrogen 2.561 N/A GLU 187.A N THR 185.A OG1 no hydrogen 3.243 N/A ASN 189.A N SER 180.A O no hydrogen 2.970 N/A LYS 190.A NZ GLY 211.A O no hydrogen 2.926 N/A LYS 190.A NZ GLU 217.A OE2 no hydrogen 2.833 N/A ASN 192.A N ASN 189.A OD1 no hydrogen 2.778 N/A GLN 193.A NE2 ILE 178.A O no hydrogen 3.154 N/A ARG 194.A N LYS 190.A O no hydrogen 3.021 N/A LYS 195.A N GLU 191.A O no hydrogen 3.068 N/A LYS 195.A NZ GLU 162.A OE2 no hydrogen 2.853 N/A LEU 196.A N ASN 192.A O no hydrogen 3.057 N/A ILE 197.A N GLN 193.A O no hydrogen 3.030 N/A SER 198.A N ARG 194.A O no hydrogen 3.366 N/A SER 198.A N LYS 195.A O no hydrogen 3.129 N/A SER 198.A OG LYS 195.A O no hydrogen 2.954 N/A MET 199.A N LEU 196.A O no hydrogen 2.970 N/A ILE 200.A N ILE 197.A O no hydrogen 3.440 N/A VAL 204.A N PRO 201.A O no hydrogen 3.143 N/A VAL 205.A N ARG 174.A O no hydrogen 3.055 N/A LYS 206.A N ASN 227.A OD1 no hydrogen 2.818 N/A LYS 206.A NZ SER 202.A O no hydrogen 3.346 N/A LYS 206.A NZ VAL 204.A O no hydrogen 2.613 N/A VAL 207.A N ILE 176.A O no hydrogen 2.888 N/A ALA 208.A N ALA 228.A O no hydrogen 2.823 N/A GLU 209.A N ILE 178.A O no hydrogen 2.971 N/A SER 210.A OG ASN 179.A OD1 no hydrogen 2.652 N/A ARG 215.A NE LEU 247.A O no hydrogen 3.247 N/A GLU 217.A N GLU 214.A O no hydrogen 3.365 N/A GLU 219.A N ARG 215.A O no hydrogen 3.096 N/A GLU 220.A N ASN 216.A O no hydrogen 3.152 N/A LEU 221.A N GLU 217.A O no hydrogen 2.939 N/A ARG 222.A N ILE 218.A O no hydrogen 2.835 N/A ARG 222.A NH1 VAL 226.A O no hydrogen 2.733 N/A LYS 223.A N GLU 219.A O no hydrogen 3.178 N/A LYS 223.A N GLU 220.A O no hydrogen 3.077 N/A LYS 223.A NZ GLU 220.A O no hydrogen 2.896 N/A LEU 224.A N GLU 220.A O no hydrogen 3.301 N/A LEU 224.A N LEU 221.A O no hydrogen 3.061 N/A GLY 225.A N ARG 222.A O no hydrogen 3.014 N/A VAL 226.A N LEU 221.A O no hydrogen 3.267 N/A ASN 227.A N LYS 206.A O no hydrogen 2.841 N/A ALA 228.A N LYS 206.A O no hydrogen 3.070 N/A PHE 229.A N ALA 46.A O no hydrogen 3.034 N/A LEU 230.A N ALA 208.A O no hydrogen 2.824 N/A ILE 231.A N ILE 48.A O no hydrogen 2.948 N/A LEU 235.A N GLY 232.A O no hydrogen 2.760 N/A MET 236.A N GLY 232.A O no hydrogen 3.385 N/A MET 236.A N SER 233.A O no hydrogen 3.210 N/A ASN 238.A N SER 234.A O no hydrogen 3.150 N/A LYS 241.A N ASN 238.A O no hydrogen 2.875 N/A ILE 242.A N PRO 239.A O no hydrogen 2.985 N/A LYS 243.A N GLU 240.A O no hydrogen 2.948 N/A GLU 244.A N LYS 241.A O no hydrogen 2.850 N/A PHE 245.A N ILE 242.A O no hydrogen 3.188 N/A ILE 246.A N ILE 242.A O no hydrogen 3.037 N/A