Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1ci1_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LYS 1.A NZ MET 223.A O no hydrogen 2.728 N/A LYS 1.A NZ ILE 226.A O no hydrogen 3.157 N/A GLN 3.A NE2 ASP 34.A OD1 no hydrogen 3.190 N/A ILE 5.A N ASN 227.A O no hydrogen 3.125 N/A ALA 6.A N GLN 36.A O no hydrogen 2.955 N/A ALA 7.A N PHE 229.A O no hydrogen 2.916 N/A ALA 8.A N VAL 38.A O no hydrogen 2.632 N/A ASN 9.A N VAL 231.A O no hydrogen 2.685 N/A TRP 10.A N ALA 40.A O no hydrogen 3.205 N/A LYS 11.A N ASN 9.A OD1 no hydrogen 2.953 N/A LYS 11.A NZ GLU 95.A OE2 no hydrogen 2.554 N/A ASN 13.A ND2 TRP 10.A O no hydrogen 2.895 N/A SER 15.A OG SER 17.A OG no hydrogen 3.296 N/A SER 17.A OG SER 15.A OG no hydrogen 3.296 N/A LEU 18.A N SER 15.A O no hydrogen 3.019 N/A LEU 18.A N SER 15.A OG no hydrogen 3.113 N/A LEU 19.A N SER 15.A O no hydrogen 2.784 N/A VAL 20.A N GLU 16.A O no hydrogen 3.066 N/A ILE 23.A N LEU 19.A O no hydrogen 2.815 N/A GLU 24.A N VAL 20.A O no hydrogen 2.964 N/A THR 25.A N PRO 21.A O no hydrogen 2.914 N/A THR 25.A OG1 PRO 21.A O no hydrogen 3.158 N/A LEU 26.A N LEU 22.A O no hydrogen 3.157 N/A ASN 27.A N ILE 23.A O no hydrogen 2.960 N/A ASN 27.A N GLU 24.A O no hydrogen 3.050 N/A ASN 27.A ND2 ARG 52.A O no hydrogen 2.868 N/A ALA 28.A N GLU 24.A O no hydrogen 3.135 N/A ALA 28.A N THR 25.A O no hydrogen 3.325 N/A ALA 29.A N THR 25.A O no hydrogen 3.124 N/A THR 30.A OG1 ALA 28.A O no hydrogen 3.377 N/A HIS 33.A NE2 THR 247.A OG1 no hydrogen 2.856 N/A GLN 36.A N PRO 4.A O no hydrogen 2.997 N/A GLN 36.A NE2 CYS 37.A O no hydrogen 2.935 N/A CYS 37.A N LYS 57.A O no hydrogen 2.902 N/A VAL 38.A N ALA 6.A O no hydrogen 2.853 N/A VAL 39.A N GLN 59.A O no hydrogen 2.970 N/A ALA 40.A N ALA 8.A O no hydrogen 2.666 N/A THR 42.A OG1 HIS 45.A ND1 no hydrogen 3.216 N/A HIS 45.A N THR 42.A O no hydrogen 2.962 N/A ILE 46.A N PHE 43.A O no hydrogen 3.322 N/A THR 49.A N HIS 45.A O no hydrogen 3.178 N/A THR 49.A OG1 HIS 45.A O no hydrogen 2.604 N/A LYS 50.A N ILE 46.A O no hydrogen 2.907 N/A LYS 50.A NZ TYR 84.A O no hydrogen 3.220 N/A ALA 51.A N MET 48.A O no hydrogen 3.229 N/A ARG 52.A N MET 48.A O no hydrogen 3.022 N/A LEU 53.A N THR 49.A O no hydrogen 2.773 N/A THR 54.A N ASN 27.A OD1 no hydrogen 2.797 N/A ASN 55.A N ASN 27.A OD1 no hydrogen 3.097 N/A ASN 55.A ND2 LEU 26.A O no hydrogen 3.001 N/A ASN 55.A ND2 ALA 29.A O no hydrogen 2.871 N/A LYS 57.A N ASN 55.A OD1 no hydrogen 3.059 N/A LYS 57.A NZ PHE 31.A O no hydrogen 3.490 N/A LYS 57.A NZ HIS 33.A O no hydrogen 3.453 N/A PHE 58.A N ASN 55.A O no hydrogen 2.812 N/A GLN 59.A N CYS 37.A O no hydrogen 2.878 N/A GLN 59.A NE2 PHE 58.A O no hydrogen 3.608 N/A ALA 61.A N VAL 39.A O no hydrogen 2.918 N/A ALA 62.A N TRP 88.A O no hydrogen 3.019 N/A GLN 63.A NE2 LYS 11.A O no hydrogen 2.828 N/A GLN 63.A NE2 ALA 40.A O no hydrogen 2.993 N/A ILE 66.A N VAL 76.A O no hydrogen 2.905 N/A SER 69.A OG SER 77.A OG no hydrogen 2.760 N/A PHE 72.A N GLY 70.A O no hydrogen 2.847 N/A GLU 75.A N PHE 72.A O no hydrogen 3.064 N/A SER 77.A OG SER 69.A OG no hydrogen 2.760 N/A LEU 78.A N ILE 66.A O no hydrogen 3.061 N/A GLN 79.A NE2 THR 67.A O no hydrogen 2.984 N/A ILE 80.A N SER 77.A OG no hydrogen 3.337 N/A LEU 81.A N SER 77.A O no hydrogen 3.086 N/A LYS 82.A N LEU 78.A O no hydrogen 2.881 N/A LYS 82.A NZ ALA 117.A O no hydrogen 2.792 N/A ASP 83.A N GLN 79.A O no hydrogen 3.065 N/A TYR 84.A N ILE 80.A O no hydrogen 3.323 N/A TYR 84.A N LEU 81.A O no hydrogen 3.163 N/A GLY 85.A N LYS 82.A O no hydrogen 2.962 N/A ILE 86.A N LEU 81.A O no hydrogen 3.154 N/A VAL 89.A N HIS 120.A O no hydrogen 3.148 N/A VAL 90.A N ALA 62.A O no hydrogen 2.913 N/A LEU 91.A N ILE 122.A O no hydrogen 2.891 N/A SER 94.A N GLU 165.A OE2 no hydrogen 3.005 N/A SER 94.A OG GLU 165.A OE2 no hydrogen 3.430 N/A GLU 95.A N HIS 93.A ND1 no hydrogen 2.994 N/A ARG 96.A N HIS 93.A O no hydrogen 2.846 N/A ARG 96.A NE GLU 102.A OE2 no hydrogen 2.964 N/A ARG 97.A N HIS 93.A O no hydrogen 3.037 N/A ARG 97.A NE GLY 92.A O no hydrogen 2.952 N/A ARG 97.A NH2 CYS 124.A O no hydrogen 2.684 N/A LEU 98.A N SER 94.A O no hydrogen 2.814 N/A TYR 99.A N GLU 95.A O no hydrogen 3.089 N/A TYR 100.A N ARG 96.A O no hydrogen 3.121 N/A GLU 102.A N ARG 96.A O no hydrogen 3.341 N/A ILE 106.A N THR 103.A OG1 no hydrogen 3.394 N/A VAL 107.A N THR 103.A O no hydrogen 2.987 N/A ALA 108.A N ASN 104.A O no hydrogen 2.961 N/A GLU 109.A N GLU 105.A O no hydrogen 3.013 N/A LYS 110.A N ILE 106.A O no hydrogen 3.105 N/A LYS 110.A NZ ASN 64.A OD1 no hydrogen 2.690 N/A LYS 110.A NZ ALA 65.A O no hydrogen 2.879 N/A LYS 110.A NZ GLU 102.A OE2 no hydrogen 2.638 N/A VAL 111.A N VAL 107.A O no hydrogen 2.914 N/A ALA 112.A N ALA 108.A O no hydrogen 3.054 N/A GLN 113.A N GLU 109.A O no hydrogen 3.066 N/A ALA 114.A N LYS 110.A O no hydrogen 2.887 N/A CYS 115.A N VAL 111.A O no hydrogen 2.864 N/A CYS 115.A SG VAL 111.A O no hydrogen 3.462 N/A ALA 116.A N ALA 112.A O no hydrogen 3.141 N/A ALA 117.A N GLN 113.A O no hydrogen 2.923 N/A GLY 118.A N CYS 115.A O no hydrogen 2.927 N/A PHE 119.A N ALA 114.A O no hydrogen 2.951 N/A HIS 120.A N SER 87.A O no hydrogen 2.880 N/A VAL 121.A N ARG 159.A O no hydrogen 2.746 N/A ILE 122.A N VAL 89.A O no hydrogen 3.067 N/A VAL 123.A N VAL 161.A O no hydrogen 2.824 N/A CYS 124.A N LEU 91.A O no hydrogen 3.063 N/A VAL 125.A N ALA 163.A O no hydrogen 3.034 N/A GLY 126.A N GLN 144.A OE1 no hydrogen 2.752 N/A GLU 127.A N GLU 127.A OE1 no hydrogen 2.722 N/A THR 128.A N GLU 131.A OE1 no hydrogen 2.785 N/A ASN 129.A ND2 GLU 133.A OE2 no hydrogen 3.003 N/A GLU 131.A N THR 128.A OG1 no hydrogen 3.267 N/A ARG 132.A N THR 128.A O no hydrogen 3.059 N/A ARG 132.A NE GLU 127.A OE2 no hydrogen 2.826 N/A ARG 132.A NH2 GLU 127.A OE2 no hydrogen 3.186 N/A ARG 132.A NH2 TYR 164.A OH no hydrogen 3.535 N/A GLU 133.A N ASN 129.A O no hydrogen 2.989 N/A ALA 134.A N GLU 130.A O no hydrogen 3.039 N/A GLY 135.A N ARG 132.A O no hydrogen 2.654 N/A ARG 136.A N GLU 131.A O no hydrogen 2.749 N/A VAL 140.A N ARG 136.A O no hydrogen 2.939 N/A VAL 141.A N THR 137.A O no hydrogen 3.040 N/A LEU 142.A N ALA 138.A O no hydrogen 3.161 N/A THR 143.A N ALA 139.A O no hydrogen 3.028 N/A THR 143.A OG1 ALA 139.A O no hydrogen 2.705 N/A GLN 144.A N VAL 140.A O no hydrogen 3.009 N/A GLN 144.A NE2 GLY 126.A O no hydrogen 3.404 N/A LEU 145.A N VAL 141.A O no hydrogen 2.954 N/A ALA 146.A N LEU 142.A O no hydrogen 2.767 N/A ALA 147.A N THR 143.A O no hydrogen 3.223 N/A ALA 149.A N LEU 145.A O no hydrogen 2.942 N/A GLN 150.A N ALA 146.A O no hydrogen 3.015 N/A GLN 150.A NE2 ALA 146.A O no hydrogen 3.054 N/A LYS 151.A N VAL 148.A O no hydrogen 3.259 N/A LEU 152.A N ALA 149.A O no hydrogen 3.031 N/A ALA 156.A N SER 153.A O no hydrogen 3.239 N/A TRP 157.A N LYS 154.A O no hydrogen 3.357 N/A SER 158.A N GLU 155.A O no hydrogen 3.373 N/A SER 158.A OG GLU 155.A O no hydrogen 3.221 N/A ARG 159.A N ALA 156.A O no hydrogen 2.862 N/A ARG 159.A NE CYS 115.A O no hydrogen 3.181 N/A ARG 159.A NH2 CYS 115.A O no hydrogen 3.432 N/A VAL 160.A N TRP 157.A O no hydrogen 3.188 N/A VAL 161.A N VAL 121.A O no hydrogen 2.673 N/A ILE 162.A N ARG 205.A O no hydrogen 2.971 N/A ALA 163.A N VAL 123.A O no hydrogen 2.776 N/A TYR 164.A N LEU 207.A O no hydrogen 2.746 N/A TYR 164.A OH GLU 127.A OE1 no hydrogen 3.068 N/A GLU 165.A N VAL 125.A O no hydrogen 3.074 N/A VAL 167.A N GLU 127.A O no hydrogen 3.148 N/A TRP 168.A NE1 GLU 127.A OE2 no hydrogen 2.914 N/A ALA 169.A N PRO 166.A O no hydrogen 2.758 N/A ILE 170.A N VAL 167.A O no hydrogen 3.073 N/A THR 172.A OG1 TRP 168.A O no hydrogen 2.910 N/A LYS 174.A N THR 172.A OG1 no hydrogen 3.241 N/A ALA 176.A N TYR 208.A OH no hydrogen 2.949 N/A THR 177.A N GLN 180.A OE1 no hydrogen 3.181 N/A GLN 180.A N THR 177.A OG1 no hydrogen 3.175 N/A ALA 181.A N THR 177.A O no hydrogen 3.006 N/A GLN 182.A N PRO 178.A O no hydrogen 2.882 N/A GLN 182.A NE2 ASP 225.A OD2 no hydrogen 2.710 N/A GLU 183.A N GLN 179.A O no hydrogen 3.141 N/A HIS 185.A N ALA 181.A O no hydrogen 3.008 N/A HIS 185.A ND1 ASP 225.A O no hydrogen 3.302 N/A GLU 186.A N GLN 182.A O no hydrogen 2.754 N/A LEU 187.A N GLU 183.A O no hydrogen 3.039 N/A LEU 188.A N VAL 184.A O no hydrogen 2.909 N/A ARG 189.A N HIS 185.A O no hydrogen 3.020 N/A ARG 189.A NE ASP 225.A OD1 no hydrogen 2.722 N/A ARG 189.A NH1 ALA 201.A O no hydrogen 2.796 N/A ARG 189.A NH1 LEU 204.A O no hydrogen 2.676 N/A ARG 189.A NH2 LEU 204.A O no hydrogen 3.561 N/A ARG 189.A NH2 ASP 225.A O no hydrogen 3.137 N/A ARG 189.A NH2 ASN 227.A OD1 no hydrogen 2.529 N/A ARG 190.A N GLU 186.A O no hydrogen 3.095 N/A TRP 191.A N LEU 187.A O no hydrogen 3.210 N/A VAL 192.A N LEU 188.A O no hydrogen 3.280 N/A ARG 193.A N ARG 189.A O no hydrogen 2.801 N/A SER 194.A N ARG 190.A O no hydrogen 2.894 N/A SER 194.A OG ARG 190.A O no hydrogen 3.354 N/A SER 194.A OG TRP 191.A O no hydrogen 2.896 N/A LYS 195.A N TRP 191.A O no hydrogen 3.069 N/A LEU 196.A N VAL 192.A O no hydrogen 2.678 N/A GLY 197.A N ARG 193.A O no hydrogen 2.838 N/A ILE 200.A N ASP 199.A OD1 no hydrogen 2.824 N/A ALA 201.A N GLY 197.A O no hydrogen 3.460 N/A ALA 202.A N THR 198.A O no hydrogen 2.731 N/A GLN 203.A N ASP 199.A O no hydrogen 3.091 N/A LEU 204.A N ILE 200.A O no hydrogen 2.924 N/A ARG 205.A NH1 GLN 3.A O no hydrogen 2.663 N/A ARG 205.A NH1 GLN 3.A OE1 no hydrogen 2.937 N/A ILE 206.A N ASN 227.A OD1 no hydrogen 2.929 N/A LEU 207.A N ILE 162.A O no hydrogen 2.575 N/A TYR 208.A N GLY 228.A O no hydrogen 3.038 N/A TYR 208.A OH GLY 210.A O no hydrogen 2.993 N/A GLY 209.A N TYR 164.A O no hydrogen 3.069 N/A SER 211.A OG ALA 169.A O no hydrogen 2.948 N/A THR 213.A N ASN 216.A OD1 no hydrogen 2.872 N/A ALA 214.A N GLU 239.A OE2 no hydrogen 2.855 N/A ASN 216.A N THR 213.A O no hydrogen 2.993 N/A ASN 216.A ND2 SER 211.A O no hydrogen 3.210 N/A ALA 217.A N THR 213.A O no hydrogen 2.894 N/A THR 219.A OG1 ASN 216.A O no hydrogen 2.799 N/A LEU 220.A N ASN 216.A O no hydrogen 3.178 N/A TYR 221.A N ALA 217.A O no hydrogen 2.886 N/A GLN 222.A N ARG 218.A O no hydrogen 3.254 N/A GLN 222.A N THR 219.A O no hydrogen 3.169 N/A GLN 222.A NE2 THR 219.A O no hydrogen 3.520 N/A MET 223.A N LEU 220.A O no hydrogen 3.440 N/A ARG 224.A NH2 GLU 186.A OE2 no hydrogen 3.278 N/A ASP 225.A N GLN 182.A OE1 no hydrogen 3.210 N/A ASN 227.A N ILE 206.A O no hydrogen 2.891 N/A PHE 229.A N ILE 5.A O no hydrogen 3.110 N/A LEU 230.A N TYR 208.A O no hydrogen 2.825 N/A VAL 231.A N ALA 7.A O no hydrogen 2.768 N/A SER 235.A N GLY 232.A O no hydrogen 2.768 N/A SER 235.A OG ASN 9.A O no hydrogen 3.558 N/A SER 235.A OG VAL 231.A O no hydrogen 3.227 N/A SER 235.A OG GLY 232.A O no hydrogen 2.380 N/A LEU 236.A N GLY 233.A O no hydrogen 3.289 N/A LYS 237.A N ALA 234.A O no hydrogen 3.427 N/A PHE 240.A N LYS 237.A O no hydrogen 2.871 N/A VAL 241.A N PRO 238.A O no hydrogen 3.250 N/A GLU 242.A N GLU 242.A OE1 no hydrogen 2.725 N/A ILE 243.A N GLU 239.A O no hydrogen 3.309 N/A ILE 244.A N PHE 240.A O no hydrogen 3.058 N/A GLU 245.A N VAL 241.A O no hydrogen 3.087 N/A ALA 246.A N GLU 242.A O no hydrogen 3.163 N/A THR 247.A N ILE 244.A O no hydrogen 3.178 N/A THR 247.A OG1 HIS 33.A NE2 no hydrogen 2.856 N/A THR 247.A OG1 ILE 244.A O no hydrogen 2.525 N/A LYS 248.A NZ GLU 245.A OE1 no hydrogen 2.675 N/A