Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3lcr_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLY 5.A N ASP 2.A OD2 no hydrogen 3.135 N/A GLU 6.A N ASP 2.A O no hydrogen 2.683 N/A LEU 7.A N TYR 3.A O no hydrogen 3.311 N/A PHE 8.A N PHE 4.A O no hydrogen 2.885 N/A LEU 9.A N GLY 5.A O no hydrogen 2.991 N/A GLN 10.A N GLU 6.A O no hydrogen 2.844 N/A ALA 11.A N LEU 7.A O no hydrogen 2.863 N/A MET 12.A N PHE 8.A O no hydrogen 3.289 N/A ARG 13.A NH2 GLN 10.A OE1 no hydrogen 2.522 N/A THR 14.A N ALA 11.A O no hydrogen 3.160 N/A THR 14.A OG1 GLN 10.A O no hydrogen 3.223 N/A THR 14.A OG1 ALA 11.A O no hydrogen 3.219 N/A GLU 16.A N ALA 11.A O no hydrogen 2.948 N/A ALA 20.A N GLU 16.A O no hydrogen 3.303 N/A GLN 21.A N LEU 17.A O no hydrogen 3.006 N/A GLN 22.A N ALA 18.A O no hydrogen 3.134 N/A LEU 23.A N GLN 19.A O no hydrogen 3.151 N/A MET 24.A N ALA 20.A O no hydrogen 3.202 N/A ALA 25.A N GLN 21.A O no hydrogen 2.959 N/A GLY 26.A N GLN 22.A O no hydrogen 2.935 N/A ALA 27.A N LEU 23.A O no hydrogen 2.900 N/A ALA 28.A N MET 24.A O no hydrogen 2.816 N/A GLN 29.A N ALA 25.A O no hydrogen 2.989 N/A LEU 30.A N GLY 26.A O no hydrogen 3.152 N/A ARG 31.A N ALA 27.A O no hydrogen 2.990 N/A ARG 31.A NH1 GLY 88.A O no hydrogen 3.240 N/A ARG 31.A NH1 THR 192.A OG1 no hydrogen 2.958 N/A ARG 31.A NH2 GLY 88.A O no hydrogen 2.763 N/A ARG 31.A NH2 GLN 93.A O no hydrogen 3.199 N/A LYS 33.A NZ ALA 28.A O no hydrogen 2.614 N/A LYS 33.A NZ ARG 31.A O no hydrogen 2.861 N/A TYR 34.A N LEU 95.A O no hydrogen 2.858 N/A TYR 34.A OH SER 105.A OG no hydrogen 2.904 N/A VAL 42.A N ALA 83.A O no hydrogen 2.792 N/A LEU 44.A N VAL 81.A O no hydrogen 2.783 N/A ARG 46.A N ASP 76.A OD2 no hydrogen 2.662 N/A GLY 47.A N ASP 76.A OD1 no hydrogen 3.135 N/A GLY 47.A N ASP 76.A OD2 no hydrogen 3.428 N/A GLN 52.A N GLU 118.A O no hydrogen 3.199 N/A GLN 52.A NE2 GLU 113.A O no hydrogen 3.398 N/A LEU 53.A N ARG 80.A O no hydrogen 2.840 N/A ILE 54.A N ALA 120.A O no hydrogen 2.859 N/A LEU 55.A N SER 82.A O no hydrogen 2.703 N/A VAL 56.A N ALA 122.A O no hydrogen 2.804 N/A CYS 57.A N LEU 84.A O no hydrogen 2.928 N/A CYS 57.A SG GLY 64.A O no hydrogen 3.620 N/A CYS 57.A SG LEU 84.A O no hydrogen 3.536 N/A THR 59.A N SER 126.A OG no hydrogen 2.868 N/A THR 59.A OG1 SER 126.A OG no hydrogen 3.361 N/A MET 61.A N GLN 194.A OE1 no hydrogen 2.788 N/A THR 63.A N VAL 60.A O no hydrogen 2.848 N/A THR 63.A OG1 PRO 58.A O no hydrogen 2.586 N/A VAL 67.A N GLY 64.A O no hydrogen 3.297 N/A TYR 68.A N PRO 65.A O no hydrogen 3.125 N/A TYR 68.A OH VAL 56.A O no hydrogen 2.715 N/A SER 69.A N GLN 66.A O no hydrogen 3.030 N/A SER 69.A OG GLN 66.A O no hydrogen 3.396 N/A ALA 72.A N TYR 68.A O no hydrogen 2.851 N/A GLU 73.A N SER 69.A O no hydrogen 3.233 N/A GLU 74.A N ARG 70.A O no hydrogen 3.170 N/A LEU 75.A N LEU 71.A O no hydrogen 3.145 N/A LEU 75.A N ALA 72.A O no hydrogen 3.056 N/A ASP 76.A N GLU 73.A O no hydrogen 3.490 N/A ARG 79.A NH1 GLY 265.A O no hydrogen 3.524 N/A ARG 79.A NH2 LEU 75.A O no hydrogen 2.910 N/A ARG 80.A N PRO 51.A O no hydrogen 2.948 N/A ARG 80.A NE GLY 50.A O no hydrogen 2.894 N/A ARG 80.A NH2 GLY 50.A O no hydrogen 3.053 N/A SER 82.A N LEU 53.A O no hydrogen 2.986 N/A ALA 83.A N VAL 42.A O no hydrogen 2.774 N/A LEU 84.A N LEU 55.A O no hydrogen 2.830 N/A VAL 85.A N GLU 40.A O no hydrogen 2.780 N/A GLY 88.A N GLN 93.A OE1 no hydrogen 2.919 N/A GLN 93.A N HIS 90.A O no hydrogen 3.405 N/A LEU 95.A N LEU 32.A O no hydrogen 3.192 N/A ALA 97.A N TYR 34.A O no hydrogen 2.913 N/A VAL 101.A N THR 98.A OG1 no hydrogen 3.159 N/A LEU 102.A N THR 98.A O no hydrogen 3.065 N/A VAL 103.A N LEU 99.A O no hydrogen 2.844 N/A ARG 104.A N THR 100.A O no hydrogen 3.008 N/A SER 105.A N VAL 101.A O no hydrogen 3.024 N/A SER 105.A OG TYR 34.A OH no hydrogen 2.904 N/A SER 105.A OG VAL 101.A O no hydrogen 3.048 N/A LEU 106.A N LEU 102.A O no hydrogen 3.050 N/A ALA 107.A N VAL 103.A O no hydrogen 2.830 N/A ASP 108.A N ARG 104.A O no hydrogen 2.944 N/A VAL 109.A N SER 105.A O no hydrogen 3.344 N/A VAL 110.A N LEU 106.A O no hydrogen 3.037 N/A GLN 111.A N ALA 107.A O no hydrogen 2.793 N/A ALA 112.A N ASP 108.A O no hydrogen 3.214 N/A GLU 113.A N VAL 109.A O no hydrogen 2.955 N/A VAL 114.A N VAL 110.A O no hydrogen 2.934 N/A ALA 115.A N GLN 111.A O no hydrogen 2.935 N/A GLY 117.A N VAL 114.A O no hydrogen 2.950 N/A ALA 120.A N GLN 52.A O no hydrogen 3.007 N/A LEU 121.A N GLY 147.A O no hydrogen 3.093 N/A ALA 122.A N ILE 54.A O no hydrogen 3.031 N/A GLY 123.A N VAL 149.A O no hydrogen 2.909 N/A HIS 124.A N TYR 68.A OH no hydrogen 2.840 N/A HIS 124.A NE2 HIS 248.A O no hydrogen 2.632 N/A SER 125.A N ILE 151.A O no hydrogen 2.763 N/A SER 126.A OG THR 59.A OG1 no hydrogen 3.361 N/A GLY 127.A N HIS 124.A O no hydrogen 2.810 N/A GLY 128.A N SER 125.A O no hydrogen 2.781 N/A VAL 129.A N SER 125.A O no hydrogen 3.111 N/A VAL 130.A N SER 126.A O no hydrogen 2.892 N/A ALA 131.A N GLY 127.A O no hydrogen 2.878 N/A TYR 132.A N GLY 128.A O no hydrogen 2.999 N/A GLU 133.A N VAL 129.A O no hydrogen 3.201 N/A VAL 134.A N VAL 130.A O no hydrogen 2.900 N/A ALA 135.A N ALA 131.A O no hydrogen 2.944 N/A ARG 136.A N TYR 132.A O no hydrogen 3.040 N/A ARG 136.A NE GLY 208.A O no hydrogen 3.194 N/A ARG 136.A NH1 GLU 133.A OE2 no hydrogen 3.221 N/A GLU 137.A N GLU 133.A O no hydrogen 3.077 N/A LEU 138.A N VAL 134.A O no hydrogen 2.925 N/A GLU 139.A N ALA 135.A O no hydrogen 2.945 N/A ALA 140.A N ARG 136.A O no hydrogen 3.026 N/A ARG 141.A N GLU 137.A O no hydrogen 3.118 N/A ARG 141.A NE GLU 137.A OE2 no hydrogen 2.923 N/A ARG 141.A NH1 ASP 108.A OD1 no hydrogen 2.505 N/A ARG 141.A NH1 GLN 111.A OE1 no hydrogen 2.775 N/A ARG 141.A NH2 ASP 108.A OD1 no hydrogen 2.740 N/A ARG 141.A NH2 GLU 137.A OE2 no hydrogen 3.533 N/A GLY 142.A N GLU 139.A O no hydrogen 3.115 N/A LEU 143.A N LEU 138.A O no hydrogen 2.817 N/A ARG 146.A N PHE 119.A O no hydrogen 2.786 N/A VAL 148.A N PRO 212.A O no hydrogen 3.087 N/A VAL 149.A N LEU 121.A O no hydrogen 2.867 N/A LEU 150.A N LEU 214.A O no hydrogen 2.886 N/A ILE 151.A N GLY 123.A O no hydrogen 2.895 N/A ASP 152.A N VAL 216.A O no hydrogen 2.848 N/A SER 153.A OG SER 125.A O no hydrogen 2.726 N/A SER 155.A N TRP 230.A O no hydrogen 2.840 N/A SER 155.A OG TRP 204.A O no hydrogen 2.726 N/A GLU 165.A N GLY 161.A O no hydrogen 3.209 N/A LEU 166.A N ARG 162.A O no hydrogen 3.132 N/A PHE 167.A N PRO 163.A O no hydrogen 2.984 N/A ARG 168.A N GLU 164.A O no hydrogen 2.853 N/A SER 169.A N GLU 165.A O no hydrogen 2.814 N/A ALA 170.A N LEU 166.A O no hydrogen 3.022 N/A LEU 171.A N PHE 167.A O no hydrogen 2.930 N/A ASN 172.A N ARG 168.A O no hydrogen 2.874 N/A GLU 173.A N SER 169.A O no hydrogen 2.984 N/A ARG 174.A NH1 ASP 247.A OD1 no hydrogen 2.812 N/A ARG 174.A NH1 ASP 247.A OD2 no hydrogen 3.441 N/A ARG 174.A NH2 ASP 247.A OD1 no hydrogen 3.347 N/A PHE 175.A N LEU 171.A O no hydrogen 3.001 N/A VAL 176.A N ASN 172.A O no hydrogen 3.002 N/A GLU 177.A N GLU 173.A O no hydrogen 3.145 N/A TYR 178.A N ARG 174.A O no hydrogen 2.981 N/A LEU 179.A N PHE 175.A O no hydrogen 3.135 N/A ARG 180.A N VAL 176.A O no hydrogen 2.883 N/A ARG 180.A NE GLU 177.A OE1 no hydrogen 2.939 N/A ARG 180.A NH1 GLU 177.A OE2 no hydrogen 2.872 N/A LEU 181.A N GLU 177.A O no hydrogen 2.964 N/A THR 182.A N TYR 178.A O no hydrogen 2.631 N/A SER 188.A OG ASP 2.A OD2 no hydrogen 2.598 N/A GLN 189.A NE2 GLY 88.A O no hydrogen 3.656 N/A GLN 189.A NE2 GLY 91.A O no hydrogen 2.652 N/A ARG 190.A N ASN 186.A O no hydrogen 3.109 N/A ARG 190.A NH1 MET 61.A O no hydrogen 2.780 N/A ARG 190.A NH1 THR 63.A O no hydrogen 3.190 N/A ILE 191.A N LEU 187.A O no hydrogen 2.989 N/A THR 192.A N SER 188.A O no hydrogen 2.987 N/A THR 192.A OG1 SER 188.A O no hydrogen 2.756 N/A THR 192.A OG1 GLN 189.A O no hydrogen 3.154 N/A ALA 193.A N GLN 189.A O no hydrogen 3.251 N/A GLN 194.A N ARG 190.A O no hydrogen 3.065 N/A VAL 195.A N ILE 191.A O no hydrogen 2.898 N/A TRP 196.A N THR 192.A O no hydrogen 2.992 N/A TRP 196.A NE1 PRO 96.A O no hydrogen 2.743 N/A CYS 197.A N ALA 193.A O no hydrogen 2.958 N/A CYS 197.A SG ALA 193.A O no hydrogen 3.223 N/A LEU 198.A N GLN 194.A O no hydrogen 2.848 N/A GLU 199.A N VAL 195.A O no hydrogen 3.196 N/A LEU 200.A N TRP 196.A O no hydrogen 3.284 N/A LEU 201.A N LEU 198.A O no hydrogen 3.020 N/A ARG 202.A N GLU 199.A O no hydrogen 3.147 N/A ARG 202.A NE GLY 158.A O no hydrogen 2.868 N/A ARG 202.A NH1 ASP 157.A O no hydrogen 3.554 N/A ARG 202.A NH1 GLY 158.A O no hydrogen 3.197 N/A ARG 202.A NH1 GLU 164.A OE1 no hydrogen 2.723 N/A ARG 202.A NH1 GLU 164.A OE2 no hydrogen 3.289 N/A ARG 202.A NH2 GLU 164.A OE2 no hydrogen 2.741 N/A TRP 204.A N LEU 201.A O no hydrogen 3.125 N/A TRP 204.A NE1 GLU 133.A OE1 no hydrogen 2.612 N/A GLY 208.A N TYR 132.A OH no hydrogen 3.039 N/A THR 210.A N GLU 139.A OE1 no hydrogen 2.890 N/A THR 210.A OG1 GLU 139.A OE1 no hydrogen 2.766 N/A ALA 211.A N GLU 139.A OE2 no hydrogen 2.886 N/A LEU 214.A N VAL 148.A O no hydrogen 3.032 N/A TYR 215.A N GLN 240.A O no hydrogen 2.839 N/A TYR 215.A OH ASP 152.A OD1 no hydrogen 3.324 N/A TYR 215.A OH SER 153.A O no hydrogen 2.521 N/A VAL 216.A N LEU 150.A O no hydrogen 2.928 N/A ARG 217.A N VAL 242.A O no hydrogen 2.751 N/A ALA 219.A N ALA 244.A O no hydrogen 2.771 N/A GLN 220.A N GLY 246.A O no hydrogen 2.954 N/A LEU 222.A N GLU 226.A OE1 no hydrogen 2.796 N/A VAL 223.A N GLU 226.A OE1 no hydrogen 3.107 N/A GLN 225.A N GLN 225.A OE1 no hydrogen 2.763 N/A GLU 229.A N GLU 229.A OE1 no hydrogen 2.655 N/A TRP 230.A N LYS 227.A O no hydrogen 3.016 N/A ARG 231.A N PRO 228.A O no hydrogen 3.104 N/A ARG 231.A NE ASP 152.A OD1 no hydrogen 2.828 N/A ARG 231.A NH1 GLU 226.A OE2 no hydrogen 3.268 N/A ARG 231.A NH2 ASP 152.A OD2 no hydrogen 3.052 N/A GLY 232.A N PRO 228.A O no hydrogen 2.904 N/A LEU 235.A N ARG 231.A O no hydrogen 2.734 N/A ALA 236.A N GLY 232.A O no hydrogen 3.085 N/A ALA 237.A N VAL 234.A O no hydrogen 3.082 N/A MET 238.A N LEU 235.A O no hydrogen 2.940 N/A GLY 239.A N THR 213.A OG1 no hydrogen 2.762 N/A VAL 242.A N TYR 215.A O no hydrogen 2.872 N/A ALA 244.A N ARG 217.A O no hydrogen 2.816 N/A ASP 247.A N THR 250.A OG1 no hydrogen 2.798 N/A HIS 248.A ND1 ASP 152.A OD2 no hydrogen 2.837 N/A PHE 249.A N ASP 247.A OD2 no hydrogen 2.886 N/A THR 250.A N ASP 247.A OD2 no hydrogen 2.822 N/A THR 250.A OG1 ASP 247.A OD2 no hydrogen 3.358 N/A ILE 251.A N ASP 247.A O no hydrogen 3.082 N/A ILE 252.A N PHE 249.A O no hydrogen 3.273 N/A GLU 253.A N THR 250.A O no hydrogen 2.977 N/A HIS 256.A N GLU 253.A O no hydrogen 3.229 N/A VAL 257.A N GLU 253.A O no hydrogen 2.995 N/A SER 259.A OG HIS 256.A O no hydrogen 3.036 N/A THR 260.A N HIS 256.A O no hydrogen 3.041 N/A THR 260.A OG1 ILE 251.A O no hydrogen 2.590 N/A THR 260.A OG1 HIS 256.A O no hydrogen 3.098 N/A ALA 261.A N VAL 257.A O no hydrogen 2.775 N/A HIS 262.A N ALA 258.A O no hydrogen 2.997 N/A ILE 263.A N SER 259.A O no hydrogen 3.161 N/A VAL 264.A N THR 260.A O no hydrogen 2.901 N/A GLY 265.A N ALA 261.A O no hydrogen 2.722 N/A ASP 266.A N HIS 262.A O no hydrogen 3.023 N/A TRP 267.A N ILE 263.A O no hydrogen 3.164 N/A LEU 268.A N VAL 264.A O no hydrogen 2.875 N/A ARG 269.A N GLY 265.A O no hydrogen 2.889 N/A ARG 269.A NH2 ASP 266.A OD1 no hydrogen 2.741 N/A GLU 270.A N ASP 266.A O no hydrogen 3.104 N/A ALA 271.A N TRP 267.A O no hydrogen 2.819 N/A HIS 272.A N LEU 268.A O no hydrogen 3.040 N/A ALA 273.A N ARG 269.A O no hydrogen 2.887 N/A