Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 2ixe_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLY 1.A N VAL 79.A O no hydrogen 3.436 N/A LEU 3.A N GLN 80.A O no hydrogen 2.660 N/A LYS 9.A N ASP 74.A OD2 no hydrogen 2.803 N/A GLY 10.A N ASP 74.A OD1 no hydrogen 2.939 N/A LEU 11.A N ASP 74.A OD1 no hydrogen 2.866 N/A VAL 12.A N LEU 37.A O no hydrogen 2.984 N/A LYS 13.A N LEU 72.A O no hydrogen 3.039 N/A PHE 14.A N PHE 35.A O no hydrogen 2.871 N/A GLN 15.A N LYS 70.A O no hydrogen 2.941 N/A ASP 16.A N THR 34.A OG1 no hydrogen 2.855 N/A VAL 17.A N LEU 33.A O no hydrogen 2.891 N/A SER 18.A N GLY 68.A O no hydrogen 2.829 N/A PHE 19.A N LEU 30.A O no hydrogen 2.889 N/A TYR 21.A OH THR 55.A OG1 no hydrogen 2.653 N/A HIS 24.A N TYR 21.A O no hydrogen 2.770 N/A VAL 27.A N HIS 24.A O no hydrogen 3.298 N/A GLN 28.A NE2 PHE 19.A O no hydrogen 3.668 N/A GLN 28.A NE2 LEU 30.A O no hydrogen 3.056 N/A VAL 29.A N PHE 19.A O no hydrogen 2.902 N/A LEU 30.A N PHE 19.A O no hydrogen 3.028 N/A GLN 31.A N GLY 227.A O no hydrogen 3.020 N/A GLN 31.A NE2 GLU 226.A O no hydrogen 3.038 N/A LEU 33.A N VAL 17.A O no hydrogen 2.976 N/A PHE 35.A N PHE 14.A O no hydrogen 3.071 N/A LEU 37.A N VAL 12.A O no hydrogen 2.765 N/A LYS 41.A N TYR 38.A O no hydrogen 3.268 N/A VAL 42.A N HIS 219.A ND1 no hydrogen 3.142 N/A THR 43.A N VAL 205.A O no hydrogen 2.849 N/A ALA 44.A N HIS 220.A O no hydrogen 2.856 N/A LEU 45.A N LEU 207.A O no hydrogen 2.813 N/A VAL 46.A N LEU 222.A O no hydrogen 2.991 N/A SER 51.A N PRO 48.A O no hydrogen 3.096 N/A SER 51.A OG PRO 48.A O no hydrogen 2.781 N/A SER 51.A OG LEU 224.A O no hydrogen 3.514 N/A LYS 53.A NZ GLY 47.A O no hydrogen 2.881 N/A SER 54.A OG ASP 176.A OD1 no hydrogen 3.559 N/A SER 54.A OG ASP 176.A OD2 no hydrogen 2.599 N/A THR 55.A OG1 TYR 21.A OH no hydrogen 2.653 N/A VAL 56.A N GLY 52.A O no hydrogen 2.918 N/A ALA 57.A N LYS 53.A O no hydrogen 3.082 N/A ALA 58.A N SER 54.A O no hydrogen 2.986 N/A LEU 59.A N THR 55.A O no hydrogen 3.041 N/A LEU 60.A N VAL 56.A O no hydrogen 2.995 N/A GLN 61.A N ALA 58.A O no hydrogen 3.179 N/A GLN 61.A NE2 ALA 57.A O no hydrogen 2.926 N/A ASN 62.A N LEU 59.A O no hydrogen 3.001 N/A LEU 63.A N ALA 58.A O no hydrogen 3.046 N/A GLN 65.A NE2 ASN 62.A OD1 no hydrogen 3.216 N/A THR 67.A N SER 18.A O no hydrogen 2.859 N/A THR 67.A OG1 SER 18.A O no hydrogen 2.926 N/A GLY 68.A N SER 18.A O no hydrogen 3.206 N/A LYS 70.A N GLN 15.A O no hydrogen 3.055 N/A LEU 72.A N LYS 13.A O no hydrogen 2.843 N/A LEU 73.A N GLU 76.A O no hydrogen 2.787 N/A ASP 74.A N LEU 11.A O no hydrogen 2.815 N/A GLU 76.A N LEU 73.A O no hydrogen 3.090 N/A LEU 78.A N VAL 71.A O no hydrogen 2.881 N/A GLN 80.A N PRO 77.A O no hydrogen 3.265 N/A TYR 81.A N LEU 78.A O no hydrogen 2.942 N/A TYR 81.A OH LEU 73.A O no hydrogen 2.588 N/A ASP 82.A N LEU 3.A O no hydrogen 2.667 N/A TYR 85.A N ASP 82.A OD2 no hydrogen 3.118 N/A TYR 85.A OH PRO 5.A O no hydrogen 2.699 N/A LEU 86.A N ASP 82.A O no hydrogen 2.933 N/A HIS 87.A N HIS 83.A O no hydrogen 3.245 N/A THR 88.A N HIS 84.A O no hydrogen 3.200 N/A THR 88.A N TYR 85.A O no hydrogen 3.131 N/A THR 88.A OG1 TYR 85.A O no hydrogen 2.577 N/A GLN 89.A N TYR 85.A O no hydrogen 3.247 N/A GLN 89.A N LEU 86.A O no hydrogen 3.094 N/A VAL 90.A N LEU 86.A O no hydrogen 2.808 N/A ALA 91.A N LEU 172.A O no hydrogen 2.929 N/A VAL 93.A N ILE 174.A O no hydrogen 2.767 N/A LEU 99.A N THR 148.A O no hydrogen 3.014 N/A ARG 102.A N GLU 106.A OE1 no hydrogen 2.892 N/A ARG 102.A NH1 GLU 106.A OE2 no hydrogen 2.771 N/A ARG 105.A N TYR 141.A O no hydrogen 2.898 N/A ARG 105.A NE ASP 142.A OD1 no hydrogen 3.093 N/A ARG 105.A NH1 ASP 142.A OD1 no hydrogen 3.146 N/A ARG 105.A NH1 ASP 142.A OD2 no hydrogen 2.971 N/A GLU 106.A N SER 103.A OG no hydrogen 3.342 N/A ASN 107.A N SER 103.A O no hydrogen 2.707 N/A ASN 107.A ND2 PHE 100.A O no hydrogen 3.070 N/A ASN 107.A ND2 GLY 101.A O no hydrogen 3.397 N/A ILE 108.A N PHE 104.A O no hydrogen 3.034 N/A ALA 109.A N ARG 105.A O no hydrogen 3.131 N/A LEU 112.A N ALA 109.A O no hydrogen 3.151 N/A ARG 114.A NH1 GLU 120.A OE1 no hydrogen 3.327 N/A THR 117.A N GLU 120.A OE1 no hydrogen 2.830 N/A THR 117.A OG1 GLU 120.A OE1 no hydrogen 3.232 N/A GLU 120.A N THR 117.A OG1 no hydrogen 3.025 N/A ILE 121.A N THR 117.A O no hydrogen 3.058 N/A THR 122.A N MET 118.A O no hydrogen 2.749 N/A THR 122.A OG1 MET 118.A O no hydrogen 2.655 N/A ALA 123.A N GLU 119.A O no hydrogen 2.944 N/A VAL 124.A N GLU 120.A O no hydrogen 3.246 N/A ALA 125.A N ILE 121.A O no hydrogen 3.169 N/A MET 126.A N THR 122.A O no hydrogen 2.888 N/A GLU 127.A N ALA 123.A O no hydrogen 3.051 N/A SER 128.A N VAL 124.A O no hydrogen 2.900 N/A SER 128.A OG VAL 124.A O no hydrogen 3.435 N/A SER 128.A OG ALA 125.A O no hydrogen 3.326 N/A SER 128.A OG ALA 159.A O no hydrogen 2.882 N/A GLY 129.A N MET 126.A O no hydrogen 3.399 N/A ALA 130.A N ALA 125.A O no hydrogen 2.826 N/A HIS 131.A N ALA 125.A O no hydrogen 3.009 N/A HIS 131.A ND1 TYR 141.A OH no hydrogen 2.708 N/A ILE 134.A N ALA 130.A O no hydrogen 3.194 N/A SER 135.A N HIS 131.A O no hydrogen 2.800 N/A SER 135.A OG HIS 131.A O no hydrogen 3.275 N/A SER 135.A OG ASP 132.A O no hydrogen 2.780 N/A GLY 136.A N ASP 132.A O no hydrogen 3.189 N/A GLY 136.A N PHE 133.A O no hydrogen 3.204 N/A PHE 137.A N ILE 134.A O no hydrogen 3.190 N/A GLY 140.A N PHE 137.A O no hydrogen 3.110 N/A TYR 141.A OH HIS 131.A ND1 no hydrogen 2.708 N/A ASP 142.A N GLN 139.A O no hydrogen 2.964 N/A THR 143.A N GLY 140.A O no hydrogen 3.096 N/A THR 143.A OG1 GLY 140.A O no hydrogen 2.737 N/A VAL 145.A N ARG 102.A O no hydrogen 2.725 N/A GLY 149.A N GLY 146.A O no hydrogen 2.706 N/A ASN 150.A N GLU 147.A O no hydrogen 3.245 N/A LEU 152.A N GLY 149.A O no hydrogen 3.258 N/A SER 153.A N GLN 156.A OE1 no hydrogen 2.962 N/A GLN 156.A N SER 153.A OG no hydrogen 3.121 N/A ARG 157.A N SER 153.A O no hydrogen 2.943 N/A ARG 157.A NE.A GLY 149.A O no hydrogen 3.190 N/A ARG 157.A NH2.A GLY 149.A O no hydrogen 3.260 N/A ARG 157.A NH2.B THR 148.A O no hydrogen 3.527 N/A GLN 158.A N GLY 154.A O no hydrogen 3.234 N/A GLN 158.A NE2 GLN 95.A O no hydrogen 2.984 N/A GLN 158.A NE2 SER 180.A OG no hydrogen 3.340 N/A ALA 159.A N GLY 155.A O no hydrogen 2.866 N/A VAL 160.A N GLN 156.A O no hydrogen 2.923 N/A ALA 161.A N ARG 157.A O no hydrogen 2.956 N/A LEU 162.A N GLN 158.A O no hydrogen 2.933 N/A ALA 163.A N ALA 159.A O no hydrogen 3.185 N/A ARG 164.A N VAL 160.A O no hydrogen 3.034 N/A ARG 164.A NH2 LEU 98.A O no hydrogen 2.478 N/A ALA 165.A N ALA 161.A O no hydrogen 3.059 N/A LEU 166.A N LEU 162.A O no hydrogen 2.824 N/A ILE 167.A N ALA 163.A O no hydrogen 3.022 N/A ARG 168.A N ALA 165.A O no hydrogen 3.261 N/A ARG 168.A NH2 TYR 110.A O no hydrogen 3.180 N/A LYS 169.A N LEU 166.A O no hydrogen 2.965 N/A ARG 171.A NH1 MET 8.A O no hydrogen 3.409 N/A LEU 172.A N GLN 89.A O no hydrogen 2.947 N/A LEU 173.A N THR 204.A O no hydrogen 2.924 N/A ILE 174.A N ALA 91.A O no hydrogen 2.829 N/A LEU 175.A N LEU 206.A O no hydrogen 2.895 N/A ASP 176.A N VAL 93.A O no hydrogen 2.853 N/A ASN 177.A N ILE 208.A O no hydrogen 2.954 N/A THR 179.A OG1 GLN 187.A OE1 no hydrogen 2.774 N/A SER 180.A OG GLN 95.A OE1 no hydrogen 2.987 N/A SER 180.A OG ASN 177.A O no hydrogen 3.392 N/A ALA 181.A N GLN 158.A OE1 no hydrogen 2.823 N/A LEU 182.A N THR 179.A O no hydrogen 3.190 N/A ASN 186.A N ASP 183.A OD1 no hydrogen 2.926 N/A GLN 187.A N ASP 183.A O no hydrogen 2.763 N/A GLN 187.A NE2 THR 179.A O no hydrogen 2.855 N/A LEU 188.A N ALA 184.A O no hydrogen 2.864 N/A ARG 189.A N GLY 185.A O no hydrogen 2.955 N/A VAL 190.A N ASN 186.A O no hydrogen 2.993 N/A GLN 191.A N GLN 187.A O no hydrogen 2.929 N/A GLN 191.A NE2 LEU 214.A O no hydrogen 3.558 N/A ARG 192.A N LEU 188.A O no hydrogen 2.929 N/A LEU 193.A N ARG 189.A O no hydrogen 2.839 N/A LEU 194.A N VAL 190.A O no hydrogen 2.845 N/A TYR 195.A N GLN 191.A O no hydrogen 2.894 N/A TYR 195.A OH LEU 214.A O no hydrogen 3.182 N/A GLU 196.A N ARG 192.A O no hydrogen 2.661 N/A SER 202.A OG GLU 199.A O no hydrogen 2.590 N/A THR 204.A N ARG 171.A O no hydrogen 2.925 N/A VAL 205.A N LYS 41.A O no hydrogen 3.075 N/A LEU 206.A N LEU 173.A O no hydrogen 2.866 N/A LEU 207.A N THR 43.A O no hydrogen 2.806 N/A ILE 208.A N LEU 175.A O no hydrogen 2.814 N/A GLN 210.A NE2 GLY 47.A O no hydrogen 3.038 N/A GLN 211.A N THR 209.A OG1 no hydrogen 2.866 N/A GLN 211.A NE2 SER 213.A OG no hydrogen 3.204 N/A LEU 214.A N GLN 211.A O no hydrogen 2.914 N/A ALA 215.A N LEU 212.A O no hydrogen 3.120 N/A GLU 216.A N SER 213.A O no hydrogen 3.466 N/A ARG 217.A NH1 GLU 196.A OE2 no hydrogen 3.473 N/A ALA 218.A N ALA 215.A O no hydrogen 2.978 N/A HIS 219.A N VAL 42.A O no hydrogen 2.873 N/A HIS 220.A NE2 GLN 232.A OE1 no hydrogen 2.742 N/A ILE 221.A N GLY 233.A O no hydrogen 2.736 N/A LEU 222.A N ALA 44.A O no hydrogen 2.742 N/A PHE 223.A N GLU 231.A O no hydrogen 2.924 N/A LEU 224.A N VAL 46.A O no hydrogen 2.780 N/A LYS 225.A N SER 228.A O no hydrogen 2.855 N/A GLY 227.A N SER 51.A O no hydrogen 2.953 N/A SER 228.A N LYS 225.A O no hydrogen 3.045 N/A CYS 230.A N PHE 223.A O no hydrogen 2.736 N/A GLY 233.A N ILE 221.A O no hydrogen 2.989 N/A THR 234.A N GLN 237.A OE1 no hydrogen 2.916 N/A HIS 235.A ND1 TYR 245.A OH no hydrogen 2.544 N/A GLN 237.A N THR 234.A OG1 no hydrogen 3.081 N/A LEU 238.A N THR 234.A O no hydrogen 2.842 N/A MET 239.A N HIS 235.A O no hydrogen 2.791 N/A GLU 240.A N LEU 236.A O no hydrogen 2.990 N/A ARG 241.A N GLN 237.A O no hydrogen 3.316 N/A ARG 241.A NE GLU 231.A OE2 no hydrogen 3.239 N/A CYS 244.A N GLU 231.A OE2 no hydrogen 3.210 N/A TYR 245.A N GLU 231.A OE1 no hydrogen 2.668 N/A TYR 245.A OH HIS 235.A ND1 no hydrogen 2.544 N/A SER 247.A N GLY 243.A O no hydrogen 2.970 N/A SER 247.A OG GLY 243.A O no hydrogen 3.085 N/A MET 248.A N CYS 244.A O no hydrogen 3.032 N/A VAL 249.A N TYR 245.A O no hydrogen 2.994 N/A GLU 250.A N ARG 246.A O no hydrogen 2.964 N/A ALA 251.A N SER 247.A O no hydrogen 3.142 N/A