Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 2qcc_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): PHE 4.A N TYR 243.A OH no hydrogen 3.041 N/A GLY 5.A N GLN 25.A OE1 no hydrogen 2.834 N/A ALA 6.A N SER 3.A OG no hydrogen 3.076 N/A ARG 7.A N SER 3.A O no hydrogen 2.899 N/A ARG 7.A NE PRO 187.A O no hydrogen 3.016 N/A ARG 7.A NH1 ASP 214.A OD1 no hydrogen 2.885 N/A ARG 7.A NH2 PRO 187.A O no hydrogen 3.243 N/A ARG 7.A NH2 ASP 214.A OD1 no hydrogen 3.547 N/A ARG 7.A NH2 ASP 214.A OD2 no hydrogen 3.181 N/A ALA 8.A N PHE 4.A O no hydrogen 2.984 N/A GLU 9.A N ALA 6.A O no hydrogen 2.882 N/A LEU 10.A N ARG 7.A O no hydrogen 3.085 N/A ILE 13.A N LEU 10.A O no hydrogen 3.240 N/A VAL 16.A N HIS 14.A ND1 no hydrogen 3.031 N/A SER 18.A N HIS 14.A O no hydrogen 2.889 N/A SER 18.A OG ALA 8.A O no hydrogen 2.707 N/A LYS 19.A N PRO 15.A O no hydrogen 2.947 N/A LEU 20.A N VAL 16.A O no hydrogen 2.897 N/A LEU 21.A N ALA 17.A O no hydrogen 2.736 N/A ARG 22.A N SER 18.A O no hydrogen 2.903 N/A LEU 23.A N LYS 19.A O no hydrogen 3.332 N/A MET 24.A N LEU 20.A O no hydrogen 2.991 N/A GLN 25.A N LEU 21.A O no hydrogen 3.065 N/A LYS 26.A N ARG 22.A O no hydrogen 2.876 N/A LYS 26.A NZ GLU 83.A OE1 no hydrogen 2.655 N/A LYS 27.A N LEU 23.A O no hydrogen 3.052 N/A LYS 27.A NZ GLY 51.A O no hydrogen 2.752 N/A LYS 27.A NZ ILE 54.A O no hydrogen 2.747 N/A LYS 27.A NZ HIS 82.A O no hydrogen 2.696 N/A LYS 27.A NZ GLU 83.A O no hydrogen 3.002 N/A THR 29.A N MET 24.A O no hydrogen 3.159 N/A THR 29.A OG1 SER 53.A O no hydrogen 2.622 N/A ASN 30.A ND2 ASP 214.A O no hydrogen 2.823 N/A ASN 30.A ND2 ALA 239.A O no hydrogen 3.357 N/A LEU 31.A N THR 29.A OG1 no hydrogen 3.219 N/A CYS 32.A N ILE 216.A O no hydrogen 2.777 N/A CYS 32.A SG LEU 33.A O no hydrogen 3.958 N/A CYS 32.A SG MET 56.A O no hydrogen 3.867 N/A LEU 33.A N MET 56.A O no hydrogen 3.034 N/A SER 34.A N VAL 218.A O no hydrogen 2.849 N/A SER 34.A OG ASP 36.A OD1 no hydrogen 3.214 N/A SER 34.A OG ASP 36.A OD2 no hydrogen 2.653 N/A ALA 35.A N LYS 58.A O no hydrogen 2.976 N/A VAL 37.A N ALA 35.A O no hydrogen 2.890 N/A LEU 39.A N GLU 42.A OE1.A no hydrogen 3.310 N/A ALA 40.A N ASP 66.A OD1 no hydrogen 2.848 N/A LEU 43.A N LEU 39.A O no hydrogen 3.161 N/A LEU 44.A N ALA 40.A O no hydrogen 2.989 N/A GLN 45.A N ARG 41.A O no hydrogen 2.879 N/A LEU 46.A N GLU 42.A O no hydrogen 2.958 N/A ALA 47.A N LEU 43.A O no hydrogen 2.905 N/A ASP 48.A N LEU 44.A O no hydrogen 2.931 N/A ALA 49.A N GLN 45.A O no hydrogen 3.107 N/A LEU 50.A N LEU 46.A O no hydrogen 2.881 N/A SER 53.A N LEU 50.A O no hydrogen 2.808 N/A SER 53.A OG GLU 233.A OE2 no hydrogen 2.840 N/A ILE 54.A N GLY 51.A O no hydrogen 3.244 N/A CYS 55.A N LEU 31.A O no hydrogen 2.952 N/A CYS 55.A SG LEU 31.A O no hydrogen 3.569 N/A LEU 57.A N LEU 85.A O no hydrogen 2.816 N/A LYS 58.A N LEU 33.A O no hydrogen 2.714 N/A LYS 58.A NZ SER 34.A OG no hydrogen 3.163 N/A LYS 58.A NZ ASP 89.A OD2 no hydrogen 2.733 N/A THR 59.A N PHE 87.A O no hydrogen 2.824 N/A THR 59.A OG1 PHE 87.A O no hydrogen 3.511 N/A THR 59.A OG1 GLU 88.A OE1 no hydrogen 2.796 N/A HIS 60.A ND1 ASP 36.A OD1 no hydrogen 3.182 N/A VAL 61.A N GLU 88.A OE1 no hydrogen 2.918 N/A ILE 63.A N HIS 60.A O no hydrogen 3.106 N/A LEU 64.A N VAL 61.A O no hydrogen 3.144 N/A ASN 65.A N SER 38.A O no hydrogen 2.917 N/A PHE 67.A N LEU 64.A O no hydrogen 3.425 N/A VAL 71.A N THR 68.A OG1 no hydrogen 3.188 N/A LYS 73.A N LEU 69.A O no hydrogen 2.950 N/A GLU 74.A N ASP 70.A O no hydrogen 3.131 N/A LEU 75.A N VAL 71.A O no hydrogen 3.127 N/A ILE 76.A N MET 72.A O no hydrogen 3.018 N/A THR 77.A N LYS 73.A O no hydrogen 3.072 N/A THR 77.A OG1 LYS 73.A O no hydrogen 3.343 N/A LEU 78.A N GLU 74.A O no hydrogen 3.197 N/A ALA 79.A N LEU 75.A O no hydrogen 2.810 N/A LYS 80.A N ILE 76.A O no hydrogen 2.898 N/A CYS 81.A N THR 77.A O no hydrogen 2.870 N/A HIS 82.A N LEU 78.A O no hydrogen 2.738 N/A HIS 82.A NE2 ASP 48.A OD1 no hydrogen 2.688 N/A PHE 84.A N ALA 79.A O no hydrogen 2.972 N/A LEU 85.A N CYS 55.A O no hydrogen 3.089 N/A ILE 86.A N ASP 115.A OD2 no hydrogen 2.829 N/A PHE 87.A N LEU 57.A O no hydrogen 2.873 N/A GLU 88.A N LEU 116.A O no hydrogen 2.932 N/A ASP 89.A N THR 59.A O no hydrogen 2.980 N/A ARG 90.A NH1 ARG 90.A O no hydrogen 2.845 N/A LYS 91.A N ASN 118.A OD1 no hydrogen 2.859 N/A LYS 91.A NZ ASP 89.A OD1 no hydrogen 2.570 N/A PHE 92.A N ASN 118.A O no hydrogen 2.977 N/A ILE 95.A N ASP 94.A OD1 no hydrogen 2.961 N/A VAL 99.A N ILE 95.A O no hydrogen 3.403 N/A LYS 100.A N GLY 96.A O no hydrogen 3.282 N/A LYS 100.A NZ ASN 97.A OD1 no hydrogen 2.867 N/A LYS 101.A N ASN 97.A O no hydrogen 2.954 N/A GLN 102.A N THR 98.A O no hydrogen 2.872 N/A TYR 103.A N VAL 99.A O no hydrogen 3.207 N/A TYR 103.A N LYS 100.A O no hydrogen 3.294 N/A GLU 104.A N LYS 100.A O no hydrogen 2.817 N/A GLY 105.A N LYS 101.A O no hydrogen 2.718 N/A LYS 109.A N GLY 105.A O no hydrogen 3.078 N/A ALA 111.A N TYR 103.A O no hydrogen 2.854 N/A SER 112.A N LYS 109.A O no hydrogen 2.949 N/A SER 112.A OG LYS 109.A O no hydrogen 2.586 N/A TRP 113.A N ILE 110.A O no hydrogen 3.068 N/A TRP 113.A NE1 PHE 108.A O no hydrogen 2.941 N/A ALA 114.A N ILE 110.A O no hydrogen 2.925 N/A LEU 116.A N ILE 86.A O no hydrogen 2.996 N/A VAL 117.A N GLY 141.A O no hydrogen 3.343 N/A ASN 118.A ND2 ASP 89.A OD1 no hydrogen 2.708 N/A ALA 119.A N LEU 143.A O no hydrogen 2.954 N/A HIS 120.A N PHE 92.A O no hydrogen 2.798 N/A GLY 124.A N VAL 121.A O no hydrogen 2.725 N/A VAL 127.A N GLY 124.A O no hydrogen 3.433 N/A LYS 129.A N SER 125.A O no hydrogen 2.891 N/A LYS 129.A NZ HIS 170.A NE2 no hydrogen 3.019 N/A GLY 130.A N GLY 126.A O no hydrogen 2.969 N/A LEU 131.A N VAL 127.A O no hydrogen 3.073 N/A GLN 132.A N VAL 128.A O no hydrogen 2.758 N/A GLN 132.A NE2 GLU 172.A OE2 no hydrogen 2.342 N/A GLU 133.A N LYS 129.A O no hydrogen 3.288 N/A GLU 133.A N GLY 130.A O no hydrogen 3.208 N/A VAL 134.A N LEU 131.A O no hydrogen 2.877 N/A GLY 135.A N LEU 131.A O no hydrogen 2.665 N/A LEU 136.A N GLN 132.A O no hydrogen 2.947 N/A LEU 138.A N VAL 134.A O no hydrogen 3.388 N/A HIS 139.A N LEU 136.A O no hydrogen 2.794 N/A ARG 140.A N GLY 135.A O no hydrogen 2.891 N/A ARG 140.A NE ALA 111.A O no hydrogen 2.977 N/A ARG 140.A NH2 ALA 111.A O no hydrogen 2.886 N/A GLY 141.A N ASP 115.A O no hydrogen 3.189 N/A CYS 142.A N PHE 173.A O no hydrogen 2.994 N/A CYS 142.A SG VAL 117.A O no hydrogen 3.901 N/A CYS 142.A SG LEU 143.A O no hydrogen 3.783 N/A LEU 143.A N VAL 117.A O no hydrogen 2.963 N/A LEU 144.A N GLY 176.A O no hydrogen 3.029 N/A ILE 145.A N ALA 119.A O no hydrogen 2.977 N/A ALA 146.A N ILE 178.A O no hydrogen 3.007 N/A SER 153.A N SER 150.A O no hydrogen 2.839 N/A SER 153.A OG MET 148.A O no hydrogen 3.256 N/A TYR 159.A N THR 156.A OG1 no hydrogen 3.144 N/A THR 160.A N THR 156.A O no hydrogen 2.970 N/A THR 160.A OG1 ALA 146.A O no hydrogen 2.753 N/A THR 160.A OG1 THR 156.A O no hydrogen 3.169 N/A ARG 161.A N GLY 157.A O no hydrogen 2.735 N/A ARG 161.A NH2 ASP 158.A OD1 no hydrogen 3.487 N/A ALA 162.A N ASP 158.A O no hydrogen 2.862 N/A ALA 163.A N TYR 159.A O no hydrogen 2.979 N/A VAL 164.A N THR 160.A O no hydrogen 3.177 N/A ARG 165.A N ARG 161.A O no hydrogen 3.078 N/A MET 166.A N ALA 162.A O no hydrogen 2.990 N/A ALA 167.A N ALA 163.A O no hydrogen 3.077 N/A GLU 168.A N VAL 164.A O no hydrogen 3.010 N/A GLU 169.A N ARG 165.A O no hydrogen 2.859 N/A HIS 170.A N ALA 167.A O no hydrogen 2.853 N/A HIS 170.A ND1 MET 166.A O no hydrogen 2.892 N/A GLU 172.A N GLU 172.A OE1 no hydrogen 2.789 N/A PHE 173.A N HIS 170.A O no hydrogen 2.943 N/A VAL 174.A N HIS 170.A O no hydrogen 2.749 N/A VAL 175.A N CYS 142.A O no hydrogen 2.775 N/A PHE 177.A N LEU 190.A O no hydrogen 2.863 N/A ILE 178.A N LEU 144.A O no hydrogen 2.981 N/A SER 179.A N LEU 192.A O no hydrogen 2.882 N/A SER 179.A OG SER 181.A O no hydrogen 2.685 N/A GLY 180.A N GLU 147.A OE1 no hydrogen 2.768 N/A SER 181.A N GLU 147.A OE1 no hydrogen 3.244 N/A SER 181.A OG GLU 147.A OE1 no hydrogen 3.507 N/A SER 181.A OG ARG 182.A O no hydrogen 3.537 N/A ARG 182.A N ARG 211.A O no hydrogen 3.024 N/A ARG 182.A NH1 GLU 1.A OE2 no hydrogen 3.190 N/A VAL 183.A N HIS 191.A NE2 no hydrogen 3.143 N/A SER 184.A N HIS 191.A NE2 no hydrogen 3.385 N/A LYS 186.A N SER 184.A OG no hydrogen 3.230 N/A PHE 189.A N LYS 186.A O no hydrogen 3.137 N/A LEU 190.A N VAL 175.A O no hydrogen 2.956 N/A HIS 191.A N ASP 214.A OD2 no hydrogen 2.709 N/A LEU 192.A N PHE 177.A O no hydrogen 2.835 N/A THR 193.A N ILE 215.A O no hydrogen 2.873 N/A THR 193.A OG1 SER 179.A O no hydrogen 2.703 N/A THR 193.A OG1 SER 213.A OG no hydrogen 2.643 N/A GLN 197.A N ASN 202.A O no hydrogen 2.977 N/A LEU 198.A N TYR 235.A OH no hydrogen 2.982 N/A ASN 202.A N GLY 195.A O no hydrogen 2.936 N/A GLU 206.A N SER 203.A OG no hydrogen 3.309 N/A VAL 207.A N SER 203.A O no hydrogen 3.014 N/A ILE 208.A N PRO 204.A O no hydrogen 2.949 N/A GLY 209.A N GLN 205.A O no hydrogen 2.902 N/A LYS 210.A N GLN 205.A O no hydrogen 3.352 N/A ARG 211.A N GLU 206.A O no hydrogen 2.784 N/A ARG 211.A NE GLU 206.A OE2 no hydrogen 3.142 N/A SER 213.A N VAL 207.A O no hydrogen 3.059 N/A SER 213.A OG HIS 191.A O no hydrogen 3.014 N/A SER 213.A OG THR 193.A OG1 no hydrogen 2.643 N/A ASP 214.A N HIS 191.A O no hydrogen 3.019 N/A ILE 215.A N HIS 191.A O no hydrogen 3.029 N/A ILE 216.A N ASN 30.A O no hydrogen 3.097 N/A ILE 217.A N THR 193.A O no hydrogen 2.921 N/A VAL 218.A N CYS 32.A O no hydrogen 2.978 N/A ILE 222.A N GLY 219.A O no hydrogen 2.861 N/A ILE 223.A N GLY 219.A O no hydrogen 2.815 N/A SER 224.A N ARG 220.A O no hydrogen 2.959 N/A ALA 225.A N ILE 222.A O no hydrogen 3.076 N/A ARG 228.A NE ILE 223.A O no hydrogen 2.607 N/A ARG 228.A NH2 GLU 42.A OE2.B no hydrogen 2.928 N/A ARG 228.A NH2 ILE 223.A O no hydrogen 3.090 N/A GLU 230.A N ASP 227.A OD1 no hydrogen 3.171 N/A ALA 231.A N ASP 227.A O no hydrogen 3.204 N/A ALA 232.A N ARG 228.A O no hydrogen 2.799 N/A GLU 233.A N LEU 229.A O no hydrogen 2.797 N/A MET 234.A N GLU 230.A O no hydrogen 2.817 N/A TYR 235.A N ALA 231.A O no hydrogen 3.061 N/A ARG 236.A N ALA 232.A O no hydrogen 2.783 N/A ARG 236.A NE GLU 233.A OE1 no hydrogen 3.496 N/A ARG 236.A NE GLU 233.A OE2 no hydrogen 3.071 N/A ARG 236.A NH1 GLU 28.A O no hydrogen 2.874 N/A ARG 236.A NH2 GLU 233.A OE1 no hydrogen 3.099 N/A LYS 237.A N GLU 233.A O no hydrogen 2.957 N/A ALA 238.A N MET 234.A O no hydrogen 3.050 N/A ALA 239.A N TYR 235.A O no hydrogen 2.972 N/A TRP 240.A N ARG 236.A O no hydrogen 2.935 N/A GLU 241.A N LYS 237.A O no hydrogen 3.094 N/A ALA 242.A N ALA 238.A O no hydrogen 3.138 N/A TYR 243.A N ALA 239.A O no hydrogen 3.002 N/A LEU 244.A N TRP 240.A O no hydrogen 2.840 N/A SER 245.A N GLU 241.A O no hydrogen 2.866 N/A SER 245.A OG GLU 241.A O no hydrogen 3.060 N/A ARG 246.A N TYR 243.A O no hydrogen 3.046 N/A ARG 246.A NH1 ILE 208.A O no hydrogen 3.162 N/A ARG 246.A NH1 SER 213.A O no hydrogen 2.659 N/A ARG 246.A NH2 ASP 214.A OD1 no hydrogen 3.211 N/A LEU 247.A N LEU 244.A O no hydrogen 3.375 N/A