Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1uu5_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ILE 1.A N LEU 37.A O no hydrogen 2.839 N/A ARG 2.A N LEU 37.A O no hydrogen 3.396 N/A LEU 4.A N THR 35.A O no hydrogen 2.702 N/A TYR 8.A N ASN 20.A O no hydrogen 2.989 N/A GLY 9.A N GLU 6.A O no hydrogen 2.952 N/A TYR 10.A OH GLU 17.A OE1 no hydrogen 2.813 N/A TRP 11.A N LEU 18.A O no hydrogen 3.050 N/A GLY 13.A N TYR 16.A O no hydrogen 2.965 N/A TYR 16.A N GLY 13.A O no hydrogen 3.002 N/A TYR 16.A OH GLY 43.A O no hydrogen 3.032 N/A GLU 17.A N GLY 67.A O no hydrogen 2.881 N/A LEU 18.A N TRP 11.A O no hydrogen 2.799 N/A LEU 19.A N TYR 65.A O no hydrogen 3.113 N/A ASN 20.A N GLY 9.A O no hydrogen 2.885 N/A ASN 20.A ND2 GLN 33.A O no hydrogen 3.683 N/A ASN 20.A ND2 THR 35.A OG1 no hydrogen 2.705 N/A LEU 22.A N ASN 20.A O no hydrogen 3.017 N/A GLY 24.A N LYS 61.A O no hydrogen 2.916 N/A LYS 25.A N LEU 22.A O no hydrogen 3.222 N/A LYS 25.A NZ ASP 26.A OD1 no hydrogen 2.925 N/A THR 27.A N GLY 24.A O no hydrogen 3.102 N/A THR 27.A OG1 GLY 24.A O no hydrogen 2.727 N/A ALA 28.A N LYS 25.A O no hydrogen 3.019 N/A THR 29.A N GLN 54.A O no hydrogen 2.867 N/A THR 29.A OG1 GLN 54.A O no hydrogen 2.917 N/A SER 30.A N GLN 54.A O no hydrogen 3.512 N/A TRP 32.A N GLU 52.A O no hydrogen 2.948 N/A TRP 32.A NE1 CYS 5.A O no hydrogen 2.816 N/A GLN 33.A NE2 THR 49.A OG1 no hydrogen 2.889 N/A CYS 34.A N ALA 50.A O no hydrogen 3.002 N/A CYS 34.A SG THR 35.A O no hydrogen 3.833 N/A THR 35.A N LEU 4.A O no hydrogen 2.986 N/A TYR 36.A N SER 48.A O no hydrogen 2.776 N/A LEU 37.A N ARG 2.A O no hydrogen 2.955 N/A ASP 38.A N GLN 46.A O no hydrogen 2.845 N/A GLY 39.A N GLN 46.A O no hydrogen 3.050 N/A ASN 41.A N GLN 46.A OE1 no hydrogen 2.984 N/A GLY 44.A N ASN 41.A O no hydrogen 3.117 N/A ILE 45.A N PHE 218.A O no hydrogen 2.885 N/A GLN 46.A N GLY 39.A O no hydrogen 2.961 N/A GLN 46.A NE2 ASN 41.A O no hydrogen 3.096 N/A GLN 46.A NE2 ASP 217.A OD1 no hydrogen 2.984 N/A TRP 47.A N CYS 215.A O no hydrogen 3.112 N/A SER 48.A N TYR 36.A O no hydrogen 2.962 N/A SER 48.A OG ASP 38.A OD2 no hydrogen 3.282 N/A THR 49.A N PHE 213.A O no hydrogen 2.898 N/A THR 49.A OG1 CYS 34.A O no hydrogen 2.816 N/A ALA 50.A N CYS 34.A O no hydrogen 3.033 N/A TRP 51.A N ALA 211.A O no hydrogen 2.952 N/A TRP 51.A NE1 TYR 90.A OH no hydrogen 2.955 N/A GLU 52.A N TRP 32.A O no hydrogen 3.099 N/A TRP 53.A N GLY 208.A O no hydrogen 2.975 N/A TRP 53.A NE1 GLN 33.A OE1 no hydrogen 2.858 N/A GLN 54.A N SER 30.A O no hydrogen 3.028 N/A ASN 59.A N ALA 56.A O no hydrogen 2.989 N/A LYS 61.A N CYS 205.A O no hydrogen 2.875 N/A LYS 61.A NZ GLY 55.A O no hydrogen 2.690 N/A LYS 61.A NZ ALA 56.A O no hydrogen 2.811 N/A LYS 61.A NZ ASN 59.A O no hydrogen 2.885 N/A LYS 61.A NZ PHE 206.A O no hydrogen 2.758 N/A SER 62.A OG GLN 33.A OE1 no hydrogen 2.573 N/A TYR 63.A N ASN 21.A O no hydrogen 2.954 N/A TYR 63.A OH ALA 100.A O no hydrogen 2.766 N/A TYR 65.A N LEU 19.A O no hydrogen 3.406 N/A VAL 66.A N VAL 201.A O no hydrogen 2.973 N/A GLY 67.A N GLU 17.A O no hydrogen 2.853 N/A LYS 68.A N TYR 199.A O no hydrogen 2.811 N/A LYS 68.A NZ GLY 15.A O no hydrogen 2.804 N/A LYS 68.A NZ GLN 69.A O no hydrogen 3.067 N/A GLN 69.A N GLY 15.A O no hydrogen 2.893 N/A ARG 72.A NH1 ASP 110.A OD1 no hydrogen 3.538 N/A ARG 74.A NH2 ASP 78.A O no hydrogen 3.367 N/A ARG 74.A NH2 TRP 223.A O no hydrogen 3.394 N/A LYS 75.A NZ GLY 73.A O no hydrogen 3.532 N/A LYS 75.A NZ ASN 195.A OD1 no hydrogen 2.649 N/A ILE 76.A N GLN 194.A O no hydrogen 2.880 N/A SER 77.A N ALA 191.A O no hydrogen 3.134 N/A ASP 78.A N LYS 75.A O no hydrogen 3.031 N/A ILE 79.A N ILE 76.A O no hydrogen 3.100 N/A ASN 80.A N TRP 223.A OXT no hydrogen 2.721 N/A SER 81.A N TRP 223.A OXT no hydrogen 3.071 N/A MET 82.A N ASP 175.A OD1 no hydrogen 2.829 N/A THR 84.A N CYS 174.A O no hydrogen 2.972 N/A THR 84.A OG1 TYR 101.A OH no hydrogen 2.760 N/A THR 84.A OG1 ARG 219.A O no hydrogen 2.797 N/A SER 85.A N ARG 219.A O no hydrogen 2.999 N/A VAL 86.A N PHE 172.A O no hydrogen 2.892 N/A SER 87.A N ASP 217.A O no hydrogen 2.937 N/A SER 87.A OG ASP 171.A OD1 no hydrogen 2.707 N/A TRP 88.A N ARG 170.A O no hydrogen 2.877 N/A TRP 88.A NE1 ILE 169.A O no hydrogen 2.919 N/A THR 89.A N THR 214.A O no hydrogen 2.900 N/A THR 89.A OG1 TYR 90.A O no hydrogen 3.383 N/A TYR 90.A OH THR 203.A OG1 no hydrogen 2.673 N/A ASP 91.A N ARG 212.A O no hydrogen 3.116 N/A ARG 92.A NE ASP 94.A OD1 no hydrogen 2.918 N/A ARG 92.A NH1 PRO 210.A O no hydrogen 2.902 N/A ARG 92.A NH2 ASP 94.A OD1 no hydrogen 3.516 N/A ARG 92.A NH2 ASP 94.A OD2 no hydrogen 3.016 N/A ARG 96.A N THR 207.A O no hydrogen 2.962 N/A ARG 96.A NE PRO 57.A O no hydrogen 2.931 N/A ARG 96.A NH1 GLY 128.A O no hydrogen 2.814 N/A ARG 96.A NH2 PRO 57.A O no hydrogen 2.993 N/A ALA 97.A N TYR 127.A O no hydrogen 3.345 N/A ASN 98.A N GLU 204.A O no hydrogen 2.971 N/A ASN 98.A ND2 GLU 204.A OE2 no hydrogen 2.831 N/A ALA 100.A N GLY 202.A O no hydrogen 2.938 N/A TYR 101.A N ILE 122.A O no hydrogen 2.854 N/A TYR 101.A OH THR 84.A OG1 no hydrogen 2.760 N/A ASP 102.A N GLN 200.A O no hydrogen 2.877 N/A VAL 103.A N LEU 120.A O no hydrogen 2.945 N/A PHE 104.A N VAL 198.A O no hydrogen 3.374 N/A THR 105.A N TYR 118.A O no hydrogen 2.984 N/A THR 105.A OG1 TYR 189.A OH no hydrogen 2.750 N/A THR 105.A OG1 GLN 194.A OE1 no hydrogen 2.777 N/A ALA 106.A N ASN 195.A O no hydrogen 2.944 N/A ARG 107.A N ASP 117.A OD2 no hydrogen 2.865 N/A ASP 110.A N ASP 108.A OD1 no hydrogen 2.876 N/A HIS 111.A N ASP 108.A O no hydrogen 3.070 N/A HIS 111.A ND1 PRO 112.A O no hydrogen 2.691 N/A ASP 117.A N THR 105.A O no hydrogen 2.799 N/A TYR 118.A N THR 105.A O no hydrogen 3.184 N/A GLU 119.A N ARG 158.A O no hydrogen 2.926 N/A LEU 120.A N VAL 103.A O no hydrogen 2.871 N/A MET 121.A N TYR 160.A O no hydrogen 2.822 N/A ILE 122.A N TYR 101.A O no hydrogen 3.114 N/A TRP 123.A N PHE 162.A O no hydrogen 2.854 N/A LEU 124.A N VAL 99.A O no hydrogen 2.706 N/A ARG 126.A NE ILE 130.A O no hydrogen 2.799 N/A ARG 126.A NH2 ILE 130.A O no hydrogen 3.112 N/A TYR 127.A N ALA 97.A O no hydrogen 2.893 N/A TYR 127.A OH ASP 168.A OD2 no hydrogen 2.695 N/A THR 135.A N THR 151.A O no hydrogen 2.993 N/A HIS 137.A N LEU 149.A O no hydrogen 2.814 N/A HIS 137.A ND1 SER 138.A OG no hydrogen 2.708 N/A SER 138.A OG HIS 137.A ND1 no hydrogen 2.708 N/A GLN 139.A NE2 ASP 148.A OD1 no hydrogen 2.927 N/A VAL 140.A N TRP 147.A O no hydrogen 2.905 N/A LEU 142.A N ARG 145.A O no hydrogen 3.006 N/A ARG 145.A N LEU 142.A O no hydrogen 3.006 N/A THR 146.A OG1 ASN 141.A OD1 no hydrogen 3.029 N/A TRP 147.A N VAL 140.A O no hydrogen 2.783 N/A TRP 147.A NE1 LEU 142.A O no hydrogen 2.880 N/A ASP 148.A N LEU 163.A O no hydrogen 2.810 N/A LEU 149.A N SER 138.A O no hydrogen 2.828 N/A TRP 150.A N SER 161.A O no hydrogen 2.814 N/A THR 151.A N THR 135.A O no hydrogen 2.988 N/A GLY 152.A N VAL 159.A O no hydrogen 3.057 N/A ASN 154.A N MET 157.A O no hydrogen 2.978 N/A MET 157.A N ASN 154.A O no hydrogen 3.203 N/A ARG 158.A N ASP 117.A O no hydrogen 3.145 N/A ARG 158.A NE TYR 160.A OH no hydrogen 3.459 N/A ARG 158.A NH1 GLY 152.A O no hydrogen 3.336 N/A ARG 158.A NH2 THR 151.A OG1 no hydrogen 3.354 N/A VAL 159.A N GLY 152.A O no hydrogen 2.784 N/A TYR 160.A N GLU 119.A O no hydrogen 2.876 N/A SER 161.A N TRP 150.A O no hydrogen 2.877 N/A PHE 162.A N MET 121.A O no hydrogen 2.867 N/A LEU 163.A N ASP 148.A O no hydrogen 2.885 N/A ILE 169.A N LEU 124.A O no hydrogen 2.825 N/A ARG 170.A NE ASP 168.A OD2 no hydrogen 3.007 N/A ARG 170.A NH1 TYR 90.A O no hydrogen 3.408 N/A ARG 170.A NH2 TYR 127.A OH no hydrogen 3.021 N/A ARG 170.A NH2 ASP 168.A OD2 no hydrogen 3.566 N/A PHE 172.A N VAL 86.A O no hydrogen 2.914 N/A CYS 174.A N THR 84.A O no hydrogen 3.037 N/A ILE 176.A N MET 82.A O no hydrogen 2.947 N/A LYS 177.A N ASP 175.A OD1 no hydrogen 2.957 N/A LYS 177.A NZ ILE 76.A O no hydrogen 2.790 N/A LYS 177.A NZ ILE 79.A O no hydrogen 2.933 N/A ASP 178.A N ASP 175.A O no hydrogen 2.941 N/A PHE 179.A N ILE 176.A O no hydrogen 2.985 N/A PHE 180.A N ILE 176.A O no hydrogen 3.134 N/A ASN 181.A N LYS 177.A O no hydrogen 2.836 N/A TYR 182.A N ASP 178.A O no hydrogen 3.169 N/A LEU 183.A N PHE 179.A O no hydrogen 3.082 N/A GLU 184.A N PHE 180.A O no hydrogen 2.803 N/A ARG 185.A N ASN 181.A O no hydrogen 2.971 N/A ASN 186.A N TYR 182.A O no hydrogen 2.973 N/A ASN 186.A ND2 TYR 182.A O no hydrogen 3.356 N/A HIS 187.A N LEU 183.A O no hydrogen 2.916 N/A TYR 189.A N LEU 183.A O no hydrogen 3.094 N/A TYR 189.A OH THR 105.A OG1 no hydrogen 2.750 N/A ALA 191.A N TYR 189.A O no hydrogen 2.943 N/A GLU 193.A N PRO 190.A O no hydrogen 3.001 N/A GLN 194.A NE2 ASP 117.A OD2 no hydrogen 3.048 N/A ASN 195.A N ALA 106.A O no hydrogen 2.777 N/A ASN 195.A ND2 ALA 106.A O no hydrogen 3.332 N/A ASN 195.A ND2 ARG 107.A O no hydrogen 2.901 N/A LEU 196.A N ARG 74.A O no hydrogen 2.931 N/A ILE 197.A N PHE 104.A O no hydrogen 2.827 N/A VAL 198.A N PHE 104.A O no hydrogen 3.409 N/A TYR 199.A OH ASP 221.A O no hydrogen 2.747 N/A GLN 200.A N ASP 102.A O no hydrogen 3.006 N/A VAL 201.A N VAL 66.A O no hydrogen 2.959 N/A GLY 202.A N ALA 100.A O no hydrogen 3.039 N/A THR 203.A N PRO 64.A O no hydrogen 3.259 N/A THR 203.A OG1 TYR 90.A OH no hydrogen 2.673 N/A THR 203.A OG1 ASN 98.A O no hydrogen 2.673 N/A GLU 204.A N ASN 98.A OD1 no hydrogen 2.980 N/A CYS 205.A N SER 62.A O no hydrogen 2.984 N/A CYS 205.A SG THR 203.A O no hydrogen 3.603 N/A CYS 205.A SG THR 203.A OG1 no hydrogen 3.707 N/A PHE 206.A N ARG 96.A O no hydrogen 2.893 N/A THR 207.A N ARG 96.A O no hydrogen 3.372 N/A GLY 208.A N TRP 53.A O no hydrogen 2.902 N/A ALA 211.A N TRP 51.A O no hydrogen 2.911 N/A ARG 212.A N ASP 91.A OD1 no hydrogen 2.927 N/A ARG 212.A NH2.A SER 48.A OG no hydrogen 2.855 N/A PHE 213.A N THR 49.A O no hydrogen 2.956 N/A THR 214.A N THR 89.A O no hydrogen 2.865 N/A CYS 215.A N TRP 47.A O no hydrogen 2.765 N/A CYS 215.A SG SER 87.A O no hydrogen 4.028 N/A ARG 216.A N SER 87.A O no hydrogen 2.823 N/A ARG 216.A NH2 TRP 88.A O no hydrogen 3.017 N/A ARG 216.A NH2 ASP 171.A OD2 no hydrogen 3.128 N/A ASP 217.A N SER 87.A O no hydrogen 3.294 N/A PHE 218.A N ILE 45.A O no hydrogen 2.921 N/A ARG 219.A N SER 85.A O no hydrogen 2.998 N/A ARG 219.A NH2 ASN 42.A O no hydrogen 3.544 N/A ALA 220.A N TYR 16.A OH no hydrogen 3.008 N/A ASP 221.A N ARG 83.A O no hydrogen 2.930 N/A TRP 223.A N SER 81.A O no hydrogen 2.963 N/A