Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3uyq_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLU 3.A N ALA 1.A O no hydrogen 2.297 N/A GLY 5.A N ASN 10.A O no hydrogen 3.057 N/A HIS 14.A N GLY 11.A O no hydrogen 2.785 N/A HIS 14.A ND1 GLU 17.A OE2 no hydrogen 2.694 N/A TRP 15.A N PRO 12.A O no hydrogen 3.440 N/A TRP 15.A NE1 GLY 5.A O no hydrogen 2.993 N/A GLU 17.A N HIS 14.A O no hydrogen 3.115 N/A PHE 19.A N TRP 15.A O no hydrogen 2.886 N/A ASN 21.A ND2 PRO 200.A O no hydrogen 3.258 N/A ALA 22.A N PHE 19.A O no hydrogen 2.974 N/A LYS 23.A N PRO 20.A O no hydrogen 3.313 N/A GLY 24.A N ASN 21.A O no hydrogen 2.759 N/A ASN 26.A N GLU 203.A OE2 no hydrogen 2.917 N/A ASN 26.A ND2 GLU 203.A OE1 no hydrogen 3.058 N/A GLN 27.A NE2 CYS 201.A O no hydrogen 3.210 N/A GLN 27.A NE2 GLU 203.A OE2 no hydrogen 2.824 N/A SER 28.A N SER 195.A OG no hydrogen 3.164 N/A SER 28.A OG TYR 192.A OH no hydrogen 2.763 N/A SER 28.A OG SER 195.A O no hydrogen 3.484 N/A LEU 32.A N THR 107.A O no hydrogen 2.859 N/A HIS 33.A NE2 GLU 31.A OE1 no hydrogen 2.888 N/A THR 34.A N ASP 109.A OD2 no hydrogen 2.884 N/A THR 34.A OG1 ASP 109.A OD1 no hydrogen 2.637 N/A THR 34.A OG1 ASP 109.A OD2 no hydrogen 3.222 N/A ASP 36.A N HIS 33.A O no hydrogen 2.787 N/A ILE 37.A N THR 34.A O no hydrogen 3.104 N/A ASP 40.A N ALA 256.A O no hydrogen 2.841 N/A SER 42.A N ASP 40.A OD2 no hydrogen 2.988 N/A SER 42.A OG ASP 40.A OD1 no hydrogen 3.101 N/A SER 42.A OG ASP 40.A OD2 no hydrogen 2.634 N/A LEU 43.A N ASP 40.A O no hydrogen 3.003 N/A GLN 44.A NE2 SER 42.A O no hydrogen 2.692 N/A TRP 46.A NE1 ARG 187.A O no hydrogen 2.969 N/A SER 47.A N ARG 79.A O no hydrogen 2.978 N/A SER 49.A N MET 77.A O no hydrogen 2.898 N/A TYR 50.A OH HIS 121.A NE2 no hydrogen 2.705 N/A ASP 51.A N SER 76.A OG no hydrogen 2.908 N/A GLY 53.A N ASP 51.A OD2 no hydrogen 2.796 N/A SER 54.A N ASP 51.A O no hydrogen 2.805 N/A SER 54.A OG ASP 51.A O no hydrogen 2.622 N/A SER 54.A OG SER 76.A OG no hydrogen 2.854 N/A ALA 55.A N GLY 52.A O no hydrogen 3.302 N/A LYS 56.A N VAL 68.A O no hydrogen 2.912 N/A ILE 58.A N ALA 172.A O no hydrogen 2.850 N/A LEU 59.A N ARG 66.A O no hydrogen 2.852 N/A ASN 60.A N LYS 170.A O no hydrogen 3.060 N/A ASN 60.A ND2 ILE 165.A O no hydrogen 2.924 N/A ASN 60.A ND2 LEU 228.A O no hydrogen 3.144 N/A GLY 62.A N ASN 60.A OD1 no hydrogen 2.900 N/A HIS 63.A N ASN 61.A OD1 no hydrogen 3.021 N/A THR 64.A N ASN 61.A OD1 no hydrogen 3.047 N/A THR 64.A OG1 CYS 65.A O no hydrogen 3.376 N/A THR 64.A OG1 LEU 94.A O no hydrogen 2.824 N/A ARG 66.A N LEU 59.A O no hydrogen 2.921 N/A VAL 67.A N PHE 92.A O no hydrogen 2.873 N/A VAL 68.A N THR 57.A O no hydrogen 2.928 N/A PHE 69.A N ARG 90.A O no hydrogen 2.789 N/A ASP 70.A N SER 54.A O no hydrogen 2.854 N/A THR 72.A N ASP 70.A OD2 no hydrogen 3.034 N/A THR 72.A OG1 ASP 70.A OD2 no hydrogen 2.611 N/A ARG 75.A NH1 ASP 70.A OD1 no hydrogen 2.738 N/A ARG 75.A NH2 ASP 51.A OD1 no hydrogen 2.961 N/A SER 76.A OG SER 54.A OG no hydrogen 2.854 N/A MET 77.A N SER 49.A O no hydrogen 3.083 N/A LEU 78.A N TYR 87.A O no hydrogen 2.906 N/A ARG 79.A N SER 47.A O no hydrogen 2.896 N/A ARG 79.A NH1 SER 49.A OG no hydrogen 2.963 N/A GLY 81.A N PRO 45.A O no hydrogen 3.004 N/A LEU 83.A N GLY 80.A O no hydrogen 3.061 N/A TYR 87.A N LEU 78.A O no hydrogen 2.873 N/A TYR 87.A OH ASP 137.A O no hydrogen 2.595 N/A ARG 88.A N TRP 122.A O no hydrogen 2.852 N/A ARG 88.A NE ASP 74.A OD1 no hydrogen 2.605 N/A ARG 88.A NH1 ASP 71.A O no hydrogen 3.055 N/A ARG 88.A NH2 ASP 74.A OD1 no hydrogen 3.359 N/A LEU 89.A N SER 76.A O no hydrogen 2.845 N/A ARG 90.A N VAL 120.A O no hydrogen 2.921 N/A ARG 90.A NH1 ASP 71.A OD1 no hydrogen 2.918 N/A GLN 91.A N VAL 120.A O no hydrogen 3.400 N/A PHE 92.A N VAL 67.A O no hydrogen 2.954 N/A HIS 93.A N HIS 118.A O no hydrogen 3.054 N/A HIS 93.A ND1 GLN 91.A OE1 no hydrogen 2.723 N/A HIS 95.A N GLU 116.A O no hydrogen 2.861 N/A HIS 95.A ND1 ASN 242.A O no hydrogen 2.801 N/A TRP 96.A N ASN 242.A OD1 no hydrogen 2.694 N/A TRP 96.A NE1 LEU 239.A O no hydrogen 2.955 N/A SER 99.A OG ASP 101.A OD1 no hydrogen 3.067 N/A HIS 102.A N SER 99.A O no hydrogen 3.447 N/A HIS 102.A ND1 ASP 101.A OD1 no hydrogen 2.651 N/A SER 104.A N TYR 113.A O no hydrogen 2.985 N/A SER 104.A OG HIS 106.A O no hydrogen 2.940 N/A GLU 105.A N GLU 116.A OE1 no hydrogen 2.888 N/A HIS 106.A N GLU 116.A OE1 no hydrogen 2.864 N/A HIS 106.A ND1 GLU 116.A OE2 no hydrogen 2.797 N/A HIS 106.A NE2 TYR 192.A OH no hydrogen 2.634 N/A VAL 108.A N VAL 111.A O no hydrogen 3.162 N/A ASP 109.A N LEU 32.A O no hydrogen 2.856 N/A VAL 111.A N VAL 108.A O no hydrogen 2.898 N/A TYR 113.A N SER 104.A OG no hydrogen 2.947 N/A ALA 114.A N LEU 146.A O no hydrogen 3.074 N/A GLU 116.A N HIS 95.A O no hydrogen 2.977 N/A LEU 117.A N ILE 144.A O no hydrogen 2.835 N/A HIS 118.A N HIS 93.A O no hydrogen 2.972 N/A HIS 118.A NE2 GLU 116.A OE2 no hydrogen 2.644 N/A LEU 119.A N ILE 142.A O no hydrogen 3.111 N/A VAL 120.A N GLN 91.A O no hydrogen 2.762 N/A HIS 121.A N ALA 140.A O no hydrogen 2.850 N/A HIS 121.A ND1 ALA 140.A O no hydrogen 2.948 N/A HIS 121.A NE2 TYR 50.A OH no hydrogen 2.705 N/A TRP 122.A N ARG 88.A O no hydrogen 3.019 N/A TRP 122.A NE1 ASP 71.A OD1 no hydrogen 2.882 N/A ASN 123.A N GLY 138.A O no hydrogen 2.881 N/A ASN 123.A ND2 TYR 87.A OH no hydrogen 3.229 N/A LYS 125.A N ASN 123.A OD1 no hydrogen 2.869 N/A TYR 126.A N ASN 123.A O no hydrogen 3.024 N/A TYR 126.A OH ASP 137.A OD2 no hydrogen 2.729 N/A ASN 127.A N PRO 124.A O no hydrogen 2.985 N/A ASN 127.A ND2 GLU 131.A OE2 no hydrogen 3.332 N/A THR 128.A N TYR 126.A O no hydrogen 2.862 N/A GLU 131.A N THR 128.A OG1 no hydrogen 3.094 N/A ALA 132.A N THR 128.A O no hydrogen 2.981 N/A LEU 133.A N PHE 129.A O no hydrogen 3.118 N/A LEU 133.A N LYS 130.A O no hydrogen 3.263 N/A LYS 134.A N GLU 131.A O no hydrogen 2.945 N/A GLN 135.A N ALA 132.A O no hydrogen 3.080 N/A ARG 136.A NE GLN 193.A OE1 no hydrogen 2.856 N/A ARG 136.A NH2 GLN 193.A OE1 no hydrogen 3.294 N/A GLY 138.A N GLN 135.A O no hydrogen 2.991 N/A ILE 139.A N CYS 204.A O no hydrogen 2.830 N/A ALA 140.A N HIS 121.A O no hydrogen 2.943 N/A VAL 141.A N VAL 206.A O no hydrogen 3.076 N/A ILE 142.A N LEU 119.A O no hydrogen 2.994 N/A GLY 143.A N LEU 208.A O no hydrogen 2.977 N/A ILE 144.A N LEU 117.A O no hydrogen 2.880 N/A LEU 146.A N ALA 115.A O no hydrogen 2.917 N/A LYS 147.A N MET 214.A O no hydrogen 2.953 N/A GLY 149.A N VAL 216.A O no hydrogen 2.774 N/A ASN 152.A N GLN 220.A OE1 no hydrogen 2.872 N/A ASN 152.A ND2 THR 215.A O no hydrogen 2.988 N/A GLU 154.A N GLU 154.A OE2 no hydrogen 2.627 N/A PHE 155.A N ASN 152.A OD1 no hydrogen 2.875 N/A GLN 156.A N ASN 152.A O no hydrogen 2.932 N/A GLN 156.A NE2 ASP 160.A OD1 no hydrogen 2.878 N/A LEU 159.A N PHE 155.A O no hydrogen 3.036 N/A ASP 160.A N GLN 156.A O no hydrogen 2.838 N/A ALA 161.A N PHE 158.A O no hydrogen 3.046 N/A LEU 162.A N LEU 159.A O no hydrogen 2.933 N/A LYS 164.A N ALA 161.A O no hydrogen 3.186 N/A ILE 165.A N LEU 162.A O no hydrogen 2.978 N/A LYS 168.A N SER 230.A O no hydrogen 2.905 N/A LYS 168.A NZ SER 229.A O no hydrogen 3.532 N/A GLY 169.A N ASN 60.A O no hydrogen 2.775 N/A LYS 170.A N THR 167.A O no hydrogen 3.229 N/A ALA 172.A N ILE 58.A O no hydrogen 2.957 N/A PHE 174.A N LYS 56.A O no hydrogen 2.847 N/A PHE 177.A N GLY 52.A O no hydrogen 2.964 N/A SER 180.A N ASP 178.A OD1 no hydrogen 2.841 N/A SER 180.A OG ASP 178.A OD1 no hydrogen 2.486 N/A SER 180.A OG ASP 178.A OD2 no hydrogen 3.031 N/A SER 181.A N ASP 178.A O no hydrogen 2.975 N/A SER 181.A OG ASP 178.A O no hydrogen 2.704 N/A LEU 182.A N PRO 179.A O no hydrogen 2.927 N/A PHE 183.A N SER 180.A O no hydrogen 3.082 N/A SER 186.A N GLU 212.A OE2 no hydrogen 2.959 N/A ARG 187.A NE TRP 46.A O no hydrogen 3.228 N/A ARG 187.A NH2 TRP 46.A O no hydrogen 3.518 N/A ASP 188.A N SER 186.A OG no hydrogen 3.082 N/A TYR 189.A N SER 257.A OG no hydrogen 3.091 N/A TYR 189.A OH GLN 44.A O no hydrogen 2.686 N/A TRP 190.A N LEU 209.A O no hydrogen 2.785 N/A THR 191.A N ARG 255.A O no hydrogen 2.859 N/A THR 191.A OG1 TRP 207.A O no hydrogen 2.754 N/A TYR 192.A OH SER 28.A OG no hydrogen 2.763 N/A TYR 192.A OH HIS 106.A NE2 no hydrogen 2.634 N/A GLY 194.A N ILE 205.A O no hydrogen 2.865 N/A SER 195.A N SER 28.A OG no hydrogen 3.153 N/A SER 195.A OG PHE 196.A O no hydrogen 2.944 N/A PHE 196.A N GLU 202.A O no hydrogen 3.121 N/A THR 197.A OG1 GLU 105.A OE1 no hydrogen 2.672 N/A THR 197.A OG1 GLU 105.A OE2 no hydrogen 3.355 N/A CYS 201.A N THR 198.A O no hydrogen 2.808 N/A CYS 201.A SG PHE 196.A O no hydrogen 4.005 N/A GLU 202.A N GLU 202.A OE1 no hydrogen 2.704 N/A CYS 204.A SG GLU 202.A O no hydrogen 3.707 N/A ILE 205.A N GLY 194.A O no hydrogen 3.083 N/A VAL 206.A N ILE 139.A O no hydrogen 2.837 N/A TRP 207.A N TYR 192.A O no hydrogen 2.892 N/A LEU 208.A N VAL 141.A O no hydrogen 2.863 N/A LEU 209.A N TRP 190.A O no hydrogen 2.995 N/A LEU 210.A N GLY 143.A O no hydrogen 2.931 N/A LYS 211.A N ASP 188.A O no hydrogen 2.803 N/A LYS 211.A NZ ASP 188.A OD1 no hydrogen 2.860 N/A VAL 216.A N LYS 147.A O no hydrogen 2.987 N/A SER 217.A N GLN 220.A OE1 no hydrogen 3.027 N/A SER 218.A OG ASP 100.A OD1 no hydrogen 2.783 N/A GLN 220.A N SER 217.A OG no hydrogen 2.810 N/A GLN 220.A NE2 ASN 152.A O no hydrogen 3.084 N/A GLN 220.A NE2 GLN 156.A OE1 no hydrogen 2.803 N/A MET 221.A N SER 217.A O no hydrogen 3.036 N/A ALA 222.A N SER 218.A O no hydrogen 3.051 N/A LYS 223.A N ASP 219.A O no hydrogen 3.264 N/A LEU 224.A N GLN 220.A O no hydrogen 3.028 N/A ARG 225.A N MET 221.A O no hydrogen 3.102 N/A ARG 225.A NE GLY 97.A O no hydrogen 3.254 N/A ARG 225.A NH1 ASP 100.A OD2 no hydrogen 3.400 N/A ARG 225.A NH2 ASP 100.A OD2 no hydrogen 3.064 N/A SER 226.A N LYS 223.A O no hydrogen 3.031 N/A SER 226.A OG LYS 223.A O no hydrogen 2.559 N/A LEU 228.A N LYS 166.A O no hydrogen 2.986 N/A SER 229.A N VAL 237.A O no hydrogen 2.839 N/A SER 229.A OG VAL 237.A O no hydrogen 3.350 N/A ALA 231.A N GLU 234.A OE1 no hydrogen 2.884 N/A VAL 237.A N SER 230.A OG no hydrogen 2.916 N/A LEU 239.A N LEU 227.A O no hydrogen 2.916 N/A ASN 242.A N TRP 96.A O no hydrogen 3.021 N/A ASN 242.A ND2 HIS 63.A O no hydrogen 3.361 N/A ASN 242.A ND2 LEU 94.A O no hydrogen 3.371 N/A ARG 244.A N GLU 105.A OE2 no hydrogen 2.746 N/A ARG 244.A NH1 ALA 22.A O no hydrogen 3.070 N/A ARG 244.A NH1 GLN 27.A OE1 no hydrogen 3.195 N/A ARG 244.A NH2 GLN 27.A OE1 no hydrogen 2.887 N/A ARG 244.A NH2 SER 28.A O no hydrogen 2.876 N/A GLN 247.A N PRO 29.A O no hydrogen 2.774 N/A GLN 247.A NE2 PRO 245.A O no hydrogen 2.675 N/A ASN 250.A ND2 GLU 25.A O no hydrogen 2.900 N/A ARG 252.A N ILE 249.A O no hydrogen 3.074 N/A ARG 252.A NE ILE 249.A O no hydrogen 3.155 N/A ARG 252.A NH1 GLN 27.A O no hydrogen 3.207 N/A ARG 252.A NH1 GLN 193.A O no hydrogen 2.898 N/A ARG 252.A NH2 GLN 27.A O no hydrogen 2.851 N/A ARG 252.A NH2 PRO 248.A O no hydrogen 2.836 N/A ARG 255.A N THR 191.A O no hydrogen 2.994 N/A ARG 255.A NH1 ASP 40.A OD1 no hydrogen 2.939 N/A ALA 256.A N ARG 38.A O no hydrogen 2.965 N/A SER 257.A N TYR 189.A O no hydrogen 2.927 N/A SER 257.A OG TYR 189.A O no hydrogen 3.239 N/A