Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1urx_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLN 1.A NE2 SER 27.A OG no hydrogen 2.706 N/A ASP 2.A N SER 27.A OG no hydrogen 3.053 N/A ASN 4.A N GLN 1.A O no hydrogen 3.022 N/A ILE 6.A N TRP 3.A O no hydrogen 2.950 N/A GLY 13.A N ASN 11.A OD1 no hydrogen 3.021 N/A MET 16.A N GLY 13.A O no hydrogen 3.234 N/A THR 17.A N VAL 267.A O no hydrogen 2.703 N/A TRP 18.A NE1 ALA 10.A O no hydrogen 2.957 N/A GLN 19.A N LYS 265.A O no hydrogen 2.899 N/A GLN 21.A N VAL 263.A O no hydrogen 2.771 N/A GLN 21.A NE2 GLN 19.A O no hydrogen 3.056 N/A VAL 24.A N GLN 21.A O no hydrogen 3.401 N/A SER 25.A N ASP 22.A O no hydrogen 3.360 N/A SER 25.A OG GLN 21.A O no hydrogen 2.770 N/A ASP 26.A N ILE 261.A O no hydrogen 2.932 N/A PHE 28.A N ASP 26.A OD2 no hydrogen 2.928 N/A ASN 29.A ND2 ASP 2.A OD2 no hydrogen 2.897 N/A TYR 30.A OH ASP 26.A OD1 no hydrogen 2.623 N/A SER 32.A N THR 68.A O no hydrogen 3.022 N/A SER 32.A OG THR 68.A OG1 no hydrogen 2.609 N/A SER 33.A N ASN 36.A O no hydrogen 3.034 N/A SER 33.A OG GLU 34.A O no hydrogen 3.491 N/A ASN 36.A N SER 33.A O no hydrogen 2.818 N/A ARG 37.A NH1.A ALA 66.A O no hydrogen 2.847 N/A ARG 37.A NH2.A GLU 34.A OE1.A no hydrogen 3.052 N/A ARG 37.A NH2.A ALA 63.A O no hydrogen 2.889 N/A ARG 37.A NH2.A ALA 66.A O no hydrogen 3.521 N/A ARG 37.A NH2.B GLU 34.A OE1.A no hydrogen 1.505 N/A PHE 41.A N PRO 38.A O no hydrogen 3.085 N/A THR 42.A N PRO 38.A O no hydrogen 2.916 N/A THR 42.A OG1 PRO 38.A O no hydrogen 3.307 N/A SER 43.A N THR 39.A O no hydrogen 3.002 N/A SER 43.A OG THR 39.A O no hydrogen 2.883 N/A LYS 44.A N PHE 41.A O no hydrogen 3.003 N/A LYS 44.A NZ SER 25.A O no hydrogen 2.765 N/A TRP 45.A N PHE 41.A O no hydrogen 2.882 N/A TRP 45.A NE1 ASP 26.A OD1 no hydrogen 2.933 N/A LYS 46.A N THR 91.A O no hydrogen 3.021 N/A LYS 46.A NZ THR 91.A OG1 no hydrogen 2.848 N/A SER 48.A OG TYR 49.A O no hydrogen 3.383 N/A TYR 49.A OH GLU 124.A OE1 no hydrogen 2.777 N/A ASN 51.A ND2 GLU 124.A OE1 no hydrogen 3.074 N/A TRP 53.A N ASN 51.A OD1 no hydrogen 3.024 N/A SER 58.A N ASN 235.A O no hydrogen 3.036 N/A SER 58.A OG THR 237.A OG1 no hydrogen 2.718 N/A THR 59.A N PRO 56.A O no hydrogen 3.035 N/A THR 59.A OG1 PRO 56.A O no hydrogen 2.707 N/A THR 59.A OG1 ASN 235.A O no hydrogen 3.541 N/A ILE 60.A N ASN 87.A OD1 no hydrogen 3.106 N/A PHE 61.A N THR 54.A O no hydrogen 2.844 N/A ASN 62.A N ASN 87.A O no hydrogen 3.048 N/A GLN 65.A N ASN 62.A O no hydrogen 3.180 N/A GLN 65.A NE2 ASN 62.A O no hydrogen 3.674 N/A ALA 66.A N ALA 63.A O no hydrogen 3.205 N/A TRP 67.A N ALA 74.A O no hydrogen 3.145 N/A THR 68.A N SER 32.A O no hydrogen 2.983 N/A THR 68.A OG1 TYR 30.A O no hydrogen 2.674 N/A THR 68.A OG1 SER 32.A OG no hydrogen 2.609 N/A ASN 69.A N GLN 72.A O no hydrogen 3.067 N/A GLY 70.A N TYR 30.A O no hydrogen 2.957 N/A SER 71.A N ASN 69.A OD1 no hydrogen 2.995 N/A SER 71.A OG ASN 69.A OD1 no hydrogen 3.360 N/A GLN 72.A N ASN 69.A OD1 no hydrogen 2.837 N/A GLN 72.A NE2 TYR 182.A OH no hydrogen 2.468 N/A LEU 73.A N VAL 258.A O no hydrogen 2.890 N/A ALA 74.A N TRP 67.A O no hydrogen 2.785 N/A ILE 75.A N PHE 256.A O no hydrogen 2.937 N/A GLN 76.A N GLN 65.A O no hydrogen 2.902 N/A ALA 77.A N ASN 254.A O no hydrogen 2.913 N/A GLN 78.A N TYR 86.A O no hydrogen 2.941 N/A ALA 80.A N LYS 84.A O no hydrogen 3.010 N/A GLY 81.A N GLN 245.A OE1 no hydrogen 2.934 N/A LYS 84.A N GLY 81.A O no hydrogen 2.998 N/A SER 85.A N SER 58.A O no hydrogen 3.064 N/A SER 85.A OG SER 58.A O no hydrogen 3.455 N/A SER 85.A OG ASN 87.A OD1 no hydrogen 2.703 N/A TYR 86.A N GLN 78.A O no hydrogen 2.880 N/A ASN 87.A N ILE 60.A O no hydrogen 2.834 N/A ASN 87.A ND2 CYS 233.A O no hydrogen 3.551 N/A GLY 88.A N GLN 76.A O no hydrogen 2.846 N/A ILE 90.A N ILE 231.A O no hydrogen 2.909 N/A THR 91.A N LYS 46.A O no hydrogen 2.952 N/A THR 91.A OG1 SER 48.A O no hydrogen 2.742 N/A SER 92.A N ILE 229.A O no hydrogen 2.877 N/A SER 92.A OG ASN 94.A O no hydrogen 2.783 N/A LYS 93.A N LYS 44.A O no hydrogen 2.892 N/A LYS 93.A NZ THR 42.A O no hydrogen 2.651 N/A ASN 94.A ND2 ASN 23.A O no hydrogen 3.421 N/A LYS 95.A NZ ASP 122.A OD1 no hydrogen 3.308 N/A LYS 95.A NZ ASP 122.A OD2 no hydrogen 2.852 N/A LYS 95.A NZ ASN 228.A OD1 no hydrogen 2.896 N/A ILE 96.A N THR 227.A O no hydrogen 2.945 N/A VAL 100.A N TRP 189.A O no hydrogen 3.007 N/A TYR 101.A N TYR 264.A O no hydrogen 2.864 N/A TYR 101.A OH GLU 103.A OE2 no hydrogen 2.606 N/A MET 102.A N CYS 187.A O no hydrogen 2.982 N/A GLU 103.A N ARG 262.A O no hydrogen 2.939 N/A ILE 104.A N TYR 185.A O no hydrogen 3.017 N/A LYS 105.A N TRP 260.A O no hydrogen 3.110 N/A LYS 105.A NZ ASP 259.A OD2 no hydrogen 2.886 N/A ALA 106.A N HIS 183.A O no hydrogen 2.906 N/A LYS 107.A N TRP 257.A O no hydrogen 2.848 N/A ALA 114.A N GLU 234.A O no hydrogen 2.859 N/A ASN 115.A N GLY 133.A O no hydrogen 2.879 N/A ALA 116.A N ASP 232.A O no hydrogen 3.013 N/A PHE 117.A N MET 131.A O no hydrogen 3.074 N/A TRP 118.A N ILE 230.A O no hydrogen 2.914 N/A TRP 118.A NE1 ASP 232.A OD1 no hydrogen 3.063 N/A THR 119.A N ILE 128.A O no hydrogen 2.809 N/A LEU 120.A N ASN 228.A O no hydrogen 3.046 N/A THR 121.A N GLN 126.A O no hydrogen 3.196 N/A THR 121.A OG1 ASP 123.A OD1 no hydrogen 2.803 N/A GLU 124.A N THR 121.A O no hydrogen 2.929 N/A THR 125.A N THR 121.A OG1 no hydrogen 3.264 N/A THR 125.A N ASP 123.A OD1 no hydrogen 2.999 N/A THR 125.A OG1 ASP 123.A OD1 no hydrogen 2.742 N/A THR 125.A OG1 ASP 123.A OD2 no hydrogen 3.444 N/A GLN 126.A N THR 121.A OG1 no hydrogen 3.290 N/A SER 127.A N HIS 152.A O no hydrogen 3.037 N/A SER 127.A OG THR 119.A O no hydrogen 2.706 N/A ILE 128.A N THR 119.A OG1 no hydrogen 3.036 N/A ASP 129.A N SER 150.A O no hydrogen 2.847 N/A MET 131.A N PHE 117.A O no hydrogen 3.271 N/A GLU 132.A N HIS 148.A O no hydrogen 2.998 N/A GLY 133.A N ASN 115.A O no hydrogen 2.894 N/A SER 136.A N GLN 111.A O no hydrogen 2.863 N/A ARG 138.A N SER 136.A OG no hydrogen 2.951 N/A ARG 138.A NE GLU 247.A OE2 no hydrogen 2.756 N/A ARG 138.A NH2 ALA 242.A O no hydrogen 2.932 N/A ARG 138.A NH2 GLU 247.A OE1 no hydrogen 2.881 N/A ARG 138.A NH2 GLU 247.A OE2 no hydrogen 3.486 N/A GLY 139.A N SER 136.A O no hydrogen 3.075 N/A GLY 140.A N ASP 137.A O no hydrogen 3.022 N/A ALA 144.A N GLY 140.A O no hydrogen 2.991 N/A GLN 145.A N THR 141.A O no hydrogen 3.027 N/A ARG 146.A N PHE 143.A O no hydrogen 3.071 N/A ARG 146.A NH1 TRP 142.A O no hydrogen 3.038 N/A MET 147.A N TYR 171.A O no hydrogen 2.952 N/A HIS 148.A N GLU 132.A O no hydrogen 2.939 N/A HIS 148.A ND1 GLU 132.A OE2 no hydrogen 2.749 N/A LEU 149.A N THR 169.A O no hydrogen 2.846 N/A SER 150.A N ASP 129.A O no hydrogen 3.304 N/A SER 150.A OG HIS 151.A O no hydrogen 3.468 N/A HIS 151.A NE2 ILE 212.A O no hydrogen 2.788 N/A HIS 152.A N SER 127.A O no hydrogen 2.800 N/A HIS 152.A ND1 ASP 161.A OD1 no hydrogen 2.723 N/A THR 153.A N TYR 162.A O no hydrogen 2.980 N/A THR 153.A OG1 ASP 213.A OD1 no hydrogen 2.852 N/A THR 153.A OG1 HIS 217.A ND1 no hydrogen 3.067 N/A PHE 154.A N THR 125.A O no hydrogen 2.919 N/A ILE 155.A N THR 160.A O no hydrogen 3.047 N/A ARG 156.A NH1 GLU 124.A O no hydrogen 2.943 N/A THR 160.A N ILE 155.A O no hydrogen 2.878 N/A THR 160.A OG1 PRO 158.A O no hydrogen 2.883 N/A TYR 162.A N THR 153.A O no hydrogen 2.980 N/A TYR 162.A OH GLU 211.A O no hydrogen 2.671 N/A GLN 163.A NE2 SER 150.A OG no hydrogen 2.767 N/A THR 169.A N GLY 166.A O no hydrogen 2.997 N/A THR 169.A OG1 GLY 166.A O no hydrogen 2.704 N/A TRP 170.A N ASP 167.A O no hydrogen 3.291 N/A TYR 171.A N MET 147.A O no hydrogen 2.871 N/A THR 176.A N ASN 173.A O no hydrogen 3.203 N/A THR 176.A OG1 ASN 173.A O no hydrogen 3.542 N/A TRP 178.A N ALA 144.A O no hydrogen 3.258 N/A TRP 178.A NE1 GLN 145.A O no hydrogen 3.084 N/A ARG 179.A NH1 GLY 135.A O no hydrogen 2.791 N/A ARG 179.A NH1 ASP 137.A OD1 no hydrogen 2.919 N/A ARG 179.A NH2 ASP 137.A OD1 no hydrogen 3.480 N/A ARG 179.A NH2 ASP 137.A OD2 no hydrogen 3.069 N/A SER 180.A N PRO 177.A O no hydrogen 3.114 N/A SER 180.A OG.B PRO 177.A O no hydrogen 2.953 N/A HIS 183.A N ALA 106.A O no hydrogen 2.989 N/A HIS 183.A ND1 ASP 200.A OD1 no hydrogen 2.753 N/A ARG 184.A N ASP 200.A OD2 no hydrogen 2.953 N/A ARG 184.A NH1 GLU 103.A OE1 no hydrogen 3.253 N/A ARG 184.A NH1 GLU 103.A OE2 no hydrogen 3.065 N/A TYR 185.A N ILE 104.A O no hydrogen 2.889 N/A GLY 186.A N TYR 198.A O no hydrogen 2.841 N/A CYS 187.A N MET 102.A O no hydrogen 2.909 N/A CYS 187.A SG GLU 196.A O no hydrogen 3.678 N/A TYR 188.A N GLU 196.A O no hydrogen 2.774 N/A TRP 189.A N VAL 100.A O no hydrogen 2.901 N/A TRP 189.A NE1 LEU 223.A O no hydrogen 2.988 N/A LYS 190.A N THR 194.A O no hydrogen 3.043 N/A PHE 193.A N ASP 191.A OD2 no hydrogen 2.955 N/A THR 194.A N ASP 191.A O no hydrogen 3.267 N/A THR 194.A OG1 ASP 191.A OD1 no hydrogen 3.217 N/A THR 194.A OG1 ASP 191.A OD2 no hydrogen 2.801 N/A LEU 195.A N VAL 207.A O no hydrogen 3.087 N/A GLU 196.A N TYR 188.A O no hydrogen 2.976 N/A TYR 197.A N ARG 205.A O no hydrogen 2.811 N/A TYR 197.A OH SER 150.A O no hydrogen 2.714 N/A TYR 198.A N GLY 186.A O no hydrogen 2.901 N/A TYR 198.A OH GLU 196.A OE1 no hydrogen 2.736 N/A ILE 199.A N VAL 202.A O no hydrogen 2.922 N/A ASP 200.A N ARG 184.A O no hydrogen 2.804 N/A VAL 202.A N ILE 199.A O no hydrogen 3.111 N/A VAL 204.A N TYR 197.A O no hydrogen 2.831 N/A ARG 205.A NH2 GLU 211.A OE1 no hydrogen 3.383 N/A ARG 205.A NH2 GLU 211.A OE2 no hydrogen 3.304 N/A VAL 207.A N LEU 195.A O no hydrogen 2.857 N/A GLU 211.A N THR 208.A O no hydrogen 2.994 N/A ILE 212.A N ARG 209.A O no hydrogen 3.059 N/A ASN 216.A N ASP 213.A O no hydrogen 3.011 N/A HIS 217.A N ASP 213.A OD1 no hydrogen 3.016 N/A HIS 217.A ND1 THR 153.A O no hydrogen 3.193 N/A HIS 217.A ND1 THR 153.A OG1 no hydrogen 3.067 N/A LEU 218.A N ASP 213.A OD2 no hydrogen 2.879 N/A GLY 219.A N ASN 216.A O no hydrogen 3.412 N/A THR 221.A OG1 LEU 218.A O no hydrogen 3.351 N/A THR 221.A OG1 GLY 222.A O no hydrogen 2.936 N/A THR 221.A OG1 ASN 224.A OD1 no hydrogen 3.348 N/A LEU 223.A N PRO 192.A O no hydrogen 2.817 N/A THR 227.A N ILE 96.A O no hydrogen 2.905 N/A ASN 228.A N LEU 120.A O no hydrogen 3.266 N/A ASN 228.A ND2 LEU 120.A O no hydrogen 2.868 N/A ASN 228.A ND2 ASP 122.A OD1 no hydrogen 2.928 N/A ILE 229.A N SER 92.A OG no hydrogen 2.915 N/A ILE 230.A N TRP 118.A O no hydrogen 2.777 N/A ILE 231.A N ILE 90.A O no hydrogen 3.039 N/A ASP 232.A N ALA 116.A O no hydrogen 3.037 N/A CYS 233.A N GLY 88.A O no hydrogen 3.224 N/A CYS 233.A SG GLN 76.A O no hydrogen 3.750 N/A CYS 233.A SG GLY 88.A O no hydrogen 3.787 N/A GLU 234.A N ALA 114.A O no hydrogen 2.968 N/A ASN 235.A N THR 59.A OG1 no hydrogen 2.791 N/A ASN 235.A ND2 SER 85.A OG no hydrogen 3.084 N/A GLN 236.A NE2 TYR 134.A OH no hydrogen 2.609 N/A THR 237.A N ASN 235.A O no hydrogen 2.865 N/A THR 237.A OG1 SER 58.A OG no hydrogen 2.718 N/A TRP 239.A N GLN 236.A O no hydrogen 3.173 N/A ARG 240.A N GLN 236.A O no hydrogen 2.910 N/A ARG 240.A NH1 GLY 139.A O no hydrogen 2.801 N/A THR 244.A N GLU 247.A OE1 no hydrogen 2.992 N/A GLN 245.A NE2 LYS 84.A O no hydrogen 2.998 N/A GLU 247.A N THR 244.A OG1 no hydrogen 3.159 N/A LEU 248.A N THR 244.A O no hydrogen 3.185 N/A ALA 249.A N GLN 245.A O no hydrogen 3.014 N/A ALA 249.A N GLU 246.A O no hydrogen 3.140 N/A ASP 250.A N GLU 247.A O no hydrogen 3.203 N/A SER 252.A N ASP 250.A OD2 no hydrogen 3.059 N/A SER 252.A OG ASP 250.A OD1 no hydrogen 3.473 N/A SER 252.A OG ASP 250.A OD2 no hydrogen 2.880 N/A LYS 253.A N ASP 250.A O no hydrogen 2.981 N/A ASN 254.A ND2 LEU 248.A O no hydrogen 2.832 N/A PHE 256.A N ILE 75.A O no hydrogen 2.799 N/A TRP 257.A N LYS 107.A O no hydrogen 3.129 N/A VAL 258.A N LEU 73.A O no hydrogen 2.895 N/A ASP 259.A N LYS 105.A O no hydrogen 2.882 N/A ILE 261.A N ASP 26.A O no hydrogen 2.920 N/A ARG 262.A N GLU 103.A O no hydrogen 2.849 N/A ARG 262.A NE GLU 103.A OE1 no hydrogen 2.880 N/A ARG 262.A NH1 PRO 7.A O no hydrogen 3.182 N/A ARG 262.A NH1 GLU 103.A OE1 no hydrogen 2.932 N/A ARG 262.A NH2 ILE 6.A O no hydrogen 2.974 N/A ARG 262.A NH2 TYR 264.A OH no hydrogen 2.994 N/A VAL 263.A N SER 25.A OG no hydrogen 3.035 N/A TYR 264.A N TYR 101.A O no hydrogen 2.845 N/A LYS 265.A N GLN 19.A O no hydrogen 2.963 N/A LYS 265.A NZ PRO 99.A O no hydrogen 2.917 N/A VAL 267.A N THR 17.A O no hydrogen 2.826 N/A