Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 2ivx_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): SER 2.A N GLU 140.A OE2 no hydrogen 3.020 N/A SER 2.A OG GLU 140.A OE1 no hydrogen 2.622 N/A ARG 4.A NH2 THR 136.A O no hydrogen 3.334 N/A TRP 5.A N SER 2.A O no hydrogen 2.912 N/A PHE 6.A N SER 3.A O no hydrogen 3.267 N/A PHE 7.A N LEU 182.A O no hydrogen 2.758 N/A THR 8.A N GLN 11.A OE1 no hydrogen 2.817 N/A THR 8.A OG1 GLN 11.A OE1 no hydrogen 3.265 N/A GLN 11.A N THR 8.A OG1 no hydrogen 3.123 N/A LEU 12.A N THR 8.A O no hydrogen 2.891 N/A GLU 13.A N ARG 9.A O no hydrogen 2.988 N/A ASN 14.A N GLU 10.A O no hydrogen 2.940 N/A THR 15.A OG1 GLU 27.A OE1 no hydrogen 3.488 N/A THR 15.A OG1 GLU 27.A OE2 no hydrogen 2.588 N/A ARG 18.A N THR 15.A OG1 no hydrogen 3.051 N/A ARG 18.A NE GLU 13.A O no hydrogen 2.769 N/A ARG 18.A NH1 LEU 12.A O no hydrogen 3.422 N/A ARG 18.A NH2 VAL 22.A O no hydrogen 2.950 N/A ARG 18.A NH2 GLU 27.A OE2 no hydrogen 2.760 N/A ARG 19.A N THR 15.A O no hydrogen 3.127 N/A ARG 19.A NH1 ASN 14.A O no hydrogen 2.978 N/A ARG 19.A NH1 ASN 14.A OD1 no hydrogen 3.300 N/A CYS 20.A N SER 17.A O no hydrogen 3.041 N/A CYS 20.A SG PRO 16.A O no hydrogen 3.433 N/A CYS 20.A SG SER 67.A OG no hydrogen 3.487 N/A CYS 20.A SG THR 69.A OG1 no hydrogen 3.517 N/A GLY 21.A N ARG 18.A O no hydrogen 2.901 N/A VAL 22.A N SER 17.A O no hydrogen 2.990 N/A GLU 27.A N GLU 23.A O no hydrogen 2.868 N/A LEU 28.A N ALA 24.A O no hydrogen 3.008 N/A SER 29.A N ASP 25.A O no hydrogen 2.972 N/A CYS 30.A N LYS 26.A O no hydrogen 2.907 N/A CYS 30.A SG LYS 26.A O no hydrogen 3.421 N/A ARG 31.A N GLU 27.A O no hydrogen 3.005 N/A ARG 31.A NH1 HIS 60.A ND1 no hydrogen 3.210 N/A ARG 31.A NH1 HIS 60.A O no hydrogen 3.060 N/A ARG 31.A NH2 GLU 27.A OE1 no hydrogen 2.916 N/A GLN 32.A N LEU 28.A O no hydrogen 2.987 N/A GLN 32.A NE2 LEU 177.A O no hydrogen 3.009 N/A GLN 32.A NE2 THR 241.A OG1 no hydrogen 3.249 N/A GLN 33.A N SER 29.A O no hydrogen 2.882 N/A GLN 33.A NE2 SER 29.A O no hydrogen 3.506 N/A GLN 33.A NE2 SER 29.A OG no hydrogen 2.892 N/A ALA 34.A N CYS 30.A O no hydrogen 2.944 N/A ALA 35.A N ARG 31.A O no hydrogen 2.879 N/A ASN 36.A N GLN 32.A O no hydrogen 2.925 N/A LEU 37.A N GLN 33.A O no hydrogen 2.996 N/A ILE 38.A N ALA 34.A O no hydrogen 2.902 N/A GLN 39.A N ALA 35.A O no hydrogen 2.848 N/A GLN 39.A NE2 GLN 43.A OE1 no hydrogen 3.023 N/A GLN 39.A NE2 GLN 49.A OE1 no hydrogen 2.868 N/A GLU 40.A N ASN 36.A O no hydrogen 3.077 N/A MET 41.A N LEU 37.A O no hydrogen 2.813 N/A GLY 42.A N ILE 38.A O no hydrogen 2.857 N/A GLN 43.A N GLN 39.A O no hydrogen 3.017 N/A ARG 44.A N GLU 40.A O no hydrogen 3.114 N/A LEU 45.A N MET 41.A O no hydrogen 2.880 N/A ASN 46.A N GLN 43.A O no hydrogen 3.015 N/A VAL 47.A N GLY 42.A O no hydrogen 3.089 N/A SER 48.A N GLN 90.A OE1 no hydrogen 2.598 N/A SER 48.A OG THR 51.A OG1 no hydrogen 3.059 N/A SER 48.A OG GLN 90.A OE1 no hydrogen 2.746 N/A GLN 49.A NE2 GLN 39.A OE1 no hydrogen 2.908 N/A GLN 49.A NE2 ASN 53.A OD1 no hydrogen 2.887 N/A THR 51.A N SER 48.A OG no hydrogen 3.127 N/A THR 51.A OG1 SER 48.A OG no hydrogen 3.059 N/A THR 51.A OG1 GLN 90.A OE1 no hydrogen 2.613 N/A ILE 52.A N SER 48.A O no hydrogen 3.213 N/A ASN 53.A N GLN 49.A O no hydrogen 2.857 N/A THR 54.A N LEU 50.A O no hydrogen 2.914 N/A THR 54.A OG1 LEU 50.A O no hydrogen 3.184 N/A THR 54.A OG1 GLU 88.A OE2 no hydrogen 2.565 N/A THR 54.A OG1 HIS 145.A NE2 no hydrogen 2.969 N/A ALA 55.A N THR 51.A O no hydrogen 3.006 N/A ILE 56.A N ILE 52.A O no hydrogen 2.938 N/A VAL 57.A N ASN 53.A O no hydrogen 3.021 N/A TYR 58.A N THR 54.A O no hydrogen 2.912 N/A TYR 58.A OH ILE 141.A O no hydrogen 2.672 N/A MET 59.A N ALA 55.A O no hydrogen 2.938 N/A HIS 60.A N ILE 56.A O no hydrogen 2.950 N/A HIS 60.A NE2 LEU 175.A O no hydrogen 2.980 N/A ARG 61.A N VAL 57.A O no hydrogen 2.920 N/A PHE 62.A N TYR 58.A O no hydrogen 2.850 N/A TYR 63.A N MET 59.A O no hydrogen 3.142 N/A TYR 63.A OH PHE 71.A O no hydrogen 2.714 N/A MET 64.A N ARG 61.A O no hydrogen 2.985 N/A HIS 65.A N PHE 62.A O no hydrogen 3.040 N/A HIS 66.A NE2 THR 136.A OG1 no hydrogen 2.783 N/A SER 67.A OG THR 69.A OG1 no hydrogen 2.728 N/A PHE 68.A N SER 17.A OG no hydrogen 2.906 N/A THR 69.A N SER 67.A OG no hydrogen 2.950 N/A THR 69.A OG1 SER 67.A OG no hydrogen 2.728 N/A LYS 70.A N SER 67.A O no hydrogen 3.093 N/A PHE 71.A N SER 67.A O no hydrogen 3.060 N/A LYS 73.A NZ GLN 33.A OE1 no hydrogen 3.529 N/A ASN 74.A N ASN 72.A OD1 no hydrogen 2.853 N/A ILE 76.A N ASN 72.A O no hydrogen 3.074 N/A SER 77.A N LYS 73.A O no hydrogen 2.893 N/A SER 77.A OG ALA 34.A O no hydrogen 3.452 N/A SER 77.A OG LYS 73.A O no hydrogen 2.773 N/A SER 78.A N ASN 74.A O no hydrogen 3.275 N/A THR 79.A N ILE 75.A O no hydrogen 3.005 N/A THR 79.A OG1 ILE 75.A O no hydrogen 2.955 N/A ALA 80.A N ILE 76.A O no hydrogen 2.809 N/A LEU 81.A N SER 77.A O no hydrogen 3.025 N/A PHE 82.A N SER 78.A O no hydrogen 2.932 N/A LEU 83.A N THR 79.A O no hydrogen 2.970 N/A ALA 84.A N ALA 80.A O no hydrogen 2.837 N/A ALA 85.A N LEU 81.A O no hydrogen 2.944 N/A LYS 86.A N PHE 82.A O no hydrogen 3.480 N/A LYS 86.A NZ GLU 130.A OE2 no hydrogen 2.559 N/A VAL 87.A N LEU 83.A O no hydrogen 2.979 N/A GLU 88.A N ALA 84.A O no hydrogen 2.831 N/A GLU 89.A N LYS 86.A O no hydrogen 3.115 N/A GLN 90.A N ALA 85.A O no hydrogen 2.832 N/A ARG 92.A NE LEU 45.A O no hydrogen 2.788 N/A ARG 92.A NH1 ALA 91.A O no hydrogen 3.162 N/A ARG 92.A NH2 LEU 45.A O no hydrogen 3.263 N/A ARG 92.A NH2 ASN 46.A O no hydrogen 3.073 N/A VAL 97.A N LYS 93.A O no hydrogen 3.064 N/A ILE 98.A N LEU 94.A O no hydrogen 2.892 N/A LYS 99.A N GLU 95.A O no hydrogen 3.012 N/A LYS 99.A NZ GLU 95.A OE2 no hydrogen 2.992 N/A VAL 100.A N HIS 96.A O no hydrogen 2.927 N/A ALA 101.A N VAL 97.A O no hydrogen 2.960 N/A HIS 102.A N ILE 98.A O no hydrogen 3.004 N/A HIS 102.A NE2 PRO 110.A O no hydrogen 2.886 N/A ALA 103.A N LYS 99.A O no hydrogen 2.945 N/A CYS 104.A N VAL 100.A O no hydrogen 2.987 N/A CYS 104.A SG VAL 100.A O no hydrogen 3.404 N/A LEU 105.A N ALA 101.A O no hydrogen 2.875 N/A HIS 106.A N HIS 102.A O no hydrogen 2.723 N/A GLU 109.A N HIS 106.A O no hydrogen 3.087 N/A LYS 115.A N ASP 113.A OD2 no hydrogen 3.183 N/A CYS 116.A N ASP 113.A O no hydrogen 3.397 N/A CYS 116.A SG ASP 113.A O no hydrogen 3.240 N/A LEU 120.A N CYS 116.A O no hydrogen 3.009 N/A GLN 121.A N ASP 117.A O no hydrogen 2.865 N/A GLN 122.A N ALA 118.A O no hydrogen 3.152 N/A THR 123.A N TYR 119.A O no hydrogen 3.072 N/A THR 123.A OG1 LEU 120.A O no hydrogen 2.650 N/A ARG 124.A N LEU 120.A O no hydrogen 3.036 N/A GLU 125.A N GLN 121.A O no hydrogen 2.861 N/A LEU 126.A N GLN 122.A O no hydrogen 3.019 N/A VAL 127.A N THR 123.A O no hydrogen 3.168 N/A ILE 128.A N ARG 124.A O no hydrogen 3.217 N/A LEU 129.A N GLU 125.A O no hydrogen 2.876 N/A GLU 130.A N LEU 126.A O no hydrogen 3.018 N/A THR 131.A N VAL 127.A O no hydrogen 3.334 N/A ILE 132.A N ILE 128.A O no hydrogen 3.023 N/A MET 133.A N LEU 129.A O no hydrogen 2.751 N/A LEU 134.A N GLU 130.A O no hydrogen 2.894 N/A GLN 135.A N THR 131.A O no hydrogen 3.003 N/A THR 136.A N ILE 132.A O no hydrogen 2.881 N/A THR 136.A OG1 HIS 66.A NE2 no hydrogen 2.783 N/A THR 136.A OG1 ILE 132.A O no hydrogen 2.824 N/A LEU 137.A N MET 133.A O no hydrogen 2.793 N/A GLY 138.A N GLN 135.A O no hydrogen 3.059 N/A PHE 139.A N LEU 134.A O no hydrogen 2.909 N/A GLU 140.A N LEU 137.A O no hydrogen 3.161 N/A HIS 145.A NE2 THR 54.A OG1 no hydrogen 2.969 N/A HIS 147.A NE2 THR 172.A OG1 no hydrogen 2.959 N/A THR 148.A OG1 HIS 145.A O no hydrogen 3.192 N/A VAL 150.A N PRO 146.A O no hydrogen 2.841 N/A VAL 151.A N HIS 147.A O no hydrogen 2.939 N/A LYS 152.A N THR 148.A O no hydrogen 3.214 N/A CYS 153.A N ASP 149.A O no hydrogen 3.035 N/A THR 154.A N VAL 150.A O no hydrogen 2.859 N/A THR 154.A OG1 VAL 150.A O no hydrogen 3.226 N/A THR 154.A OG1 VAL 151.A O no hydrogen 3.334 N/A GLN 155.A N VAL 151.A O no hydrogen 3.019 N/A LEU 156.A N LYS 152.A O no hydrogen 3.209 N/A VAL 157.A N CYS 153.A O no hydrogen 2.897 N/A ARG 158.A N GLN 155.A O no hydrogen 3.267 N/A ALA 159.A N THR 154.A O no hydrogen 2.963 N/A LEU 163.A N SER 160.A OG no hydrogen 3.053 N/A ALA 164.A N SER 160.A O no hydrogen 2.878 N/A GLN 165.A N LYS 161.A O no hydrogen 2.918 N/A THR 166.A N ASP 162.A O no hydrogen 2.860 N/A THR 166.A OG1 ASP 162.A O no hydrogen 2.758 N/A THR 166.A OG1 ASP 162.A OD1.B no hydrogen 3.124 N/A SER 167.A N LEU 163.A O no hydrogen 2.981 N/A SER 167.A OG LEU 163.A O no hydrogen 2.931 N/A TYR 168.A N ALA 164.A O no hydrogen 3.023 N/A PHE 169.A N GLN 165.A O no hydrogen 2.899 N/A MET 170.A N THR 166.A O no hydrogen 3.000 N/A ALA 171.A N SER 167.A O no hydrogen 3.080 N/A THR 172.A N TYR 168.A O no hydrogen 3.043 N/A THR 172.A OG1 HIS 147.A NE2 no hydrogen 2.959 N/A THR 172.A OG1 TYR 168.A O no hydrogen 3.427 N/A ASN 173.A N PHE 169.A O no hydrogen 2.867 N/A ASN 173.A ND2 PHE 169.A O no hydrogen 2.953 N/A SER 174.A N MET 170.A O no hydrogen 2.812 N/A SER 174.A OG ALA 171.A O no hydrogen 2.613 N/A LEU 175.A N ALA 171.A O no hydrogen 3.310 N/A LEU 175.A N THR 172.A O no hydrogen 3.021 N/A HIS 176.A N THR 172.A O no hydrogen 3.056 N/A HIS 176.A NE2 GLN 39.A OE1 no hydrogen 2.927 N/A LEU 177.A N ASN 173.A O no hydrogen 2.890 N/A THR 178.A N SER 174.A O no hydrogen 3.083 N/A THR 178.A OG1 SER 174.A O no hydrogen 2.638 N/A PHE 180.A N THR 178.A OG1 no hydrogen 2.945 N/A LEU 182.A N THR 179.A O no hydrogen 3.026 N/A GLN 183.A N PHE 180.A O no hydrogen 3.012 N/A TYR 184.A N PHE 180.A O no hydrogen 2.900 N/A THR 187.A OG1 ASP 219.A OD2 no hydrogen 2.736 N/A VAL 188.A N LYS 185.A O no hydrogen 2.942 N/A ILE 189.A N LYS 185.A O no hydrogen 3.214 N/A ALA 190.A N PRO 186.A O no hydrogen 2.827 N/A CYS 191.A N THR 187.A O no hydrogen 3.219 N/A CYS 191.A SG THR 187.A O no hydrogen 3.428 N/A CYS 191.A SG TRP 215.A O no hydrogen 3.883 N/A VAL 192.A N VAL 188.A O no hydrogen 3.016 N/A CYS 193.A N ILE 189.A O no hydrogen 2.974 N/A CYS 193.A SG ILE 189.A O no hydrogen 3.378 N/A ILE 194.A N ALA 190.A O no hydrogen 3.065 N/A HIS 195.A N CYS 191.A O no hydrogen 2.823 N/A HIS 195.A NE2 ASP 228.A OD1 no hydrogen 2.832 N/A LEU 196.A N VAL 192.A O no hydrogen 2.990 N/A ALA 197.A N CYS 193.A O no hydrogen 3.049 N/A CYS 198.A N ILE 194.A O no hydrogen 2.853 N/A CYS 198.A SG ILE 194.A O no hydrogen 3.372 N/A LYS 199.A N HIS 195.A O no hydrogen 2.923 N/A TRP 200.A N LEU 196.A O no hydrogen 2.942 N/A SER 201.A N ALA 197.A O no hydrogen 3.042 N/A SER 201.A OG ALA 197.A O no hydrogen 2.884 N/A ASN 202.A N LYS 199.A O no hydrogen 3.232 N/A TRP 203.A N CYS 198.A O no hydrogen 2.887 N/A SER 208.A N LYS 212.A O no hydrogen 3.074 N/A SER 208.A OG ASP 210.A OD1 no hydrogen 2.320 N/A SER 208.A OG LYS 212.A O no hydrogen 3.511 N/A SER 208.A OG TYR 217.A OH no hydrogen 2.995 N/A GLY 211.A N SER 208.A O no hydrogen 2.938 N/A LYS 212.A N ASP 210.A OD1 no hydrogen 3.270 N/A HIS 213.A N GLU 216.A OE2 no hydrogen 2.924 N/A GLU 216.A N HIS 213.A O no hydrogen 2.933 N/A TYR 217.A N TRP 214.A O no hydrogen 3.065 N/A TYR 217.A OH SER 208.A OG no hydrogen 2.995 N/A VAL 218.A N TRP 215.A O no hydrogen 2.956 N/A ASP 219.A N TRP 215.A O no hydrogen 2.966 N/A THR 221.A N ASP 219.A OD1 no hydrogen 2.825 N/A THR 221.A OG1 ASP 219.A OD1 no hydrogen 2.637 N/A VAL 222.A N ASP 219.A OD1 no hydrogen 2.953 N/A LEU 226.A N THR 223.A OG1 no hydrogen 3.049 N/A LEU 227.A N THR 223.A O no hydrogen 2.974 N/A ASP 228.A N LEU 224.A O no hydrogen 2.864 N/A GLU 229.A N GLU 225.A O no hydrogen 3.006 N/A LEU 230.A N LEU 226.A O no hydrogen 2.883 N/A THR 231.A N LEU 227.A O no hydrogen 2.867 N/A THR 231.A OG1 LEU 227.A O no hydrogen 2.729 N/A HIS 232.A N ASP 228.A O no hydrogen 2.947 N/A GLU 233.A N GLU 229.A O no hydrogen 3.001 N/A PHE 234.A N LEU 230.A O no hydrogen 2.895 N/A LEU 235.A N THR 231.A O no hydrogen 2.952 N/A GLN 236.A N HIS 232.A O no hydrogen 2.953 N/A ILE 237.A N GLU 233.A O no hydrogen 3.011 N/A LEU 238.A N PHE 234.A O no hydrogen 2.980 N/A GLU 239.A N LEU 235.A O no hydrogen 2.973 N/A LYS 240.A N GLN 236.A O no hydrogen 3.155 N/A LYS 240.A N ILE 237.A O no hydrogen 3.150 N/A THR 241.A N LEU 238.A O no hydrogen 3.089 N/A THR 241.A OG1 ILE 237.A O no hydrogen 2.911 N/A LEU 245.A N THR 241.A O no hydrogen 3.081 N/A LYS 246.A N PRO 242.A O no hydrogen 3.100 N/A LYS 247.A N ASN 243.A O no hydrogen 3.048 N/A ILE 248.A N ARG 244.A O no hydrogen 3.024 N/A ARG 249.A N LEU 245.A O no hydrogen 3.051 N/A ASN 250.A N LYS 246.A O no hydrogen 2.934 N/A TRP 251.A N LYS 247.A O no hydrogen 2.849 N/A ARG 252.A N ILE 248.A O no hydrogen 3.001 N/A ARG 252.A NH2 GLN 255.A OE1.A no hydrogen 3.030 N/A ALA 253.A N ARG 249.A O no hydrogen 2.947 N/A ASN 254.A N ASN 250.A O no hydrogen 2.955 N/A GLN 255.A N TRP 251.A O no hydrogen 2.922 N/A GLN 255.A NE2.A ASP 162.A O no hydrogen 3.629 N/A GLN 255.A NE2.B TRP 251.A O no hydrogen 3.071 N/A ALA 256.A N ARG 252.A O no hydrogen 2.693 N/A