Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4b2i_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLY 4.A N THR 23.A OG1 no hydrogen 2.911 N/A ARG 5.A NH2 GLU 22.A OE2 no hydrogen 3.005 N/A ILE 6.A N ILE 21.A O no hydrogen 2.866 N/A SER 7.A N GLY 55.A O no hydrogen 2.809 N/A SER 7.A OG ASP 14.A OD2 no hydrogen 2.670 N/A THR 8.A N ASP 14.A OD1 no hydrogen 2.844 N/A THR 8.A OG1 ASP 14.A OD1 no hydrogen 2.807 N/A GLY 9.A N SER 7.A OG no hydrogen 3.035 N/A SER 10.A N THR 8.A OG1 no hydrogen 3.115 N/A SER 10.A OG ASP 220.A OD1 no hydrogen 2.712 N/A SER 12.A N ASP 220.A OD1 no hydrogen 2.913 N/A LEU 13.A N SER 10.A OG no hydrogen 3.001 N/A ASP 14.A N SER 10.A O no hydrogen 2.820 N/A LYS 15.A N LYS 11.A O no hydrogen 2.914 N/A LEU 16.A N SER 12.A O no hydrogen 3.088 N/A LEU 17.A N LEU 13.A O no hydrogen 3.021 N/A LEU 17.A N ASP 14.A O no hydrogen 3.094 N/A GLY 18.A N LYS 15.A O no hydrogen 3.162 N/A GLY 19.A N ASP 14.A O no hydrogen 2.676 N/A ILE 21.A N ILE 6.A O no hydrogen 2.956 N/A THR 23.A N GLY 4.A O no hydrogen 2.833 N/A THR 23.A OG1 GLY 4.A O no hydrogen 3.520 N/A THR 23.A OG1 ASP 169.A OD1 no hydrogen 2.683 N/A GLN 24.A N ILE 170.A O no hydrogen 2.887 N/A GLN 24.A NE2 ALA 1.A O no hydrogen 2.941 N/A GLN 24.A NE2 ASP 169.A OD1 no hydrogen 2.865 N/A THR 27.A N VAL 172.A O no hydrogen 2.881 N/A GLU 28.A N LEU 182.A O no hydrogen 2.802 N/A VAL 29.A N VAL 174.A O no hydrogen 2.898 N/A PHE 30.A N VAL 184.A O no hydrogen 2.830 N/A GLY 31.A N ASN 176.A O no hydrogen 3.237 N/A SER 35.A N GLU 32.A O no hydrogen 2.931 N/A SER 35.A OG GLU 32.A O no hydrogen 3.122 N/A LYS 37.A N SER 35.A OG no hydrogen 3.373 N/A LYS 37.A NZ GLY 31.A O no hydrogen 3.322 N/A THR 38.A OG1 ASP 131.A OD1 no hydrogen 3.409 N/A THR 38.A OG1 ASP 131.A OD2 no hydrogen 2.925 N/A LEU 40.A N GLY 36.A O no hydrogen 2.842 N/A ALA 41.A N LYS 37.A O no hydrogen 3.057 N/A HIS 42.A N THR 38.A O no hydrogen 2.910 N/A HIS 42.A ND1 THR 38.A O no hydrogen 2.796 N/A THR 43.A N GLN 39.A O no hydrogen 2.952 N/A THR 43.A OG1 GLN 39.A O no hydrogen 2.860 N/A LEU 44.A N LEU 40.A O no hydrogen 2.930 N/A ALA 45.A N ALA 41.A O no hydrogen 3.087 N/A VAL 46.A N THR 43.A O no hydrogen 3.026 N/A MET 47.A N THR 43.A O no hydrogen 2.836 N/A VAL 48.A N LEU 44.A O no hydrogen 2.990 N/A GLN 49.A N VAL 46.A O no hydrogen 3.023 N/A GLN 49.A NE2 ALA 45.A O no hydrogen 2.996 N/A GLN 49.A NE2 VAL 89.A O no hydrogen 2.979 N/A LEU 50.A N MET 47.A O no hydrogen 2.976 N/A GLU 54.A N PRO 51.A O no hydrogen 2.819 N/A GLY 55.A N PRO 52.A O no hydrogen 2.951 N/A GLY 56.A N PRO 51.A O no hydrogen 3.114 N/A LEU 57.A N VAL 48.A O no hydrogen 2.988 N/A ASN 58.A N LEU 50.A O no hydrogen 2.843 N/A GLY 59.A N VAL 48.A O no hydrogen 3.034 N/A SER 60.A N PRO 124.A O no hydrogen 2.789 N/A SER 60.A OG ARG 123.A O no hydrogen 2.656 N/A VAL 61.A N HIS 92.A O no hydrogen 2.909 N/A MET 62.A N LEU 127.A O no hydrogen 2.942 N/A TRP 63.A N ALA 94.A O no hydrogen 2.805 N/A ILE 64.A N ILE 129.A O no hydrogen 2.838 N/A ASP 65.A N ALA 96.A O no hydrogen 2.937 N/A THR 66.A N ASP 131.A O no hydrogen 2.908 N/A THR 66.A OG1 SER 132.A O no hydrogen 3.485 N/A THR 66.A OG1 SER 132.A OG no hydrogen 3.418 N/A THR 66.A OG1 SER 135.A OG no hydrogen 2.747 N/A THR 69.A N ASP 65.A OD1 no hydrogen 3.042 N/A THR 69.A OG1 ASP 65.A OD1 no hydrogen 3.467 N/A THR 69.A OG1 ASP 131.A OD2 no hydrogen 2.859 N/A PHE 70.A N ASP 65.A OD2 no hydrogen 3.127 N/A ARG 71.A N HIS 42.A NE2 no hydrogen 2.915 N/A ARG 71.A NH1 ASN 68.A O no hydrogen 2.862 N/A ARG 71.A NH1 PHE 70.A O no hydrogen 3.347 N/A ARG 71.A NH2 ASN 68.A O no hydrogen 3.452 N/A ARG 74.A N ARG 71.A O no hydrogen 2.906 N/A ARG 74.A NE GLN 39.A OE1 no hydrogen 2.752 N/A ARG 74.A NH1 GLU 77.A OE1 no hydrogen 2.928 N/A ARG 74.A NH1 THR 214.A O no hydrogen 3.124 N/A ARG 74.A NH2 GLN 39.A OE1 no hydrogen 2.895 N/A ARG 74.A NH2 THR 214.A O no hydrogen 2.886 N/A ILE 75.A N ARG 71.A O no hydrogen 3.167 N/A ARG 76.A N PRO 72.A O no hydrogen 2.973 N/A ARG 76.A NE GLU 73.A OE2 no hydrogen 3.171 N/A GLU 77.A N GLU 73.A O no hydrogen 3.007 N/A ILE 78.A N ARG 74.A O no hydrogen 2.930 N/A ALA 79.A N ILE 75.A O no hydrogen 2.846 N/A GLN 80.A N ARG 76.A O no hydrogen 2.909 N/A ASN 81.A N GLU 77.A O no hydrogen 2.985 N/A ASN 81.A ND2 GLU 77.A O no hydrogen 2.993 N/A ARG 82.A N ILE 78.A O no hydrogen 3.140 N/A ARG 82.A N ALA 79.A O no hydrogen 3.222 N/A ARG 82.A NE LYS 216.A O no hydrogen 2.857 N/A ARG 82.A NH2 LYS 216.A O no hydrogen 3.005 N/A GLY 83.A N GLN 80.A O no hydrogen 2.964 N/A LEU 84.A N ALA 79.A O no hydrogen 2.769 N/A ASP 87.A N ASP 85.A OD1 no hydrogen 3.120 N/A VAL 89.A N ASP 85.A O no hydrogen 3.095 N/A LEU 90.A N PRO 86.A O no hydrogen 3.113 N/A LYS 91.A N ASP 87.A O no hydrogen 3.064 N/A HIS 92.A N VAL 89.A O no hydrogen 3.253 N/A HIS 92.A ND1 GLU 88.A O no hydrogen 2.634 N/A ILE 93.A N LEU 90.A O no hydrogen 3.132 N/A ALA 94.A N VAL 61.A O no hydrogen 2.845 N/A TYR 95.A OH ASP 65.A OD2 no hydrogen 2.619 N/A ALA 96.A N TRP 63.A O no hydrogen 2.878 N/A ARG 97.A NE ASP 65.A O no hydrogen 3.345 N/A ARG 97.A NH2 THR 66.A O no hydrogen 2.884 N/A ALA 98.A N ASP 65.A O no hydrogen 2.893 N/A SER 101.A N GLU 140.A OE2 no hydrogen 2.851 N/A SER 101.A OG GLU 140.A OE1 no hydrogen 2.620 N/A HIS 103.A N ASN 100.A OD1 no hydrogen 2.804 N/A GLN 104.A N ASN 100.A O no hydrogen 2.903 N/A MET 105.A N SER 101.A O no hydrogen 3.023 N/A LEU 106.A N ASN 102.A O no hydrogen 2.919 N/A LEU 107.A N HIS 103.A O no hydrogen 2.820 N/A VAL 108.A N GLN 104.A O no hydrogen 3.309 N/A GLN 109.A N MET 105.A O no hydrogen 3.168 N/A GLN 110.A N LEU 106.A O no hydrogen 2.809 N/A ALA 111.A N LEU 107.A O no hydrogen 2.837 N/A ASP 113.A N GLN 110.A O no hydrogen 3.107 N/A ILE 115.A N ALA 111.A O no hydrogen 3.084 N/A LYS 116.A N GLU 112.A O no hydrogen 2.856 N/A GLU 117.A N ASP 113.A O no hydrogen 3.086 N/A LEU 118.A N MET 114.A O no hydrogen 3.014 N/A LEU 119.A N LYS 116.A O no hydrogen 3.325 N/A THR 121.A N LEU 118.A O no hydrogen 3.108 N/A THR 121.A OG1 LEU 118.A O no hydrogen 2.717 N/A ARG 123.A N THR 121.A OG1 no hydrogen 3.141 N/A ARG 123.A NH2 GLN 49.A OE1 no hydrogen 2.942 N/A ARG 123.A NH2 GLY 59.A O no hydrogen 2.806 N/A LYS 126.A N SER 60.A O no hydrogen 2.912 N/A LYS 126.A NZ ASP 169.A O no hydrogen 2.925 N/A LEU 128.A N ALA 171.A O no hydrogen 2.964 N/A ILE 129.A N MET 62.A O no hydrogen 2.850 N/A VAL 130.A N PHE 173.A O no hydrogen 2.958 N/A ASP 131.A N ILE 64.A O no hydrogen 2.965 N/A SER 132.A N THR 66.A OG1 no hydrogen 2.871 N/A SER 132.A OG THR 66.A OG1 no hydrogen 3.418 N/A LEU 133.A N THR 175.A O no hydrogen 2.841 N/A SER 135.A OG THR 66.A OG1 no hydrogen 2.747 N/A SER 135.A OG SER 132.A OG no hydrogen 3.278 N/A HIS 136.A NE2 ALA 98.A O no hydrogen 2.799 N/A ARG 138.A N THR 134.A O no hydrogen 2.858 N/A ARG 138.A NH1 THR 134.A OG1 no hydrogen 3.411 N/A ARG 138.A NH2 THR 134.A OG1 no hydrogen 3.264 N/A SER 139.A N SER 135.A O no hydrogen 3.085 N/A GLU 140.A N HIS 136.A O no hydrogen 2.943 N/A TYR 141.A N PHE 137.A O no hydrogen 3.071 N/A TYR 141.A OH GLU 149.A OE2 no hydrogen 3.259 N/A LEU 147.A N ARG 144.A O no hydrogen 3.308 N/A ARG 150.A N ALA 146.A O no hydrogen 3.013 N/A ARG 150.A NE PHE 137.A O no hydrogen 3.327 N/A ARG 150.A NH2 TYR 141.A O no hydrogen 2.617 N/A GLN 151.A N LEU 147.A O no hydrogen 2.964 N/A GLN 152.A N ALA 148.A O no hydrogen 2.990 N/A LYS 153.A N GLU 149.A O no hydrogen 2.905 N/A LYS 153.A NZ GLU 149.A OE2 no hydrogen 3.382 N/A LEU 154.A N ARG 150.A O no hydrogen 2.897 N/A ALA 155.A N GLN 151.A O no hydrogen 2.870 N/A LYS 156.A N GLN 152.A O no hydrogen 3.031 N/A LYS 156.A NZ GLN 109.A OE1 no hydrogen 2.906 N/A LYS 156.A NZ ASP 160.A OD1 no hydrogen 3.318 N/A LYS 156.A NZ ASP 160.A OD2 no hydrogen 2.831 N/A HIS 157.A N LYS 153.A O no hydrogen 2.929 N/A LEU 158.A N LEU 154.A O no hydrogen 2.883 N/A ALA 159.A N ALA 155.A O no hydrogen 2.938 N/A ASP 160.A N LYS 156.A O no hydrogen 2.881 N/A LEU 161.A N HIS 157.A O no hydrogen 2.972 N/A HIS 162.A N LEU 158.A O no hydrogen 2.863 N/A ARG 163.A N ALA 159.A O no hydrogen 3.000 N/A ARG 163.A NH1 GLU 112.A OE1 no hydrogen 2.929 N/A ARG 163.A NH1 GLU 112.A OE2 no hydrogen 3.386 N/A ARG 163.A NH2 GLU 112.A OE2 no hydrogen 2.914 N/A LEU 164.A N ASP 160.A O no hydrogen 3.121 N/A ALA 165.A N LEU 161.A O no hydrogen 2.946 N/A ASN 166.A N HIS 162.A O no hydrogen 2.912 N/A ASN 166.A ND2 GLN 24.A O no hydrogen 3.100 N/A LEU 167.A N ARG 163.A O no hydrogen 2.849 N/A TYR 168.A N LEU 164.A O no hydrogen 3.093 N/A TYR 168.A OH GLU 112.A OE2 no hydrogen 2.604 N/A ILE 170.A N ALA 165.A O no hydrogen 3.034 N/A ALA 171.A N LYS 126.A O no hydrogen 2.881 N/A VAL 172.A N ALA 25.A O no hydrogen 3.061 N/A PHE 173.A N LEU 128.A O no hydrogen 2.906 N/A VAL 174.A N THR 27.A O no hydrogen 2.886 N/A THR 175.A N VAL 130.A O no hydrogen 3.098 N/A THR 175.A OG1 ASP 131.A OD1 no hydrogen 2.671 N/A ASN 176.A N VAL 29.A O no hydrogen 2.893 N/A THR 181.A OG1 GLU 28.A OE1 no hydrogen 2.680 N/A LEU 182.A N ILE 26.A O no hydrogen 2.870 N/A ARG 183.A NE TYR 185.A OH no hydrogen 2.752 N/A ARG 183.A NH2 ASP 200.A OD2 no hydrogen 3.010 N/A VAL 184.A N GLU 28.A O no hydrogen 2.974 N/A TYR 185.A N ARG 197.A O no hydrogen 2.862 N/A LEU 186.A N PHE 30.A O no hydrogen 2.850 N/A ARG 187.A N ILE 195.A O no hydrogen 2.915 N/A ARG 187.A NH1 GLU 208.A OE2 no hydrogen 2.900 N/A ARG 187.A NH2 GLU 208.A OE1 no hydrogen 3.085 N/A ARG 187.A NH2 GLU 208.A OE2 no hydrogen 3.074 N/A GLY 189.A N LYS 193.A O no hydrogen 2.867 N/A LYS 193.A N LYS 190.A O no hydrogen 3.142 N/A ARG 194.A N PHE 211.A O no hydrogen 2.872 N/A ARG 194.A NE GLY 34.A O no hydrogen 2.923 N/A ARG 194.A NH2 GLY 34.A O no hydrogen 2.809 N/A ILE 195.A N ARG 187.A O no hydrogen 2.865 N/A ALA 196.A N ALA 209.A O no hydrogen 2.869 N/A ARG 197.A N TYR 185.A O no hydrogen 2.846 N/A ARG 197.A NH2 GLU 206.A OE1 no hydrogen 3.405 N/A LEU 198.A N GLY 207.A O no hydrogen 3.012 N/A ILE 199.A N ARG 183.A O no hydrogen 3.195 N/A ASP 200.A N GLU 206.A OE2 no hydrogen 2.954 N/A ALA 209.A N ALA 196.A O no hydrogen 2.892 N/A PHE 211.A N ARG 194.A O no hydrogen 2.875 N/A SER 212.A N GLU 219.A O no hydrogen 2.749 N/A SER 212.A OG ASP 220.A OXT no hydrogen 2.907 N/A THR 214.A N GLY 217.A O no hydrogen 2.677 N/A THR 214.A OG1 GLU 219.A OE2 no hydrogen 2.746 N/A LYS 216.A N THR 214.A OG1 no hydrogen 2.998 N/A LYS 216.A NZ ASN 81.A O no hydrogen 2.734 N/A GLY 217.A N THR 214.A O no hydrogen 2.937 N/A ILE 218.A N THR 43.A OG1 no hydrogen 3.081 N/A GLU 219.A N SER 212.A O no hydrogen 3.173 N/A