Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4fd7_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ARG 4.A NH1 ASP 34.A OD2 no hydrogen 2.807 N/A ARG 4.A NH2 ASP 34.A OD1 no hydrogen 2.815 N/A ARG 4.A NH2 ASP 34.A OD2 no hydrogen 3.461 N/A ARG 4.A NH2 ARG 84.A O no hydrogen 2.790 N/A LYS 7.A N SER 5.A OG no hydrogen 3.088 N/A VAL 8.A N SER 5.A O no hydrogen 3.271 N/A SER 12.A N ASP 34.A OD2 no hydrogen 2.727 N/A SER 12.A OG PRO 9.A O no hydrogen 2.301 N/A TRP 14.A N VAL 32.A O no hydrogen 2.886 N/A TRP 14.A NE1 ASP 34.A OD1 no hydrogen 2.944 N/A HIS 15.A N VAL 32.A O no hydrogen 3.226 N/A HIS 15.A NE2 GLU 166.A OE1 no hydrogen 2.748 N/A PHE 17.A N TYR 30.A O no hydrogen 3.172 N/A ALA 19.A N VAL 28.A O no hydrogen 3.114 N/A LYS 20.A NZ GLN 25.A O no hydrogen 3.149 N/A ASP 21.A N GLN 26.A O no hydrogen 2.839 N/A LEU 22.A N ASP 21.A OD2 no hydrogen 2.605 N/A GLN 25.A N GLN 25.A OE1 no hydrogen 3.003 N/A GLN 26.A N SER 24.A OG no hydrogen 2.797 N/A VAL 28.A N ALA 19.A O no hydrogen 2.863 N/A TYR 30.A N PHE 17.A O no hydrogen 2.881 N/A TYR 30.A OH LYS 20.A O no hydrogen 2.714 N/A ARG 31.A N PHE 90.A O no hydrogen 2.847 N/A ARG 31.A NE GLN 33.A OE1 no hydrogen 2.860 N/A ARG 31.A NH1 GLU 92.A OE1 no hydrogen 3.514 N/A VAL 32.A N HIS 15.A O no hydrogen 2.868 N/A GLN 33.A N VAL 88.A O no hydrogen 2.910 N/A GLN 33.A NE2 ASP 34.A O no hydrogen 2.959 N/A ASP 34.A N SER 12.A O no hydrogen 2.909 N/A LEU 35.A N SER 86.A O no hydrogen 3.030 N/A ARG 39.A N PRO 36.A O no hydrogen 2.952 N/A ARG 39.A NE ASP 42.A OD2 no hydrogen 2.818 N/A ARG 39.A NH1 ASP 42.A OD2 no hydrogen 3.232 N/A ARG 39.A NH1 ASP 95.A O no hydrogen 3.041 N/A ARG 39.A NH2 ASP 95.A O no hydrogen 2.747 N/A PHE 40.A N GLU 37.A O no hydrogen 2.960 N/A ALA 43.A N ARG 39.A O no hydrogen 2.833 N/A ILE 44.A N PHE 40.A O no hydrogen 2.923 N/A ARG 45.A N GLU 41.A O no hydrogen 2.769 N/A HIS 46.A N ASP 42.A O no hydrogen 2.786 N/A MET 47.A N ALA 43.A O no hydrogen 2.784 N/A CYS 48.A N ILE 44.A O no hydrogen 2.868 N/A CYS 48.A SG ILE 44.A O no hydrogen 3.363 N/A ASP 49.A N ARG 45.A O no hydrogen 2.774 N/A ASP 49.A N HIS 46.A O no hydrogen 3.044 N/A TYR 50.A N HIS 46.A O no hydrogen 3.024 N/A PHE 51.A N SER 153.A OG no hydrogen 3.180 N/A ALA 52.A N MET 47.A O no hydrogen 2.993 N/A ARG 53.A N TYR 50.A O no hydrogen 2.896 N/A ARG 53.A NE ASP 54.A OD1 no hydrogen 2.678 N/A ARG 53.A NE ASP 54.A OD2 no hydrogen 3.463 N/A ARG 53.A NH1 ASP 54.A OD2 no hydrogen 2.930 N/A ASP 54.A N TYR 50.A O no hydrogen 2.791 N/A GLU 55.A N PHE 51.A O no hydrogen 3.070 N/A ASN 58.A N GLU 55.A OE1 no hydrogen 2.823 N/A ASN 58.A ND2 PHE 51.A O no hydrogen 3.328 N/A GLN 59.A N GLU 55.A O no hydrogen 2.978 N/A GLN 59.A NE2 ARG 53.A O no hydrogen 2.841 N/A ALA 60.A N LEU 56.A O no hydrogen 2.932 N/A LYS 61.A N MET 57.A O no hydrogen 2.991 N/A LYS 61.A NZ ASN 220.A O no hydrogen 2.709 N/A GLY 62.A N GLN 59.A O no hydrogen 3.194 N/A LEU 63.A N ASN 58.A O no hydrogen 2.966 N/A LYS 65.A N GLY 62.A O no hydrogen 3.279 N/A ASP 66.A N LEU 63.A O no hydrogen 3.104 N/A ALA 69.A N ASP 66.A OD1 no hydrogen 2.899 N/A MET 70.A N ASP 66.A O no hydrogen 3.014 N/A GLY 71.A N LEU 67.A O no hydrogen 2.906 N/A ASP 72.A N VAL 68.A O no hydrogen 2.962 N/A VAL 73.A N ALA 69.A O no hydrogen 3.019 N/A VAL 74.A N MET 70.A O no hydrogen 2.930 N/A ALA 75.A N GLY 71.A O no hydrogen 2.963 N/A LEU 76.A N ASP 72.A O no hydrogen 3.016 N/A TRP 77.A N VAL 73.A O no hydrogen 2.925 N/A TRP 77.A NE1 MET 150.A O no hydrogen 2.650 N/A LYS 78.A N VAL 74.A O no hydrogen 2.918 N/A LYS 78.A NZ GLU 41.A OE1 no hydrogen 3.409 N/A ALA 79.A N ALA 75.A O no hydrogen 2.983 N/A MET 80.A N LEU 76.A O no hydrogen 3.017 N/A LEU 81.A N TRP 77.A O no hydrogen 2.984 N/A ASP 83.A N MET 80.A O no hydrogen 3.021 N/A ARG 84.A N LEU 81.A O no hydrogen 2.957 N/A ARG 84.A NE GLU 37.A OE2 no hydrogen 2.992 N/A ARG 84.A NH2 GLU 37.A OE2 no hydrogen 3.156 N/A SER 86.A OG LEU 103.A O no hydrogen 3.505 N/A LEU 87.A N ASN 101.A O no hydrogen 2.953 N/A VAL 88.A N GLN 33.A O no hydrogen 2.921 N/A CYS 89.A N GLY 99.A O no hydrogen 2.914 N/A CYS 89.A SG ARG 31.A O no hydrogen 3.548 N/A PHE 90.A N ARG 31.A O no hydrogen 2.927 N/A ARG 91.A NH1 ASP 21.A OD2 no hydrogen 3.051 N/A GLU 92.A N TRP 29.A O no hydrogen 2.950 N/A SER 94.A N ARG 91.A O no hydrogen 3.041 N/A GLU 96.A N SER 94.A OG no hydrogen 3.171 N/A VAL 98.A N CYS 89.A O no hydrogen 2.886 N/A VAL 100.A N SER 153.A O no hydrogen 2.895 N/A ASN 101.A N LEU 87.A O no hydrogen 2.894 N/A ASN 101.A ND2 GLY 151.A O no hydrogen 2.846 N/A ILE 102.A N GLY 151.A O no hydrogen 3.158 N/A LEU 103.A N SER 86.A OG no hydrogen 2.976 N/A ASP 104.A N ASN 148.A O no hydrogen 3.007 N/A ALA 106.A N TYR 146.A O no hydrogen 2.859 N/A SER 107.A N ASP 110.A OD2 no hydrogen 2.911 N/A SER 107.A OG HIS 145.A ND1 no hydrogen 2.878 N/A ARG 108.A N ASP 144.A O no hydrogen 2.909 N/A ARG 108.A NE ASP 144.A OD1 no hydrogen 2.776 N/A ARG 108.A NH1 ASP 139.A OD1 no hydrogen 2.799 N/A ARG 108.A NH2 VAL 143.A O no hydrogen 3.099 N/A ASP 110.A N SER 107.A O no hydrogen 2.978 N/A ALA 114.A N TYR 125.A OH no hydrogen 3.420 N/A PHE 116.A N GLN 122.A OE1 no hydrogen 2.746 N/A ASN 117.A N ASP 72.A OD1 no hydrogen 2.913 N/A SER 118.A N ASP 72.A OD2 no hydrogen 2.818 N/A SER 118.A OG ASP 72.A OD2 no hydrogen 2.536 N/A PHE 121.A N SER 118.A OG no hydrogen 2.774 N/A GLN 122.A N SER 118.A O no hydrogen 2.993 N/A GLN 122.A NE2 ALA 114.A O no hydrogen 2.979 N/A GLN 122.A NE2 ASP 126.A OD1 no hydrogen 3.200 N/A GLN 122.A NE2 ASP 126.A OD2 no hydrogen 3.532 N/A ALA 123.A N ALA 119.A O no hydrogen 2.906 N/A ILE 124.A N ILE 120.A O no hydrogen 3.040 N/A TYR 125.A N PHE 121.A O no hydrogen 2.833 N/A ASP 126.A N GLN 122.A O no hydrogen 2.885 N/A THR 127.A N ALA 123.A O no hydrogen 2.870 N/A THR 127.A OG1 ALA 123.A O no hydrogen 2.645 N/A THR 127.A OG1 TYR 221.A OH no hydrogen 2.677 N/A ILE 128.A N ILE 124.A O no hydrogen 2.975 N/A GLU 129.A N TYR 125.A O no hydrogen 2.878 N/A TYR 130.A N ASP 126.A O no hydrogen 2.919 N/A VAL 131.A N THR 127.A O no hydrogen 2.998 N/A SER 132.A N ILE 128.A O no hydrogen 2.823 N/A SER 132.A OG TYR 146.A OH no hydrogen 3.313 N/A SER 132.A OG TYR 231.A OH no hydrogen 2.911 N/A HIS 133.A N GLU 129.A O no hydrogen 2.914 N/A GLN 134.A N TYR 130.A O no hydrogen 2.961 N/A ALA 135.A N VAL 131.A O no hydrogen 2.952 N/A ASN 136.A N SER 132.A O no hydrogen 3.221 N/A ARG 140.A N ASN 136.A O no hydrogen 3.001 N/A ARG 140.A NH1 ALA 135.A O no hydrogen 2.992 N/A ARG 140.A NH1 ASP 204.A OD1 no hydrogen 3.011 N/A ARG 140.A NH2 ASP 204.A OD1 no hydrogen 3.176 N/A TYR 141.A N ILE 137.A O no hydrogen 2.976 N/A TYR 141.A OH SER 233.A OG no hydrogen 2.721 N/A VAL 143.A N PHE 138.A O no hydrogen 3.033 N/A HIS 145.A ND1 SER 107.A OG no hydrogen 2.878 N/A TYR 146.A N ALA 106.A O no hydrogen 2.934 N/A TYR 146.A OH TYR 231.A OH no hydrogen 2.775 N/A LEU 147.A N LEU 182.A O no hydrogen 2.964 N/A ASN 148.A N ASP 104.A O no hydrogen 2.830 N/A ALA 149.A N ASN 148.A OD1 no hydrogen 2.672 N/A MET 150.A N ILE 102.A O no hydrogen 2.874 N/A SER 153.A N VAL 100.A O no hydrogen 2.866 N/A SER 153.A OG HIS 46.A ND1 no hydrogen 3.011 N/A SER 153.A OG HIS 46.A O no hydrogen 3.538 N/A ASP 155.A N VAL 98.A O no hydrogen 2.883 N/A LYS 157.A N ASP 155.A OD1 no hydrogen 3.027 N/A LYS 157.A NZ GLU 96.A OE2 no hydrogen 3.147 N/A LYS 157.A NZ ASP 155.A OD2 no hydrogen 3.209 N/A TYR 158.A N ASP 155.A O no hydrogen 2.775 N/A ARG 159.A N PRO 156.A O no hydrogen 3.165 N/A ARG 159.A NE VAL 154.A O no hydrogen 3.108 N/A ARG 159.A NH1 ASP 54.A OD2 no hydrogen 3.340 N/A ARG 159.A NH2 ASP 54.A OD2 no hydrogen 2.830 N/A ARG 159.A NH2 VAL 154.A O no hydrogen 2.939 N/A ARG 161.A NE LYS 20.A O no hydrogen 3.077 N/A ARG 161.A NE ASP 21.A O no hydrogen 3.306 N/A ARG 161.A NH1 ASP 21.A O no hydrogen 3.086 N/A GLU 166.A N GLY 162.A O no hydrogen 3.094 N/A ILE 167.A N ILE 163.A O no hydrogen 2.924 N/A LEU 168.A N ALA 164.A O no hydrogen 2.990 N/A ARG 169.A N THR 165.A O no hydrogen 2.863 N/A ARG 169.A NE GLU 166.A OE1 no hydrogen 2.850 N/A ARG 169.A NH2 GLU 166.A OE2 no hydrogen 3.136 N/A ALA 170.A N GLU 166.A O no hydrogen 3.040 N/A ARG 171.A N LEU 168.A O no hydrogen 3.065 N/A ARG 171.A NH1 SER 183.A OG no hydrogen 2.974 N/A ARG 171.A NH1 THR 185.A OG1 no hydrogen 2.962 N/A ARG 171.A NH2 ASN 101.A OD1 no hydrogen 2.947 N/A ILE 172.A N ARG 169.A O no hydrogen 3.101 N/A LEU 174.A N ALA 170.A O no hydrogen 3.375 N/A CYS 175.A N ARG 171.A O no hydrogen 2.828 N/A CYS 175.A SG ARG 171.A O no hydrogen 3.287 N/A ARG 176.A N ILE 172.A O no hydrogen 3.148 N/A ALA 177.A N PRO 173.A O no hydrogen 2.950 N/A VAL 178.A N LEU 174.A O no hydrogen 3.112 N/A GLY 179.A N CYS 175.A O no hydrogen 2.908 N/A LEU 180.A N CYS 175.A O no hydrogen 2.914 N/A SER 183.A N LEU 234.A O no hydrogen 2.966 N/A SER 183.A OG LEU 147.A O no hydrogen 2.645 N/A ALA 184.A N LEU 147.A O no hydrogen 3.030 N/A THR 185.A N MET 232.A O no hydrogen 2.940 N/A THR 185.A OG1 ALA 184.A O no hydrogen 2.714 N/A PHE 187.A N LYS 230.A O no hydrogen 2.839 N/A THR 188.A OG1 GLU 55.A OE2 no hydrogen 2.553 N/A GLY 189.A N SER 192.A OG no hydrogen 3.310 N/A SER 192.A OG GLY 189.A O no hydrogen 2.926 N/A GLN 193.A N GLY 189.A O no hydrogen 3.059 N/A GLN 193.A NE2 PHE 187.A O no hydrogen 2.857 N/A GLN 193.A NE2 PHE 228.A O no hydrogen 2.858 N/A THR 194.A N PRO 190.A O no hydrogen 2.931 N/A THR 194.A OG1 PRO 190.A O no hydrogen 2.904 N/A ALA 195.A N ASN 191.A O no hydrogen 2.882 N/A ALA 196.A N SER 192.A O no hydrogen 2.934 N/A THR 197.A N GLN 193.A O no hydrogen 2.909 N/A THR 197.A OG1 GLN 193.A O no hydrogen 3.088 N/A ARG 198.A N THR 194.A O no hydrogen 2.930 N/A VAL 199.A N ALA 195.A O no hydrogen 3.060 N/A GLY 200.A N ALA 196.A O no hydrogen 3.205 N/A GLY 200.A N THR 197.A O no hydrogen 2.852 N/A PHE 201.A N ALA 196.A O no hydrogen 2.965 N/A GLN 202.A N SER 233.A O no hydrogen 2.788 N/A ASP 204.A N TYR 231.A O no hydrogen 2.689 N/A PHE 205.A N TYR 231.A O no hydrogen 3.145 N/A ILE 207.A N CYS 229.A O no hydrogen 3.014 N/A TYR 209.A N ASN 227.A O no hydrogen 3.200 N/A TYR 209.A OH THR 188.A O no hydrogen 2.791 N/A GLY 210.A N GLU 225.A O no hydrogen 2.726 N/A GLU 211.A N THR 208.A OG1 no hydrogen 3.017 N/A LEU 212.A N THR 208.A O no hydrogen 2.913 N/A ALA 213.A N TYR 209.A O no hydrogen 2.957 N/A ARG 214.A N GLY 210.A O no hydrogen 3.097 N/A VAL 215.A N GLU 211.A O no hydrogen 2.909 N/A ASP 216.A N LEU 212.A O no hydrogen 2.912 N/A ARG 218.A N ASP 216.A OD1 no hydrogen 2.782 N/A ARG 218.A NH1 ASP 126.A OD2 no hydrogen 2.780 N/A ARG 218.A NH2 ASP 126.A OD2 no hydrogen 3.009 N/A PHE 219.A N ASP 216.A O no hydrogen 2.898 N/A TYR 221.A OH THR 127.A OG1 no hydrogen 2.677 N/A GLY 223.A N GLU 225.A OE1 no hydrogen 3.076 N/A GLY 223.A N GLU 225.A OE2 no hydrogen 3.029 N/A ILE 224.A N TYR 221.A O no hydrogen 3.221 N/A GLU 225.A N GLU 225.A OE1 no hydrogen 2.867 N/A ASN 227.A N ILE 224.A O no hydrogen 3.038 N/A CYS 229.A N ILE 207.A O no hydrogen 2.829 N/A CYS 229.A SG TYR 209.A OH no hydrogen 3.733 N/A LYS 230.A N PHE 187.A O no hydrogen 2.993 N/A LYS 230.A NZ GLU 203.A OE2 no hydrogen 2.729 N/A TYR 231.A N PHE 205.A O no hydrogen 2.818 N/A TYR 231.A OH TYR 146.A OH no hydrogen 2.775 N/A MET 232.A N THR 185.A O no hydrogen 2.936 N/A SER 233.A N GLN 202.A O no hydrogen 2.840 N/A SER 233.A OG TYR 141.A OH no hydrogen 2.721 N/A SER 233.A OG ASP 204.A OD1 no hydrogen 2.402 N/A LEU 234.A N SER 183.A O no hydrogen 2.801 N/A VAL 236.A N LYS 181.A O no hydrogen 2.918 N/A