Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4f0c_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LYS 4.A NZ PHE 31.A O no hydrogen 3.316 N/A GLN 5.A N SER 30.A OG no hydrogen 2.929 N/A GLN 5.A NE2 ASP 62.A OD1 no hydrogen 3.177 N/A PHE 6.A N SER 30.A O no hydrogen 3.147 N/A THR 7.A N ILE 61.A O no hydrogen 2.982 N/A THR 7.A OG1 GLU 32.A OE1 no hydrogen 2.641 N/A THR 7.A OG1 HIS 63.A NE2 no hydrogen 2.573 N/A LEU 8.A N GLU 32.A O no hydrogen 2.897 N/A PHE 9.A N ALA 59.A O no hydrogen 2.875 N/A ASN 10.A N VAL 34.A O no hydrogen 2.873 N/A HIS 11.A N ASN 10.A OD1 no hydrogen 2.808 N/A GLN 12.A N GLN 12.A OE1 no hydrogen 2.846 N/A VAL 13.A N HIS 11.A ND1 no hydrogen 3.230 N/A GLY 14.A N HIS 11.A ND1 no hydrogen 3.124 N/A TRP 18.A N PRO 15.A O no hydrogen 3.017 N/A TRP 18.A NE1 HIS 11.A O no hydrogen 2.869 N/A LYS 19.A N ASN 16.A O no hydrogen 3.360 N/A LYS 19.A NZ ASN 16.A OD1 no hydrogen 3.524 N/A LYS 19.A NZ SER 73.A OG no hydrogen 2.728 N/A LYS 19.A NZ ASP 74.A OD1 no hydrogen 2.981 N/A LYS 19.A NZ GLN 108.A OE1 no hydrogen 2.757 N/A VAL 20.A N GLY 17.A O no hydrogen 3.082 N/A ASP 21.A N GLY 17.A O no hydrogen 3.100 N/A MET 22.A N TRP 18.A O no hydrogen 2.902 N/A LEU 23.A N LYS 19.A O no hydrogen 3.173 N/A LEU 24.A N VAL 20.A O no hydrogen 2.932 N/A ARG 25.A N ASP 21.A O no hydrogen 3.013 N/A ARG 25.A NE ASP 21.A OD1 no hydrogen 2.677 N/A ARG 25.A NH1 GLU 214.A OE2 no hydrogen 2.877 N/A ARG 25.A NH2 ASP 21.A OD2 no hydrogen 3.033 N/A GLU 26.A N MET 22.A O no hydrogen 2.925 N/A LEU 27.A N LEU 23.A O no hydrogen 3.007 N/A GLY 28.A N ARG 25.A O no hydrogen 3.129 N/A LEU 29.A N LEU 24.A O no hydrogen 3.011 N/A GLU 32.A N PHE 6.A O no hydrogen 2.873 N/A VAL 34.A N LEU 8.A O no hydrogen 2.956 N/A VAL 36.A N ASN 10.A O no hydrogen 3.100 N/A ASN 37.A N GLU 42.A OE1 no hydrogen 2.841 N/A GLN 40.A N ASN 37.A OD1 no hydrogen 3.184 N/A ARG 41.A N LEU 38.A O no hydrogen 3.042 N/A GLU 42.A N ASN 37.A O no hydrogen 3.104 N/A HIS 43.A N HIS 43.A ND1 no hydrogen 2.841 N/A LYS 44.A N.A ARG 41.A O no hydrogen 3.063 N/A LYS 44.A N.B ARG 41.A O no hydrogen 3.060 N/A LYS 44.A NZ.B ASN 54.A O no hydrogen 3.196 N/A LYS 44.A NZ.B GLY 55.A O no hydrogen 2.862 N/A SER 45.A N GLU 42.A O no hydrogen 3.172 N/A SER 45.A OG GLU 42.A O no hydrogen 2.615 N/A SER 45.A OG SER 47.A OG no hydrogen 2.777 N/A SER 47.A OG SER 45.A OG no hydrogen 2.777 N/A PHE 48.A N SER 45.A O no hydrogen 2.860 N/A THR 49.A N SER 45.A O no hydrogen 2.851 N/A THR 49.A OG1 SER 45.A O no hydrogen 3.328 N/A LYS 50.A N PRO 46.A O no hydrogen 3.085 N/A TYR 51.A N PHE 48.A O no hydrogen 2.787 N/A ASN 52.A N PHE 48.A O no hydrogen 2.999 N/A ASN 52.A ND2 ARG 56.A O no hydrogen 2.841 N/A ASN 54.A N ASN 52.A OD1 no hydrogen 2.827 N/A GLY 55.A N ASN 52.A O no hydrogen 2.786 N/A LEU 60.A N VAL 70.A O no hydrogen 2.863 N/A ILE 61.A N THR 7.A O no hydrogen 2.882 N/A ASP 62.A N PHE 68.A O no hydrogen 2.794 N/A HIS 63.A N GLN 5.A O no hydrogen 2.720 N/A HIS 63.A ND1 ASP 67.A OD1 no hydrogen 2.749 N/A HIS 63.A NE2 THR 7.A OG1 no hydrogen 2.573 N/A TYR 64.A N ASP 62.A OD1 no hydrogen 3.090 N/A TYR 64.A OH GLY 3.A O no hydrogen 2.731 N/A TYR 65.A N ASP 62.A O no hydrogen 3.098 N/A PHE 68.A N TYR 65.A O no hydrogen 3.145 N/A VAL 70.A N LEU 60.A O no hydrogen 3.065 N/A ILE 76.A N GLU 72.A O no hydrogen 2.936 N/A LEU 77.A N SER 73.A O no hydrogen 3.050 N/A LEU 78.A N ASP 74.A O no hydrogen 3.157 N/A TYR 79.A N ALA 75.A O no hydrogen 2.874 N/A TYR 79.A OH ASP 62.A OD2 no hydrogen 2.543 N/A ILE 80.A N ILE 76.A O no hydrogen 2.917 N/A VAL 81.A N LEU 77.A O no hydrogen 3.084 N/A GLU 82.A N.A LEU 78.A O no hydrogen 2.894 N/A GLU 82.A N.B LEU 78.A O no hydrogen 2.874 N/A LYS 83.A N TYR 79.A O no hydrogen 3.101 N/A TYR 84.A N ILE 80.A O no hydrogen 2.784 N/A TYR 84.A OH ASP 62.A OD2 no hydrogen 2.573 N/A ASP 85.A N VAL 81.A O no hydrogen 3.251 N/A HIS 88.A N ASP 85.A O no hydrogen 2.940 N/A LYS 89.A N ASP 85.A OD1 no hydrogen 2.772 N/A PHE 90.A N ASP 85.A OD2 no hydrogen 2.832 N/A SER 91.A OG ASP 85.A OD2 no hydrogen 2.653 N/A ASP 97.A N THR 94.A OG1 no hydrogen 3.164 N/A LYS 98.A N THR 94.A O no hydrogen 2.873 N/A ILE 99.A N PHE 95.A O no hydrogen 2.934 N/A ILE 100.A N ASP 96.A O no hydrogen 3.418 N/A MET 101.A N ASP 97.A O no hydrogen 2.824 N/A THR 102.A N LYS 98.A O no hydrogen 2.929 N/A THR 102.A OG1 LYS 98.A O no hydrogen 3.092 N/A GLN 103.A N ILE 99.A O no hydrogen 2.838 N/A TRP 104.A N ILE 100.A O no hydrogen 3.034 N/A LEU 105.A N MET 101.A O no hydrogen 2.998 N/A PHE 106.A N THR 102.A O no hydrogen 2.852 N/A PHE 107.A N GLN 103.A O no hydrogen 2.912 N/A GLN 108.A N TRP 104.A O no hydrogen 2.901 N/A GLN 108.A NE2 GLN 112.A OE1 no hydrogen 2.788 N/A ALA 109.A N LEU 105.A O no hydrogen 2.796 N/A SER 110.A N PHE 106.A O no hydrogen 2.940 N/A SER 110.A OG PHE 106.A O no hydrogen 2.706 N/A GLY 111.A N PHE 107.A O no hydrogen 2.792 N/A GLN 112.A N PHE 107.A O no hydrogen 3.286 N/A GLN 112.A N GLN 108.A O no hydrogen 3.028 N/A GLN 112.A NE2 PHE 172.A O no hydrogen 2.977 N/A GLN 112.A NE2 ASN 176.A OD1 no hydrogen 2.847 N/A GLY 113.A N GLN 108.A O no hydrogen 3.115 N/A PHE 116.A N GLN 112.A O no hydrogen 2.859 N/A GLY 117.A N GLY 113.A O no hydrogen 2.787 N/A GLN 118.A N PRO 114.A O no hydrogen 3.103 N/A GLN 118.A N TYR 115.A O no hydrogen 3.112 N/A GLN 118.A NE2 PRO 114.A O no hydrogen 2.918 N/A ALA 119.A N TYR 115.A O no hydrogen 3.200 N/A GLY 120.A N PHE 116.A O no hydrogen 2.923 N/A TRP 121.A N GLY 117.A O no hydrogen 2.833 N/A PHE 122.A N GLN 118.A O no hydrogen 2.977 N/A LEU 123.A N ALA 119.A O no hydrogen 2.909 N/A ALA 124.A N GLY 120.A O no hydrogen 2.875 N/A VAL 125.A N GLY 120.A O no hydrogen 2.930 N/A ALA 126.A N TRP 121.A O no hydrogen 3.070 N/A GLU 130.A N PRO 127.A O no hydrogen 2.732 N/A ARG 131.A NE ALA 126.A O no hydrogen 2.736 N/A ARG 131.A NH2 ALA 126.A O no hydrogen 3.145 N/A ASN 132.A N PHE 122.A O no hydrogen 2.679 N/A ILE 135.A N ASN 132.A OD1 no hydrogen 3.194 N/A ALA 136.A N ASN 132.A O no hydrogen 2.930 N/A GLU 137.A N PRO 133.A O no hydrogen 2.947 N/A GLU 137.A N THR 134.A O no hydrogen 3.285 N/A ARG 138.A N ILE 135.A O no hydrogen 3.181 N/A ARG 138.A NE TYR 139.A OH no hydrogen 3.252 N/A GLN 140.A N ALA 136.A O no hydrogen 2.858 N/A GLN 140.A NE2 LEU 183.A O no hydrogen 2.904 N/A LYS 141.A N GLU 137.A O no hydrogen 2.913 N/A GLU 142.A N ARG 138.A O no hydrogen 3.213 N/A ILE 143.A N TYR 139.A O no hydrogen 2.892 N/A LEU 144.A N GLN 140.A O no hydrogen 3.110 N/A ARG 145.A N LYS 141.A O no hydrogen 2.924 N/A ARG 145.A NE GLU 142.A OE1 no hydrogen 3.161 N/A ARG 145.A NE GLU 142.A OE2 no hydrogen 3.068 N/A ARG 145.A NH2 GLU 142.A OE2 no hydrogen 2.962 N/A VAL 146.A N GLU 142.A O no hydrogen 2.916 N/A PHE 147.A N ILE 143.A O no hydrogen 2.902 N/A GLY 148.A N LEU 144.A O no hydrogen 2.850 N/A VAL 149.A N ARG 145.A O no hydrogen 2.912 N/A LEU 150.A N VAL 146.A O no hydrogen 2.944 N/A GLU 151.A N PHE 147.A O no hydrogen 2.792 N/A SER 152.A N GLY 148.A O no hydrogen 2.919 N/A SER 152.A OG VAL 149.A O no hydrogen 2.633 N/A VAL 153.A N VAL 149.A O no hydrogen 3.369 N/A VAL 153.A N LEU 150.A O no hydrogen 3.243 N/A LEU 154.A N LEU 150.A O no hydrogen 2.848 N/A SER 155.A N GLU 151.A O no hydrogen 3.121 N/A SER 155.A OG GLU 151.A O no hydrogen 3.233 N/A SER 155.A OG SER 152.A O no hydrogen 3.568 N/A GLN 156.A N VAL 153.A O no hydrogen 2.982 N/A ARG 157.A NH1 LEU 160.A O no hydrogen 2.937 N/A LEU 160.A N ASP 169.A OD1 no hydrogen 2.876 N/A LYS 164.A N VAL 161.A O no hydrogen 3.290 N/A LYS 164.A NZ HIS 88.A O no hydrogen 2.842 N/A LYS 164.A NZ SER 91.A O no hydrogen 3.020 N/A THR 166.A N ASP 169.A OD2 no hydrogen 2.984 N/A THR 166.A OG1 ASP 169.A OD2 no hydrogen 3.562 N/A ILE 167.A N PHE 90.A O no hydrogen 2.938 N/A ALA 168.A N THR 166.A OG1 no hydrogen 3.089 N/A ILE 170.A N THR 166.A O no hydrogen 3.158 N/A SER 171.A N ILE 167.A O no hydrogen 2.879 N/A SER 171.A OG ALA 168.A O no hydrogen 2.811 N/A PHE 172.A N ASP 169.A O no hydrogen 3.155 N/A VAL 173.A N ILE 170.A O no hydrogen 3.058 N/A TRP 175.A NE1 ASN 16.A OD1 no hydrogen 2.931 N/A ASN 176.A N PHE 172.A O no hydrogen 3.140 N/A ALA 177.A N VAL 173.A O no hydrogen 2.929 N/A THR 178.A N ILE 174.A O no hydrogen 3.020 N/A THR 178.A OG1 ILE 174.A O no hydrogen 2.804 N/A ALA 179.A N TRP 175.A O no hydrogen 2.842 N/A VAL 180.A N ASN 176.A O no hydrogen 2.908 N/A ASN 181.A N ALA 177.A O no hydrogen 3.014 N/A ASN 181.A ND2 ALA 177.A O no hydrogen 3.018 N/A LEU 183.A N THR 178.A O no hydrogen 3.195 N/A VAL 184.A N ALA 179.A O no hydrogen 2.935 N/A TYR 187.A N VAL 184.A O no hydrogen 3.010 N/A TYR 187.A OH GLU 137.A OE2 no hydrogen 2.768 N/A PHE 190.A N TYR 187.A O no hydrogen 2.976 N/A ASP 191.A N ASP 195.A OD2 no hydrogen 2.910 N/A LYS 194.A N ASP 191.A OD1 no hydrogen 3.156 N/A ASP 195.A N ASP 191.A O no hydrogen 2.823 N/A PHE 196.A N PHE 192.A O no hydrogen 2.835 N/A SER 198.A N GLU 151.A OE2 no hydrogen 3.094 N/A SER 198.A OG GLU 151.A OE2 no hydrogen 2.836 N/A VAL 199.A N GLU 151.A OE1 no hydrogen 3.054 N/A HIS 200.A N PHE 196.A O no hydrogen 2.813 N/A ARG 201.A N PRO 197.A O no hydrogen 2.912 N/A ARG 201.A NH1 LEU 154.A O no hydrogen 2.840 N/A ARG 201.A NH2 LEU 154.A O no hydrogen 2.988 N/A ARG 201.A NH2 GLN 158.A O no hydrogen 3.480 N/A TRP 202.A N SER 198.A O no hydrogen 3.044 N/A TRP 202.A NE1 ASP 169.A OD1 no hydrogen 2.822 N/A HIS 203.A N VAL 199.A O no hydrogen 2.830 N/A THR 204.A N HIS 200.A O no hydrogen 2.845 N/A THR 204.A OG1 HIS 200.A O no hydrogen 2.738 N/A ALA 205.A N ARG 201.A O no hydrogen 2.980 N/A LEU 206.A N TRP 202.A O no hydrogen 3.006 N/A ILE 207.A N HIS 203.A O no hydrogen 2.971 N/A THR 208.A N THR 204.A O no hydrogen 3.160 N/A THR 208.A OG1 THR 204.A O no hydrogen 2.887 N/A THR 208.A OG1 ALA 205.A O no hydrogen 3.254 N/A ARG 209.A N LEU 206.A O no hydrogen 3.176 N/A ARG 209.A NE GLU 26.A OE2 no hydrogen 2.642 N/A ARG 209.A NH2 GLU 26.A OE1 no hydrogen 3.014 N/A ARG 209.A NH2 GLU 26.A OE2 no hydrogen 3.570 N/A ALA 213.A N ARG 209.A O no hydrogen 2.813 N/A GLU 214.A N PRO 210.A O no hydrogen 2.841 N/A SER 215.A N ALA 211.A O no hydrogen 2.929 N/A SER 215.A OG ASP 21.A OD1 no hydrogen 2.745 N/A LEU 216.A N ILE 212.A O no hydrogen 2.920 N/A LYS 217.A N ALA 213.A O no hydrogen 3.001 N/A THR 218.A N GLU 214.A O no hydrogen 2.899 N/A THR 218.A OG1 GLU 214.A O no hydrogen 2.811 N/A LYS 219.A N SER 215.A O no hydrogen 2.968 N/A LYS 219.A NZ GLN 12.A O no hydrogen 3.251 N/A LYS 219.A NZ VAL 13.A O no hydrogen 3.213 N/A ALA 220.A N LEU 216.A O no hydrogen 3.095 N/A GLU 221.A N LYS 217.A O no hydrogen 3.046 N/A ALA 222.A N THR 218.A O no hydrogen 2.876 N/A ILE 223.A N LYS 219.A O no hydrogen 2.975 N/A ALA 224.A N ALA 220.A O no hydrogen 3.031 N/A GLN 225.A N GLU 221.A O no hydrogen 2.900 N/A MET 226.A N ILE 223.A O no hydrogen 2.936 N/A ASN 227.A N ALA 224.A O no hydrogen 3.414 N/A ARG 228.A N GLN 225.A O no hydrogen 3.072 N/A