Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4e6u_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ILE 3.A N ASP 1.A OD2 no hydrogen 3.068 N/A HIS 4.A N ILE 21.A O no hydrogen 2.879 N/A HIS 4.A ND1 THR 6.A OG1 no hydrogen 2.772 N/A THR 6.A N HIS 4.A ND1 no hydrogen 3.161 N/A THR 6.A OG1 HIS 4.A ND1 no hydrogen 2.772 N/A ALA 7.A N HIS 4.A O no hydrogen 3.034 N/A ILE 8.A N CYS 25.A O no hydrogen 2.863 N/A ASP 10.A N ILE 27.A O no hydrogen 2.885 N/A SER 12.A N ASP 10.A OD2 no hydrogen 2.949 N/A SER 12.A OG ASP 10.A OD2 no hydrogen 2.702 N/A ALA 13.A N ASP 10.A O no hydrogen 2.893 N/A VAL 14.A N VAL 31.A O no hydrogen 2.903 N/A ALA 16.A N ILE 33.A O no hydrogen 2.878 N/A GLN 20.A N THR 37.A O no hydrogen 2.968 N/A ILE 21.A N LEU 2.A O no hydrogen 2.901 N/A GLY 22.A N LEU 39.A O no hydrogen 3.006 N/A GLY 22.A N HIS 40.A O no hydrogen 3.287 N/A TYR 24.A N THR 6.A OG1 no hydrogen 2.931 N/A CYS 25.A SG GLY 22.A O no hydrogen 3.444 N/A CYS 25.A SG HIS 40.A O no hydrogen 2.943 N/A ILE 26.A N VAL 43.A O no hydrogen 2.912 N/A ILE 27.A N ILE 8.A O no hydrogen 2.822 N/A GLY 28.A N VAL 45.A O no hydrogen 2.819 N/A GLN 30.A N SER 12.A OG no hydrogen 2.909 N/A THR 32.A N THR 49.A O no hydrogen 2.946 N/A ILE 33.A N VAL 14.A O no hydrogen 2.968 N/A GLY 34.A N ILE 51.A O no hydrogen 2.771 N/A GLY 36.A N SER 17.A O no hydrogen 3.231 N/A THR 37.A N GLY 34.A O no hydrogen 3.244 N/A THR 37.A OG1 GLY 34.A O no hydrogen 3.402 N/A THR 37.A OG1 GLY 52.A O no hydrogen 2.801 N/A LYS 38.A N ASN 55.A O no hydrogen 2.830 N/A LEU 39.A N GLN 20.A O no hydrogen 2.782 N/A HIS 40.A N ILE 57.A O no hydrogen 2.867 N/A HIS 40.A NE2 GLU 56.A OE1 no hydrogen 2.714 N/A SER 41.A OG HIS 42.A ND1 no hydrogen 2.829 N/A HIS 42.A N PRO 23.A O no hydrogen 2.907 N/A HIS 42.A ND1 SER 41.A OG no hydrogen 2.829 N/A VAL 44.A N ALA 61.A O no hydrogen 3.159 N/A VAL 45.A N ILE 26.A O no hydrogen 2.831 N/A GLY 46.A N VAL 63.A O no hydrogen 2.861 N/A GLY 47.A N GLY 64.A O no hydrogen 3.219 N/A PHE 48.A N PRO 29.A O no hydrogen 2.864 N/A THR 49.A N GLN 30.A O no hydrogen 3.282 N/A THR 49.A OG1 GLY 47.A O no hydrogen 2.816 N/A ARG 50.A N LEU 79.A O no hydrogen 2.929 N/A ARG 50.A NE.B GLU 80.A OE2.A no hydrogen 2.451 N/A ILE 51.A N THR 32.A O no hydrogen 2.832 N/A GLY 52.A N ILE 81.A O no hydrogen 2.930 N/A GLN 53.A N ASN 83.A OD1 no hydrogen 2.819 N/A ASN 54.A N ALA 35.A O no hydrogen 2.911 N/A ASN 55.A N THR 37.A OG1 no hydrogen 3.046 N/A ASN 55.A ND2 GLY 82.A O no hydrogen 2.811 N/A GLU 56.A N ASN 85.A O no hydrogen 2.926 N/A ILE 57.A N LYS 38.A O no hydrogen 2.859 N/A PHE 58.A N ILE 87.A O no hydrogen 2.887 N/A PHE 60.A N HIS 42.A O no hydrogen 2.822 N/A ALA 61.A N PHE 58.A O no hydrogen 3.318 N/A SER 62.A N CYS 91.A O no hydrogen 2.863 N/A VAL 63.A N VAL 44.A O no hydrogen 2.802 N/A GLY 64.A N LEU 93.A O no hydrogen 2.764 N/A GLU 65.A N LEU 93.A O no hydrogen 3.290 N/A VAL 66.A N GLU 65.A OE2 no hydrogen 2.831 N/A LYS 71.A N ASP 69.A OD1.A no hydrogen 2.841 N/A TYR 72.A N ASP 69.A O no hydrogen 3.078 N/A TYR 72.A OH GLU 75.A O no hydrogen 2.576 N/A LYS 73.A N GLU 75.A OE1 no hydrogen 2.857 N/A GLU 75.A N GLU 75.A OE1 no hydrogen 2.916 N/A THR 77.A OG1 GLY 96.A O no hydrogen 2.766 N/A TRP 78.A N ALA 102.A O no hydrogen 2.978 N/A LEU 79.A N PHE 48.A O no hydrogen 3.010 N/A GLU 80.A N THR 104.A O no hydrogen 2.822 N/A ILE 81.A N ARG 50.A O no hydrogen 2.834 N/A GLY 82.A N ILE 106.A O no hydrogen 2.973 N/A GLY 82.A N GLY 107.A O no hydrogen 2.993 N/A ASN 83.A N SER 108.A OG no hydrogen 2.913 N/A ASN 84.A N GLN 53.A O no hydrogen 2.865 N/A ASN 85.A N ASN 55.A OD1 no hydrogen 2.886 N/A ASN 85.A ND2 ASN 55.A OD1 no hydrogen 2.985 N/A ASN 85.A ND2 GLY 107.A O no hydrogen 2.850 N/A LEU 86.A N ASN 110.A O no hydrogen 2.868 N/A ILE 87.A N GLU 56.A O no hydrogen 2.850 N/A ARG 88.A N LEU 112.A O no hydrogen 2.908 N/A ARG 88.A NE GLU 89.A OE1 no hydrogen 2.957 N/A ARG 88.A NH2 GLU 89.A OE1 no hydrogen 2.922 N/A GLU 89.A N GLU 89.A OE1 no hydrogen 2.779 N/A CYS 91.A N ARG 88.A O no hydrogen 3.407 N/A CYS 91.A SG ARG 88.A O no hydrogen 3.324 N/A CYS 91.A SG LEU 112.A O no hydrogen 3.736 N/A CYS 91.A SG MET 113.A O no hydrogen 3.299 N/A SER 92.A N THR 116.A O no hydrogen 2.936 N/A SER 92.A OG HIS 117.A ND1 no hydrogen 2.832 N/A LEU 93.A N SER 62.A O no hydrogen 2.869 N/A HIS 94.A N ILE 118.A O no hydrogen 2.963 N/A ARG 95.A N GLU 65.A O no hydrogen 2.857 N/A ARG 95.A NE THR 77.A O no hydrogen 3.268 N/A ARG 95.A NH1 GLY 47.A O no hydrogen 3.306 N/A ARG 95.A NH1 GLY 64.A O no hydrogen 2.798 N/A GLY 96.A N TRP 78.A O no hydrogen 3.218 N/A THR 97.A N ASP 121.A OD1 no hydrogen 2.779 N/A THR 97.A OG1 ASP 121.A OD1 no hydrogen 3.509 N/A THR 97.A OG1 ASP 121.A OD2 no hydrogen 2.633 N/A GLN 99.A N GLN 99.A OE1 no hydrogen 2.803 N/A ASP 100.A N THR 97.A O no hydrogen 3.260 N/A ALA 102.A N THR 97.A O no hydrogen 2.842 N/A THR 104.A N TRP 78.A O no hydrogen 2.996 N/A THR 104.A OG1 HIS 94.A O no hydrogen 2.645 N/A LYS 105.A N CYS 122.A O no hydrogen 2.902 N/A LYS 105.A NZ.A GLU 80.A OE1.A no hydrogen 3.025 N/A ILE 106.A N GLU 80.A O no hydrogen 2.844 N/A GLY 107.A N VAL 124.A O no hydrogen 2.864 N/A GLY 107.A N GLY 125.A O no hydrogen 3.209 N/A SER 108.A N ASP 126.A OD1 no hydrogen 2.841 N/A HIS 109.A N ASN 83.A O no hydrogen 2.914 N/A ASN 110.A N ASN 85.A OD1 no hydrogen 2.873 N/A ASN 110.A ND2 ASN 85.A OD1 no hydrogen 2.998 N/A ASN 110.A ND2 GLY 125.A O no hydrogen 2.919 N/A LEU 111.A N ASN 128.A O no hydrogen 2.900 N/A LEU 112.A N LEU 86.A O no hydrogen 2.806 N/A MET 113.A N PHE 130.A O no hydrogen 2.874 N/A ASN 115.A N GLU 89.A O no hydrogen 2.986 N/A ASN 115.A ND2 HIS 90.A O no hydrogen 3.472 N/A THR 116.A N MET 113.A O no hydrogen 3.142 N/A THR 116.A OG1 MET 113.A O no hydrogen 2.756 N/A HIS 117.A N VAL 134.A O no hydrogen 2.929 N/A HIS 117.A ND1 SER 92.A OG no hydrogen 2.832 N/A ILE 118.A N SER 92.A O no hydrogen 2.856 N/A ALA 119.A N VAL 136.A O no hydrogen 3.015 N/A HIS 120.A ND1 ASP 121.A OD2 no hydrogen 2.768 N/A ASP 121.A N THR 104.A OG1 no hydrogen 2.852 N/A CYS 122.A N ALA 119.A O no hydrogen 3.334 N/A CYS 122.A SG ALA 119.A O no hydrogen 3.375 N/A CYS 122.A SG ALA 137.A O no hydrogen 3.098 N/A ILE 123.A N VAL 140.A O no hydrogen 2.929 N/A VAL 124.A N LYS 105.A O no hydrogen 2.801 N/A GLY 125.A N ILE 142.A O no hydrogen 2.931 N/A GLY 125.A N GLY 143.A O no hydrogen 3.170 N/A ASP 126.A N ASP 144.A OD1 no hydrogen 2.847 N/A HIS 127.A N SER 108.A O no hydrogen 2.959 N/A ASN 128.A N ASN 110.A OD1 no hydrogen 2.892 N/A ASN 128.A ND2 ASN 110.A OD1 no hydrogen 3.021 N/A ASN 128.A ND2 GLY 143.A O no hydrogen 2.934 N/A ILE 129.A N VAL 146.A O no hydrogen 2.897 N/A PHE 130.A N LEU 111.A O no hydrogen 2.869 N/A ALA 131.A N VAL 148.A O no hydrogen 2.942 N/A ASN 133.A N VAL 114.A O no hydrogen 2.917 N/A GLY 135.A N SER 152.A O no hydrogen 2.934 N/A VAL 136.A N HIS 117.A O no hydrogen 2.901 N/A ALA 137.A N ILE 154.A O no hydrogen 2.985 N/A HIS 139.A N HIS 120.A O no hydrogen 2.973 N/A HIS 139.A ND1 ASP 100.A OD2 no hydrogen 2.823 N/A HIS 141.A N CYS 158.A O no hydrogen 3.082 N/A ILE 142.A N ILE 123.A O no hydrogen 2.779 N/A GLY 143.A N ILE 160.A O no hydrogen 2.913 N/A ASP 144.A N SER 162.A OG no hydrogen 2.912 N/A HIS 145.A N ASP 126.A O no hydrogen 2.992 N/A VAL 146.A N ASN 128.A OD1 no hydrogen 2.818 N/A ILE 147.A N SER 164.A O no hydrogen 3.212 N/A VAL 148.A N ILE 129.A O no hydrogen 2.862 N/A GLY 149.A N ILE 166.A O no hydrogen 2.772 N/A ASN 151.A N ASN 132.A O no hydrogen 2.829 N/A SER 152.A OG GLY 149.A O no hydrogen 2.912 N/A SER 152.A OG GLY 167.A O no hydrogen 2.957 N/A GLY 153.A N SER 170.A O no hydrogen 2.929 N/A ILE 154.A N GLY 135.A O no hydrogen 2.873 N/A HIS 155.A N ILE 172.A O no hydrogen 2.862 N/A HIS 155.A ND1 GLN 156.A O no hydrogen 3.149 N/A PHE 157.A N GLY 138.A O no hydrogen 2.944 N/A CYS 158.A N HIS 155.A O no hydrogen 3.243 N/A CYS 158.A SG HIS 155.A O no hydrogen 3.352 N/A CYS 158.A SG ILE 172.A O no hydrogen 4.004 N/A LYS 159.A N ASP 175.A OD1 no hydrogen 2.861 N/A LYS 159.A NZ HIS 141.A ND1 no hydrogen 3.417 N/A ILE 160.A N HIS 141.A O no hydrogen 2.841 N/A ASP 161.A N VAL 176.A O no hydrogen 2.924 N/A TYR 163.A N ASP 144.A O no hydrogen 3.014 N/A SER 164.A N ASP 161.A O no hydrogen 3.338 N/A SER 164.A OG ASP 161.A O no hydrogen 2.695 N/A MET 165.A N VAL 180.A O no hydrogen 2.964 N/A ILE 166.A N ILE 147.A O no hydrogen 2.865 N/A GLY 167.A N ALA 182.A O no hydrogen 2.888 N/A ALA 169.A N GLY 150.A O no hydrogen 2.784 N/A SER 170.A N SER 152.A OG no hydrogen 3.042 N/A SER 170.A OG GLY 167.A O no hydrogen 2.735 N/A LEU 171.A N GLY 184.A O no hydrogen 2.935 N/A ILE 172.A N GLY 153.A O no hydrogen 2.836 N/A ASP 175.A N GLY 255.A O no hydrogen 2.849 N/A VAL 176.A N LYS 159.A O no hydrogen 2.905 N/A ALA 178.A N SER 248.A OG no hydrogen 2.985 N/A TYR 179.A N SER 162.A O no hydrogen 2.928 N/A TYR 179.A OH GLU 241.A O no hydrogen 2.675 N/A VAL 180.A N PRO 177.A O no hydrogen 3.127 N/A MET 181.A N GLY 191.A O no hydrogen 2.822 N/A ALA 182.A N MET 165.A O no hydrogen 2.937 N/A SER 183.A N HIS 188.A O no hydrogen 3.019 N/A GLY 184.A N SER 170.A OG no hydrogen 2.992 N/A HIS 188.A N SER 183.A O no hydrogen 2.905 N/A HIS 188.A ND1 ARG 258.A OXT no hydrogen 2.617 N/A ALA 189.A N ARG 258.A O no hydrogen 3.261 N/A PHE 190.A N MET 181.A O no hydrogen 2.754 N/A ASN 193.A N TYR 179.A O no hydrogen 2.683 N/A ASN 193.A ND2 TYR 163.A O no hydrogen 2.989 N/A ILE 194.A N ILE 192.A O no hydrogen 2.765 N/A GLY 196.A N ASN 193.A OD1 no hydrogen 3.028 N/A MET 197.A N ASN 193.A O no hydrogen 2.947 N/A ARG 198.A N ILE 194.A O no hydrogen 2.784 N/A ARG 199.A N GLU 195.A O no hydrogen 2.814 N/A LYS 200.A N GLY 196.A O no hydrogen 3.141 N/A GLY 201.A N ARG 198.A O no hydrogen 2.910 N/A TRP 202.A N MET 197.A O no hydrogen 3.050 N/A SER 203.A OG THR 206.A OG1 no hydrogen 2.697 N/A THR 206.A N SER 203.A OG no hydrogen 3.399 N/A THR 206.A OG1 SER 203.A OG no hydrogen 2.697 N/A ILE 207.A N SER 203.A O no hydrogen 3.040 N/A GLN 208.A N LYS 204.A O no hydrogen 2.786 N/A GLN 208.A NE2 GLU 212.A OE1.A no hydrogen 3.211 N/A GLY 209.A N ASN 205.A O no hydrogen 3.053 N/A LEU 210.A N THR 206.A O no hydrogen 3.101 N/A ARG 211.A N ILE 207.A O no hydrogen 2.914 N/A GLU 212.A N GLN 208.A O no hydrogen 2.929 N/A ALA 213.A N GLY 209.A O no hydrogen 2.911 N/A TYR 214.A N LEU 210.A O no hydrogen 2.850 N/A LYS 215.A N ARG 211.A O no hydrogen 3.008 N/A LEU 216.A N GLU 212.A O no hydrogen 2.959 N/A ILE 217.A N ALA 213.A O no hydrogen 2.959 N/A PHE 218.A N TYR 214.A O no hydrogen 2.856 N/A LYS 219.A N LYS 215.A O no hydrogen 2.901 N/A SER 220.A OG.A LYS 215.A O no hydrogen 2.976 N/A SER 220.A OG.B LEU 216.A O no hydrogen 2.738 N/A LEU 222.A N SER 220.A OG.B no hydrogen 3.162 N/A THR 223.A N GLN 226.A OE1 no hydrogen 2.927 N/A GLN 226.A N THR 223.A OG1 no hydrogen 3.136 N/A ALA 227.A N THR 223.A O no hydrogen 2.837 N/A ILE 228.A N SER 224.A O no hydrogen 2.937 N/A ASP 229.A N VAL 225.A O no hydrogen 3.026 N/A GLN 230.A N GLN 226.A O no hydrogen 3.190 N/A ILE 231.A N ALA 227.A O no hydrogen 2.907 N/A LYS 232.A N ILE 228.A O no hydrogen 2.841 N/A SER 233.A N ASP 229.A O no hydrogen 3.025 N/A SER 233.A OG GLU 234.A OE2 no hydrogen 2.740 N/A GLU 234.A N GLN 230.A O no hydrogen 3.051 N/A ILE 235.A N ILE 231.A O no hydrogen 2.951 N/A LEU 236.A N ILE 231.A O no hydrogen 2.809 N/A SER 238.A N ILE 235.A O no hydrogen 3.234 N/A VAL 239.A N ILE 235.A O no hydrogen 2.912 N/A VAL 239.A N LEU 236.A O no hydrogen 3.241 N/A GLU 241.A N GLU 241.A OE1 no hydrogen 2.739 N/A ALA 242.A N VAL 239.A O no hydrogen 2.929 N/A GLN 243.A N PRO 240.A O no hydrogen 3.054 N/A GLN 243.A NE2 ASP 247.A OD1 no hydrogen 2.903 N/A LEU 244.A N GLU 241.A O no hydrogen 3.410 N/A ILE 246.A N ALA 242.A O no hydrogen 3.146 N/A ASP 247.A N GLN 243.A O no hydrogen 2.856 N/A SER 248.A N LEU 244.A O no hydrogen 3.034 N/A SER 248.A OG ASP 161.A OD2 no hydrogen 2.648 N/A SER 248.A OG LEU 244.A O no hydrogen 3.091 N/A LEU 249.A N LEU 245.A O no hydrogen 3.177 N/A GLU 250.A N ILE 246.A O no hydrogen 2.903 N/A GLN 251.A N ASP 247.A O no hydrogen 2.881 N/A SER 252.A OG ASP 175.A OD2 no hydrogen 2.829 N/A ARG 254.A NE LEU 173.A O no hydrogen 2.813 N/A ARG 254.A NH2 LEU 173.A O no hydrogen 2.874 N/A VAL 257.A N ASP 175.A O no hydrogen 2.873 N/A ARG 258.A NH1 ILE 217.A O no hydrogen 2.992 N/A