Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4e5o_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): HIS 2.A NE2 ARG 248.A O no hydrogen 2.704 N/A GLU 4.A N HIS 2.A ND1 no hydrogen 2.941 N/A LEU 5.A N HIS 2.A O no hydrogen 2.995 N/A GLN 6.A N GLY 3.A O no hydrogen 2.911 N/A GLN 6.A NE2 GLY 3.A O no hydrogen 3.339 N/A GLN 6.A NE2 ARG 38.A O no hydrogen 2.391 N/A TYR 7.A OH MET 193.A O no hydrogen 2.720 N/A LEU 8.A N GLU 4.A O no hydrogen 3.008 N/A ARG 9.A N LEU 5.A O no hydrogen 2.856 N/A GLN 10.A N GLN 6.A O no hydrogen 3.033 N/A VAL 11.A N TYR 7.A O no hydrogen 2.961 N/A GLU 12.A N LEU 8.A O no hydrogen 2.893 N/A HIS 13.A N ARG 9.A O no hydrogen 2.888 N/A ILE 14.A N GLN 10.A O no hydrogen 2.958 N/A LEU 15.A N VAL 11.A O no hydrogen 2.937 N/A ARG 16.A N GLU 12.A O no hydrogen 2.899 N/A CYS 17.A N HIS 13.A O no hydrogen 2.800 N/A GLY 18.A N ILE 14.A O no hydrogen 2.962 N/A PHE 19.A N SER 31.A O no hydrogen 3.068 N/A LYS 20.A NZ GLU 22.A OE2 no hydrogen 2.642 N/A LYS 21.A N THR 29.A O no hydrogen 2.920 N/A LYS 21.A NZ ASP 228.A OD2 no hydrogen 2.780 N/A THR 25.A N ASP 23.A OD2 no hydrogen 2.962 N/A THR 25.A OG1 ASP 23.A OD1 no hydrogen 3.096 N/A THR 25.A OG1 ASP 23.A OD2 no hydrogen 2.628 N/A THR 25.A OG1 THR 27.A OG1 no hydrogen 2.827 N/A GLY 26.A N ASP 23.A O no hydrogen 2.924 N/A THR 27.A N THR 25.A OG1 no hydrogen 3.013 N/A THR 27.A OG1 THR 25.A OG1 no hydrogen 2.827 N/A GLY 28.A N ASP 23.A OD1 no hydrogen 2.830 N/A THR 29.A N LYS 21.A O no hydrogen 2.953 N/A THR 29.A OG1 LYS 21.A O no hydrogen 2.986 N/A LEU 30.A N ILE 231.A O no hydrogen 2.896 N/A SER 31.A N PHE 19.A O no hydrogen 2.803 N/A SER 31.A OG ASP 228.A OD1 no hydrogen 2.691 N/A VAL 32.A N ALA 229.A O no hydrogen 2.937 N/A GLY 34.A N GLY 227.A O no hydrogen 2.896 N/A MET 35.A N LEU 226.A O no hydrogen 3.119 N/A ALA 37.A N HIS 224.A O no hydrogen 2.954 N/A ARG 38.A N GLN 6.A OE1 no hydrogen 2.828 N/A ARG 38.A NH1 ASP 221.A OD2 no hydrogen 3.033 N/A TYR 39.A N PHE 222.A O no hydrogen 2.855 N/A LEU 41.A N GLY 220.A O no hydrogen 2.747 N/A ARG 42.A N SER 40.A OG no hydrogen 3.165 N/A ARG 42.A NE GLU 181.A OE1 no hydrogen 3.120 N/A ARG 42.A NE GLU 181.A OE2 no hydrogen 2.967 N/A ARG 42.A NH1 SER 40.A OG no hydrogen 3.106 N/A ARG 42.A NH1 ASP 221.A OD1 no hydrogen 2.856 N/A ARG 42.A NH2 GLU 181.A OE1 no hydrogen 2.974 N/A ARG 42.A NH2 ASP 221.A OD2 no hydrogen 3.336 N/A PHE 45.A N PRO 251.A O no hydrogen 2.801 N/A LEU 47.A N PHE 45.A O no hydrogen 2.764 N/A THR 49.A N GLU 4.A OE1 no hydrogen 2.876 N/A THR 49.A N GLU 4.A OE2 no hydrogen 3.195 N/A THR 49.A OG1 GLU 4.A OE1 no hydrogen 2.744 N/A THR 49.A OG1 ARG 248.A O no hydrogen 3.413 N/A THR 50.A N GLU 4.A OE2 no hydrogen 2.841 N/A THR 50.A OG1 GLU 4.A OE2 no hydrogen 2.664 N/A THR 50.A OG1 GLN 242.A OE1 no hydrogen 2.882 N/A VAL 53.A N TYR 275.A OH no hydrogen 2.960 N/A TRP 55.A N VAL 53.A O no hydrogen 2.892 N/A VAL 58.A N PHE 54.A O no hydrogen 3.027 N/A LEU 59.A N TRP 55.A O no hydrogen 2.910 N/A GLU 60.A N LYS 56.A O no hydrogen 2.914 N/A GLU 61.A N GLY 57.A O no hydrogen 2.879 N/A LEU 62.A N VAL 58.A O no hydrogen 3.079 N/A LEU 63.A N LEU 59.A O no hydrogen 3.025 N/A TRP 64.A N GLU 60.A O no hydrogen 3.010 N/A TRP 64.A NE1 ASN 71.A O no hydrogen 2.993 N/A PHE 65.A N GLU 61.A O no hydrogen 2.971 N/A ILE 66.A N LEU 62.A O no hydrogen 3.012 N/A LYS 67.A N LEU 63.A O no hydrogen 3.136 N/A LYS 67.A NZ GLU 74.A OE2.A no hydrogen 2.716 N/A GLY 68.A N PHE 65.A O no hydrogen 2.902 N/A SER 69.A N TRP 64.A O no hydrogen 3.178 N/A SER 69.A OG GLU 74.A OE2.B no hydrogen 2.585 N/A THR 70.A OG1 TYR 120.A OH no hydrogen 2.953 N/A ASN 71.A N SER 69.A OG no hydrogen 3.084 N/A ALA 72.A N GLY 103.A O no hydrogen 2.717 N/A LYS 73.A N ASN 71.A OD1 no hydrogen 2.879 N/A GLU 74.A N.A ASN 71.A O no hydrogen 2.922 N/A GLU 74.A N.B ASN 71.A O no hydrogen 2.938 N/A LEU 75.A N ALA 72.A O no hydrogen 3.028 N/A SER 76.A N ALA 72.A O no hydrogen 2.798 N/A SER 76.A OG ASP 84.A OD1 no hydrogen 3.357 N/A SER 76.A OG ASP 84.A OD2 no hydrogen 2.601 N/A SER 77.A N LYS 73.A O no hydrogen 2.933 N/A SER 77.A OG LYS 73.A O no hydrogen 3.445 N/A SER 77.A OG GLU 74.A O.A no hydrogen 3.434 N/A SER 77.A OG GLU 74.A O.B no hydrogen 3.054 N/A LYS 78.A N LEU 75.A O no hydrogen 2.882 N/A GLY 79.A N SER 76.A O no hydrogen 2.958 N/A TRP 83.A NE1 GLU 61.A OE2 no hydrogen 2.873 N/A ASP 84.A N ARG 81.A O no hydrogen 2.972 N/A GLY 87.A N ASP 84.A O no hydrogen 3.009 N/A SER 88.A N ALA 85.A O no hydrogen 3.381 N/A SER 88.A OG ALA 85.A O no hydrogen 3.097 N/A ARG 89.A N GLU 102.A OE2 no hydrogen 3.021 N/A ARG 89.A NH1 ASP 93.A OD1 no hydrogen 3.048 N/A ARG 89.A NH1 ARG 100.A O no hydrogen 3.111 N/A ARG 89.A NH2 ARG 100.A O no hydrogen 2.576 N/A PHE 91.A N SER 88.A OG no hydrogen 3.119 N/A LEU 92.A N SER 88.A O no hydrogen 2.785 N/A ASP 93.A N ARG 89.A O no hydrogen 2.890 N/A SER 94.A N ASP 90.A O no hydrogen 3.010 N/A SER 94.A OG PHE 91.A O no hydrogen 2.662 N/A LEU 95.A N LEU 92.A O no hydrogen 3.221 N/A GLY 96.A N ASP 93.A O no hydrogen 2.939 N/A PHE 97.A N LEU 92.A O no hydrogen 2.869 N/A ARG 100.A N PHE 97.A O no hydrogen 3.075 N/A ARG 100.A NH1 ASP 104.A O no hydrogen 3.508 N/A ARG 100.A NH1 LEU 163.A O no hydrogen 3.055 N/A ARG 100.A NH2 LEU 163.A O no hydrogen 2.891 N/A GLY 103.A N GLY 87.A O no hydrogen 2.660 N/A ASP 104.A N GLN 101.A O no hydrogen 3.108 N/A LEU 105.A N THR 70.A O no hydrogen 3.007 N/A GLY 106.A N ASP 104.A OD1 no hydrogen 3.002 N/A VAL 108.A N GLY 106.A O no hydrogen 2.869 N/A GLN 112.A N VAL 108.A O no hydrogen 3.006 N/A GLN 112.A NE2 PRO 107.A O no hydrogen 2.868 N/A GLN 112.A NE2 ASP 160.A OD2 no hydrogen 2.790 N/A TRP 113.A N TYR 109.A O no hydrogen 2.809 N/A ARG 114.A N GLY 110.A O no hydrogen 3.141 N/A ARG 114.A N PHE 111.A O no hydrogen 3.261 N/A ARG 114.A NE ASP 133.A OD1 no hydrogen 2.757 N/A ARG 114.A NH1 ILE 66.A O no hydrogen 2.712 N/A ARG 114.A NH1 ASP 263.A OD1 no hydrogen 2.915 N/A ARG 114.A NH2 ASP 133.A OD1 no hydrogen 3.412 N/A ARG 114.A NH2 ASP 133.A OD2 no hydrogen 2.898 N/A HIS 115.A N PHE 111.A O no hydrogen 2.619 N/A HIS 115.A ND1 GLN 130.A O no hydrogen 2.753 N/A PHE 116.A N VAL 132.A O no hydrogen 2.991 N/A ALA 118.A N HIS 115.A O no hydrogen 3.068 N/A TYR 120.A OH THR 70.A OG1 no hydrogen 2.953 N/A TYR 120.A OH ASP 104.A OD1 no hydrogen 2.461 N/A LYS 121.A N.A TYR 127.A OH no hydrogen 2.704 N/A LYS 121.A N.B TYR 127.A OH no hydrogen 2.721 N/A LYS 121.A NZ.A ASP 126.A O no hydrogen 3.550 N/A LYS 121.A NZ.B TYR 120.A O no hydrogen 3.122 N/A ASP 122.A N SER 125.A OG no hydrogen 3.228 N/A MET 123.A N ASP 104.A OD2 no hydrogen 2.936 N/A ASP 124.A N ASP 122.A OD1 no hydrogen 2.947 N/A SER 125.A N ASP 122.A O no hydrogen 3.275 N/A SER 125.A OG ASP 122.A O no hydrogen 3.332 N/A SER 125.A OG ASP 122.A OD1 no hydrogen 3.200 N/A TYR 127.A OH ASP 122.A O no hydrogen 2.688 N/A SER 128.A N ASP 126.A OD1 no hydrogen 2.829 N/A SER 128.A OG ASP 126.A OD1 no hydrogen 2.664 N/A GLN 130.A N TYR 127.A O no hydrogen 2.743 N/A VAL 132.A N PHE 116.A O no hydrogen 2.782 N/A GLN 134.A NE2 GLN 112.A O no hydrogen 2.879 N/A GLN 134.A NE2 CYS 154.A O no hydrogen 2.799 N/A LEU 135.A N TRP 113.A O no hydrogen 3.272 N/A GLN 136.A N ASP 133.A OD1 no hydrogen 3.084 N/A GLN 136.A NE2 ASP 140.A OD1 no hydrogen 2.818 N/A LYS 137.A N ASP 133.A O no hydrogen 2.923 N/A VAL 138.A N GLN 134.A O no hydrogen 2.826 N/A ILE 139.A N LEU 135.A O no hydrogen 3.125 N/A ASP 140.A N GLN 136.A O no hydrogen 2.944 N/A THR 141.A N LYS 137.A O no hydrogen 2.935 N/A THR 141.A OG1 LYS 137.A O no hydrogen 2.917 N/A ILE 142.A N VAL 138.A O no hydrogen 2.946 N/A LYS 143.A N ILE 139.A O no hydrogen 3.158 N/A THR 144.A N ASP 140.A O no hydrogen 3.028 N/A THR 144.A N THR 141.A O no hydrogen 3.225 N/A THR 144.A OG1 ASP 140.A O no hydrogen 3.215 N/A ASN 145.A N THR 141.A O no hydrogen 2.737 N/A ASP 148.A N ASN 145.A O no hydrogen 2.897 N/A ARG 150.A N ASP 148.A OD2 no hydrogen 2.744 N/A MET 153.A N CYS 173.A O no hydrogen 2.903 N/A CYS 154.A N GLN 134.A OE1 no hydrogen 2.819 N/A CYS 154.A SG TRP 156.A O no hydrogen 3.486 N/A CYS 154.A SG ALA 171.A O no hydrogen 3.721 N/A ALA 155.A N ALA 171.A O no hydrogen 2.885 N/A TRP 156.A N ALA 171.A O no hydrogen 3.087 N/A ASN 157.A ND2 GLN 112.A OE1 no hydrogen 2.883 N/A ASP 160.A N ASN 157.A O no hydrogen 3.059 N/A ASP 160.A N ASN 157.A OD1 no hydrogen 3.389 N/A LEU 161.A N PRO 158.A O no hydrogen 3.416 N/A LEU 163.A N ASP 160.A O no hydrogen 2.897 N/A MET 164.A N LEU 161.A O no hydrogen 2.930 N/A ALA 165.A N LEU 105.A O no hydrogen 2.811 N/A CYS 169.A SG SER 190.A O no hydrogen 3.768 N/A HIS 170.A N TYR 109.A OH no hydrogen 2.991 N/A ALA 171.A N TYR 187.A O no hydrogen 3.039 N/A CYS 173.A N MET 153.A O no hydrogen 2.870 N/A CYS 173.A SG MET 153.A O no hydrogen 3.953 N/A GLN 174.A N GLN 185.A O no hydrogen 2.893 N/A PHE 175.A N ILE 151.A O no hydrogen 2.794 N/A TYR 176.A N SER 183.A O no hydrogen 2.940 N/A VAL 178.A N GLU 181.A O no hydrogen 3.151 N/A GLU 181.A N VAL 178.A O no hydrogen 2.934 N/A LEU 182.A N GLN 218.A O no hydrogen 2.738 N/A SER 183.A N TYR 176.A O no hydrogen 2.714 N/A CYS 184.A N ASP 221.A O no hydrogen 2.982 N/A CYS 184.A SG GLN 174.A O no hydrogen 4.008 N/A GLN 185.A N GLN 174.A O no hydrogen 2.746 N/A GLN 185.A NE2 GLN 36.A OE1 no hydrogen 3.185 N/A GLN 185.A NE2 THR 225.A OG1 no hydrogen 2.676 N/A LEU 186.A N VAL 223.A O no hydrogen 2.926 N/A TYR 187.A N LEU 172.A O no hydrogen 2.867 N/A GLN 188.A N THR 225.A O no hydrogen 2.840 N/A GLN 188.A NE2 SER 190.A O no hydrogen 2.986 N/A GLN 188.A NE2 ASN 200.A OD1 no hydrogen 2.945 N/A ARG 189.A N CYS 169.A O no hydrogen 2.817 N/A ARG 189.A NE PRO 168.A O no hydrogen 2.836 N/A ARG 189.A NH2 PRO 167.A O no hydrogen 3.270 N/A GLY 191.A N ASP 228.A O no hydrogen 2.909 N/A MET 193.A N HIS 230.A O no hydrogen 2.840 N/A LEU 195.A N ASP 192.A OD1 no hydrogen 3.070 N/A GLY 196.A N ASP 192.A O no hydrogen 2.936 N/A VAL 197.A N ASP 192.A O no hydrogen 2.890 N/A ASN 200.A N GLY 196.A O no hydrogen 2.924 N/A ILE 201.A N VAL 197.A O no hydrogen 2.897 N/A ALA 202.A N PRO 198.A O no hydrogen 3.278 N/A SER 203.A N PHE 199.A O no hydrogen 2.938 N/A SER 203.A OG PHE 199.A O no hydrogen 3.249 N/A TYR 204.A N ASN 200.A O no hydrogen 3.098 N/A ALA 205.A N ILE 201.A O no hydrogen 2.923 N/A LEU 206.A N ALA 202.A O no hydrogen 2.847 N/A LEU 207.A N SER 203.A O no hydrogen 3.007 N/A THR 208.A N TYR 204.A O no hydrogen 3.011 N/A THR 208.A OG1 TYR 204.A O no hydrogen 2.837 N/A TYR 209.A N ALA 205.A O no hydrogen 2.984 N/A TYR 209.A OH LEU 41.A O no hydrogen 2.751 N/A TYR 209.A OH GLU 44.A O no hydrogen 2.791 N/A MET 210.A N LEU 206.A O no hydrogen 2.902 N/A ILE 211.A N LEU 207.A O no hydrogen 2.856 N/A ALA 212.A N THR 208.A O no hydrogen 2.795 N/A HIS 213.A N TYR 209.A O no hydrogen 2.811 N/A ILE 214.A N MET 210.A O no hydrogen 3.127 N/A THR 215.A N ILE 211.A O no hydrogen 2.889 N/A THR 215.A OG1 ILE 211.A O no hydrogen 2.795 N/A THR 215.A OG1 ALA 212.A O no hydrogen 3.341 N/A GLY 216.A N HIS 213.A O no hydrogen 3.388 N/A LEU 217.A N ALA 212.A O no hydrogen 3.015 N/A GLN 218.A N GLY 180.A O no hydrogen 3.109 N/A GLY 220.A N LEU 182.A O no hydrogen 2.867 N/A ASP 221.A N SER 183.A OG no hydrogen 2.884 N/A PHE 222.A N TYR 39.A O no hydrogen 2.880 N/A VAL 223.A N CYS 184.A O no hydrogen 2.743 N/A HIS 224.A N ALA 37.A O no hydrogen 2.826 N/A THR 225.A N LEU 186.A O no hydrogen 2.978 N/A THR 225.A OG1 GLN 36.A OE1 no hydrogen 2.983 N/A LEU 226.A N MET 35.A O no hydrogen 2.954 N/A GLY 227.A N GLN 188.A O no hydrogen 2.858 N/A ASP 228.A N ARG 189.A O no hydrogen 2.954 N/A ALA 229.A N VAL 32.A O no hydrogen 2.966 N/A HIS 230.A N GLY 191.A O no hydrogen 2.950 N/A HIS 230.A ND1 ASP 228.A O no hydrogen 3.032 N/A HIS 230.A ND1 ASP 228.A OD1 no hydrogen 3.147 N/A ILE 231.A N LEU 30.A O no hydrogen 2.893 N/A LEU 233.A N GLY 28.A O no hydrogen 3.003 N/A HIS 235.A N TYR 232.A O no hydrogen 2.841 N/A ILE 236.A N LEU 233.A O no hydrogen 3.344 N/A LEU 239.A N HIS 235.A O no hydrogen 2.941 N/A LYS 240.A N ILE 236.A O no hydrogen 2.940 N/A LYS 240.A NZ GLU 237.A OE2 no hydrogen 2.598 N/A ILE 241.A N GLU 237.A O no hydrogen 3.198 N/A GLN 242.A N PRO 238.A O no hydrogen 2.874 N/A LEU 243.A N LEU 239.A O no hydrogen 2.879 N/A GLN 244.A N ILE 241.A O no hydrogen 3.032 N/A ARG 245.A N GLN 242.A O no hydrogen 2.815 N/A ARG 245.A NH1 THR 50.A O no hydrogen 2.749 N/A ARG 248.A N THR 49.A OG1 no hydrogen 2.927 N/A ARG 248.A NH1 ASN 276.A O no hydrogen 2.828 N/A LYS 252.A N GLU 273.A O.A no hydrogen 2.948 N/A LYS 252.A N GLU 273.A O.B no hydrogen 2.966 N/A LYS 252.A NZ ASP 43.A O no hydrogen 2.586 N/A LYS 254.A N GLN 271.A O no hydrogen 2.782 N/A LEU 256.A N ASP 269.A O no hydrogen 2.695 N/A ARG 257.A NE ASP 269.A OD1 no hydrogen 2.810 N/A ARG 257.A NH1 ASP 264.A OD2 no hydrogen 2.818 N/A ARG 257.A NH2 ASP 264.A O no hydrogen 2.873 N/A ARG 257.A NH2 ASP 264.A OD2 no hydrogen 3.159 N/A ARG 257.A NH2 ASP 269.A OD2 no hydrogen 2.765 N/A LYS 258.A NZ VAL 259.A O no hydrogen 3.489 N/A ASP 264.A N THR 261.A O no hydrogen 3.064 N/A LYS 266.A N ASP 269.A OD2 no hydrogen 2.873 N/A LYS 266.A NZ ASP 264.A O no hydrogen 3.236 N/A LYS 266.A NZ ASP 264.A OD1 no hydrogen 2.934 N/A ASP 269.A N LYS 266.A O no hydrogen 2.934 N/A PHE 270.A N VAL 267.A O no hydrogen 3.375 N/A GLN 271.A N LYS 254.A O no hydrogen 2.934 N/A GLN 271.A NE2 GLU 273.A OE2.A no hydrogen 2.426 N/A GLU 273.A N.A LYS 252.A O no hydrogen 2.776 N/A GLU 273.A N.B LYS 252.A O no hydrogen 2.748 N/A TYR 275.A OH LEU 48.A O no hydrogen 2.627 N/A HIS 278.A N THR 49.A O no hydrogen 2.821 N/A HIS 278.A NE2 GLU 246.A O no hydrogen 2.602 N/A