Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1nq6_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ALA 1.A N ASP 6.A OD1 no hydrogen 2.974 N/A ALA 3.A N ALA 35.A O no hydrogen 2.874 N/A GLY 5.A N GLN 36.A O no hydrogen 3.091 N/A ASP 6.A N GLY 2.A O no hydrogen 2.817 N/A ALA 7.A N ALA 3.A O no hydrogen 3.116 N/A ALA 8.A N LEU 4.A O no hydrogen 2.980 N/A ALA 9.A N GLY 5.A O no hydrogen 2.896 N/A ALA 10.A N ASP 6.A O no hydrogen 3.094 N/A LYS 11.A N ALA 8.A O no hydrogen 3.069 N/A LYS 11.A NZ LEU 302.A OXT no hydrogen 2.669 N/A GLY 12.A N ALA 9.A O no hydrogen 3.059 N/A ARG 13.A N ALA 8.A O no hydrogen 3.053 N/A ARG 13.A NE CYS 262.A O no hydrogen 2.708 N/A ARG 13.A NH2 CYS 256.A O no hydrogen 3.463 N/A ARG 13.A NH2 VAL 259.A O no hydrogen 2.899 N/A TYR 14.A N THR 263.A O no hydrogen 3.031 N/A GLY 16.A N ILE 265.A O no hydrogen 2.735 N/A ALA 17.A N SER 39.A O no hydrogen 3.050 N/A ALA 18.A N VAL 267.A O no hydrogen 2.955 N/A VAL 19.A N THR 41.A O no hydrogen 2.764 N/A ALA 20.A N TYR 29.A OH no hydrogen 3.013 N/A ALA 21.A N GLU 45.A OE2 no hydrogen 2.819 N/A HIS 23.A N ALA 20.A O no hydrogen 3.150 N/A HIS 23.A ND1 GLU 26.A OE2 no hydrogen 2.759 N/A LEU 24.A N ALA 21.A O no hydrogen 3.149 N/A GLU 26.A N HIS 23.A O no hydrogen 3.007 N/A ALA 30.A N GLU 26.A O no hydrogen 2.940 N/A SER 31.A N ALA 27.A O no hydrogen 2.913 N/A THR 32.A N ALA 28.A O no hydrogen 2.973 N/A THR 32.A OG1 ALA 28.A O no hydrogen 2.763 N/A LEU 33.A N TYR 29.A O no hydrogen 2.969 N/A ASP 34.A N ALA 30.A O no hydrogen 2.929 N/A ALA 35.A N SER 31.A O no hydrogen 2.906 N/A GLN 36.A N LEU 33.A O no hydrogen 3.326 N/A PHE 37.A N LEU 33.A O no hydrogen 3.045 N/A GLY 38.A N PHE 15.A O no hydrogen 2.850 N/A SER 39.A OG LYS 76.A O no hydrogen 3.498 N/A VAL 40.A N LYS 76.A O no hydrogen 2.845 N/A THR 41.A N ALA 17.A O no hydrogen 2.989 N/A GLU 43.A N VAL 19.A O no hydrogen 2.915 N/A ASN 44.A N GLU 45.A OE1 no hydrogen 2.978 N/A GLU 45.A N GLU 45.A OE1 no hydrogen 2.651 N/A LYS 47.A N ASN 44.A O no hydrogen 3.221 N/A LYS 47.A NZ ASN 44.A OD1 no hydrogen 2.762 N/A LYS 47.A NZ GLN 87.A OE1 no hydrogen 3.091 N/A ALA 50.A N LYS 47.A O no hydrogen 2.943 N/A VAL 51.A N LYS 47.A O no hydrogen 3.106 N/A VAL 51.A N TRP 48.A O no hydrogen 3.219 N/A GLU 52.A N TRP 48.A O no hydrogen 2.839 N/A ASN 56.A N GLU 52.A OE2 no hydrogen 2.748 N/A SER 57.A N SER 54.A O no hydrogen 3.050 N/A SER 59.A N VAL 51.A O no hydrogen 2.890 N/A SER 59.A OG ALA 50.A O no hydrogen 2.815 N/A ASP 64.A N PHE 60.A O no hydrogen 2.784 N/A ARG 65.A N SER 61.A O no hydrogen 3.084 N/A ARG 65.A N ALA 62.A O no hydrogen 3.243 N/A VAL 67.A N ALA 63.A O no hydrogen 2.985 N/A SER 68.A N ASP 64.A O no hydrogen 2.849 N/A SER 68.A OG.B ASP 64.A O no hydrogen 2.825 N/A HIS 69.A N ARG 65.A O no hydrogen 3.155 N/A ALA 70.A N ILE 66.A O no hydrogen 2.946 N/A GLN 71.A N VAL 67.A O no hydrogen 2.925 N/A SER 72.A N SER 68.A O no hydrogen 3.094 N/A SER 72.A OG HIS 69.A O no hydrogen 2.838 N/A LYS 73.A N HIS 69.A O no hydrogen 3.134 N/A LYS 73.A N ALA 70.A O no hydrogen 3.075 N/A GLY 74.A N GLN 71.A O no hydrogen 3.285 N/A MET 75.A N ALA 70.A O no hydrogen 2.799 N/A LYS 76.A N GLY 38.A O no hydrogen 3.023 N/A ARG 78.A N VAL 40.A O no hydrogen 2.881 N/A ARG 78.A NH1 ASP 123.A OD1 no hydrogen 3.282 N/A ARG 78.A NH1 ASP 123.A OD2 no hydrogen 3.097 N/A ARG 78.A NH2 ASP 123.A OD1 no hydrogen 2.839 N/A GLY 79.A N SER 121.A O no hydrogen 2.752 N/A HIS 80.A ND1 ASP 123.A OD2 no hydrogen 2.821 N/A THR 81.A OG1 ASP 123.A O no hydrogen 2.842 N/A LEU 82.A N ASP 123.A O no hydrogen 2.983 N/A VAL 83.A N VAL 124.A O no hydrogen 2.898 N/A TRP 84.A NE1 GLU 127.A OE1 no hydrogen 2.863 N/A TRP 91.A NE1 SER 53.A O no hydrogen 2.786 N/A VAL 92.A N PRO 89.A O no hydrogen 3.252 N/A LEU 95.A N VAL 92.A O no hydrogen 3.272 N/A LEU 100.A N ALA 96.A O no hydrogen 2.868 N/A ARG 101.A N ALA 97.A O no hydrogen 2.972 N/A ARG 101.A NE GLU 153.A OE1 no hydrogen 2.804 N/A SER 102.A N THR 98.A O no hydrogen 3.195 N/A ALA 103.A N ASP 99.A O no hydrogen 2.876 N/A MET 104.A N LEU 100.A O no hydrogen 2.757 N/A ASN 105.A N ARG 101.A O no hydrogen 2.967 N/A ASN 106.A N SER 102.A O no hydrogen 2.886 N/A ASN 106.A ND2 ASN 56.A OD1 no hydrogen 2.941 N/A HIS 107.A N ALA 103.A O no hydrogen 2.915 N/A ILE 108.A N MET 104.A O no hydrogen 2.997 N/A THR 109.A N ASN 105.A O no hydrogen 2.875 N/A THR 109.A OG1 ASN 105.A O no hydrogen 2.702 N/A GLN 110.A N ASN 106.A O no hydrogen 2.935 N/A GLN 110.A NE2 ASN 56.A OD1 no hydrogen 2.804 N/A GLN 110.A NE2 ASN 106.A OD1 no hydrogen 2.815 N/A VAL 111.A N HIS 107.A O no hydrogen 3.030 N/A MET 112.A N ILE 108.A O no hydrogen 3.010 N/A THR 113.A N THR 109.A O no hydrogen 2.924 N/A THR 113.A OG1 THR 109.A O no hydrogen 2.650 N/A HIS 114.A N GLN 110.A O no hydrogen 3.111 N/A HIS 114.A NE2 ASP 64.A OD2 no hydrogen 2.748 N/A TYR 115.A N VAL 111.A O no hydrogen 3.442 N/A TYR 115.A OH ASP 64.A OD1 no hydrogen 2.810 N/A LYS 116.A N THR 113.A O no hydrogen 3.229 N/A GLY 117.A N ASP 162.A OD2 no hydrogen 3.073 N/A LYS 118.A N TYR 115.A O no hydrogen 2.922 N/A HIS 120.A N VAL 77.A O no hydrogen 2.842 N/A HIS 120.A ND1 SER 121.A OG no hydrogen 3.011 N/A SER 121.A OG HIS 120.A ND1 no hydrogen 3.011 N/A SER 121.A OG GLN 232.A OE1 no hydrogen 2.973 N/A TRP 122.A N LYS 166.A O no hydrogen 2.815 N/A ASP 123.A N GLY 79.A O no hydrogen 2.830 N/A VAL 124.A N CYS 168.A O no hydrogen 2.953 N/A ASN 126.A N VAL 83.A O no hydrogen 3.027 N/A GLU 127.A N ASN 170.A O no hydrogen 2.856 N/A ALA 128.A N TYR 169.A OH no hydrogen 2.881 N/A GLN 130.A N ALA 136.A O no hydrogen 2.887 N/A GLN 130.A NE2 ARG 137.A O no hydrogen 3.000 N/A SER 134.A OG GLN 130.A OE1 no hydrogen 3.265 N/A ALA 136.A N SER 134.A OG no hydrogen 3.018 N/A ARG 137.A NH1 GLN 143.A OE1 no hydrogen 2.889 N/A ARG 137.A NH1 ASN 148.A O no hydrogen 3.078 N/A ARG 137.A NH2 ASN 148.A O no hydrogen 3.310 N/A ARG 138.A N ALA 128.A O no hydrogen 2.894 N/A ARG 138.A NE GLU 127.A O no hydrogen 2.909 N/A ARG 138.A NH2 TYR 172.A OH no hydrogen 2.994 N/A SER 139.A OG ASP 144.A OD1 no hydrogen 3.413 N/A SER 139.A OG ASP 144.A OD2 no hydrogen 3.218 N/A SER 140.A N ASP 144.A OD1 no hydrogen 3.384 N/A GLN 143.A N SER 140.A OG no hydrogen 2.965 N/A GLN 143.A NE2 ASN 148.A OD1 no hydrogen 2.875 N/A ASP 144.A N SER 140.A O no hydrogen 2.721 N/A LYS 145.A N PRO 141.A O no hydrogen 3.017 N/A LYS 145.A NZ SER 93.A O no hydrogen 3.026 N/A LYS 145.A NZ LEU 95.A O no hydrogen 2.841 N/A LEU 146.A N PHE 142.A O no hydrogen 2.958 N/A GLY 147.A N GLN 143.A O no hydrogen 3.030 N/A PHE 150.A N GLY 147.A O no hydrogen 3.177 N/A GLU 153.A N GLY 149.A O no hydrogen 3.066 N/A ALA 154.A N PHE 150.A O no hydrogen 2.953 N/A PHE 155.A N ILE 151.A O no hydrogen 3.075 N/A ARG 156.A N GLU 152.A O no hydrogen 2.969 N/A ARG 156.A NE GLU 152.A OE2 no hydrogen 3.007 N/A ARG 156.A NH2 GLU 152.A OE2 no hydrogen 2.820 N/A THR 157.A N GLU 153.A O no hydrogen 3.008 N/A THR 157.A OG1 GLU 153.A O no hydrogen 3.143 N/A ALA 158.A N ALA 154.A O no hydrogen 2.965 N/A ARG 159.A N PHE 155.A O no hydrogen 2.970 N/A ARG 159.A NH1 ASP 199.A OD2 no hydrogen 2.781 N/A ARG 159.A NH2 ASP 199.A OD1 no hydrogen 2.816 N/A ARG 159.A NH2 ASP 199.A OD2 no hydrogen 3.483 N/A THR 160.A N ARG 156.A O no hydrogen 3.273 N/A THR 160.A OG1 THR 157.A O no hydrogen 2.881 N/A VAL 161.A N ALA 158.A O no hydrogen 3.061 N/A ASP 162.A N ALA 158.A O no hydrogen 3.269 N/A ASP 164.A N ASP 162.A OD1 no hydrogen 3.089 N/A LYS 166.A N HIS 120.A O no hydrogen 2.947 N/A LYS 166.A NZ ASP 230.A OD2 no hydrogen 2.912 N/A LEU 167.A N ASP 199.A OD2 no hydrogen 2.933 N/A CYS 168.A N TRP 122.A O no hydrogen 2.734 N/A TYR 169.A N CYS 200.A O no hydrogen 3.094 N/A TYR 169.A OH ASP 171.A OD2 no hydrogen 2.672 N/A ASN 170.A N VAL 125.A O no hydrogen 3.009 N/A ASN 170.A ND2 ASN 126.A OD1 no hydrogen 2.774 N/A ASN 170.A ND2 GLU 235.A OE2 no hydrogen 3.168 N/A ASP 171.A N GLY 202.A O no hydrogen 3.244 N/A TYR 172.A N ASP 171.A OD1 no hydrogen 2.857 N/A TYR 172.A OH ASP 131.A OD2 no hydrogen 2.627 N/A ASN 173.A ND2 ASP 131.A OD1 no hydrogen 3.292 N/A THR 174.A OG1 ASP 171.A O no hydrogen 3.412 N/A GLN 177.A N ASP 216.A OD2 no hydrogen 2.825 N/A ASN 178.A N SER 181.A OG no hydrogen 2.997 N/A ASN 178.A ND2 ASN 173.A O no hydrogen 3.405 N/A LYS 180.A NZ ASP 131.A OD1 no hydrogen 2.808 N/A LYS 180.A NZ ASP 171.A OD1 no hydrogen 3.327 N/A LYS 180.A NZ TYR 172.A O no hydrogen 2.881 N/A SER 181.A N ASN 178.A OD1 no hydrogen 2.804 N/A SER 181.A OG GLY 176.A O no hydrogen 2.670 N/A SER 181.A OG ASN 178.A O no hydrogen 3.388 N/A SER 181.A OG ASN 178.A OD1 no hydrogen 3.435 N/A ASN 182.A N ASN 178.A O no hydrogen 2.799 N/A ALA 183.A N ALA 179.A O no hydrogen 3.133 N/A VAL 184.A N LYS 180.A O no hydrogen 3.196 N/A TYR 185.A N SER 181.A O no hydrogen 2.792 N/A GLU 186.A N ASN 182.A O no hydrogen 2.912 N/A MET 187.A N ALA 183.A O no hydrogen 3.147 N/A VAL 188.A N VAL 184.A O no hydrogen 2.868 N/A LYS 189.A N TYR 185.A O no hydrogen 2.867 N/A ASP 190.A N GLU 186.A O no hydrogen 3.036 N/A PHE 191.A N MET 187.A O no hydrogen 2.854 N/A LYS 192.A N VAL 188.A O no hydrogen 2.841 N/A LYS 192.A NZ ILE 198.A O no hydrogen 3.115 N/A GLN 193.A N LYS 189.A O no hydrogen 2.878 N/A ARG 194.A N ASP 190.A O no hydrogen 3.118 N/A ARG 194.A N PHE 191.A O no hydrogen 3.237 N/A ARG 194.A NE ASP 190.A OD1 no hydrogen 2.959 N/A ARG 194.A NE ASP 190.A OD2 no hydrogen 3.389 N/A ARG 194.A NH1 GLU 152.A OE1 no hydrogen 3.030 N/A ARG 194.A NH1 GLU 152.A OE2 no hydrogen 3.326 N/A ARG 194.A NH2 GLU 152.A OE1 no hydrogen 2.984 N/A ARG 194.A NH2 ASP 190.A OD2 no hydrogen 2.802 N/A GLY 195.A N LYS 192.A O no hydrogen 3.387 N/A VAL 196.A N PHE 191.A O no hydrogen 2.929 N/A ILE 198.A N VAL 196.A O no hydrogen 2.855 N/A ASP 199.A N LEU 167.A O no hydrogen 2.963 N/A VAL 201.A N ASP 230.A O no hydrogen 2.986 N/A GLY 202.A N TYR 169.A O no hydrogen 2.687 N/A PHE 203.A N GLN 232.A O no hydrogen 2.791 N/A GLN 204.A N ASP 171.A O no hydrogen 2.939 N/A GLN 204.A NE2 ASN 126.A OD1 no hydrogen 3.553 N/A GLN 204.A NE2 GLU 127.A OE2 no hydrogen 2.933 N/A SER 205.A OG ASP 175.A OD1 no hydrogen 2.811 N/A SER 205.A OG PHE 203.A O no hydrogen 3.433 N/A HIS 206.A ND1 ASP 237.A OD1 no hydrogen 2.767 N/A HIS 206.A NE2 GLU 235.A OE1 no hydrogen 2.837 N/A PHE 207.A N ASP 237.A O no hydrogen 2.903 N/A ASN 208.A N SER 211.A O no hydrogen 3.013 N/A ASN 210.A N ASN 208.A OD1 no hydrogen 3.034 N/A SER 211.A N ASN 208.A O no hydrogen 3.028 N/A SER 211.A N ASN 208.A OD1 no hydrogen 2.959 N/A PHE 217.A N PRO 214.A O no hydrogen 3.198 N/A ASN 220.A N ASP 216.A O no hydrogen 2.887 N/A ASN 220.A ND2 ASP 175.A O no hydrogen 3.070 N/A LEU 221.A N PHE 217.A O no hydrogen 3.036 N/A GLN 222.A N GLN 218.A O no hydrogen 2.879 N/A GLN 222.A NE2 GLN 222.A O no hydrogen 3.447 N/A GLN 222.A NE2 ASP 226.A OD1 no hydrogen 2.916 N/A ARG 223.A N ALA 219.A O no hydrogen 3.008 N/A ARG 223.A NE ASN 220.A OD1 no hydrogen 2.817 N/A ARG 223.A NH1 ASN 182.A OD1 no hydrogen 2.968 N/A ARG 223.A NH2 ASN 182.A OD1 no hydrogen 2.884 N/A ARG 223.A NH2 ASN 220.A OD1 no hydrogen 3.027 N/A PHE 224.A N ASN 220.A O no hydrogen 3.361 N/A ALA 225.A N LEU 221.A O no hydrogen 2.974 N/A ASP 226.A N GLN 222.A O no hydrogen 2.872 N/A LEU 227.A N PHE 224.A O no hydrogen 3.031 N/A GLY 228.A N ALA 225.A O no hydrogen 2.970 N/A ASP 230.A N ASP 199.A O no hydrogen 2.941 N/A VAL 231.A N ARG 261.A O no hydrogen 2.792 N/A GLN 232.A N VAL 201.A O no hydrogen 3.044 N/A ILE 233.A N GLY 264.A O no hydrogen 3.025 N/A THR 234.A N PHE 203.A O no hydrogen 2.866 N/A THR 234.A OG1 ASN 170.A OD1 no hydrogen 2.760 N/A GLU 235.A N GLN 204.A O no hydrogen 3.050 N/A LEU 236.A N THR 266.A O no hydrogen 2.837 N/A ASP 237.A N SER 205.A O no hydrogen 3.323 N/A ILE 238.A N PRO 282.A O no hydrogen 3.079 N/A GLU 239.A N PHE 207.A O no hydrogen 3.085 N/A GLY 240.A N GLY 280.A O no hydrogen 2.974 N/A GLN 245.A N SER 241.A O no hydrogen 3.319 N/A GLN 245.A NE2 ILE 238.A O no hydrogen 2.774 N/A GLN 245.A NE2 THR 281.A O no hydrogen 2.900 N/A ALA 246.A N GLY 242.A O no hydrogen 2.949 N/A ALA 247.A N SER 243.A O no hydrogen 2.822 N/A ASN 248.A N ALA 244.A O no hydrogen 3.095 N/A TYR 249.A N GLN 245.A O no hydrogen 2.994 N/A TYR 249.A OH PRO 282.A O no hydrogen 2.655 N/A THR 250.A N ALA 246.A O no hydrogen 2.982 N/A THR 250.A OG1 ALA 246.A O no hydrogen 3.273 N/A LYS 251.A N ALA 247.A O no hydrogen 3.039 N/A VAL 252.A N ASN 248.A O no hydrogen 3.211 N/A VAL 253.A N TYR 249.A O no hydrogen 2.947 N/A ASN 254.A N THR 250.A O no hydrogen 2.866 N/A ALA 255.A N LYS 251.A O no hydrogen 3.028 N/A CYS 256.A N VAL 252.A O no hydrogen 3.085 N/A CYS 256.A SG CYS 262.A O no hydrogen 3.672 N/A LEU 257.A N VAL 253.A O no hydrogen 2.924 N/A ALA 258.A N ASN 254.A O no hydrogen 2.952 N/A ALA 258.A N ALA 255.A O no hydrogen 3.265 N/A VAL 259.A N CYS 256.A O no hydrogen 2.974 N/A ARG 261.A NE ASP 230.A OD1 no hydrogen 2.996 N/A ARG 261.A NH2 ASP 230.A OD1 no hydrogen 3.117 N/A CYS 262.A N VAL 259.A O no hydrogen 2.970 N/A CYS 262.A SG VAL 231.A O no hydrogen 3.829 N/A THR 263.A N VAL 231.A O no hydrogen 3.063 N/A ILE 265.A N TYR 14.A O no hydrogen 3.138 N/A THR 266.A N ILE 233.A O no hydrogen 2.777 N/A VAL 267.A N GLY 16.A O no hydrogen 2.954 N/A TRP 268.A N LEU 236.A O no hydrogen 2.882 N/A GLY 269.A N VAL 267.A O no hydrogen 2.849 N/A THR 271.A OG1 ASP 286.A O no hydrogen 2.799 N/A ASP 272.A N PHE 285.A O no hydrogen 2.907 N/A LYS 273.A N THR 271.A OG1 no hydrogen 3.140 N/A LYS 273.A NZ TYR 274.A OH no hydrogen 3.456 N/A TYR 274.A N THR 271.A O no hydrogen 3.087 N/A TYR 274.A OH GLU 26.A OE1 no hydrogen 2.686 N/A SER 275.A N ASP 272.A O no hydrogen 3.172 N/A TRP 276.A NE1 ASP 237.A OD2 no hydrogen 2.979 N/A ARG 277.A N SER 275.A OG no hydrogen 2.943 N/A ARG 277.A NH1 TRP 276.A O no hydrogen 3.041 N/A GLY 280.A N ARG 277.A O no hydrogen 2.928 N/A THR 281.A N SER 278.A O no hydrogen 3.026 N/A THR 281.A OG1 GLY 240.A O no hydrogen 2.972 N/A LEU 283.A N ASP 272.A OD1 no hydrogen 2.869 N/A ASP 286.A N ASN 290.A O no hydrogen 3.012 N/A ASP 288.A N ASP 286.A OD1 no hydrogen 2.917 N/A TYR 289.A N ASP 286.A O no hydrogen 2.994 N/A ASN 290.A N ASP 286.A OD1 no hydrogen 2.921 N/A LYS 292.A N LEU 284.A O no hydrogen 3.081 N/A LYS 292.A NZ GLN 245.A OE1 no hydrogen 3.262 N/A LYS 292.A NZ ASP 272.A OD2 no hydrogen 2.760 N/A LYS 292.A NZ THR 281.A O no hydrogen 2.887 N/A LYS 292.A NZ LEU 283.A O no hydrogen 2.908 N/A TYR 295.A OH GLN 36.A OE1 no hydrogen 2.682 N/A ASP 296.A N LYS 292.A O no hydrogen 3.195 N/A ALA 297.A N PRO 293.A O no hydrogen 3.080 N/A VAL 298.A N ALA 294.A O no hydrogen 3.020 N/A LEU 299.A N TYR 295.A O no hydrogen 2.958 N/A ALA 300.A N ASP 296.A O no hydrogen 2.972 N/A ALA 301.A N ALA 297.A O no hydrogen 3.013 N/A ALA 301.A N VAL 298.A O no hydrogen 3.088 N/A LEU 302.A N VAL 298.A O no hydrogen 3.083 N/A LEU 302.A N LEU 299.A O no hydrogen 3.342 N/A