Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1nj4_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): THR 5.A N LEU 1.A O no hydrogen 2.708 N/A THR 5.A OG1 LEU 1.A O no hydrogen 2.587 N/A ASP 14.A N GLU 239.A OE2 no hydrogen 2.776 N/A ALA 15.A N ILE 13.A O no hydrogen 2.815 N/A GLU 16.A N GLY 229.A O no hydrogen 3.100 N/A SER 17.A N MET 228.A O no hydrogen 3.031 N/A TYR 18.A N GLN 32.A O no hydrogen 3.048 N/A ILE 19.A N ALA 226.A O no hydrogen 2.916 N/A LEU 20.A N ALA 30.A O no hydrogen 2.979 N/A ILE 21.A N ILE 224.A O no hydrogen 2.911 N/A ASP 22.A N LYS 27.A O no hydrogen 2.940 N/A TYR 23.A N ARG 222.A O no hydrogen 2.822 N/A SER 25.A N ASP 22.A OD2 no hydrogen 2.731 N/A SER 25.A OG ASP 22.A OD2 no hydrogen 3.365 N/A SER 25.A OG THR 287.A OG1 no hydrogen 2.546 N/A GLY 26.A N ASP 22.A O no hydrogen 2.833 N/A LYS 27.A N SER 25.A OG no hydrogen 3.038 N/A LEU 29.A N LEU 20.A O no hydrogen 2.745 N/A GLN 32.A N TYR 18.A O no hydrogen 3.109 N/A GLN 32.A NE2 TYR 18.A OH no hydrogen 3.190 N/A ASN 33.A ND2 GLU 16.A O no hydrogen 3.009 N/A VAL 36.A N ASN 33.A O no hydrogen 3.237 N/A ARG 37.A NE ASN 132.A OD1 no hydrogen 2.764 N/A ARG 37.A NH2 LYS 131.A O no hydrogen 3.035 N/A ARG 37.A NH2 ASN 132.A OD1 no hydrogen 3.328 N/A ARG 38.A N SER 148.A O no hydrogen 2.834 N/A ARG 38.A NH2 ALA 208.A O no hydrogen 2.770 N/A ALA 41.A N ASP 39.A OD2 no hydrogen 2.750 N/A LEU 43.A N PRO 40.A O no hydrogen 2.906 N/A THR 44.A N ALA 41.A O no hydrogen 3.347 N/A THR 44.A OG1 ALA 41.A O no hydrogen 3.194 N/A THR 44.A OG1 GLN 146.A OE1 no hydrogen 2.709 N/A LYS 45.A N SER 42.A O no hydrogen 3.034 N/A LYS 45.A NZ SER 98.A O no hydrogen 3.460 N/A LYS 45.A NZ ASN 100.A OD1 no hydrogen 2.722 N/A LYS 45.A NZ HIS 139.A O no hydrogen 3.061 N/A MET 46.A N LEU 43.A O no hydrogen 2.870 N/A MET 47.A N THR 44.A O no hydrogen 2.815 N/A THR 48.A N THR 44.A O no hydrogen 3.248 N/A THR 48.A OG1 VAL 138.A O no hydrogen 2.613 N/A SER 49.A N LYS 45.A O no hydrogen 2.879 N/A SER 49.A OG ASN 95.A OD1 no hydrogen 3.402 N/A SER 49.A OG GLU 167.A OE1 no hydrogen 2.716 N/A SER 49.A OG TYR 171.A OH no hydrogen 2.623 N/A TYR 50.A N MET 46.A O no hydrogen 2.997 N/A TYR 50.A OH ASP 163.A OD1 no hydrogen 2.542 N/A VAL 51.A N MET 47.A O no hydrogen 2.960 N/A ILE 52.A N THR 48.A O no hydrogen 3.027 N/A GLY 53.A N SER 49.A O no hydrogen 2.727 N/A GLN 54.A N TYR 50.A O no hydrogen 2.897 N/A GLN 54.A NE2 TYR 50.A OH no hydrogen 3.039 N/A ALA 55.A N VAL 51.A O no hydrogen 2.940 N/A MET 56.A N ILE 52.A O no hydrogen 2.925 N/A LYS 57.A N GLY 53.A O no hydrogen 2.858 N/A LYS 57.A NZ ASP 163.A O no hydrogen 3.009 N/A ALA 58.A N GLN 54.A O no hydrogen 2.943 N/A GLY 59.A N MET 56.A O no hydrogen 2.953 N/A LYS 60.A N ALA 55.A O no hydrogen 3.002 N/A LYS 62.A N ASP 65.A OD1 no hydrogen 3.122 N/A LYS 62.A NZ ASP 65.A OD2 no hydrogen 2.963 N/A ASP 65.A N LYS 62.A O no hydrogen 3.030 N/A VAL 67.A N VAL 85.A O no hydrogen 2.771 N/A ILE 69.A N MET 83.A O no hydrogen 2.822 N/A SER 75.A N LYS 72.A O no hydrogen 3.165 N/A PHE 78.A N SER 75.A O no hydrogen 3.088 N/A GLY 82.A N ILE 69.A O no hydrogen 2.903 N/A MET 83.A N LYS 80.A O no hydrogen 3.060 N/A GLN 84.A NE2 THR 68.A OG1 no hydrogen 2.649 N/A VAL 85.A N VAL 67.A O no hydrogen 2.860 N/A VAL 87.A N ASP 65.A O no hydrogen 2.864 N/A SER 88.A N GLU 63.A O no hydrogen 2.857 N/A GLN 89.A N PRO 86.A O no hydrogen 3.070 N/A LEU 90.A N PRO 86.A O no hydrogen 3.168 N/A ILE 91.A N VAL 87.A O no hydrogen 2.856 N/A ARG 92.A NE GLU 173.A OE1 no hydrogen 2.614 N/A ARG 92.A NH1 GLU 63.A OE1 no hydrogen 2.883 N/A ARG 92.A NH1 SER 88.A O no hydrogen 3.089 N/A ARG 92.A NH2 GLU 173.A OE2 no hydrogen 2.961 N/A ASP 93.A N GLN 89.A O no hydrogen 3.009 N/A ILE 94.A N LEU 90.A O no hydrogen 3.019 N/A ASN 95.A N ILE 91.A O no hydrogen 2.805 N/A ASN 95.A ND2 GLU 167.A OE1 no hydrogen 2.792 N/A LEU 96.A N ARG 92.A O no hydrogen 2.787 N/A GLN 97.A N ASP 93.A O no hydrogen 3.029 N/A GLN 97.A NE2 LEU 184.A O no hydrogen 2.690 N/A SER 98.A N ILE 94.A O no hydrogen 2.945 N/A GLY 99.A N ASP 93.A O no hydrogen 2.976 N/A CYS 103.A N GLY 99.A O no hydrogen 3.338 N/A CYS 103.A SG GLY 99.A O no hydrogen 3.405 N/A CYS 103.A SG VAL 138.A O no hydrogen 3.788 N/A VAL 104.A N ASN 100.A O no hydrogen 3.251 N/A ALA 105.A N ASP 101.A O no hydrogen 2.955 N/A MET 106.A N ALA 102.A O no hydrogen 2.966 N/A ALA 107.A N CYS 103.A O no hydrogen 2.890 N/A ASP 108.A N VAL 104.A O no hydrogen 3.114 N/A PHE 109.A N ALA 105.A O no hydrogen 3.078 N/A ALA 110.A N MET 106.A O no hydrogen 2.889 N/A ALA 111.A N ALA 107.A O no hydrogen 2.792 N/A GLY 112.A N ASP 108.A O no hydrogen 2.824 N/A ALA 116.A N SER 113.A OG no hydrogen 3.005 N/A PHE 117.A N SER 113.A O no hydrogen 2.936 N/A VAL 118.A N GLN 114.A O no hydrogen 2.863 N/A GLY 119.A N ASP 115.A O no hydrogen 3.024 N/A LEU 120.A N ALA 116.A O no hydrogen 3.142 N/A MET 121.A N PHE 117.A O no hydrogen 2.953 N/A ASN 122.A N VAL 118.A O no hydrogen 2.851 N/A ASN 122.A ND2 PHE 135.A O no hydrogen 3.036 N/A SER 123.A N GLY 119.A O no hydrogen 2.854 N/A SER 123.A OG GLY 119.A O no hydrogen 2.871 N/A TYR 124.A N LEU 120.A O no hydrogen 3.002 N/A VAL 125.A N MET 121.A O no hydrogen 3.080 N/A ASN 126.A N ASN 122.A O no hydrogen 3.238 N/A ALA 127.A N SER 123.A O no hydrogen 2.903 N/A LEU 128.A N TYR 124.A O no hydrogen 2.822 N/A GLY 129.A N ASN 126.A O no hydrogen 3.069 N/A LEU 130.A N VAL 125.A O no hydrogen 3.060 N/A ASN 132.A N ASP 152.A OD1 no hydrogen 2.874 N/A THR 133.A OG1 SER 148.A OG no hydrogen 2.674 N/A THR 133.A OG1 ASP 152.A OD1 no hydrogen 2.728 N/A HIS 134.A N TYR 147.A O no hydrogen 2.882 N/A PHE 135.A N ASN 122.A OD1 no hydrogen 2.861 N/A GLY 140.A N THR 137.A OG1 no hydrogen 2.921 N/A LEU 141.A N THR 137.A OG1 no hydrogen 3.322 N/A GLN 146.A N ALA 143.A O no hydrogen 2.887 N/A GLN 146.A NE2 ASP 39.A OD2 no hydrogen 3.057 N/A GLN 146.A NE2 ALA 41.A O no hydrogen 2.967 N/A TYR 147.A N HIS 134.A O no hydrogen 3.064 N/A SER 148.A N ARG 38.A O no hydrogen 2.832 N/A SER 148.A OG THR 133.A OG1 no hydrogen 2.674 N/A SER 149.A OG ALA 34.A O no hydrogen 3.312 N/A ARG 151.A N ALA 34.A O no hydrogen 2.918 N/A ARG 151.A NE ASP 35.A OD1 no hydrogen 2.786 N/A ARG 151.A NH2 GLU 31.A OE1 no hydrogen 3.418 N/A ARG 151.A NH2 ASP 35.A OD2 no hydrogen 2.863 N/A ASP 152.A N SER 149.A OG no hydrogen 3.196 N/A MET 153.A N SER 149.A O no hydrogen 2.954 N/A ALA 154.A N ALA 150.A O no hydrogen 3.065 N/A LEU 155.A N ARG 151.A O no hydrogen 2.956 N/A ILE 156.A N ASP 152.A O no hydrogen 2.874 N/A GLY 157.A N MET 153.A O no hydrogen 2.931 N/A GLN 158.A N ALA 154.A O no hydrogen 2.814 N/A GLN 158.A NE2 TYR 23.A O no hydrogen 2.853 N/A ALA 159.A N LEU 155.A O no hydrogen 2.908 N/A LEU 160.A N ILE 156.A O no hydrogen 2.903 N/A ILE 161.A N GLY 157.A O no hydrogen 3.179 N/A ARG 162.A N GLN 158.A O no hydrogen 2.880 N/A ARG 162.A NE ASP 163.A OD2 no hydrogen 2.629 N/A ARG 162.A NH1 ASP 163.A OD1 no hydrogen 3.145 N/A ASP 163.A N ALA 159.A O no hydrogen 2.659 N/A VAL 164.A N LEU 160.A O no hydrogen 3.031 N/A TYR 168.A N VAL 164.A O no hydrogen 2.948 N/A TYR 168.A OH ASP 198.A OD2 no hydrogen 2.770 N/A SER 169.A N PRO 165.A O no hydrogen 3.005 N/A SER 169.A OG PRO 165.A O no hydrogen 2.588 N/A ILE 170.A N GLU 167.A O no hydrogen 3.195 N/A TYR 171.A N TYR 168.A O no hydrogen 2.994 N/A TYR 171.A OH SER 49.A OG no hydrogen 2.623 N/A GLU 173.A N ILE 170.A O no hydrogen 3.021 N/A LYS 174.A NZ LEU 190.A O no hydrogen 3.430 N/A PHE 176.A N GLN 183.A O no hydrogen 3.041 N/A PHE 178.A N ILE 181.A O no hydrogen 2.800 N/A ASN 179.A N GLN 89.A OE1 no hydrogen 2.779 N/A ILE 181.A N PHE 178.A O no hydrogen 2.991 N/A GLN 183.A N PHE 176.A O no hydrogen 2.784 N/A ASN 185.A N LYS 174.A O no hydrogen 2.843 N/A ASN 185.A ND2 TYR 171.A O no hydrogen 2.806 N/A ASN 185.A ND2 GLU 173.A O no hydrogen 2.820 N/A ARG 186.A N LEU 96.A O no hydrogen 2.935 N/A ARG 186.A NH2 GLN 97.A O no hydrogen 2.910 N/A ASN 187.A N ASN 185.A OD1 no hydrogen 2.999 N/A LEU 190.A N ASN 187.A O no hydrogen 3.103 N/A TRP 191.A N GLY 188.A O no hydrogen 2.974 N/A ASP 192.A N LEU 189.A O no hydrogen 2.987 N/A SER 194.A N ASP 192.A OD2 no hydrogen 2.938 N/A LEU 195.A N ASP 192.A OD2 no hydrogen 3.079 N/A ASP 198.A N SER 215.A O no hydrogen 3.114 N/A ILE 200.A N VAL 213.A O no hydrogen 2.763 N/A LYS 201.A N VAL 213.A O no hydrogen 3.000 N/A LYS 201.A NZ ASN 95.A O no hydrogen 2.886 N/A LYS 201.A NZ SER 98.A OG no hydrogen 2.891 N/A THR 202.A OG1 ASN 211.A O no hydrogen 3.424 N/A GLY 203.A N ASN 211.A O no hydrogen 2.688 N/A THR 205.A N GLY 209.A O no hydrogen 3.170 N/A LYS 207.A NZ ASP 39.A OD1 no hydrogen 3.015 N/A GLY 209.A N THR 205.A O no hydrogen 2.723 N/A TYR 210.A N GLY 230.A O no hydrogen 3.050 N/A ASN 211.A N GLY 203.A O no hydrogen 2.716 N/A LEU 212.A N VAL 227.A O no hydrogen 3.080 N/A VAL 213.A N LYS 201.A O no hydrogen 2.867 N/A ALA 214.A N SER 225.A O no hydrogen 2.796 N/A SER 215.A N GLY 199.A O no hydrogen 3.030 N/A SER 215.A OG LEU 223.A O no hydrogen 2.941 N/A ALA 216.A N LEU 223.A O no hydrogen 3.143 N/A THR 217.A N ASN 196.A O no hydrogen 3.103 N/A GLU 218.A N MET 221.A O no hydrogen 2.911 N/A MET 221.A N GLU 218.A O no hydrogen 2.926 N/A ARG 222.A NH1 ASP 198.A OD1 no hydrogen 3.494 N/A ARG 222.A NH1 ASP 198.A OD2 no hydrogen 2.846 N/A ARG 222.A NH1 SER 215.A OG no hydrogen 2.810 N/A ARG 222.A NH2 ASP 198.A OD1 no hydrogen 2.862 N/A LEU 223.A N ALA 216.A O no hydrogen 3.024 N/A ILE 224.A N ILE 21.A O no hydrogen 2.847 N/A SER 225.A N ALA 214.A O no hydrogen 2.893 N/A ALA 226.A N ILE 19.A O no hydrogen 2.999 N/A VAL 227.A N LEU 212.A O no hydrogen 2.980 N/A MET 228.A N SER 17.A O no hydrogen 2.741 N/A GLY 230.A N TYR 210.A O no hydrogen 2.693 N/A ARG 231.A N ASP 14.A O no hydrogen 3.047 N/A ARG 231.A NE GLU 16.A OE2 no hydrogen 3.273 N/A ARG 231.A NH1 ASP 14.A OD2 no hydrogen 2.978 N/A ARG 231.A NH2 GLU 16.A OE2 no hydrogen 2.975 N/A GLY 235.A N THR 232.A O no hydrogen 3.275 N/A GLY 235.A N THR 232.A OG1 no hydrogen 3.206 N/A ARG 236.A N PHE 233.A O no hydrogen 3.206 N/A ARG 236.A NH2 PHE 233.A O no hydrogen 2.928 N/A GLU 239.A N GLY 235.A O no hydrogen 2.965 N/A LYS 241.A N GLU 237.A O no hydrogen 3.031 N/A LYS 241.A NZ ASP 192.A OD1 no hydrogen 2.634 N/A LYS 241.A NZ ASP 192.A OD2 no hydrogen 3.267 N/A LYS 242.A N ALA 238.A O no hydrogen 2.942 N/A LYS 242.A NZ GLN 12.A O no hydrogen 2.650 N/A LYS 242.A NZ GLU 239.A OE1 no hydrogen 3.473 N/A LYS 242.A NZ GLU 239.A OE2 no hydrogen 3.073 N/A LEU 243.A N GLU 239.A O no hydrogen 3.287 N/A LEU 244.A N SER 240.A O no hydrogen 2.828 N/A THR 245.A N LYS 241.A O no hydrogen 2.917 N/A THR 245.A OG1 LYS 241.A O no hydrogen 2.888 N/A TRP 246.A N LYS 242.A O no hydrogen 3.013 N/A TRP 246.A NE1 GLY 9.A O no hydrogen 2.749 N/A GLY 247.A N LEU 243.A O no hydrogen 3.011 N/A PHE 248.A N LEU 244.A O no hydrogen 3.092 N/A ARG 249.A N THR 245.A O no hydrogen 3.007 N/A PHE 250.A N TRP 246.A O no hydrogen 3.031 N/A PHE 251.A N GLY 247.A O no hydrogen 2.991 N/A GLU 252.A N ILE 288.A O no hydrogen 2.809 N/A THR 253.A OG1 ASP 22.A OD1 no hydrogen 2.323 N/A THR 253.A OG1 THR 287.A OG1 no hydrogen 3.177 N/A VAL 254.A N LEU 286.A O no hydrogen 2.736 N/A VAL 259.A N ASP 283.A OD2 no hydrogen 3.385 N/A LYS 261.A N LYS 258.A O no hydrogen 3.201 N/A PHE 263.A N LEU 278.A O no hydrogen 2.755 N/A ALA 264.A N LEU 278.A O no hydrogen 3.244 N/A SER 265.A OG GLU 262.A OE1 no hydrogen 2.654 N/A GLU 266.A N ALA 276.A O no hydrogen 3.124 N/A VAL 268.A N ASP 274.A O no hydrogen 2.839 N/A TRP 269.A N LEU 307.A O no hydrogen 2.775 N/A ASP 272.A N PRO 341.A O no hydrogen 2.915 N/A SER 273.A OG ASP 272.A OD1 no hydrogen 2.709 N/A ALA 276.A N GLU 266.A O no hydrogen 2.773 N/A SER 277.A OG GLU 262.A OE2 no hydrogen 2.611 N/A LEU 278.A N ALA 264.A O no hydrogen 2.845 N/A GLY 279.A N VAL 335.A O no hydrogen 2.912 N/A VAL 284.A N LEU 257.A O no hydrogen 3.042 N/A LEU 286.A N VAL 254.A O no hydrogen 2.807 N/A THR 287.A OG1 SER 25.A OG no hydrogen 2.546 N/A THR 287.A OG1 THR 253.A OG1 no hydrogen 3.177 N/A ILE 288.A N GLU 252.A O no hydrogen 2.974 N/A ARG 290.A N PHE 250.A O no hydrogen 2.769 N/A ARG 290.A NE PHE 248.A O no hydrogen 2.830 N/A ARG 290.A NE PHE 251.A O no hydrogen 3.189 N/A ARG 290.A NH2 PHE 248.A O no hydrogen 3.315 N/A ARG 290.A NH2 PHE 251.A O no hydrogen 2.894 N/A GLY 291.A N GLU 252.A OE1 no hydrogen 3.253 N/A ARG 292.A N PRO 289.A O no hydrogen 3.264 N/A ARG 292.A NE LYS 4.A O no hydrogen 2.752 N/A ARG 292.A NH1 ASP 325.A OD2 no hydrogen 2.509 N/A ARG 292.A NH2 ASP 295.A OD2 no hydrogen 2.593 N/A ASP 295.A N ARG 292.A O no hydrogen 2.774 N/A LEU 296.A N MET 293.A O no hydrogen 3.198 N/A LYS 297.A N GLN 323.A O no hydrogen 2.775 N/A SER 299.A N ASN 321.A O no hydrogen 2.989 N/A TYR 300.A OH GLU 266.A OE2 no hydrogen 2.778 N/A VAL 301.A N THR 319.A O no hydrogen 2.908 N/A ASN 303.A N VAL 317.A O no hydrogen 2.904 N/A SER 304.A OG GLU 306.A O no hydrogen 2.712 N/A ALA 309.A N TRP 269.A O no hydrogen 2.848 N/A LEU 311.A N ILE 340.A O no hydrogen 2.795 N/A GLN 312.A N GLN 315.A OE1 no hydrogen 2.799 N/A ASN 314.A N VAL 336.A O no hydrogen 2.619 N/A GLN 315.A N GLN 312.A O no hydrogen 3.150 N/A VAL 317.A N LEU 334.A O no hydrogen 2.849 N/A THR 319.A N VAL 301.A O no hydrogen 2.858 N/A ILE 320.A N ARG 332.A O no hydrogen 2.779 N/A ASN 321.A N SER 299.A O no hydrogen 2.736 N/A PHE 322.A N GLU 330.A O no hydrogen 2.835 N/A GLN 323.A N LYS 297.A O no hydrogen 2.669 N/A LEU 324.A N LYS 327.A O no hydrogen 3.011 N/A LYS 327.A N LEU 324.A O no hydrogen 2.905 N/A ILE 329.A N PHE 322.A O no hydrogen 2.768 N/A GLU 330.A N PHE 322.A O no hydrogen 3.347 N/A GLN 331.A NE2 ASN 321.A OD1 no hydrogen 2.715 N/A ARG 332.A N ILE 320.A O no hydrogen 2.929 N/A ARG 332.A NH2 GLU 330.A OE1 no hydrogen 2.861 N/A LEU 334.A N GLY 318.A O no hydrogen 2.754 N/A VAL 335.A N GLY 279.A O no hydrogen 2.790 N/A VAL 336.A N GLN 315.A O no hydrogen 2.941 N/A LEU 337.A N SER 277.A O no hydrogen 2.696 N/A ILE 340.A N LEU 311.A O no hydrogen 2.759 N/A GLY 343.A N PHE 270.A O no hydrogen 3.009 N/A