Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3n99_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ARG 4.A NE ASP 145.A OD1 no hydrogen 3.394 N/A ARG 4.A NE ASP 145.A OD2 no hydrogen 3.347 N/A ARG 4.A NH2 ASP 145.A OD1 no hydrogen 2.660 N/A ASN 6.A N LYS 142.A O no hydrogen 3.363 N/A ASN 6.A ND2 GLY 140.A O no hydrogen 2.883 N/A LYS 7.A N THR 5.A OG1 no hydrogen 3.280 N/A LYS 7.A NZ ASP 157.A OD1 no hydrogen 3.023 N/A LYS 7.A NZ GLU 160.A OE2 no hydrogen 3.273 N/A ARG 9.A N ASN 6.A O no hydrogen 2.954 N/A LEU 10.A N LYS 7.A O no hydrogen 3.245 N/A ILE 13.A N ALA 136.A O no hydrogen 3.092 N/A VAL 15.A N ILE 134.A O no hydrogen 2.841 N/A GLY 17.A N ILE 132.A O no hydrogen 2.972 N/A GLU 18.A N MET 70.A O no hydrogen 2.814 N/A ILE 19.A N ASP 130.A O no hydrogen 3.047 N/A ALA 20.A N SER 68.A O no hydrogen 2.906 N/A LYS 23.A N LEU 42.A O no hydrogen 3.071 N/A LYS 23.A NZ HIS 113.A NE2 no hydrogen 2.880 N/A SER 26.A OG TYR 28.A O no hydrogen 3.464 N/A TYR 28.A N SER 26.A OG no hydrogen 3.011 N/A SER 29.A N ARG 37.A O no hydrogen 2.872 N/A THR 31.A N THR 35.A O no hydrogen 2.831 N/A THR 31.A OG1 THR 35.A O no hydrogen 3.253 N/A THR 31.A OG1 THR 35.A OG1 no hydrogen 2.879 N/A THR 32.A N VAL 249.A O no hydrogen 3.026 N/A THR 32.A OG1 GLU 33.A OE2 no hydrogen 2.184 N/A GLY 34.A N THR 31.A O no hydrogen 3.136 N/A THR 35.A N THR 31.A OG1 no hydrogen 3.063 N/A THR 35.A OG1 THR 31.A OG1 no hydrogen 2.879 N/A ARG 37.A N SER 29.A O no hydrogen 2.927 N/A GLY 43.A N GLU 64.A OE1 no hydrogen 2.841 N/A GLY 44.A N ALA 20.A O no hydrogen 3.069 N/A THR 46.A N GLY 66.A O no hydrogen 2.938 N/A THR 46.A OG1 GLU 64.A O no hydrogen 3.037 N/A LYS 50.A N ASP 53.A OD2 no hydrogen 2.994 N/A LYS 50.A NZ ASP 53.A OD1 no hydrogen 2.980 N/A GLY 52.A N LEU 215.A O no hydrogen 2.809 N/A ASP 53.A N LYS 50.A O no hydrogen 2.974 N/A SER 54.A OG TYR 56.A O no hydrogen 3.158 N/A SER 54.A OG ASP 212.A OD1 no hydrogen 2.598 N/A ALA 55.A N LEU 213.A O no hydrogen 2.822 N/A TYR 56.A N SER 54.A OG no hydrogen 3.052 N/A TYR 56.A OH ALA 202.A O no hydrogen 2.724 N/A TRP 58.A NE1 SER 54.A O no hydrogen 2.841 N/A ASP 61.A N PRO 40.A O no hydrogen 2.961 N/A HIS 62.A N ALA 247.A O no hydrogen 3.333 N/A HIS 62.A ND1 ASP 61.A OD2 no hydrogen 2.572 N/A VAL 63.A N SER 246.A OG no hydrogen 2.791 N/A GLY 66.A N VAL 49.A O no hydrogen 3.074 N/A VAL 67.A N VAL 116.A O no hydrogen 2.961 N/A SER 68.A N GLY 44.A O no hydrogen 2.997 N/A SER 68.A OG GLU 64.A OE1 no hydrogen 2.505 N/A VAL 69.A N VAL 114.A O no hydrogen 2.856 N/A MET 70.A N GLU 18.A O no hydrogen 2.844 N/A ARG 72.A NE GLU 76.A OE1 no hydrogen 2.685 N/A ARG 72.A NH2 GLU 76.A OE1 no hydrogen 3.263 N/A ARG 72.A NH2 GLU 76.A OE2 no hydrogen 3.266 N/A ARG 73.A NH1 GLU 76.A OE2 no hydrogen 3.188 N/A GLU 76.A N ARG 73.A O no hydrogen 2.952 N/A GLU 77.A N LYS 74.A O no hydrogen 3.108 N/A LEU 80.A N GLU 76.A O no hydrogen 3.299 N/A MET 81.A N GLU 77.A O no hydrogen 2.967 N/A THR 82.A N ILE 78.A O no hydrogen 2.851 N/A THR 82.A OG1 ILE 78.A O no hydrogen 2.787 N/A LEU 83.A N PRO 79.A O no hydrogen 2.990 N/A SER 84.A OG LEU 80.A O no hydrogen 2.704 N/A CYS 85.A N ASN 88.A OD1 no hydrogen 2.858 N/A CYS 85.A SG LEU 83.A O no hydrogen 3.539 N/A ILE 86.A N ASN 153.A O no hydrogen 2.870 N/A GLY 87.A N VAL 104.A O no hydrogen 2.792 N/A ASN 88.A N CYS 85.A O no hydrogen 2.964 N/A ASN 88.A ND2 TRP 137.A O no hydrogen 2.766 N/A ASN 88.A ND2 ASP 155.A OD2 no hydrogen 2.762 N/A VAL 90.A N GLY 102.A O no hydrogen 2.844 N/A ILE 91.A N LEU 133.A O no hydrogen 2.760 N/A VAL 92.A N SER 100.A O no hydrogen 2.819 N/A MET 93.A N LYS 131.A O no hydrogen 2.829 N/A LYS 98.A N GLY 95.A O no hydrogen 3.326 N/A GLY 99.A N VAL 92.A O no hydrogen 2.872 N/A SER 100.A N ALA 97.A O no hydrogen 2.843 N/A SER 100.A OG ALA 97.A O no hydrogen 2.869 N/A ARG 101.A NE GLU 89.A OE2 no hydrogen 2.750 N/A GLY 102.A N VAL 90.A O no hydrogen 2.777 N/A PHE 103.A N HIS 117.A O no hydrogen 3.039 N/A VAL 104.A N ASN 88.A O no hydrogen 3.119 N/A THR 105.A N LEU 115.A O no hydrogen 2.798 N/A GLY 106.A N LEU 115.A O no hydrogen 3.427 N/A LYS 107.A NZ MET 81.A O no hydrogen 2.704 N/A LYS 107.A NZ SER 84.A O no hydrogen 2.730 N/A LYS 107.A NZ ASN 153.A OD1 no hydrogen 2.902 N/A LYS 107.A NZ ALA 194.A O no hydrogen 2.751 N/A HIS 108.A N HIS 113.A O no hydrogen 2.823 N/A HIS 108.A ND1 GLU 64.A OE2 no hydrogen 2.938 N/A GLY 109.A N ASP 197.A OD1 no hydrogen 2.829 N/A GLY 110.A N ASN 112.A OD1 no hydrogen 3.264 N/A ASN 112.A ND2 GLU 77.A OE1 no hydrogen 2.881 N/A HIS 113.A N HIS 108.A O no hydrogen 2.964 N/A HIS 113.A ND1 GLU 64.A OE1 no hydrogen 2.846 N/A VAL 114.A N VAL 69.A O no hydrogen 2.924 N/A LEU 115.A N GLY 106.A O no hydrogen 2.822 N/A VAL 116.A N VAL 67.A O no hydrogen 2.969 N/A HIS 117.A N PHE 103.A O no hydrogen 2.778 N/A VAL 122.A N GLU 119.A O no hydrogen 3.005 N/A LEU 123.A N GLU 120.A O no hydrogen 3.225 N/A LYS 125.A N VAL 122.A O no hydrogen 2.928 N/A LYS 125.A NZ GLU 121.A O no hydrogen 3.333 N/A LEU 126.A N LEU 123.A O no hydrogen 3.194 N/A MET 127.A N ASP 130.A OD2 no hydrogen 2.916 N/A GLY 129.A N ILE 19.A O no hydrogen 2.884 N/A ASP 130.A N MET 127.A O no hydrogen 2.995 N/A LYS 131.A N SER 94.A OG no hydrogen 2.919 N/A ILE 132.A N GLY 17.A O no hydrogen 2.890 N/A LEU 133.A N ILE 91.A O no hydrogen 2.922 N/A ILE 134.A N VAL 15.A O no hydrogen 2.767 N/A LYS 135.A N GLU 89.A O no hydrogen 2.955 N/A ALA 136.A N ILE 13.A O no hydrogen 2.933 N/A TRP 137.A N ASN 88.A OD1 no hydrogen 3.001 N/A GLN 139.A NE2 THR 82.A O no hydrogen 2.735 N/A GLN 139.A NE2 ASN 153.A OD1 no hydrogen 2.919 N/A LEU 141.A N GLY 138.A O no hydrogen 3.163 N/A LYS 142.A N ASN 6.A OD1 no hydrogen 2.737 N/A LEU 144.A N ARG 4.A O no hydrogen 2.879 N/A HIS 146.A N LEU 143.A O no hydrogen 3.061 N/A HIS 146.A NE2 GLU 166.A OE2 no hydrogen 2.521 N/A VAL 149.A N HIS 146.A O no hydrogen 2.920 N/A LYS 150.A N THR 262.A O no hydrogen 2.896 N/A MET 152.A N ILE 260.A O no hydrogen 3.026 N/A ASN 153.A N GLN 139.A OE1 no hydrogen 2.997 N/A ASN 153.A ND2 SER 193.A O no hydrogen 2.792 N/A ASN 153.A ND2 VAL 259.A O no hydrogen 2.686 N/A ASP 155.A N ILE 86.A O no hydrogen 2.831 N/A ASP 157.A N ASP 155.A OD1 no hydrogen 2.900 N/A LEU 158.A N ASP 155.A OD1 no hydrogen 3.228 N/A PHE 159.A N ASP 155.A O no hydrogen 2.857 N/A GLU 160.A N PRO 156.A O no hydrogen 3.314 N/A LYS 161.A N LEU 158.A O no hydrogen 2.857 N/A LEU 162.A N PHE 159.A O no hydrogen 3.272 N/A GLN 165.A N HIS 172.A O no hydrogen 3.050 N/A LYS 167.A N LYS 170.A O no hydrogen 2.930 N/A LYS 170.A N LYS 167.A O no hydrogen 3.227 N/A LYS 170.A NZ SER 266.A O no hydrogen 3.070 N/A ILE 171.A N LYS 267.A O no hydrogen 2.788 N/A HIS 172.A N GLN 165.A O no hydrogen 2.810 N/A HIS 172.A ND1 GLU 271.A OE2 no hydrogen 2.451 N/A VAL 173.A N LEU 269.A O no hydrogen 2.903 N/A VAL 175.A N GLU 271.A O no hydrogen 3.000 N/A VAL 176.A N ILE 218.A O no hydrogen 2.819 N/A LYS 178.A NZ PRO 270.A O no hydrogen 3.277 N/A ILE 179.A N ALA 220.A O no hydrogen 2.807 N/A MET 183.A N PRO 180.A O no hydrogen 2.934 N/A MET 184.A N ALA 181.A O no hydrogen 2.929 N/A GLY 185.A N ASP 199.A O no hydrogen 2.641 N/A SER 186.A N GLY 252.A O no hydrogen 2.809 N/A ILE 188.A N GLY 185.A O no hydrogen 3.139 N/A GLY 189.A N VAL 230.A O no hydrogen 2.929 N/A ALA 190.A N GLY 187.A O no hydrogen 2.935 N/A SER 193.A N TYR 228.A O no hydrogen 2.938 N/A SER 193.A OG ASN 226.A O no hydrogen 2.626 N/A SER 193.A OG TYR 228.A O no hydrogen 3.142 N/A ALA 194.A N SER 192.A OG no hydrogen 2.970 N/A SER 195.A N SER 192.A O no hydrogen 3.027 N/A SER 195.A OG SER 192.A O no hydrogen 3.314 N/A THR 196.A OG1 ASP 197.A O no hydrogen 3.025 N/A THR 196.A OG1 ASP 197.A OD1 no hydrogen 3.342 N/A TYR 198.A N VAL 257.A O no hydrogen 2.995 N/A TYR 198.A OH HIS 224.A ND1 no hydrogen 2.811 N/A ASP 199.A N SER 186.A O no hydrogen 2.968 N/A ILE 200.A N PRO 255.A O no hydrogen 2.856 N/A MET 201.A N MET 183.A O no hydrogen 2.662 N/A ASN 204.A N ASP 207.A OD2 no hydrogen 3.222 N/A ASP 207.A N ASN 204.A O no hydrogen 3.070 N/A LEU 208.A N PRO 205.A O no hydrogen 2.922 N/A GLY 209.A N GLU 206.A O no hydrogen 2.843 N/A VAL 210.A N PRO 205.A O no hydrogen 3.386 N/A LYS 214.A N ASP 217.A OD2 no hydrogen 2.768 N/A LYS 214.A NZ ASP 212.A OD2 no hydrogen 3.377 N/A LEU 215.A N ASP 53.A O no hydrogen 2.801 N/A GLY 216.A N VAL 243.A O no hydrogen 2.808 N/A ASP 217.A N LYS 214.A O no hydrogen 3.053 N/A ILE 218.A N ALA 276.A O no hydrogen 2.910 N/A VAL 219.A N GLY 241.A O no hydrogen 2.999 N/A ALA 220.A N ALA 177.A O no hydrogen 2.940 N/A ILE 221.A N SER 239.A O no hydrogen 2.796 N/A GLN 222.A N ILE 179.A O no hydrogen 2.769 N/A ASP 223.A N ALA 237.A O no hydrogen 2.813 N/A HIS 224.A ND1 TYR 198.A OH no hydrogen 2.811 N/A ASP 225.A N LYS 232.A O no hydrogen 2.751 N/A ASN 226.A N THR 262.A OG1 no hydrogen 3.001 N/A ASN 226.A ND2 TYR 198.A OH no hydrogen 3.092 N/A ASN 226.A ND2 SER 239.A OG no hydrogen 2.919 N/A SER 227.A N ASP 225.A OD1 no hydrogen 3.232 N/A SER 227.A OG ASP 225.A OD1 no hydrogen 2.631 N/A VAL 230.A N ALA 190.A O no hydrogen 2.943 N/A GLY 231.A N ASN 226.A OD1 no hydrogen 2.785 N/A LYS 232.A N ASP 225.A O no hydrogen 3.092 N/A ARG 234.A N ASP 223.A O no hydrogen 2.932 N/A ARG 234.A NH1 ASP 264.A OD1 no hydrogen 3.474 N/A GLY 236.A N ASP 223.A OD1 no hydrogen 2.965 N/A ALA 237.A N ARG 234.A O no hydrogen 2.974 N/A VAL 238.A N GLY 263.A O no hydrogen 2.822 N/A SER 239.A N ILE 221.A O no hydrogen 3.073 N/A SER 239.A OG HIS 224.A O no hydrogen 2.615 N/A SER 239.A OG THR 262.A OG1 no hydrogen 2.885 N/A ILE 240.A N MET 261.A O no hydrogen 2.768 N/A GLY 241.A N VAL 219.A O no hydrogen 3.008 N/A VAL 242.A N VAL 258.A O no hydrogen 2.865 N/A VAL 243.A N ASP 217.A O no hydrogen 3.036 N/A VAL 244.A N GLY 256.A O no hydrogen 2.736 N/A HIS 245.A ND1 SER 246.A O no hydrogen 2.905 N/A SER 246.A N VAL 63.A O no hydrogen 2.897 N/A SER 246.A OG ALA 247.A O no hydrogen 2.898 N/A ALA 247.A N ALA 55.A O no hydrogen 2.673 N/A CYS 248.A SG SER 246.A O no hydrogen 3.657 N/A CYS 248.A SG GLY 254.A O no hydrogen 3.547 N/A VAL 249.A N ASP 61.A OD1 no hydrogen 2.737 N/A SER 250.A OG VAL 30.A O no hydrogen 2.752 N/A HIS 253.A N SER 250.A O no hydrogen 3.284 N/A GLY 254.A N ASP 199.A OD2 no hydrogen 3.188 N/A VAL 257.A N TYR 198.A O no hydrogen 2.784 N/A VAL 258.A N VAL 242.A O no hydrogen 2.864 N/A ILE 260.A N ILE 240.A O no hydrogen 2.834 N/A MET 261.A N ILE 240.A O no hydrogen 3.265 N/A THR 262.A N LYS 150.A O no hydrogen 2.923 N/A THR 262.A OG1 VAL 238.A O no hydrogen 3.540 N/A THR 262.A OG1 SER 239.A OG no hydrogen 2.885 N/A GLY 263.A N VAL 238.A O no hydrogen 2.939 N/A GLU 265.A N GLY 236.A O no hydrogen 2.790 N/A SER 266.A N ASP 264.A OD2 no hydrogen 2.980 N/A SER 266.A OG ASP 264.A OD2 no hydrogen 2.710 N/A LYS 267.A N ASP 264.A O no hydrogen 3.022 N/A ILE 268.A N ASP 264.A O no hydrogen 3.010 N/A LEU 269.A N ILE 171.A O no hydrogen 2.712 N/A GLU 271.A N VAL 173.A O no hydrogen 2.803 N/A VAL 273.A N VAL 175.A O no hydrogen 2.864 N/A ARG 275.A NE ASP 280.A OD1 no hydrogen 3.248 N/A ARG 275.A NE ASP 280.A OD2 no hydrogen 2.715 N/A ARG 275.A NH2 ASP 280.A OD1 no hydrogen 2.956 N/A ASN 277.A ND2 LEU 215.A O no hydrogen 3.128 N/A ASN 277.A ND2 ASP 217.A OD1 no hydrogen 2.698 N/A ILE 278.A N GLY 216.A O no hydrogen 2.856 N/A SER 279.A N ASN 277.A OD1 no hydrogen 2.891 N/A SER 279.A OG ASN 277.A OD1 no hydrogen 2.844 N/A ASP 280.A N ASN 277.A O no hydrogen 3.116 N/A TYR 281.A N ILE 278.A O no hydrogen 3.008 N/A LEU 282.A N SER 279.A O no hydrogen 3.497 N/A