Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3ibq_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): SER 1.A OG GLN 72.A OE1 no hydrogen 2.862 N/A THR 2.A N ASP 71.A OD2 no hydrogen 2.874 N/A VAL 4.A N ALA 30.A O no hydrogen 2.930 N/A ALA 5.A N LEU 74.A O no hydrogen 3.030 N/A GLU 6.A N LEU 32.A O no hydrogen 3.171 N/A LEU 8.A N SER 35.A O no hydrogen 2.941 N/A ALA 10.A N LEU 37.A O no hydrogen 2.931 N/A VAL 11.A N SER 38.A O no hydrogen 3.178 N/A SER 15.A N ASP 209.A OD2 no hydrogen 3.044 N/A SER 15.A OG ASP 7.A O no hydrogen 2.854 N/A SER 15.A OG ASP 7.A OD2 no hydrogen 2.842 N/A LEU 16.A N ASP 7.A O no hydrogen 3.210 N/A SER 17.A OG ILE 14.A O no hydrogen 2.878 N/A SER 18.A N ILE 14.A O no hydrogen 3.305 N/A SER 18.A N SER 15.A O no hydrogen 3.009 N/A SER 18.A OG SER 15.A O no hydrogen 3.099 N/A ALA 19.A N SER 15.A O no hydrogen 2.925 N/A LEU 20.A N LEU 16.A O no hydrogen 3.214 N/A VAL 22.A N SER 18.A O no hydrogen 3.413 N/A LEU 23.A N ALA 19.A O no hydrogen 2.913 N/A THR 24.A N LEU 20.A O no hydrogen 3.055 N/A THR 24.A OG1 LEU 20.A O no hydrogen 2.834 N/A ALA 25.A N PRO 21.A O no hydrogen 2.967 N/A TYR 27.A N LEU 23.A O no hydrogen 3.149 N/A TYR 27.A OH GLY 217.A O no hydrogen 2.653 N/A ASP 28.A N SER 1.A O no hydrogen 2.978 N/A LEU 32.A N VAL 4.A O no hydrogen 3.011 N/A THR 34.A N GLU 6.A O no hydrogen 3.233 N/A THR 34.A OG1 TYR 77.A O no hydrogen 2.916 N/A LEU 37.A N LEU 8.A O no hydrogen 2.897 N/A SER 38.A N ALA 48.A O no hydrogen 2.960 N/A SER 38.A OG ALA 48.A O no hydrogen 3.533 N/A THR 39.A OG1 HIS 40.A O no hydrogen 2.900 N/A HIS 40.A N VAL 11.A O no hydrogen 3.177 N/A HIS 40.A NE2 ARG 251.A O no hydrogen 2.912 N/A SER 42.A N HIS 40.A ND1 no hydrogen 3.204 N/A ALA 48.A N SER 38.A OG no hydrogen 2.641 N/A VAL 50.A N LEU 36.A O no hydrogen 2.900 N/A SER 53.A N ASP 51.A OD1 no hydrogen 2.986 N/A SER 53.A OG ASP 51.A OD1 no hydrogen 2.819 N/A SER 53.A OG ASP 51.A OD2 no hydrogen 3.431 N/A TRP 55.A N LEU 52.A O no hydrogen 2.897 N/A LEU 56.A N LEU 52.A O no hydrogen 3.115 N/A VAL 59.A N TRP 55.A O no hydrogen 3.077 N/A PHE 60.A N LEU 56.A O no hydrogen 3.079 N/A ALA 61.A N PRO 57.A O no hydrogen 3.032 N/A HIS 62.A N GLN 58.A O no hydrogen 2.884 N/A TRP 63.A N VAL 59.A O no hydrogen 2.912 N/A THR 64.A N PHE 60.A O no hydrogen 2.996 N/A THR 64.A OG1 PHE 60.A O no hydrogen 3.037 N/A ARG 65.A N ALA 61.A O no hydrogen 3.153 N/A ALA 66.A N HIS 62.A O no hydrogen 2.956 N/A GLN 67.A N THR 64.A O no hydrogen 2.924 N/A LEU 68.A N TRP 63.A O no hydrogen 3.224 N/A ASP 71.A N THR 2.A O no hydrogen 3.298 N/A GLN 72.A N THR 2.A O no hydrogen 3.249 N/A ALA 73.A N LEU 98.A O no hydrogen 2.995 N/A LEU 74.A N LEU 3.A O no hydrogen 2.917 N/A ILE 75.A N VAL 100.A O no hydrogen 2.962 N/A GLY 76.A N ALA 5.A O no hydrogen 2.887 N/A GLY 79.A N TYR 119.A OH no hydrogen 2.827 N/A LEU 83.A N SER 80.A OG no hydrogen 3.208 N/A CYS 84.A N SER 80.A O no hydrogen 3.121 N/A CYS 84.A SG SER 80.A O no hydrogen 3.520 N/A CYS 84.A SG TYR 119.A OH no hydrogen 3.671 N/A GLN 85.A N VAL 81.A O no hydrogen 3.143 N/A GLN 86.A N ALA 82.A O no hydrogen 3.072 N/A ILE 87.A N LEU 83.A O no hydrogen 2.986 N/A THR 88.A N CYS 84.A O no hydrogen 2.864 N/A THR 88.A OG1 CYS 84.A O no hydrogen 2.717 N/A THR 89.A N GLN 85.A O no hydrogen 3.096 N/A THR 89.A OG1 GLN 86.A O no hydrogen 3.360 N/A TYR 90.A N GLN 86.A O no hydrogen 3.158 N/A LEU 91.A N ILE 87.A O no hydrogen 2.931 N/A GLU 92.A N THR 88.A O no hydrogen 3.085 N/A GLN 93.A N THR 89.A O no hydrogen 3.232 N/A GLN 93.A N TYR 90.A O no hydrogen 3.139 N/A GLN 93.A NE2 THR 64.A OG1 no hydrogen 3.362 N/A GLN 94.A N LEU 91.A O no hydrogen 2.984 N/A SER 97.A N ASP 71.A O no hydrogen 3.041 N/A SER 97.A OG ASP 71.A O no hydrogen 3.209 N/A LEU 99.A N ASP 130.A OD1 no hydrogen 2.951 N/A VAL 100.A N ALA 73.A O no hydrogen 2.961 N/A VAL 101.A N VAL 131.A O no hydrogen 3.056 N/A ASP 102.A N ILE 75.A O no hydrogen 3.010 N/A VAL 104.A N ASP 102.A O no hydrogen 2.880 N/A LEU 105.A N GLU 138.A OE2 no hydrogen 3.116 N/A GLY 106.A N GLU 138.A OE2 no hydrogen 3.509 N/A ASP 107.A N GLN 110.A O no hydrogen 3.249 N/A LEU 108.A N ASP 107.A OD1 no hydrogen 2.935 N/A GLY 109.A N THR 137.A OG1 no hydrogen 2.893 N/A GLN 110.A N ASP 107.A O no hydrogen 3.163 N/A TYR 112.A N LEU 105.A O no hydrogen 2.914 N/A PHE 115.A N TYR 112.A O no hydrogen 3.222 N/A TYR 119.A N ASP 116.A O no hydrogen 3.060 N/A TYR 119.A N ASP 116.A OD1 no hydrogen 3.322 N/A VAL 120.A N ASP 116.A O no hydrogen 3.284 N/A ALA 121.A N GLN 117.A O no hydrogen 3.077 N/A ALA 122.A N ASP 118.A O no hydrogen 3.115 N/A ARG 123.A NE LEU 142.A O no hydrogen 2.816 N/A ARG 123.A NH2 LEU 141.A O no hydrogen 3.197 N/A ARG 123.A NH2 LEU 142.A O no hydrogen 3.225 N/A GLN 124.A N ALA 121.A O no hydrogen 3.264 N/A LEU 125.A N ALA 122.A O no hydrogen 3.142 N/A GLN 127.A N GLN 124.A O no hydrogen 3.319 N/A GLN 128.A NE2 THR 88.A O no hydrogen 3.105 N/A ALA 129.A N ILE 126.A O no hydrogen 3.022 N/A ASP 130.A N LEU 99.A O no hydrogen 2.844 N/A VAL 131.A N LEU 99.A O no hydrogen 3.398 N/A ILE 132.A N HIS 169.A O no hydrogen 3.061 N/A LEU 133.A N VAL 101.A O no hydrogen 3.215 N/A ASN 135.A N GLU 138.A OE1 no hydrogen 2.713 N/A ASN 135.A ND2 GLY 106.A O no hydrogen 2.945 N/A THR 136.A N ASP 174.A OD1 no hydrogen 3.148 N/A THR 136.A N ASP 174.A OD2 no hydrogen 3.406 N/A THR 136.A OG1 ASP 174.A OD1 no hydrogen 2.954 N/A GLU 138.A N ASN 135.A OD1 no hydrogen 2.746 N/A ALA 139.A N ASN 135.A O no hydrogen 2.874 N/A ALA 140.A N THR 136.A O no hydrogen 3.383 N/A LEU 141.A N THR 137.A O no hydrogen 3.058 N/A LEU 142.A N GLU 138.A O no hydrogen 2.779 N/A THR 143.A N ALA 139.A O no hydrogen 3.143 N/A THR 143.A OG1 ALA 139.A O no hydrogen 3.148 N/A THR 143.A OG1 ALA 140.A O no hydrogen 3.105 N/A GLY 144.A N LEU 141.A O no hydrogen 3.393 N/A ALA 145.A N THR 143.A OG1 no hydrogen 3.337 N/A GLU 154.A N ASP 152.A OD1 no hydrogen 3.124 N/A VAL 155.A N ASP 152.A O no hydrogen 2.811 N/A ILE 156.A N ASP 152.A O no hydrogen 2.934 N/A LEU 157.A N LEU 153.A O no hydrogen 3.094 N/A ALA 159.A N VAL 155.A O no hydrogen 3.220 N/A LEU 160.A N ILE 156.A O no hydrogen 3.023 N/A GLN 161.A N LEU 157.A O no hydrogen 2.976 N/A GLN 161.A NE2 ALA 168.A O no hydrogen 2.907 N/A ALA 162.A N PRO 158.A O no hydrogen 3.071 N/A GLN 163.A N LEU 160.A O no hydrogen 2.950 N/A GLN 163.A NE2 LEU 142.A O no hydrogen 3.133 N/A LEU 164.A N GLN 161.A O no hydrogen 3.028 N/A LYS 165.A NZ GLN 128.A O no hydrogen 2.977 N/A LYS 165.A NZ ASP 130.A OD2 no hydrogen 3.106 N/A ALA 168.A N LYS 165.A O no hydrogen 3.247 N/A HIS 169.A N ASP 130.A O no hydrogen 2.868 N/A ALA 170.A N GLN 161.A OE1 no hydrogen 2.925 N/A VAL 171.A N ILE 132.A O no hydrogen 3.060 N/A ILE 172.A N ALA 184.A O no hydrogen 2.895 N/A THR 173.A N PRO 134.A O no hydrogen 3.045 N/A THR 173.A OG1 PRO 134.A O no hydrogen 3.426 N/A VAL 175.A N GLY 182.A O no hydrogen 2.824 N/A ARG 177.A N GLN 180.A O no hydrogen 3.032 N/A GLN 180.A N ARG 177.A O no hydrogen 2.862 N/A ILE 181.A N ALA 197.A O no hydrogen 2.888 N/A GLY 182.A N VAL 175.A O no hydrogen 2.957 N/A CYS 183.A N CYS 195.A O no hydrogen 3.084 N/A CYS 183.A SG ASN 233.A OD1 no hydrogen 3.573 N/A ALA 184.A N ILE 172.A O no hydrogen 2.957 N/A TRP 185.A N GLN 193.A O no hydrogen 3.114 N/A ASP 187.A N HIS 191.A O no hydrogen 2.902 N/A ALA 189.A N ASP 187.A OD1 no hydrogen 2.869 N/A GLY 190.A N ASP 187.A O no hydrogen 2.815 N/A HIS 191.A N ASP 187.A OD1 no hydrogen 2.997 N/A GLN 193.A N TRP 185.A O no hydrogen 2.726 N/A TYR 194.A OH VAL 175.A O no hydrogen 2.993 N/A CYS 195.A N CYS 183.A O no hydrogen 3.024 N/A CYS 195.A SG CYS 195.A O no hydrogen 2.728 N/A CYS 195.A SG ASN 233.A OD1 no hydrogen 3.414 N/A ALA 197.A N ILE 181.A O no hydrogen 2.944 N/A ARG 199.A N ASP 179.A O no hydrogen 2.922 N/A ARG 199.A NH1 ALA 178.A O no hydrogen 3.527 N/A ARG 199.A NH2 ALA 178.A O no hydrogen 3.512 N/A TYR 204.A OH PRO 201.A O no hydrogen 2.797 N/A ASN 205.A ND2 ARG 251.A O no hydrogen 2.961 N/A THR 210.A N GLY 206.A O no hydrogen 2.990 N/A THR 210.A OG1 GLY 206.A O no hydrogen 3.485 N/A LEU 211.A N THR 207.A O no hydrogen 2.971 N/A ALA 212.A N GLY 208.A O no hydrogen 2.946 N/A ALA 213.A N ASP 209.A O no hydrogen 3.056 N/A VAL 214.A N THR 210.A O no hydrogen 2.905 N/A ILE 215.A N LEU 211.A O no hydrogen 2.965 N/A ALA 216.A N ALA 212.A O no hydrogen 2.933 N/A GLY 217.A N ALA 213.A O no hydrogen 2.963 N/A LEU 218.A N VAL 214.A O no hydrogen 3.014 N/A LEU 219.A N ILE 215.A O no hydrogen 3.102 N/A GLY 220.A N ALA 216.A O no hydrogen 2.934 N/A ARG 221.A N LEU 218.A O no hydrogen 3.044 N/A ARG 221.A NH2 ASN 267.A OD1 no hydrogen 2.416 N/A GLY 222.A N LEU 219.A O no hydrogen 2.994 N/A TYR 223.A N LEU 218.A O no hydrogen 3.292 N/A THR 228.A N PRO 224.A O no hydrogen 3.069 N/A THR 228.A OG1 TYR 223.A O no hydrogen 3.044 N/A THR 228.A OG1 PRO 224.A O no hydrogen 2.951 N/A LEU 229.A N LEU 225.A O no hydrogen 2.963 N/A ALA 230.A N ALA 226.A O no hydrogen 3.016 N/A ARG 231.A N PRO 227.A O no hydrogen 3.070 N/A ALA 232.A N THR 228.A O no hydrogen 2.967 N/A ASN 233.A N LEU 229.A O no hydrogen 3.182 N/A GLN 234.A N ALA 230.A O no hydrogen 3.252 N/A GLN 234.A NE2 GLN 234.A O no hydrogen 2.747 N/A TRP 235.A N ARG 231.A O no hydrogen 2.859 N/A LEU 236.A N ALA 232.A O no hydrogen 2.973 N/A ASN 237.A N ASN 233.A O no hydrogen 3.088 N/A ASN 237.A ND2 ARG 198.A O no hydrogen 2.929 N/A VAL 239.A N LEU 236.A O no hydrogen 2.836 N/A ALA 240.A N ASN 237.A O no hydrogen 2.959 N/A THR 242.A N ALA 238.A O no hydrogen 3.014 N/A THR 242.A OG1 ALA 238.A O no hydrogen 2.793 N/A ILE 243.A N VAL 239.A O no hydrogen 3.080 N/A ALA 244.A N ALA 240.A O no hydrogen 3.087 N/A GLN 245.A N GLU 241.A O no hydrogen 3.112 N/A GLN 245.A N THR 242.A O no hydrogen 3.172 N/A ASN 246.A N ILE 243.A O no hydrogen 3.030 N/A ARG 247.A NE GLN 245.A OE1 no hydrogen 2.878 N/A ARG 247.A NH1 GLY 253.A O no hydrogen 2.819 N/A ARG 247.A NH2 GLN 245.A OE1 no hydrogen 3.035 N/A ARG 247.A NH2 GLY 253.A O no hydrogen 3.314 N/A ARG 251.A N ASP 249.A OD1 no hydrogen 2.950 N/A ARG 251.A NE ASP 249.A OD1 no hydrogen 2.814 N/A ARG 251.A NE ASP 249.A OD2 no hydrogen 3.427 N/A ARG 251.A NH1 GLY 43.A O no hydrogen 2.976 N/A ARG 251.A NH2 ASP 249.A OD2 no hydrogen 2.838 N/A GLY 253.A N GLY 12.A O no hydrogen 2.840 N/A VAL 254.A N ASN 205.A O no hydrogen 3.051 N/A ALA 255.A N THR 242.A OG1 no hydrogen 2.926 N/A ASP 258.A N GLU 241.A OE1 no hydrogen 2.705 N/A LEU 260.A N LEU 256.A O no hydrogen 2.861 N/A GLN 261.A N GLY 257.A O no hydrogen 3.086 N/A ALA 262.A N ASP 258.A O no hydrogen 2.971 N/A ILE 263.A N LEU 259.A O no hydrogen 2.908 N/A LEU 264.A N LEU 260.A O no hydrogen 2.894 N/A ALA 265.A N GLN 261.A O no hydrogen 3.076 N/A LEU 266.A N ALA 262.A O no hydrogen 3.027 N/A ASN 267.A N ILE 263.A O no hydrogen 3.012 N/A ASN 267.A ND2 ALA 25.A O no hydrogen 2.919 N/A GLU 268.A N LEU 264.A O no hydrogen 3.336 N/A GLU 268.A N ALA 265.A O no hydrogen 3.105 N/A