Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1nzj_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): TYR 3.A OH GLU 184.A OE2 no hydrogen 2.663 N/A ILE 4.A N THR 183.A OG1 no hydrogen 2.972 N/A GLY 5.A N ARG 36.A O no hydrogen 2.943 N/A ARG 6.A NE ASP 177.A OD1 no hydrogen 2.781 N/A ARG 6.A NE ASP 177.A OD2 no hydrogen 3.397 N/A ARG 6.A NH2 ASP 177.A OD1 no hydrogen 3.550 N/A ARG 6.A NH2 ASP 177.A OD2 no hydrogen 2.917 N/A PHE 7.A N LEU 38.A O no hydrogen 2.914 N/A SER 10.A OG SER 12.A OG no hydrogen 3.386 N/A SER 12.A OG SER 10.A OG no hydrogen 3.386 N/A LEU 15.A N GLN 60.A OE1 no hydrogen 2.988 N/A HIS 16.A N SER 19.A OG no hydrogen 3.091 N/A SER 19.A OG HIS 16.A ND1 no hydrogen 3.112 N/A SER 19.A OG HIS 16.A O no hydrogen 3.347 N/A LEU 20.A N HIS 16.A O no hydrogen 2.970 N/A ILE 21.A N PHE 17.A O no hydrogen 3.097 N/A ALA 22.A N GLY 18.A O no hydrogen 3.447 N/A ALA 23.A N SER 19.A O no hydrogen 2.935 N/A LEU 24.A N LEU 20.A O no hydrogen 2.742 N/A GLY 25.A N ILE 21.A O no hydrogen 2.930 N/A SER 26.A N ALA 22.A O no hydrogen 3.098 N/A SER 26.A OG ALA 22.A O no hydrogen 2.975 N/A SER 26.A OG ALA 23.A O no hydrogen 2.988 N/A TYR 27.A N ALA 23.A O no hydrogen 2.953 N/A LEU 28.A N LEU 24.A O no hydrogen 2.835 N/A GLN 29.A N GLY 25.A O no hydrogen 3.092 N/A GLN 29.A NE2 GLU 184.A OE2 no hydrogen 2.816 N/A ALA 30.A N SER 26.A O no hydrogen 3.091 N/A ARG 31.A N TYR 27.A O no hydrogen 2.921 N/A ARG 31.A NH1 GLY 35.A O no hydrogen 3.112 N/A ARG 31.A NH1 ASP 69.A OD2 no hydrogen 2.848 N/A ARG 31.A NH2 HIS 67.A O no hydrogen 3.019 N/A ARG 31.A NH2 ASP 69.A OD1 no hydrogen 3.194 N/A ARG 31.A NH2 ASP 69.A OD2 no hydrogen 3.339 N/A ALA 32.A N LEU 28.A O no hydrogen 2.858 N/A ARG 33.A N GLN 29.A O no hydrogen 3.087 N/A GLN 34.A N ARG 31.A O no hydrogen 3.119 N/A GLY 35.A N ALA 30.A O no hydrogen 2.882 N/A ARG 36.A N TYR 3.A O no hydrogen 2.955 N/A TRP 37.A N ASP 69.A OD2 no hydrogen 2.979 N/A TRP 37.A NE1 SER 26.A OG no hydrogen 2.945 N/A LEU 38.A N GLY 5.A O no hydrogen 2.963 N/A ARG 40.A N PHE 7.A O no hydrogen 3.024 N/A ARG 40.A NH1 ASP 177.A OD1 no hydrogen 3.082 N/A ARG 40.A NH2 ASP 177.A OD1 no hydrogen 2.921 N/A ARG 40.A NH2 GLN 180.A OE1 no hydrogen 2.865 N/A ILE 41.A N LEU 73.A O no hydrogen 2.865 N/A GLU 42.A N PRO 9.A O no hydrogen 2.934 N/A ASP 45.A N GLU 49.A OE2 no hydrogen 3.046 N/A ARG 48.A N ASP 45.A O no hydrogen 2.879 N/A GLU 49.A N PRO 46.A O no hydrogen 3.223 N/A VAL 50.A N PRO 11.A O no hydrogen 3.122 N/A ALA 53.A N VAL 50.A O no hydrogen 3.039 N/A THR 56.A N GLY 52.A O no hydrogen 3.053 N/A THR 56.A OG1 GLY 52.A O no hydrogen 3.095 N/A ILE 57.A N ALA 53.A O no hydrogen 2.937 N/A LEU 58.A N ALA 54.A O no hydrogen 3.071 N/A ARG 59.A N GLU 55.A O no hydrogen 3.067 N/A GLN 60.A N THR 56.A O no hydrogen 2.889 N/A GLN 60.A NE2 LEU 15.A O no hydrogen 3.333 N/A LEU 61.A N ILE 57.A O no hydrogen 2.996 N/A GLU 62.A N LEU 58.A O no hydrogen 3.167 N/A HIS 63.A N ARG 59.A O no hydrogen 2.947 N/A HIS 63.A NE2 GLY 225.A O no hydrogen 2.793 N/A TYR 64.A N GLN 60.A O no hydrogen 3.042 N/A TYR 64.A N LEU 61.A O no hydrogen 3.252 N/A TYR 64.A OH PRO 223.A O no hydrogen 3.273 N/A GLY 65.A N GLU 62.A O no hydrogen 3.049 N/A LEU 66.A N LEU 61.A O no hydrogen 2.906 N/A ASP 69.A N TRP 37.A O no hydrogen 2.892 N/A LEU 73.A N VAL 39.A O no hydrogen 3.275 N/A GLN 75.A N ILE 41.A O no hydrogen 3.048 N/A SER 76.A N ASP 43.A OD1 no hydrogen 2.893 N/A SER 76.A OG ASP 43.A OD1 no hydrogen 3.348 N/A SER 76.A OG ASP 43.A OD2 no hydrogen 2.600 N/A GLN 77.A N TRP 74.A O no hydrogen 2.923 N/A ARG 78.A N GLN 75.A O no hydrogen 3.011 N/A ARG 78.A NE ASP 176.A OD1 no hydrogen 2.840 N/A ARG 78.A NH2 ASP 176.A OD1 no hydrogen 2.978 N/A HIS 79.A NE2 ILE 44.A O no hydrogen 3.027 N/A ALA 81.A N ASP 80.A OD1 no hydrogen 2.938 N/A TYR 82.A N ARG 78.A O no hydrogen 3.164 N/A TYR 82.A OH ASP 176.A OD2 no hydrogen 2.558 N/A ARG 83.A N HIS 79.A O no hydrogen 2.962 N/A GLU 84.A N ASP 80.A O no hydrogen 3.030 N/A ALA 85.A N ALA 81.A O no hydrogen 3.059 N/A LEU 86.A N TYR 82.A O no hydrogen 2.968 N/A ALA 87.A N ARG 83.A O no hydrogen 2.957 N/A TRP 88.A N GLU 84.A O no hydrogen 3.062 N/A LEU 89.A N ALA 85.A O no hydrogen 3.026 N/A HIS 90.A N LEU 86.A O no hydrogen 3.053 N/A GLU 91.A N ALA 87.A O no hydrogen 2.985 N/A GLN 92.A N TRP 88.A O no hydrogen 2.928 N/A GLY 93.A N HIS 90.A O no hydrogen 3.236 N/A LEU 94.A N LEU 89.A O no hydrogen 2.896 N/A TYR 96.A N ARG 129.A O no hydrogen 3.010 N/A TYR 96.A OH ASP 157.A OD2 no hydrogen 2.701 N/A CYS 98.A N ALA 127.A O no hydrogen 2.870 N/A CYS 98.A SG TYR 112.A OH no hydrogen 3.446 N/A CYS 100.A SG TYR 112.A OH no hydrogen 3.723 N/A CYS 100.A SG HIS 115.A ND1 no hydrogen 3.852 N/A ARG 104.A N THR 101.A OG1 no hydrogen 3.068 N/A ARG 104.A NH1 ASP 113.A OD1 no hydrogen 3.064 N/A ARG 104.A NH2 ASP 113.A OD1 no hydrogen 3.508 N/A ARG 104.A NH2 ASP 113.A OD2 no hydrogen 2.846 N/A ILE 105.A N THR 101.A O no hydrogen 3.255 N/A GLN 106.A N ARG 102.A O no hydrogen 2.965 N/A SER 107.A N ALA 103.A O no hydrogen 2.988 N/A SER 107.A OG ARG 104.A O no hydrogen 2.724 N/A ILE 108.A N ARG 104.A O no hydrogen 3.339 N/A ILE 108.A N ILE 105.A O no hydrogen 3.302 N/A GLY 109.A N GLN 106.A O no hydrogen 3.285 N/A GLY 110.A N ILE 105.A O no hydrogen 2.956 N/A TYR 112.A N GLU 156.A OE1 no hydrogen 2.883 N/A HIS 115.A N ASP 113.A OD1 no hydrogen 3.197 N/A CYS 116.A N TYR 112.A OH no hydrogen 2.790 N/A CYS 116.A SG TYR 112.A OH no hydrogen 3.406 N/A CYS 116.A SG HIS 115.A ND1 no hydrogen 3.631 N/A ARG 117.A N GLY 114.A O no hydrogen 3.045 N/A ARG 117.A NH1 GLN 132.A O no hydrogen 3.124 N/A ARG 117.A NH1 ASP 157.A OD2 no hydrogen 3.030 N/A ARG 117.A NH2 GLN 132.A O no hydrogen 3.122 N/A LEU 119.A N CYS 116.A O no hydrogen 3.183 N/A ALA 127.A N CYS 98.A O no hydrogen 2.970 N/A VAL 128.A N HIS 161.A O no hydrogen 2.890 N/A ARG 129.A N TYR 96.A O no hydrogen 2.929 N/A ARG 129.A NH1 ASP 157.A O no hydrogen 2.890 N/A ILE 130.A N PHE 158.A O no hydrogen 3.024 N/A ARG 131.A N LEU 94.A O no hydrogen 2.888 N/A ARG 131.A NE ARG 117.A O no hydrogen 3.481 N/A ARG 131.A NH2 ARG 117.A O no hydrogen 3.476 N/A GLN 132.A N ASP 157.A OD1 no hydrogen 3.081 N/A GLN 132.A NE2 ALA 154.A O no hydrogen 2.956 N/A GLN 132.A NE2 GLU 156.A O no hydrogen 2.927 N/A VAL 136.A N SER 200.A OG no hydrogen 3.016 N/A PHE 139.A N ILE 147.A O no hydrogen 3.074 N/A ASP 141.A N GLY 145.A O no hydrogen 2.876 N/A GLN 142.A N TYR 212.A O no hydrogen 2.834 N/A LEU 143.A N ASP 141.A OD1 no hydrogen 2.928 N/A ARG 144.A N ASP 141.A OD1 no hydrogen 2.912 N/A ARG 144.A NE HIS 214.A O no hydrogen 2.762 N/A ARG 144.A NH1 HIS 214.A O no hydrogen 3.130 N/A ARG 144.A NH1 SER 270.A O no hydrogen 2.885 N/A GLY 145.A N ASP 141.A O no hydrogen 2.934 N/A ILE 147.A N PHE 139.A O no hydrogen 2.882 N/A ALA 149.A N THR 137.A O no hydrogen 2.898 N/A ASP 150.A N GLU 193.A OE1 no hydrogen 3.032 N/A LEU 153.A N ASP 150.A OD1 no hydrogen 3.291 N/A ALA 154.A N ASP 150.A O no hydrogen 2.935 N/A ARG 155.A N GLU 151.A O no hydrogen 3.065 N/A GLU 156.A N LEU 153.A O no hydrogen 3.424 N/A ILE 160.A N VAL 128.A O no hydrogen 2.867 N/A HIS 161.A N VAL 128.A O no hydrogen 3.321 N/A ARG 162.A N LEU 166.A O no hydrogen 2.914 N/A ARG 162.A NE ASP 164.A OD2 no hydrogen 3.216 N/A ARG 162.A NH1 ASP 164.A OD1 no hydrogen 3.074 N/A ARG 163.A NH1 THR 99.A O no hydrogen 3.345 N/A GLY 165.A N ARG 162.A O no hydrogen 2.958 N/A LEU 166.A N ASP 164.A OD2 no hydrogen 3.311 N/A ALA 168.A N ILE 160.A O no hydrogen 3.280 N/A TYR 169.A OH GLU 42.A OE2 no hydrogen 2.939 N/A ALA 172.A N ALA 168.A O no hydrogen 3.060 N/A VAL 173.A N TYR 169.A O no hydrogen 2.926 N/A VAL 175.A N LEU 171.A O no hydrogen 3.090 N/A ASP 176.A N ALA 172.A O no hydrogen 2.925 N/A ASP 177.A N VAL 173.A O no hydrogen 2.917 N/A HIS 178.A N VAL 174.A O no hydrogen 3.005 N/A PHE 179.A N VAL 175.A O no hydrogen 3.011 N/A GLN 180.A N ASP 176.A O no hydrogen 2.964 N/A GLY 181.A N HIS 178.A O no hydrogen 3.089 N/A VAL 182.A N ASP 177.A O no hydrogen 3.001 N/A THR 183.A N ILE 4.A O no hydrogen 2.867 N/A THR 183.A OG1 ILE 4.A O no hydrogen 3.369 N/A GLU 184.A N ILE 4.A O no hydrogen 3.386 N/A ILE 185.A N ASP 211.A O no hydrogen 2.862 N/A ARG 187.A N ILE 213.A O no hydrogen 2.975 N/A ARG 187.A NE HIS 214.A NE2 no hydrogen 3.028 N/A ARG 187.A NH1 GLN 198.A OE1 no hydrogen 3.115 N/A ARG 187.A NH2 THR 195.A OG1 no hydrogen 2.916 N/A ARG 187.A NH2 GLN 198.A OE1 no hydrogen 2.983 N/A ALA 189.A N LEU 215.A O no hydrogen 2.912 N/A LEU 191.A N GLY 188.A O no hydrogen 3.113 N/A ILE 192.A N ALA 189.A O no hydrogen 3.288 N/A THR 195.A N ILE 192.A O no hydrogen 3.157 N/A THR 195.A OG1 LEU 191.A O no hydrogen 2.945 N/A THR 195.A OG1 ILE 192.A O no hydrogen 3.096 N/A ARG 197.A NE LEU 153.A O no hydrogen 3.078 N/A ARG 197.A NH2 LEU 153.A O no hydrogen 2.919 N/A GLN 198.A N PRO 194.A O no hydrogen 3.103 N/A ILE 199.A N THR 195.A O no hydrogen 2.907 N/A SER 200.A N VAL 196.A O no hydrogen 2.975 N/A SER 200.A OG GLN 132.A OE1 no hydrogen 3.433 N/A SER 200.A OG VAL 196.A O no hydrogen 3.102 N/A LEU 201.A N ARG 197.A O no hydrogen 3.057 N/A TYR 202.A N GLN 198.A O no hydrogen 2.972 N/A GLN 203.A N ILE 199.A O no hydrogen 3.031 N/A LEU 204.A N SER 200.A O no hydrogen 3.024 N/A PHE 205.A N LEU 201.A O no hydrogen 2.980 N/A GLY 206.A N GLN 203.A O no hydrogen 3.155 N/A TRP 207.A N TYR 202.A O no hydrogen 2.979 N/A ASP 211.A N THR 183.A O no hydrogen 3.024 N/A ILE 213.A N ILE 185.A O no hydrogen 2.913 N/A HIS 214.A N ASP 141.A OD2 no hydrogen 2.859 N/A HIS 214.A ND1 ASP 141.A OD2 no hydrogen 2.877 N/A LEU 215.A N ARG 187.A O no hydrogen 2.788 N/A LEU 217.A N ALA 271.A O no hydrogen 2.947 N/A LEU 219.A N VAL 273.A O no hydrogen 3.204 N/A LEU 222.A N LEU 15.A O no hydrogen 3.087 N/A ARG 228.A N ASP 226.A OD1 no hydrogen 3.057 N/A ARG 228.A NE ASP 226.A OD1 no hydrogen 3.049 N/A ARG 228.A NE ASP 226.A OD2 no hydrogen 3.391 N/A ARG 228.A NH1 ASP 226.A OD2 no hydrogen 2.802 N/A ARG 228.A NH2 GLN 247.A O no hydrogen 3.122 N/A ARG 228.A NH2 PHE 249.A O no hydrogen 2.887 N/A LEU 231.A N PRO 227.A O no hydrogen 3.011 N/A ILE 232.A N ARG 228.A O no hydrogen 2.948 N/A ALA 233.A N PRO 229.A O no hydrogen 3.025 N/A ALA 234.A N VAL 230.A O no hydrogen 2.964 N/A LEU 235.A N LEU 231.A O no hydrogen 2.920 N/A GLN 236.A N ILE 232.A O no hydrogen 2.969 N/A PHE 237.A N ALA 233.A O no hydrogen 2.956 N/A LEU 238.A N ALA 234.A O no hydrogen 3.082 N/A GLY 239.A N GLN 236.A O no hydrogen 2.947 N/A GLN 240.A N LEU 235.A O no hydrogen 2.937 N/A GLN 247.A N GLN 247.A OE1 no hydrogen 2.936 N/A ASP 248.A N HIS 245.A O no hydrogen 3.225 N/A PHE 249.A N TRP 246.A O no hydrogen 3.152 N/A SER 250.A N GLN 253.A OE1 no hydrogen 3.017 N/A SER 250.A OG GLN 253.A OE1 no hydrogen 3.532 N/A GLU 252.A N GLU 252.A OE1 no hydrogen 2.857 N/A GLN 253.A N SER 250.A OG no hydrogen 3.211 N/A ILE 254.A N SER 250.A O no hydrogen 3.036 N/A LEU 255.A N VAL 251.A O no hydrogen 2.939 N/A GLN 256.A N GLU 252.A O no hydrogen 2.985 N/A SER 257.A N GLN 253.A O no hydrogen 3.102 N/A ALA 258.A N ILE 254.A O no hydrogen 2.985 N/A VAL 259.A N LEU 255.A O no hydrogen 2.895 N/A LYS 260.A N GLN 256.A O no hydrogen 3.210 N/A ASN 261.A N SER 257.A O no hydrogen 2.931 N/A TRP 262.A N VAL 259.A O no hydrogen 3.281 N/A TRP 262.A NE1 GLN 29.A OE1 no hydrogen 2.898 N/A ALA 266.A N ARG 263.A O no hydrogen 3.146 N/A VAL 267.A N LEU 264.A O no hydrogen 3.049 N/A VAL 273.A N LEU 217.A O no hydrogen 2.887 N/A