Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 5ew3_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): TYR 2.A OH GLU 8.A OE1 no hydrogen 2.779 N/A SER 5.A OG ASP 3.A OD1 no hydrogen 2.727 N/A LYS 6.A N ASP 3.A OD1 no hydrogen 3.306 N/A TRP 7.A N ASP 3.A O no hydrogen 3.220 N/A GLU 8.A N ALA 4.A O no hydrogen 2.830 N/A PHE 9.A N ALA 84.A O no hydrogen 2.838 N/A ARG 11.A NE PRO 91.A O no hydrogen 2.998 N/A ARG 11.A NH1 LYS 87.A O no hydrogen 2.820 N/A ARG 11.A NH2 LYS 87.A O no hydrogen 2.870 N/A ARG 11.A NH2 PRO 91.A O no hydrogen 2.831 N/A ARG 13.A N PRO 10.A O no hydrogen 3.068 N/A ARG 13.A NE PHE 34.A O no hydrogen 2.928 N/A ARG 13.A NH2 PHE 34.A O no hydrogen 3.172 N/A ARG 13.A NH2 GLY 35.A O no hydrogen 2.956 N/A LEU 14.A N ARG 11.A O no hydrogen 3.270 N/A LYS 15.A N ASP 32.A O no hydrogen 3.052 N/A GLY 17.A N GLU 30.A O no hydrogen 2.778 N/A LEU 20.A N VAL 28.A O no hydrogen 2.797 N/A GLY 21.A N VAL 28.A O no hydrogen 3.321 N/A GLY 23.A N GLY 26.A O no hydrogen 3.125 N/A GLN 27.A N MET 49.A O no hydrogen 3.239 N/A VAL 28.A N GLY 21.A O no hydrogen 2.802 N/A ILE 29.A N VAL 47.A O no hydrogen 2.906 N/A GLU 30.A N LYS 18.A O no hydrogen 2.813 N/A ALA 31.A N VAL 45.A O no hydrogen 2.906 N/A ASP 32.A N LYS 15.A O no hydrogen 3.088 N/A ALA 33.A N ARG 43.A O no hydrogen 2.803 N/A PHE 34.A N ARG 13.A O no hydrogen 3.009 N/A GLY 35.A N THR 41.A O no hydrogen 2.792 N/A THR 39.A OG1 ASP 37.A O no hydrogen 2.879 N/A THR 39.A OG1 THR 41.A OG1 no hydrogen 3.207 N/A THR 41.A OG1 THR 39.A OG1 no hydrogen 3.207 N/A ARG 43.A N ALA 33.A O no hydrogen 2.993 N/A ARG 43.A NH1 ASP 37.A OD1 no hydrogen 2.921 N/A ARG 43.A NH1 ASP 37.A OD2 no hydrogen 3.124 N/A THR 44.A OG1 ASP 32.A OD1 no hydrogen 3.254 N/A VAL 45.A N ALA 31.A O no hydrogen 2.765 N/A ALA 46.A N VAL 96.A O no hydrogen 3.013 N/A VAL 47.A N ILE 29.A O no hydrogen 2.818 N/A LYS 48.A N VAL 94.A O no hydrogen 3.000 N/A LYS 48.A NZ GLU 65.A OE1 no hydrogen 3.197 N/A LYS 48.A NZ GLU 65.A OE2 no hydrogen 2.964 N/A LYS 48.A NZ ASP 170.A O no hydrogen 2.741 N/A LYS 48.A NZ PHE 171.A O no hydrogen 3.221 N/A MET 49.A N GLN 27.A O no hydrogen 3.145 N/A LEU 50.A N LEU 92.A O no hydrogen 3.405 N/A LYS 51.A NZ ALA 24.A O no hydrogen 3.133 N/A THR 55.A N GLU 58.A OE1 no hydrogen 3.055 N/A THR 55.A OG1 GLU 58.A OE1 no hydrogen 3.130 N/A HIS 59.A N THR 55.A O no hydrogen 3.097 N/A ARG 60.A N HIS 56.A O no hydrogen 3.038 N/A ALA 61.A N SER 57.A O no hydrogen 3.080 N/A LEU 62.A N GLU 58.A O no hydrogen 3.093 N/A MET 63.A N HIS 59.A O no hydrogen 3.062 N/A SER 64.A N ARG 60.A O no hydrogen 2.824 N/A SER 64.A OG ARG 60.A O no hydrogen 2.722 N/A GLU 65.A N ALA 61.A O no hydrogen 3.026 N/A LEU 66.A N LEU 62.A O no hydrogen 3.067 N/A LYS 67.A N MET 63.A O no hydrogen 3.047 N/A ILE 68.A N SER 64.A O no hydrogen 2.817 N/A LEU 69.A N GLU 65.A O no hydrogen 2.917 N/A ILE 70.A N LEU 66.A O no hydrogen 2.999 N/A HIS 71.A N LYS 67.A O no hydrogen 3.007 N/A HIS 71.A NE2 ARG 146.A O no hydrogen 2.756 N/A ILE 72.A N ILE 68.A O no hydrogen 2.888 N/A GLY 73.A N LEU 69.A O no hydrogen 3.437 N/A ASN 77.A N HIS 75.A ND1 no hydrogen 2.937 N/A ASN 77.A ND2 VAL 166.A O no hydrogen 2.997 N/A VAL 78.A N HIS 75.A O no hydrogen 3.332 N/A VAL 79.A N ILE 168.A O no hydrogen 2.909 N/A ASN 80.A N GLU 97.A OE2 no hydrogen 2.850 N/A LEU 82.A N ILE 95.A O no hydrogen 2.861 N/A GLY 83.A N ILE 95.A O no hydrogen 3.281 N/A ALA 84.A N TRP 7.A O no hydrogen 2.799 N/A CYS 85.A N MET 93.A O no hydrogen 2.970 N/A CYS 85.A SG PHE 9.A O no hydrogen 3.348 N/A THR 86.A N GLU 8.A OE2 no hydrogen 3.048 N/A THR 86.A OG1 GLU 8.A OE1 no hydrogen 2.679 N/A LYS 87.A N GLU 8.A OE2 no hydrogen 3.168 N/A MET 93.A N CYS 85.A O no hydrogen 3.070 N/A VAL 94.A N LYS 48.A O no hydrogen 2.989 N/A ILE 95.A N GLY 83.A O no hydrogen 2.995 N/A VAL 96.A N ALA 46.A O no hydrogen 3.012 N/A GLU 97.A N ASN 80.A O no hydrogen 2.889 N/A CYS 99.A SG SER 161.A OG no hydrogen 3.202 N/A PHE 101.A N LEU 160.A O no hydrogen 3.211 N/A ASN 103.A ND2 THR 106.A OG1 no hydrogen 3.087 N/A LEU 104.A N ILE 158.A O no hydrogen 2.790 N/A SER 105.A OG GLY 208.A O no hydrogen 3.469 N/A THR 106.A N ASN 103.A OD1 no hydrogen 2.941 N/A THR 106.A OG1 ASN 103.A OD1 no hydrogen 3.237 N/A TYR 107.A N ASN 103.A O no hydrogen 3.185 N/A LEU 108.A N LEU 104.A O no hydrogen 2.864 N/A ARG 109.A N SER 105.A O no hydrogen 3.209 N/A ARG 109.A NE SER 105.A O no hydrogen 3.235 N/A SER 110.A N TYR 107.A O no hydrogen 3.262 N/A SER 110.A OG TYR 107.A O no hydrogen 2.731 N/A LYS 111.A N LEU 108.A O no hydrogen 3.197 N/A LYS 111.A NZ ASP 122.A O no hydrogen 2.809 N/A ARG 112.A NE LEU 207.A O no hydrogen 2.950 N/A ARG 112.A NH2 SER 206.A O no hydrogen 3.545 N/A ARG 112.A NH2 LEU 207.A O no hydrogen 3.039 N/A GLU 114.A N LYS 111.A O no hydrogen 3.113 N/A VAL 116.A N LEU 124.A O no hydrogen 3.267 N/A LYS 119.A NZ LYS 121.A O no hydrogen 3.271 N/A LEU 124.A N GLU 114.A O no hydrogen 2.881 N/A THR 125.A N HIS 128.A ND1 no hydrogen 3.332 N/A THR 125.A OG1 HIS 128.A ND1 no hydrogen 2.732 N/A LEU 126.A N PRO 117.A O no hydrogen 3.064 N/A HIS 128.A ND1 THR 125.A OG1 no hydrogen 2.732 N/A LEU 129.A N THR 125.A O no hydrogen 3.396 N/A ILE 130.A N LEU 126.A O no hydrogen 2.938 N/A CYS 131.A N GLU 127.A O no hydrogen 2.836 N/A TYR 132.A N HIS 128.A O no hydrogen 2.912 N/A TYR 132.A OH ASN 164.A OD1 no hydrogen 2.749 N/A SER 133.A N LEU 129.A O no hydrogen 3.213 N/A SER 133.A OG LEU 129.A O no hydrogen 2.773 N/A PHE 134.A N ILE 130.A O no hydrogen 2.897 N/A GLN 135.A N CYS 131.A O no hydrogen 2.936 N/A GLN 135.A NE2 CYS 131.A O no hydrogen 3.645 N/A GLN 135.A NE2 ASN 164.A O no hydrogen 2.995 N/A VAL 136.A N TYR 132.A O no hydrogen 3.066 N/A ALA 137.A N SER 133.A O no hydrogen 3.023 N/A LYS 138.A N PHE 134.A O no hydrogen 2.996 N/A GLY 139.A N GLN 135.A O no hydrogen 3.088 N/A MET 140.A N VAL 136.A O no hydrogen 2.873 N/A GLU 141.A N ALA 137.A O no hydrogen 2.800 N/A PHE 142.A N LYS 138.A O no hydrogen 3.029 N/A LEU 143.A N GLY 139.A O no hydrogen 3.021 N/A ALA 144.A N MET 140.A O no hydrogen 2.987 N/A SER 145.A N GLU 141.A O no hydrogen 3.069 N/A SER 145.A OG PHE 142.A O no hydrogen 2.733 N/A ARG 146.A N PHE 142.A O no hydrogen 3.169 N/A ARG 146.A N LEU 143.A O no hydrogen 3.283 N/A ARG 146.A NE HIS 71.A O no hydrogen 3.077 N/A ARG 146.A NE ILE 72.A O no hydrogen 3.209 N/A ARG 146.A NH1 HIS 71.A O no hydrogen 2.798 N/A LYS 147.A N ALA 144.A O no hydrogen 2.995 N/A CYS 148.A N LEU 143.A O no hydrogen 2.858 N/A CYS 148.A SG ARG 146.A O no hydrogen 3.675 N/A HIS 150.A N ASP 193.A OD2 no hydrogen 2.871 N/A HIS 150.A NE2 CYS 169.A O no hydrogen 2.795 N/A ASP 152.A N HIS 150.A ND1 no hydrogen 3.219 N/A ALA 155.A N GLU 203.A OE2 no hydrogen 3.024 N/A ARG 156.A NH1 ASP 152.A OD1 no hydrogen 2.795 N/A ASN 157.A N ALA 154.A O no hydrogen 2.860 N/A ASN 157.A ND2 ASP 152.A O no hydrogen 2.795 N/A ASN 157.A ND2 ASP 152.A OD2 no hydrogen 2.978 N/A ILE 158.A N ALA 155.A O no hydrogen 3.029 N/A LEU 159.A N LYS 167.A O no hydrogen 2.903 N/A LEU 160.A N GLY 102.A O no hydrogen 2.852 N/A SER 161.A N VAL 165.A O no hydrogen 2.801 N/A VAL 166.A N GLN 135.A OE1 no hydrogen 2.879 N/A LYS 167.A N LEU 159.A O no hydrogen 2.806 N/A LYS 167.A NZ LEU 76.A O no hydrogen 2.795 N/A LYS 167.A NZ GLU 97.A OE2 no hydrogen 3.560 N/A ILE 168.A N ASN 77.A O no hydrogen 2.850 N/A CYS 169.A N ASN 157.A O no hydrogen 2.943 N/A CYS 169.A SG ASN 157.A O no hydrogen 3.374 N/A PHE 171.A N ASN 157.A OD1 no hydrogen 3.151 N/A GLY 172.A N ASP 170.A OD1 no hydrogen 3.273 N/A LEU 175.A N LEU 173.A O no hydrogen 2.876 N/A LYS 176.A NZ PRO 211.A O no hydrogen 2.764 N/A TRP 177.A N PRO 174.A O no hydrogen 3.174 N/A TRP 177.A NE1 GLU 203.A OE2 no hydrogen 2.801 N/A MET 178.A N LEU 175.A O no hydrogen 3.328 N/A GLU 181.A N GLU 181.A OE1 no hydrogen 2.848 N/A THR 182.A N ALA 179.A O no hydrogen 3.032 N/A THR 182.A OG1 VAL 187.A O no hydrogen 2.782 N/A ILE 183.A N ALA 179.A O no hydrogen 3.145 N/A PHE 184.A N PRO 180.A O no hydrogen 2.882 N/A ASP 185.A N GLU 181.A O no hydrogen 3.080 N/A VAL 187.A N GLU 181.A O no hydrogen 3.075 N/A THR 189.A N SER 192.A OG no hydrogen 2.889 N/A GLN 191.A NE2 PRO 253.A O no hydrogen 2.949 N/A GLN 191.A NE2 ARG 256.A O no hydrogen 3.145 N/A GLN 191.A NE2 PRO 257.A O no hydrogen 3.430 N/A SER 192.A N THR 189.A O no hydrogen 3.256 N/A SER 192.A OG THR 189.A O no hydrogen 2.695 N/A VAL 194.A N ILE 190.A O no hydrogen 3.310 N/A SER 196.A N SER 192.A O no hydrogen 3.328 N/A SER 196.A OG TRP 177.A O no hydrogen 2.716 N/A SER 196.A OG SER 192.A O no hydrogen 3.321 N/A PHE 197.A N ASP 193.A O no hydrogen 2.849 N/A GLY 198.A N VAL 194.A O no hydrogen 3.121 N/A VAL 199.A N TRP 195.A O no hydrogen 3.262 N/A LEU 200.A N SER 196.A O no hydrogen 2.909 N/A LEU 201.A N PHE 197.A O no hydrogen 2.802 N/A TRP 202.A N GLY 198.A O no hydrogen 3.134 N/A TRP 202.A NE1 ARG 232.A O no hydrogen 2.996 N/A GLU 203.A N VAL 199.A O no hydrogen 2.968 N/A ILE 204.A N LEU 200.A O no hydrogen 2.997 N/A PHE 205.A N LEU 201.A O no hydrogen 2.992 N/A SER 206.A OG TRP 202.A O no hydrogen 2.791 N/A SER 206.A OG GLU 203.A O no hydrogen 3.097 N/A LEU 207.A N ILE 204.A O no hydrogen 3.279 N/A GLY 208.A N GLU 203.A O no hydrogen 2.889 N/A ALA 209.A N SER 206.A OG no hydrogen 3.320 N/A VAL 215.A N TYR 212.A O no hydrogen 3.415 N/A PHE 221.A N ASP 218.A OD1 no hydrogen 3.504 N/A CYS 222.A N ASP 218.A O no hydrogen 3.409 N/A CYS 222.A SG ASP 218.A O no hydrogen 3.169 N/A ARG 223.A N GLU 219.A O no hydrogen 2.949 N/A ARG 224.A N GLU 220.A O no hydrogen 2.883 N/A LEU 225.A N PHE 221.A O no hydrogen 3.090 N/A LYS 226.A N CYS 222.A O no hydrogen 3.155 N/A GLU 227.A N ARG 223.A O no hydrogen 3.002 N/A GLY 228.A N LEU 225.A O no hydrogen 3.167 N/A THR 229.A N ARG 224.A O no hydrogen 2.948 N/A THR 229.A OG1 ARG 224.A O no hydrogen 2.953 N/A ARG 230.A NE TRP 249.A O no hydrogen 2.823 N/A ARG 230.A NH1 LEU 225.A O no hydrogen 3.053 N/A ARG 230.A NH1 THR 229.A O no hydrogen 2.846 N/A ARG 230.A NH2 TRP 249.A O no hydrogen 2.824 N/A TYR 236.A N PHE 205.A O no hydrogen 2.933 N/A THR 237.A N PRO 234.A O no hydrogen 3.525 N/A THR 237.A OG1 THR 238.A O no hydrogen 3.140 N/A THR 238.A OG1 GLU 240.A OE1 no hydrogen 3.139 N/A GLU 240.A N GLU 240.A OE1 no hydrogen 2.809 N/A MET 241.A N THR 238.A OG1 no hydrogen 3.359 N/A TYR 242.A N THR 238.A O no hydrogen 3.213 N/A TYR 242.A OH MET 231.A O no hydrogen 2.721 N/A GLN 243.A N PRO 239.A O no hydrogen 3.226 N/A THR 244.A N GLU 240.A O no hydrogen 3.056 N/A THR 244.A OG1 GLU 240.A O no hydrogen 2.738 N/A THR 244.A OG1 HIS 265.A NE2 no hydrogen 2.968 N/A MET 245.A N MET 241.A O no hydrogen 3.183 N/A LEU 246.A N TYR 242.A O no hydrogen 3.086 N/A ASP 247.A N GLN 243.A O no hydrogen 2.864 N/A CYS 248.A N THR 244.A O no hydrogen 3.078 N/A CYS 248.A SG THR 244.A O no hydrogen 3.173 N/A TRP 249.A N MET 245.A O no hydrogen 2.947 N/A HIS 250.A N ASP 247.A O no hydrogen 3.437 N/A GLN 255.A N GLU 252.A O no hydrogen 3.020 N/A ARG 256.A N PRO 253.A O no hydrogen 3.357 N/A ARG 256.A NE HIS 250.A O no hydrogen 2.710 N/A ARG 256.A NH1 GLU 181.A OE2 no hydrogen 2.787 N/A ARG 256.A NH1 GLN 191.A O no hydrogen 2.842 N/A ARG 256.A NH2 GLU 181.A OE1 no hydrogen 2.915 N/A ARG 256.A NH2 HIS 250.A O no hydrogen 3.190 N/A THR 258.A N GLU 261.A OE2 no hydrogen 3.443 N/A SER 260.A OG GLU 141.A OE2 no hydrogen 2.854 N/A GLU 261.A N THR 258.A OG1 no hydrogen 3.372 N/A LEU 262.A N THR 258.A O no hydrogen 3.061 N/A VAL 263.A N PHE 259.A O no hydrogen 2.921 N/A GLU 264.A N SER 260.A O no hydrogen 3.287 N/A HIS 265.A N GLU 261.A O no hydrogen 2.893 N/A HIS 265.A NE2 THR 244.A OG1 no hydrogen 2.968 N/A LEU 266.A N LEU 262.A O no hydrogen 2.840 N/A GLY 267.A N VAL 263.A O no hydrogen 2.985 N/A ASN 268.A N GLU 264.A O no hydrogen 3.150 N/A LEU 269.A N HIS 265.A O no hydrogen 3.214 N/A LEU 270.A N LEU 266.A O no hydrogen 3.158 N/A ALA 272.A N ASN 268.A O no hydrogen 2.993 N/A ASN 273.A N LEU 269.A O no hydrogen 2.973 N/A ALA 274.A N GLN 271.A O no hydrogen 3.025 N/A