Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3pw8_C.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ARG 5.A N THR 1.A O no hydrogen 2.729 N/A PHE 6.A N GLN 2.A O no hydrogen 3.417 N/A GLU 7.A N GLU 3.A O no hydrogen 3.130 N/A ARG 9.A N ARG 5.A O no hydrogen 3.007 N/A ILE 10.A N PHE 6.A O no hydrogen 2.968 N/A ALA 11.A N GLN 8.A O no hydrogen 2.778 N/A GLN 12.A N GLN 8.A O no hydrogen 2.894 N/A GLU 13.A N ARG 9.A O no hydrogen 2.684 N/A THR 14.A N ARG 9.A O no hydrogen 3.231 N/A ILE 16.A N SER 139.A O no hydrogen 3.102 N/A GLU 17.A N ASP 20.A OD2 no hydrogen 3.257 N/A ASP 20.A N GLU 17.A O no hydrogen 2.966 N/A TYR 26.A OH SER 139.A OG no hydrogen 2.790 N/A ARG 27.A N PRO 23.A O no hydrogen 3.134 N/A ARG 27.A NH1 LEU 85.A O no hydrogen 3.324 N/A LYS 28.A N ASP 24.A O no hydrogen 3.128 N/A THR 29.A N ALA 25.A O no hydrogen 3.054 N/A LEU 30.A N TYR 26.A O no hydrogen 3.307 N/A LEU 30.A N ARG 27.A O no hydrogen 3.133 N/A ILE 31.A N ARG 27.A O no hydrogen 3.018 N/A ARG 32.A N LYS 28.A O no hydrogen 3.162 N/A ARG 32.A NH2 THR 29.A OG1 no hydrogen 3.232 N/A GLN 33.A N THR 29.A O no hydrogen 2.969 N/A GLN 33.A NE2 TYR 143.A OH no hydrogen 3.347 N/A ILE 34.A N LEU 30.A O no hydrogen 2.952 N/A GLY 35.A N ILE 31.A O no hydrogen 2.750 N/A GLN 36.A N ARG 32.A O no hydrogen 3.080 N/A HIS 37.A N GLN 33.A O no hydrogen 2.997 N/A HIS 37.A ND1 TYR 143.A OH no hydrogen 2.905 N/A HIS 37.A NE2 GLN 132.A OE1 no hydrogen 3.241 N/A ALA 38.A N ILE 34.A O no hydrogen 3.097 N/A HIS 39.A N GLY 35.A O no hydrogen 2.932 N/A HIS 39.A ND1 TYR 79.A OH no hydrogen 2.772 N/A SER 40.A N GLN 36.A O no hydrogen 2.970 N/A SER 40.A OG GLN 36.A O no hydrogen 2.831 N/A GLU 41.A N HIS 37.A O no hydrogen 3.387 N/A ILE 42.A N ALA 38.A O no hydrogen 3.101 N/A VAL 43.A N HIS 39.A O no hydrogen 2.938 N/A GLY 44.A N SER 40.A O no hydrogen 2.844 N/A MET 45.A N ILE 42.A O no hydrogen 3.205 N/A LEU 46.A N VAL 43.A O no hydrogen 2.809 N/A GLY 49.A N MET 45.A O no hydrogen 2.600 N/A ASN 50.A N LEU 46.A O no hydrogen 2.921 N/A TRP 51.A N GLU 48.A O no hydrogen 3.241 N/A TRP 51.A NE1 THR 111.A O no hydrogen 2.974 N/A ILE 52.A N GLY 49.A O no hydrogen 3.067 N/A ARG 54.A N TRP 51.A O no hydrogen 3.197 N/A ARG 54.A NH2 ASN 50.A O no hydrogen 2.767 N/A ARG 54.A NH2 ASN 50.A OD1 no hydrogen 3.166 N/A ALA 55.A N ILE 52.A O no hydrogen 3.358 N/A ARG 60.A N THR 57.A OG1 no hydrogen 3.029 N/A LYS 61.A N THR 57.A O no hydrogen 2.834 N/A LYS 61.A NZ ILE 52.A O no hydrogen 3.221 N/A LYS 61.A NZ THR 53.A O no hydrogen 3.329 N/A ALA 62.A N LEU 58.A O no hydrogen 2.885 N/A ILE 63.A N ARG 59.A O no hydrogen 3.080 N/A LEU 64.A N ARG 60.A O no hydrogen 3.046 N/A LEU 65.A N LYS 61.A O no hydrogen 2.906 N/A ALA 66.A N ALA 62.A O no hydrogen 2.871 N/A LYS 67.A N ILE 63.A O no hydrogen 2.862 N/A LYS 67.A NZ GLU 48.A OE2 no hydrogen 2.680 N/A LYS 67.A NZ GLU 71.A OE2 no hydrogen 3.016 N/A LYS 67.A NZ ASP 125.A OD1 no hydrogen 2.873 N/A LYS 67.A NZ ASP 125.A OD2 no hydrogen 3.262 N/A VAL 68.A N LEU 64.A O no hydrogen 3.013 N/A GLN 69.A N LEU 65.A O no hydrogen 2.991 N/A ASP 70.A N ALA 66.A O no hydrogen 2.908 N/A GLU 71.A N LYS 67.A O no hydrogen 2.996 N/A ALA 72.A N VAL 68.A O no hydrogen 3.244 N/A GLY 73.A N GLN 69.A O no hydrogen 3.197 N/A HIS 74.A N ASP 70.A O no hydrogen 3.009 N/A HIS 74.A NE2 GLU 153.A OE1 no hydrogen 2.635 N/A GLY 75.A N GLU 71.A O no hydrogen 2.924 N/A LEU 76.A N ALA 72.A O no hydrogen 3.087 N/A TYR 77.A N GLY 73.A O no hydrogen 3.033 N/A LEU 78.A N HIS 74.A O no hydrogen 3.114 N/A TYR 79.A N GLY 75.A O no hydrogen 2.911 N/A TYR 79.A OH HIS 39.A ND1 no hydrogen 2.772 N/A SER 80.A N LEU 76.A O no hydrogen 3.041 N/A ALA 81.A N TYR 77.A O no hydrogen 3.007 N/A ALA 82.A N LEU 78.A O no hydrogen 2.883 N/A GLU 83.A N TYR 79.A O no hydrogen 2.755 N/A THR 84.A N SER 80.A O no hydrogen 3.192 N/A THR 84.A N ALA 81.A O no hydrogen 3.239 N/A THR 84.A OG1 ALA 81.A O no hydrogen 2.755 N/A THR 84.A OG1 TYR 140.A OH no hydrogen 2.785 N/A LEU 85.A N ALA 82.A O no hydrogen 3.084 N/A GLY 86.A N GLU 83.A O no hydrogen 3.078 N/A CYS 87.A SG ALA 82.A O no hydrogen 3.200 N/A ARG 89.A N GLU 83.A OE2 no hydrogen 2.811 N/A ILE 92.A N ALA 88.A O no hydrogen 3.210 N/A TYR 93.A N ARG 89.A O no hydrogen 3.035 N/A GLN 94.A N GLU 90.A O no hydrogen 3.111 N/A LYS 95.A N ILE 92.A O no hydrogen 3.070 N/A MET 96.A N ILE 92.A O no hydrogen 3.039 N/A LEU 97.A N TYR 93.A O no hydrogen 3.164 N/A ASP 98.A N GLN 94.A O no hydrogen 3.101 N/A GLY 99.A N MET 96.A O no hydrogen 3.017 N/A ARG 100.A N LYS 95.A O no hydrogen 2.908 N/A ARG 100.A NH2 ASP 98.A OD2 no hydrogen 3.098 N/A MET 101.A N LYS 95.A O no hydrogen 3.310 N/A LYS 102.A N GLN 36.A OE1 no hydrogen 3.376 N/A TYR 103.A OH ASN 108.A OD1 no hydrogen 2.524 N/A SER 104.A N SER 40.A OG no hydrogen 2.843 N/A PHE 107.A N SER 104.A O no hydrogen 3.347 N/A ASN 108.A N SER 105.A O no hydrogen 3.184 N/A ASN 108.A ND2 SER 105.A O no hydrogen 2.982 N/A TYR 109.A OH GLU 262.A OE2 no hydrogen 2.831 N/A THR 111.A OG1 PRO 47.A O no hydrogen 2.984 N/A THR 111.A OG1 ASN 50.A OD1 no hydrogen 3.209 N/A LEU 112.A N ASP 116.A OD2 no hydrogen 2.787 N/A SER 113.A OG ASP 116.A OD1 no hydrogen 3.069 N/A ASP 116.A N SER 113.A OG no hydrogen 3.416 N/A ILE 117.A N TRP 114.A O no hydrogen 3.025 N/A VAL 119.A N ALA 115.A O no hydrogen 2.935 N/A ILE 120.A N ASP 116.A O no hydrogen 2.801 N/A GLY 121.A N ILE 117.A O no hydrogen 2.862 N/A TRP 122.A N GLY 118.A O no hydrogen 2.827 N/A TRP 122.A N VAL 119.A O no hydrogen 3.253 N/A TRP 122.A NE1 GLN 231.A OE1 no hydrogen 2.851 N/A LEU 123.A N VAL 119.A O no hydrogen 2.721 N/A ASP 125.A N ILE 120.A O no hydrogen 2.922 N/A GLY 126.A N TRP 122.A O no hydrogen 3.172 N/A ALA 127.A N LEU 123.A O no hydrogen 2.762 N/A ALA 128.A N VAL 124.A O no hydrogen 3.107 N/A ILE 129.A N ASP 125.A O no hydrogen 2.809 N/A VAL 130.A N GLY 126.A O no hydrogen 2.983 N/A ASN 131.A N ALA 127.A O no hydrogen 3.358 N/A GLN 132.A N ALA 128.A O no hydrogen 2.897 N/A GLN 132.A NE2 GLU 154.A OE1 no hydrogen 3.337 N/A VAL 133.A N ILE 129.A O no hydrogen 2.803 N/A ALA 134.A N VAL 130.A O no hydrogen 3.420 N/A LEU 135.A N GLN 132.A O no hydrogen 3.038 N/A CYS 136.A N VAL 133.A O no hydrogen 2.977 N/A CYS 136.A SG GLN 132.A O no hydrogen 3.553 N/A ARG 137.A NH2 GLU 13.A OE1 no hydrogen 2.954 N/A THR 138.A N LEU 135.A O no hydrogen 2.907 N/A THR 138.A OG1 ILE 212.A O no hydrogen 2.697 N/A SER 139.A N LYS 211.A O no hydrogen 2.853 N/A SER 139.A OG TYR 26.A OH no hydrogen 2.790 N/A SER 139.A OG TRP 210.A O no hydrogen 2.949 N/A TYR 140.A OH THR 84.A OG1 no hydrogen 2.785 N/A GLY 141.A N ILE 16.A O no hydrogen 2.957 N/A TYR 143.A OH HIS 37.A ND1 no hydrogen 2.905 N/A ALA 144.A N TYR 140.A O no hydrogen 2.956 N/A ARG 145.A N GLY 141.A O no hydrogen 2.820 N/A ARG 145.A NH1 GLU 17.A OE2 no hydrogen 3.036 N/A ARG 145.A NH2 GLU 17.A OE1 no hydrogen 3.505 N/A ALA 146.A N PRO 142.A O no hydrogen 3.061 N/A MET 147.A N TYR 143.A O no hydrogen 2.856 N/A VAL 148.A N ALA 144.A O no hydrogen 3.224 N/A VAL 148.A N ARG 145.A O no hydrogen 3.205 N/A LYS 149.A N ARG 145.A O no hydrogen 3.118 N/A ILE 150.A N ALA 146.A O no hydrogen 2.955 N/A CYS 151.A N MET 147.A O no hydrogen 3.132 N/A CYS 151.A SG MET 147.A O no hydrogen 3.272 N/A LYS 152.A N VAL 148.A O no hydrogen 3.152 N/A GLU 153.A N LYS 149.A O no hydrogen 3.240 N/A GLU 154.A N ILE 150.A O no hydrogen 2.755 N/A SER 155.A N CYS 151.A O no hydrogen 3.341 N/A SER 155.A OG CYS 151.A O no hydrogen 2.930 N/A PHE 156.A N GLU 153.A O no hydrogen 3.285 N/A HIS 157.A NE2 ASP 70.A OD2 no hydrogen 2.981 N/A GLN 158.A N GLU 154.A O no hydrogen 3.058 N/A GLN 158.A NE2 TRP 122.A O no hydrogen 2.872 N/A ARG 159.A N SER 155.A O no hydrogen 3.213 N/A GLN 160.A N PHE 156.A O no hydrogen 3.198 N/A GLY 161.A N HIS 157.A O no hydrogen 2.806 N/A PHE 162.A N GLN 158.A O no hydrogen 2.927 N/A GLU 163.A N ARG 159.A O no hydrogen 3.024 N/A ALA 164.A N GLN 160.A O no hydrogen 2.998 N/A CYS 165.A N GLY 161.A O no hydrogen 3.138 N/A CYS 165.A SG GLY 161.A O no hydrogen 3.499 N/A MET 166.A N PHE 162.A O no hydrogen 2.829 N/A ALA 167.A N GLU 163.A O no hydrogen 2.936 N/A LEU 168.A N ALA 164.A O no hydrogen 3.353 N/A ALA 169.A N CYS 165.A O no hydrogen 2.902 N/A GLN 170.A N MET 166.A O no hydrogen 3.094 N/A GLY 171.A N LEU 168.A O no hydrogen 3.188 N/A SER 172.A N GLN 175.A OE1 no hydrogen 3.161 N/A SER 172.A OG GLN 175.A OE1 no hydrogen 3.479 N/A GLN 175.A N SER 172.A O no hydrogen 3.042 N/A GLN 175.A N SER 172.A OG no hydrogen 3.339 N/A LYS 176.A N SER 172.A O no hydrogen 3.179 N/A GLN 177.A N GLU 173.A O no hydrogen 3.196 N/A GLN 177.A NE2 GLU 173.A OE2 no hydrogen 2.919 N/A MET 178.A N ALA 174.A O no hydrogen 3.241 N/A LEU 179.A N GLN 175.A O no hydrogen 3.226 N/A GLN 180.A N LYS 176.A O no hydrogen 3.058 N/A GLN 180.A NE2 GLN 180.A O no hydrogen 2.987 N/A GLN 180.A NE2 ASN 184.A OD1 no hydrogen 3.260 N/A GLN 180.A NE2 THR 238.A O no hydrogen 2.987 N/A ASP 181.A N GLN 177.A O no hydrogen 3.070 N/A ALA 182.A N MET 178.A O no hydrogen 3.080 N/A ILE 183.A N LEU 179.A O no hydrogen 2.837 N/A ASN 184.A N GLN 180.A O no hydrogen 2.912 N/A ARG 185.A N ASP 181.A O no hydrogen 3.074 N/A ARG 185.A NE ASP 181.A OD2 no hydrogen 3.013 N/A ARG 185.A NH1 ASP 116.A OD2 no hydrogen 2.552 N/A ARG 185.A NH2 ASP 116.A OD1 no hydrogen 2.479 N/A ARG 185.A NH2 ASP 116.A OD2 no hydrogen 3.299 N/A ARG 185.A NH2 ASP 181.A OD2 no hydrogen 3.298 N/A PHE 186.A N ILE 183.A O no hydrogen 2.915 N/A TRP 187.A N ILE 183.A O no hydrogen 2.830 N/A TRP 188.A NE1 PRO 240.A O no hydrogen 2.792 N/A ALA 190.A N PHE 186.A O no hydrogen 2.825 N/A LEU 191.A N TRP 187.A O no hydrogen 3.135 N/A MET 192.A N TRP 188.A O no hydrogen 3.269 N/A MET 193.A N ALA 190.A O no hydrogen 2.924 N/A GLY 195.A N MET 192.A O no hydrogen 3.190 N/A ASP 198.A N ASP 218.A OD2 no hydrogen 3.293 N/A SER 201.A OG SER 204.A OG no hydrogen 2.719 N/A SER 204.A N SER 201.A O no hydrogen 3.002 N/A SER 204.A OG SER 201.A OG no hydrogen 2.719 N/A SER 207.A N ASN 203.A O no hydrogen 3.098 N/A SER 207.A OG ASN 203.A O no hydrogen 3.362 N/A LEU 208.A N SER 204.A O no hydrogen 3.098 N/A THR 209.A N ALA 205.A O no hydrogen 3.274 N/A THR 209.A OG1 ALA 205.A O no hydrogen 3.141 N/A TRP 210.A N ARG 206.A O no hydrogen 2.936 N/A LYS 211.A N LEU 208.A O no hydrogen 3.068 N/A LYS 211.A NZ ILE 10.A O no hydrogen 3.411 N/A LYS 211.A NZ GLU 13.A OE2 no hydrogen 3.213 N/A ILE 212.A N SER 207.A O no hydrogen 2.866 N/A LYS 213.A N SER 207.A O no hydrogen 3.116 N/A LYS 213.A NZ SER 204.A OG no hydrogen 3.193 N/A LYS 213.A NZ ASN 217.A OD1 no hydrogen 3.169 N/A ARG 214.A NH1 ARG 137.A O no hydrogen 2.984 N/A ARG 214.A NH2 GLU 13.A OE2 no hydrogen 3.563 N/A THR 216.A N GLU 219.A OE1 no hydrogen 2.941 N/A THR 216.A OG1 ASP 198.A OD1 no hydrogen 3.290 N/A THR 216.A OG1 ASP 198.A OD2 no hydrogen 3.008 N/A ASN 217.A ND2 PRO 196.A O no hydrogen 3.433 N/A ASP 218.A N ASP 198.A OD1 no hydrogen 3.391 N/A GLU 219.A N THR 216.A OG1 no hydrogen 3.061 N/A LEU 220.A N THR 216.A O no hydrogen 3.030 N/A ARG 221.A N ASN 217.A O no hydrogen 3.110 N/A ARG 221.A NH1 GLY 195.A O no hydrogen 2.808 N/A ARG 221.A NH1 PRO 196.A O no hydrogen 3.332 N/A ARG 221.A NH1 ASP 218.A OD1 no hydrogen 3.042 N/A ARG 221.A NH2 LEU 191.A O no hydrogen 2.625 N/A ARG 221.A NH2 GLY 195.A O no hydrogen 2.911 N/A GLN 222.A N ASP 218.A O no hydrogen 2.901 N/A GLN 222.A NE2 GLN 222.A O no hydrogen 3.018 N/A GLN 222.A NE2 ASP 226.A OD2 no hydrogen 2.828 N/A GLN 222.A NE2 TYR 253.A O no hydrogen 3.166 N/A ARG 223.A N GLU 219.A O no hydrogen 3.079 N/A PHE 224.A N LEU 220.A O no hydrogen 2.893 N/A VAL 225.A N ARG 221.A O no hydrogen 3.047 N/A ASP 226.A N GLN 222.A O no hydrogen 3.021 N/A ASN 227.A N ARG 223.A O no hydrogen 2.905 N/A THR 228.A N PHE 224.A O no hydrogen 2.908 N/A THR 228.A OG1 PHE 224.A O no hydrogen 2.728 N/A VAL 229.A N VAL 225.A O no hydrogen 3.048 N/A VAL 232.A N THR 228.A O no hydrogen 3.041 N/A GLU 233.A N VAL 229.A O no hydrogen 3.023 N/A MET 234.A N PRO 230.A O no hydrogen 2.932 N/A LEU 235.A N GLN 231.A O no hydrogen 3.317 N/A GLY 236.A N GLU 233.A O no hydrogen 3.189 N/A MET 237.A N VAL 232.A O no hydrogen 3.252 N/A THR 238.A N GLN 180.A OE1 no hydrogen 3.041 N/A ASP 241.A N VAL 239.A O no hydrogen 2.658 N/A ASP 243.A N ASP 241.A OD1 no hydrogen 2.924 N/A LEU 244.A N ASP 241.A O no hydrogen 3.468 N/A HIS 245.A N ARG 254.A O no hydrogen 3.178 N/A ASP 247.A N HIS 252.A O no hydrogen 2.861 N/A SER 250.A N ASP 247.A O no hydrogen 3.034 N/A SER 250.A OG ASP 247.A OD2 no hydrogen 3.013 N/A GLY 251.A N ASP 247.A O no hydrogen 2.697 N/A HIS 252.A ND1 ASP 226.A OD2 no hydrogen 2.708 N/A TYR 253.A N ASP 226.A OD1 no hydrogen 3.009 N/A ARG 254.A N HIS 245.A O no hydrogen 3.001 N/A GLY 256.A N ASP 241.A OD2 no hydrogen 2.815 N/A GLU 262.A N ASP 259.A OD1 no hydrogen 3.229 N/A PHE 263.A N ASP 259.A O no hydrogen 3.176 N/A ASN 264.A N TRP 260.A O no hydrogen 2.939 N/A GLU 265.A N GLN 261.A O no hydrogen 3.340 N/A VAL 266.A N GLU 262.A O no hydrogen 2.904 N/A ILE 267.A N PHE 263.A O no hydrogen 3.017 N/A ASN 268.A N ASN 264.A O no hydrogen 3.303 N/A ASN 268.A ND2 ASN 264.A O no hydrogen 2.980 N/A GLY 269.A N VAL 266.A O no hydrogen 3.139 N/A ARG 270.A N GLU 265.A O no hydrogen 2.944 N/A GLY 271.A N ASN 274.A OD1 no hydrogen 2.807 N/A CYS 273.A N ASN 108.A O no hydrogen 2.728 N/A CYS 273.A SG ASN 108.A O no hydrogen 3.590 N/A ASN 274.A ND2 VAL 266.A O no hydrogen 3.144 N/A GLN 275.A NE2 ASP 279.A OD1 no hydrogen 2.899 N/A GLU 276.A N GLU 276.A OE1 no hydrogen 3.022 N/A ARG 277.A N CYS 273.A O no hydrogen 2.835 N/A ARG 277.A NE PHE 107.A O no hydrogen 2.675 N/A ARG 277.A NH2 PHE 107.A O no hydrogen 3.505 N/A ARG 277.A NH2 TYR 109.A O no hydrogen 2.824 N/A LEU 278.A N ASN 274.A O no hydrogen 3.094 N/A ASP 279.A N GLN 275.A O no hydrogen 2.925 N/A ALA 280.A N GLU 276.A O no hydrogen 2.956 N/A LYS 281.A N ARG 277.A O no hydrogen 3.076 N/A ARG 282.A N LEU 278.A O no hydrogen 2.664 N/A ARG 282.A NH1 LEU 97.A O no hydrogen 2.888 N/A ARG 282.A NH2 ASP 279.A OD1 no hydrogen 3.177 N/A LYS 283.A N ASP 279.A O no hydrogen 2.771 N/A LYS 283.A NZ GLU 287.A OE1 no hydrogen 3.172 N/A LYS 283.A NZ GLU 287.A OE2 no hydrogen 2.814 N/A ALA 284.A N ALA 280.A O no hydrogen 3.124 N/A TRP 285.A N LYS 281.A O no hydrogen 2.996 N/A GLU 286.A N ARG 282.A O no hydrogen 2.939 N/A GLU 287.A N LYS 283.A O no hydrogen 2.920 N/A THR 289.A N GLU 286.A O no hydrogen 3.059 N/A THR 289.A OG1 TRP 285.A O no hydrogen 3.405 N/A THR 289.A OG1 GLU 286.A O no hydrogen 2.943 N/A VAL 291.A N GLY 288.A O no hydrogen 2.951 N/A ARG 292.A N GLY 288.A O no hydrogen 3.257 N/A ARG 292.A NH1 TRP 285.A O no hydrogen 3.212 N/A ARG 292.A NH2 TRP 285.A O no hydrogen 2.941 N/A GLU 293.A N THR 289.A O no hydrogen 2.985 N/A ALA 294.A N TRP 290.A O no hydrogen 3.185 N/A ALA 295.A N VAL 291.A O no hydrogen 3.091 N/A LEU 296.A N ARG 292.A O no hydrogen 3.062 N/A ALA 297.A N GLU 293.A O no hydrogen 3.162 N/A HIS 298.A N ALA 294.A O no hydrogen 3.083 N/A ALA 299.A N ALA 295.A O no hydrogen 3.199 N/A LYS 301.A N HIS 298.A O no hydrogen 3.281 N/A