Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3nw7_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLU 5.A N ASP 4.A OD2 no hydrogen 3.199 N/A GLU 7.A N ASP 4.A O no hydrogen 3.015 N/A VAL 8.A N VAL 82.A O no hydrogen 2.959 N/A ARG 10.A NH1 PRO 88.A O no hydrogen 2.854 N/A ARG 10.A NH2 GLN 85.A O no hydrogen 2.633 N/A GLU 11.A N GLU 11.A OE1 no hydrogen 2.814 N/A LYS 12.A N ALA 9.A O no hydrogen 2.922 N/A ILE 13.A N ARG 10.A O no hydrogen 3.012 N/A THR 14.A N VAL 31.A O no hydrogen 2.902 N/A SER 16.A N GLU 29.A O no hydrogen 2.979 N/A SER 16.A OG GLU 29.A O no hydrogen 3.341 N/A ARG 17.A NE GLU 29.A OE1 no hydrogen 3.364 N/A ARG 17.A NH2 GLU 29.A OE1 no hydrogen 3.558 N/A LEU 19.A N VAL 27.A O no hydrogen 2.661 N/A GLY 20.A N VAL 27.A O no hydrogen 3.364 N/A GLY 22.A N GLY 25.A O no hydrogen 2.876 N/A SER 23.A OG GLY 169.A O no hydrogen 3.530 N/A VAL 27.A N GLY 20.A O no hydrogen 2.855 N/A TYR 28.A N ILE 46.A O no hydrogen 2.798 N/A GLU 29.A N ARG 17.A O no hydrogen 2.982 N/A GLY 30.A N VAL 44.A O no hydrogen 2.994 N/A VAL 31.A N THR 14.A O no hydrogen 2.838 N/A ALA 32.A N THR 42.A O no hydrogen 2.997 N/A LYS 33.A N LYS 12.A O no hydrogen 2.961 N/A GLY 34.A N GLU 39.A O no hydrogen 3.074 N/A GLU 39.A N VAL 36.A O no hydrogen 3.082 N/A THR 42.A N ALA 32.A O no hydrogen 3.024 N/A THR 42.A OG1 GLU 39.A OE1 no hydrogen 2.907 N/A ARG 43.A NH2 GLU 29.A OE2 no hydrogen 2.554 N/A VAL 44.A N GLY 30.A O no hydrogen 3.075 N/A ALA 45.A N MET 93.A O no hydrogen 2.941 N/A ILE 46.A N TYR 28.A O no hydrogen 2.537 N/A LYS 47.A N VAL 91.A O no hydrogen 2.815 N/A LYS 47.A NZ ASP 167.A OD1 no hydrogen 3.534 N/A LYS 47.A NZ ASP 167.A OD2 no hydrogen 2.794 N/A THR 48.A OG1 MET 26.A O no hydrogen 2.692 N/A ASN 50.A N PHE 24.A O no hydrogen 3.209 N/A ALA 52.A N ASN 50.A OD1 no hydrogen 2.898 N/A SER 54.A N GLU 57.A OE2 no hydrogen 3.157 N/A SER 54.A OG GLU 57.A OE2 no hydrogen 3.132 N/A ARG 56.A NH2 GLU 60.A OE1 no hydrogen 2.793 N/A GLU 57.A N SER 54.A OG no hydrogen 3.256 N/A ARG 58.A N SER 54.A O no hydrogen 3.194 N/A ARG 58.A NH2 GLU 51.A O no hydrogen 2.793 N/A ILE 59.A N MET 55.A O no hydrogen 3.065 N/A GLU 60.A N ARG 56.A O no hydrogen 2.967 N/A PHE 61.A N GLU 57.A O no hydrogen 2.758 N/A LEU 62.A N ARG 58.A O no hydrogen 3.064 N/A ASN 63.A N ILE 59.A O no hydrogen 2.812 N/A GLU 64.A N GLU 60.A O no hydrogen 3.031 N/A ALA 65.A N PHE 61.A O no hydrogen 3.293 N/A SER 66.A N LEU 62.A O no hydrogen 3.218 N/A SER 66.A N ASN 63.A O no hydrogen 3.264 N/A SER 66.A OG LEU 62.A O no hydrogen 2.877 N/A VAL 67.A N GLU 64.A O no hydrogen 3.333 N/A MET 68.A N ALA 65.A O no hydrogen 3.221 N/A LYS 69.A N SER 66.A O no hydrogen 3.178 N/A LYS 69.A NZ TYR 1.A OH no hydrogen 3.104 N/A LYS 69.A NZ ASP 4.A OD1 no hydrogen 2.732 N/A LYS 69.A NZ SER 66.A OG no hydrogen 3.221 N/A PHE 71.A N MET 68.A O no hydrogen 3.084 N/A ASN 72.A N TYR 139.A OH no hydrogen 3.016 N/A HIS 75.A ND1 ASP 135.A OD2 no hydrogen 2.697 N/A VAL 76.A N CYS 73.A O no hydrogen 3.312 N/A VAL 77.A N ILE 165.A O no hydrogen 2.798 N/A ARG 78.A N GLU 94.A OE1 no hydrogen 3.084 N/A LEU 80.A N ILE 92.A O no hydrogen 2.669 N/A GLY 81.A N ILE 92.A O no hydrogen 3.142 N/A VAL 82.A N TRP 6.A O no hydrogen 2.905 N/A VAL 83.A N LEU 90.A O no hydrogen 2.840 N/A SER 84.A N GLU 7.A OE2 no hydrogen 2.781 N/A SER 84.A OG GLU 7.A OE1 no hydrogen 2.702 N/A SER 84.A OG GLU 7.A OE2 no hydrogen 3.124 N/A SER 84.A OG GLN 85.A OE1 no hydrogen 3.103 N/A GLN 85.A N GLU 7.A OE2 no hydrogen 3.167 N/A LEU 90.A N VAL 83.A O no hydrogen 2.843 N/A VAL 91.A N LYS 47.A O no hydrogen 3.119 N/A ILE 92.A N GLY 81.A O no hydrogen 2.731 N/A MET 93.A N ALA 45.A O no hydrogen 3.035 N/A GLU 94.A N ARG 78.A O no hydrogen 2.777 N/A THR 97.A OG1 GLU 159.A OE1 no hydrogen 2.705 N/A ARG 98.A N VAL 157.A O no hydrogen 2.885 N/A ARG 98.A NE GLU 159.A O no hydrogen 2.799 N/A ARG 98.A NH2 GLU 159.A O no hydrogen 3.225 N/A LEU 101.A N CYS 155.A O no hydrogen 2.845 N/A LYS 102.A N ALA 152.A O no hydrogen 3.263 N/A LYS 102.A NZ ASP 178.A OD1 no hydrogen 3.256 N/A LYS 102.A NZ ASP 178.A OD2 no hydrogen 2.732 N/A LYS 102.A NZ GLN 222.A OE1 no hydrogen 2.789 N/A SER 103.A N ASP 100.A OD1 no hydrogen 2.889 N/A SER 103.A OG ASP 100.A OD1 no hydrogen 3.354 N/A SER 103.A OG ASP 100.A OD2 no hydrogen 3.024 N/A TYR 104.A N ASP 100.A O no hydrogen 2.979 N/A LEU 105.A N LEU 101.A O no hydrogen 2.865 N/A ARG 106.A N LYS 102.A O no hydrogen 2.906 N/A ARG 106.A NE ALA 220.A O no hydrogen 2.731 N/A ARG 106.A NH2 ALA 220.A O no hydrogen 2.770 N/A ARG 106.A NH2 GLN 222.A OE1 no hydrogen 2.825 N/A SER 107.A N SER 103.A O no hydrogen 2.877 N/A SER 107.A OG TYR 104.A O no hydrogen 2.633 N/A LEU 108.A N LEU 105.A O no hydrogen 3.100 N/A ARG 109.A N ARG 106.A O no hydrogen 3.179 N/A ARG 109.A NE LEU 219.A O no hydrogen 3.004 N/A ASN 115.A N GLU 113.A OE2 no hydrogen 3.220 N/A LYS 125.A N SER 122.A OG no hydrogen 3.206 N/A MET 126.A N SER 122.A O no hydrogen 3.021 N/A ILE 127.A N LEU 123.A O no hydrogen 2.800 N/A GLN 128.A N SER 124.A O no hydrogen 3.037 N/A GLN 128.A NE2 GLU 132.A OE2 no hydrogen 3.025 N/A MET 129.A N LYS 125.A O no hydrogen 3.188 N/A ALA 130.A N MET 126.A O no hydrogen 2.995 N/A GLY 131.A N ILE 127.A O no hydrogen 2.851 N/A GLU 132.A N GLN 128.A O no hydrogen 3.142 N/A ILE 133.A N MET 129.A O no hydrogen 3.026 N/A ALA 134.A N ALA 130.A O no hydrogen 2.861 N/A ASP 135.A N GLY 131.A O no hydrogen 2.916 N/A GLY 136.A N GLU 132.A O no hydrogen 3.048 N/A MET 137.A N ILE 133.A O no hydrogen 3.023 N/A ALA 138.A N ALA 134.A O no hydrogen 2.778 N/A TYR 139.A N ASP 135.A O no hydrogen 2.877 N/A LEU 140.A N GLY 136.A O no hydrogen 3.002 N/A ASN 141.A N MET 137.A O no hydrogen 2.938 N/A ALA 142.A N ALA 138.A O no hydrogen 3.063 N/A ASN 143.A N TYR 139.A O no hydrogen 3.096 N/A ASN 143.A N LEU 140.A O no hydrogen 3.079 N/A ASN 143.A ND2 TYR 139.A O no hydrogen 2.914 N/A ASN 143.A ND2 GLU 295.A OE1 no hydrogen 3.238 N/A LYS 144.A N ASN 141.A O no hydrogen 2.981 N/A PHE 145.A N LEU 140.A O no hydrogen 3.003 N/A HIS 147.A N ASP 205.A OD2 no hydrogen 2.851 N/A ARG 148.A N ASP 205.A OD1 no hydrogen 3.042 N/A ASP 149.A N HIS 147.A ND1 no hydrogen 3.039 N/A ALA 152.A N GLU 215.A OE1 no hydrogen 2.995 N/A ARG 153.A NE TYR 179.A OH no hydrogen 2.856 N/A ARG 153.A NH1 ASP 178.A OD2 no hydrogen 2.827 N/A ARG 153.A NH2 ASP 149.A OD1 no hydrogen 2.947 N/A ASN 154.A N ALA 151.A O no hydrogen 2.955 N/A ASN 154.A ND2 ASP 149.A O no hydrogen 2.755 N/A CYS 155.A N ALA 152.A O no hydrogen 3.128 N/A CYS 155.A SG ALA 151.A O no hydrogen 3.598 N/A MET 156.A N LYS 164.A O no hydrogen 2.853 N/A VAL 157.A N GLY 99.A O no hydrogen 2.770 N/A ALA 158.A N THR 162.A O no hydrogen 2.878 N/A PHE 161.A N ALA 158.A O no hydrogen 2.780 N/A THR 162.A N ASP 160.A OD1 no hydrogen 3.004 N/A THR 162.A OG1 ASP 160.A OD1 no hydrogen 2.562 N/A VAL 163.A N GLU 132.A OE1 no hydrogen 3.005 N/A LYS 164.A N MET 156.A O no hydrogen 2.943 N/A LYS 164.A NZ HIS 74.A O no hydrogen 2.946 N/A LYS 164.A NZ GLU 94.A OE2 no hydrogen 2.549 N/A ILE 165.A N HIS 75.A O no hydrogen 2.835 N/A GLY 166.A N ASN 154.A O no hydrogen 2.829 N/A THR 171.A OG1 ASN 154.A OD1 no hydrogen 2.650 N/A ILE 174.A N THR 171.A O no hydrogen 3.069 N/A TYR 175.A N THR 171.A O no hydrogen 2.873 N/A TYR 175.A OH ASP 100.A OD1 no hydrogen 2.947 N/A TYR 175.A OH ASP 100.A OD2 no hydrogen 2.844 N/A ASP 178.A N TYR 175.A O no hydrogen 2.844 N/A TYR 179.A N GLU 176.A O no hydrogen 3.104 N/A TYR 179.A OH ASP 149.A OD1 no hydrogen 3.429 N/A TYR 179.A OH ASP 149.A OD2 no hydrogen 2.592 N/A TYR 180.A N LEU 185.A O no hydrogen 2.805 N/A TYR 180.A OH GLU 230.A OE1 no hydrogen 2.753 N/A LEU 185.A N TYR 180.A O no hydrogen 2.767 N/A VAL 187.A N LEU 185.A O no hydrogen 2.879 N/A ARG 188.A NH1 PRO 223.A O no hydrogen 2.896 N/A ARG 188.A NH1 TYR 224.A O no hydrogen 3.167 N/A ARG 188.A NH1 LEU 227.A O no hydrogen 3.251 N/A ARG 188.A NH2 LEU 227.A O no hydrogen 2.881 N/A ARG 188.A NH2 ASN 229.A OD1 no hydrogen 3.279 N/A TRP 189.A N PRO 186.A O no hydrogen 3.075 N/A TRP 189.A NE1 GLU 215.A OE1 no hydrogen 2.789 N/A MET 190.A N VAL 187.A O no hydrogen 3.333 N/A SER 191.A OG SER 194.A OG no hydrogen 2.878 N/A GLU 193.A N GLU 193.A OE1 no hydrogen 2.890 N/A SER 194.A N SER 191.A O no hydrogen 3.105 N/A SER 194.A N SER 191.A OG no hydrogen 3.089 N/A SER 194.A OG SER 191.A OG no hydrogen 2.878 N/A SER 194.A OG VAL 199.A O no hydrogen 2.642 N/A LEU 195.A N SER 191.A O no hydrogen 3.127 N/A LYS 196.A N PRO 192.A O no hydrogen 3.031 N/A LYS 196.A NZ TYR 262.A OH no hydrogen 2.924 N/A ASP 197.A N GLU 193.A O no hydrogen 2.861 N/A GLY 198.A N SER 194.A O no hydrogen 2.961 N/A THR 201.A N SER 204.A OG no hydrogen 2.831 N/A TYR 203.A N THR 201.A OG1 no hydrogen 3.201 N/A SER 204.A N THR 201.A O no hydrogen 2.949 N/A SER 204.A OG THR 201.A O no hydrogen 2.713 N/A ASP 205.A N THR 201.A O no hydrogen 3.122 N/A VAL 206.A N THR 202.A O no hydrogen 2.876 N/A TRP 207.A N TYR 203.A O no hydrogen 3.216 N/A SER 208.A N SER 204.A O no hydrogen 3.118 N/A SER 208.A OG TRP 189.A O no hydrogen 2.550 N/A SER 208.A OG SER 204.A O no hydrogen 3.307 N/A PHE 209.A N ASP 205.A O no hydrogen 2.856 N/A GLY 210.A N VAL 206.A O no hydrogen 3.152 N/A VAL 211.A N TRP 207.A O no hydrogen 3.281 N/A VAL 212.A N SER 208.A O no hydrogen 2.902 N/A LEU 213.A N PHE 209.A O no hydrogen 2.990 N/A TRP 214.A N GLY 210.A O no hydrogen 3.010 N/A TRP 214.A NE1 ASP 243.A O no hydrogen 3.003 N/A GLU 215.A N VAL 211.A O no hydrogen 2.802 N/A ILE 216.A N VAL 212.A O no hydrogen 2.864 N/A ALA 217.A N LEU 213.A O no hydrogen 2.865 N/A THR 218.A N TRP 214.A O no hydrogen 2.941 N/A THR 218.A N GLU 215.A O no hydrogen 3.307 N/A THR 218.A OG1 TRP 214.A O no hydrogen 2.871 N/A THR 218.A OG1 GLU 215.A O no hydrogen 3.378 N/A LEU 219.A N ILE 216.A O no hydrogen 3.335 N/A ALA 220.A N GLU 215.A O no hydrogen 2.664 N/A GLU 221.A N THR 218.A OG1 no hydrogen 3.271 N/A GLN 222.A N GLN 225.A OE1 no hydrogen 3.161 N/A GLN 222.A NE2 ASP 178.A OD1 no hydrogen 2.724 N/A LEU 227.A N TYR 224.A O no hydrogen 2.916 N/A SER 228.A N GLN 231.A OE1 no hydrogen 2.757 N/A GLN 231.A N SER 228.A OG no hydrogen 3.209 N/A VAL 232.A N SER 228.A O no hydrogen 2.843 N/A LEU 233.A N ASN 229.A O no hydrogen 3.244 N/A ARG 234.A N GLU 230.A O no hydrogen 3.196 N/A PHE 235.A N GLN 231.A O no hydrogen 2.878 N/A VAL 236.A N VAL 232.A O no hydrogen 2.881 N/A MET 237.A N LEU 233.A O no hydrogen 3.094 N/A GLU 238.A N ARG 234.A O no hydrogen 3.068 N/A GLY 239.A N VAL 236.A O no hydrogen 2.923 N/A GLY 240.A N PHE 235.A O no hydrogen 2.810 N/A LYS 244.A NZ CYS 248.A O no hydrogen 3.127 N/A LYS 244.A NZ ASP 250.A OD1 no hydrogen 3.443 N/A CYS 248.A N PRO 245.A O no hydrogen 2.921 N/A CYS 248.A SG PRO 249.A O no hydrogen 3.432 N/A LEU 252.A N PRO 249.A O no hydrogen 2.945 N/A PHE 253.A N PRO 249.A O no hydrogen 3.189 N/A GLU 254.A N ASP 250.A O no hydrogen 2.847 N/A LEU 255.A N MET 251.A O no hydrogen 3.364 N/A MET 256.A N LEU 252.A O no hydrogen 3.212 N/A ARG 257.A N PHE 253.A O no hydrogen 2.865 N/A MET 258.A N GLU 254.A O no hydrogen 2.914 N/A CYS 259.A N LEU 255.A O no hydrogen 3.086 N/A CYS 259.A SG LEU 255.A O no hydrogen 3.303 N/A TRP 260.A N MET 256.A O no hydrogen 2.949 N/A TRP 260.A N ARG 257.A O no hydrogen 3.171 N/A GLN 261.A N MET 258.A O no hydrogen 3.466 N/A TYR 262.A OH MET 237.A O no hydrogen 2.546 N/A LYS 265.A N ASN 263.A OD1 no hydrogen 3.095 N/A MET 266.A N ASN 263.A O no hydrogen 3.063 N/A ARG 267.A N PRO 264.A O no hydrogen 3.285 N/A ARG 267.A NE GLN 261.A O no hydrogen 2.765 N/A ARG 267.A NH1 GLU 193.A OE2 no hydrogen 2.793 N/A ARG 267.A NH1 TYR 203.A O no hydrogen 2.964 N/A ARG 267.A NH2 GLU 193.A OE1 no hydrogen 2.912 N/A ARG 267.A NH2 GLN 261.A O no hydrogen 3.132 N/A SER 269.A N GLU 272.A OE1 no hydrogen 3.270 N/A GLU 272.A N SER 269.A OG no hydrogen 3.002 N/A ILE 273.A N SER 269.A O no hydrogen 2.887 N/A ILE 274.A N PHE 270.A O no hydrogen 2.954 N/A SER 275.A N LEU 271.A O no hydrogen 2.892 N/A SER 276.A N GLU 272.A O no hydrogen 3.207 N/A SER 276.A OG ILE 273.A O no hydrogen 2.683 N/A ILE 277.A N ILE 274.A O no hydrogen 2.965 N/A LYS 278.A NZ SER 275.A O no hydrogen 2.958 N/A LYS 278.A NZ SER 275.A OG no hydrogen 3.356 N/A LYS 278.A NZ GLU 279.A OE2 no hydrogen 3.125 N/A GLU 280.A N ILE 277.A O no hydrogen 2.832 N/A MET 281.A N LYS 278.A O no hydrogen 3.045 N/A GLU 282.A N GLN 128.A OE1 no hydrogen 2.830 N/A PHE 285.A N GLU 282.A O no hydrogen 3.055 N/A ARG 286.A N PRO 283.A O no hydrogen 3.235 N/A GLU 287.A N GLY 284.A O no hydrogen 2.919 N/A VAL 288.A N GLY 284.A O no hydrogen 3.067 N/A SER 289.A N PHE 285.A O no hydrogen 2.987 N/A SER 289.A OG PHE 285.A O no hydrogen 2.640 N/A PHE 290.A N ASP 135.A OD2 no hydrogen 2.905 N/A TYR 291.A N ASP 135.A OD1 no hydrogen 2.791 N/A TYR 292.A N SER 289.A OG no hydrogen 3.188 N/A SER 293.A N PHE 290.A O no hydrogen 2.884 N/A SER 293.A OG PHE 290.A O no hydrogen 2.568 N/A ASN 296.A N SER 293.A O no hydrogen 3.070 N/A ASN 296.A ND2 TYR 291.A O no hydrogen 2.720 N/A LYS 297.A N GLU 295.A O no hydrogen 2.901 N/A