Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 2w4o_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ILE 1.A N GLU 66.A OE2 no hydrogen 3.374 N/A ASP 2.A N GLU 66.A OE1 no hydrogen 3.330 N/A SER 4.A N ASP 2.A O no hydrogen 2.992 N/A ASN 5.A N ILE 64.A O no hydrogen 2.887 N/A ASN 5.A ND2 GLU 63.A OE1 no hydrogen 3.122 N/A ASP 7.A N ASN 5.A OD1 no hydrogen 2.870 N/A ASP 11.A N ALA 8.A O no hydrogen 2.856 N/A PHE 12.A N LEU 9.A O no hydrogen 2.626 N/A PHE 13.A N LEU 9.A O no hydrogen 2.884 N/A GLU 14.A N LYS 31.A O no hydrogen 2.824 N/A GLU 16.A N ARG 29.A O no hydrogen 2.650 N/A LEU 19.A N VAL 27.A O no hydrogen 2.873 N/A GLY 20.A N VAL 27.A O no hydrogen 3.312 N/A ARG 21.A NE GLU 18.A OE2 no hydrogen 2.842 N/A ARG 21.A NH2 GLU 18.A OE1 no hydrogen 2.729 N/A GLY 22.A N SER 25.A O no hydrogen 2.691 N/A THR 24.A OG1 SER 25.A OG no hydrogen 2.628 N/A SER 25.A OG THR 24.A OG1 no hydrogen 2.628 N/A ILE 26.A N VAL 43.A O no hydrogen 3.120 N/A VAL 27.A N GLY 20.A O no hydrogen 2.847 N/A TYR 28.A N LEU 41.A O no hydrogen 2.784 N/A ARG 29.A N SER 17.A O no hydrogen 2.846 N/A CYS 30.A N TYR 39.A O no hydrogen 2.888 N/A CYS 30.A SG TYR 39.A O no hydrogen 3.487 N/A LYS 31.A N GLU 14.A O no hydrogen 2.923 N/A GLN 32.A N LYS 37.A O no hydrogen 2.772 N/A LYS 33.A N PHE 12.A O no hydrogen 2.748 N/A LYS 33.A NZ SER 10.A O no hydrogen 3.540 N/A THR 35.A OG1 GLN 32.A OE1 no hydrogen 2.579 N/A GLN 36.A N GLN 32.A O no hydrogen 2.878 N/A LYS 37.A N THR 35.A OG1 no hydrogen 2.963 N/A TYR 39.A N CYS 30.A O no hydrogen 2.766 N/A ALA 40.A N LEU 75.A O no hydrogen 2.949 N/A LEU 41.A N TYR 28.A O no hydrogen 2.752 N/A LYS 42.A N LEU 73.A O no hydrogen 2.850 N/A LYS 42.A NZ ASP 142.A OD1 no hydrogen 2.510 N/A VAL 43.A N ILE 26.A O no hydrogen 2.719 N/A LEU 44.A N ILE 71.A O no hydrogen 2.903 N/A LYS 45.A N THR 24.A O no hydrogen 3.410 N/A LYS 46.A N THR 69.A O no hydrogen 3.081 N/A LEU 51.A N ILE 47.A O no hydrogen 3.040 N/A ARG 52.A N VAL 49.A O no hydrogen 2.831 N/A LEU 53.A N VAL 49.A O no hydrogen 2.960 N/A LEU 53.A N LEU 50.A O no hydrogen 3.089 N/A SER 54.A N TYR 111.A OH no hydrogen 2.777 N/A ASN 57.A N HIS 55.A ND1 no hydrogen 2.933 N/A ASN 57.A ND2 GLN 104.A OE1 no hydrogen 3.138 N/A ASN 57.A ND2 LEU 138.A O no hydrogen 2.690 N/A ILE 58.A N HIS 55.A O no hydrogen 2.989 N/A ILE 59.A N ILE 140.A O no hydrogen 2.976 N/A LYS 60.A N GLU 76.A OE2 no hydrogen 2.955 N/A LYS 62.A N VAL 74.A O no hydrogen 2.627 N/A GLU 63.A N VAL 74.A O no hydrogen 3.295 N/A PHE 65.A N SER 72.A O no hydrogen 2.835 N/A GLU 66.A N ASN 5.A O no hydrogen 3.091 N/A THR 67.A N GLU 70.A O no hydrogen 2.871 N/A THR 67.A OG1 GLU 70.A O no hydrogen 3.007 N/A GLU 70.A N THR 67.A OG1 no hydrogen 2.930 N/A ILE 71.A N LEU 44.A O no hydrogen 2.838 N/A SER 72.A N PHE 65.A O no hydrogen 2.792 N/A LEU 73.A N LYS 42.A O no hydrogen 2.900 N/A VAL 74.A N GLU 63.A O no hydrogen 2.760 N/A LEU 75.A N ALA 40.A O no hydrogen 2.791 N/A GLU 76.A N LYS 60.A O no hydrogen 3.022 N/A THR 79.A N ALA 130.A O no hydrogen 2.880 N/A THR 79.A OG1 ALA 130.A O no hydrogen 3.356 N/A GLY 80.A N TYR 129.A O no hydrogen 2.776 N/A LEU 83.A N LEU 127.A O no hydrogen 2.896 N/A ASP 85.A N GLU 82.A O no hydrogen 3.000 N/A ARG 86.A N GLU 82.A O no hydrogen 2.915 N/A ARG 86.A NH1 GLY 80.A O no hydrogen 3.417 N/A ARG 86.A NH1 THR 131.A O no hydrogen 3.180 N/A ARG 86.A NH2 ALA 133.A O no hydrogen 2.798 N/A ILE 87.A N LEU 83.A O no hydrogen 3.108 N/A GLU 89.A N ARG 86.A O no hydrogen 3.013 N/A LYS 90.A N ILE 87.A O no hydrogen 3.244 N/A LYS 90.A NZ ASP 97.A OD1 no hydrogen 3.366 N/A TYR 93.A N HIS 250.A ND1 no hydrogen 2.803 N/A TYR 93.A OH LEU 175.A O no hydrogen 2.771 N/A SER 94.A N ASP 97.A OD2 no hydrogen 2.853 N/A SER 94.A OG ASP 97.A OD2 no hydrogen 3.438 N/A ARG 96.A N SER 94.A OG no hydrogen 3.070 N/A ASP 97.A N SER 94.A O no hydrogen 2.982 N/A ALA 98.A N SER 94.A O no hydrogen 3.197 N/A ALA 99.A N GLU 95.A O no hydrogen 2.741 N/A ASP 100.A N ARG 96.A O no hydrogen 2.921 N/A ALA 101.A N ASP 97.A O no hydrogen 3.216 N/A VAL 102.A N ALA 98.A O no hydrogen 3.029 N/A LYS 103.A N ALA 99.A O no hydrogen 2.871 N/A GLN 104.A N ASP 100.A O no hydrogen 3.299 N/A GLN 104.A NE2 ASP 100.A O no hydrogen 3.252 N/A ILE 105.A N ALA 101.A O no hydrogen 3.040 N/A LEU 106.A N VAL 102.A O no hydrogen 2.817 N/A GLU 107.A N LYS 103.A O no hydrogen 2.904 N/A ALA 108.A N GLN 104.A O no hydrogen 2.930 N/A VAL 109.A N ILE 105.A O no hydrogen 2.823 N/A ALA 110.A N LEU 106.A O no hydrogen 2.819 N/A TYR 111.A N GLU 107.A O no hydrogen 3.020 N/A LEU 112.A N ALA 108.A O no hydrogen 2.981 N/A HIS 113.A N VAL 109.A O no hydrogen 2.783 N/A HIS 113.A NE2 ASP 164.A OD2 no hydrogen 2.807 N/A GLU 114.A N ALA 110.A O no hydrogen 2.877 N/A ASN 115.A N TYR 111.A O no hydrogen 3.144 N/A ASN 115.A ND2 TYR 111.A O no hydrogen 2.846 N/A GLY 116.A N HIS 113.A O no hydrogen 2.807 N/A ILE 117.A N LEU 112.A O no hydrogen 2.699 N/A HIS 119.A N ASP 164.A OD2 no hydrogen 2.814 N/A HIS 119.A NE2 ALA 141.A O no hydrogen 3.118 N/A ARG 120.A N ASP 164.A OD1 no hydrogen 2.742 N/A ASP 121.A N HIS 119.A ND1 no hydrogen 2.926 N/A LYS 123.A N ASN 126.A OD1 no hydrogen 3.189 N/A LYS 123.A NZ ASP 121.A OD1 no hydrogen 3.501 N/A ASN 126.A N LYS 123.A O no hydrogen 3.012 N/A ASN 126.A ND2 ASP 121.A O no hydrogen 2.789 N/A ASN 126.A ND2 ASP 142.A OD2 no hydrogen 3.486 N/A LEU 127.A N PRO 124.A O no hydrogen 3.412 N/A LEU 128.A N LYS 139.A O no hydrogen 2.815 N/A TYR 129.A N GLY 81.A O no hydrogen 2.885 N/A ALA 130.A N PRO 137.A O no hydrogen 3.023 N/A ALA 133.A N THR 131.A OG1 no hydrogen 3.043 N/A ALA 136.A N ALA 133.A O no hydrogen 3.023 N/A LEU 138.A N GLN 104.A OE1 no hydrogen 2.824 N/A LYS 139.A N LEU 128.A O no hydrogen 2.478 N/A LYS 139.A NZ GLU 76.A OE2 no hydrogen 3.148 N/A ILE 140.A N ASN 57.A O no hydrogen 2.825 N/A ALA 141.A N ASN 126.A O no hydrogen 2.796 N/A TYR 148.A N THR 145.A O no hydrogen 3.135 N/A CYS 149.A N PRO 146.A O no hydrogen 3.085 N/A CYS 149.A SG THR 145.A O no hydrogen 3.905 N/A GLU 152.A N GLU 152.A OE1 no hydrogen 2.812 N/A ILE 153.A N ALA 150.A O no hydrogen 3.114 N/A LEU 154.A N ALA 150.A O no hydrogen 3.388 N/A ARG 155.A N PRO 151.A O no hydrogen 2.851 N/A GLY 156.A N ILE 153.A O no hydrogen 3.160 N/A GLU 162.A N GLU 162.A OE1 no hydrogen 2.752 N/A VAL 163.A N GLY 160.A O no hydrogen 3.204 N/A ASP 164.A N PRO 161.A O no hydrogen 3.105 N/A TRP 166.A N GLU 162.A O no hydrogen 3.160 N/A SER 167.A N VAL 163.A O no hydrogen 3.195 N/A SER 167.A OG TYR 148.A O no hydrogen 3.009 N/A SER 167.A OG VAL 163.A O no hydrogen 3.179 N/A VAL 168.A N ASP 164.A O no hydrogen 3.001 N/A GLY 169.A N MET 165.A O no hydrogen 3.095 N/A ILE 170.A N TRP 166.A O no hydrogen 3.095 N/A ILE 171.A N SER 167.A O no hydrogen 3.115 N/A THR 172.A N VAL 168.A O no hydrogen 2.894 N/A THR 172.A OG1 VAL 168.A O no hydrogen 2.758 N/A TYR 173.A N GLY 169.A O no hydrogen 2.861 N/A TYR 173.A OH TYR 201.A O no hydrogen 2.570 N/A ILE 174.A N ILE 170.A O no hydrogen 3.040 N/A LEU 175.A N ILE 171.A O no hydrogen 2.975 N/A LEU 176.A N THR 172.A O no hydrogen 3.042 N/A CYS 177.A N ILE 174.A O no hydrogen 3.212 N/A CYS 177.A SG TYR 173.A O no hydrogen 3.493 N/A CYS 177.A SG PHE 179.A O no hydrogen 3.395 N/A GLY 178.A N ILE 174.A O no hydrogen 2.718 N/A GLU 180.A N GLU 180.A OE1 no hydrogen 3.179 N/A ARG 186.A N ASP 184.A OD1 no hydrogen 2.945 N/A ARG 186.A NE ASP 184.A OD1 no hydrogen 3.166 N/A ARG 186.A NH2 ASP 184.A OD2 no hydrogen 3.246 N/A GLY 187.A N ASP 184.A O no hydrogen 3.079 N/A GLN 189.A N GLN 189.A OE1 no hydrogen 2.701 N/A GLN 189.A NE2 ARG 186.A O no hydrogen 2.948 N/A PHE 190.A N GLY 187.A O no hydrogen 3.004 N/A MET 191.A N GLY 187.A O no hydrogen 3.040 N/A PHE 192.A N ASP 188.A O no hydrogen 2.712 N/A ARG 193.A N GLN 189.A O no hydrogen 3.136 N/A ARG 194.A N PHE 190.A O no hydrogen 2.974 N/A ARG 194.A NE GLU 199.A O no hydrogen 3.234 N/A ARG 194.A NH1 ASP 184.A OD2 no hydrogen 3.486 N/A ARG 194.A NH2 GLU 199.A O no hydrogen 3.121 N/A ILE 195.A N MET 191.A O no hydrogen 2.971 N/A LEU 196.A N PHE 192.A O no hydrogen 2.901 N/A ASN 197.A N ARG 193.A O no hydrogen 2.940 N/A CYS 198.A N ILE 195.A O no hydrogen 3.009 N/A CYS 198.A SG ILE 222.A O no hydrogen 3.380 N/A GLU 199.A N ARG 194.A O no hydrogen 2.813 N/A TYR 201.A OH GLU 199.A OE2 no hydrogen 2.524 N/A SER 204.A OG ASP 208.A OD1 no hydrogen 2.855 N/A TRP 207.A N ILE 203.A O no hydrogen 3.145 N/A ASP 208.A N PRO 205.A O no hydrogen 2.913 N/A VAL 210.A N TRP 207.A O no hydrogen 3.021 N/A SER 211.A N GLU 95.A OE2 no hydrogen 2.777 N/A SER 211.A OG GLU 95.A OE1 no hydrogen 2.840 N/A ALA 214.A N SER 211.A OG no hydrogen 2.894 N/A LYS 215.A N SER 211.A O no hydrogen 3.181 N/A LYS 215.A NZ TRP 207.A O no hydrogen 3.399 N/A ASP 216.A N LEU 212.A O no hydrogen 2.840 N/A LEU 217.A N ASN 213.A O no hydrogen 3.053 N/A VAL 218.A N ALA 214.A O no hydrogen 3.016 N/A ARG 219.A N LYS 215.A O no hydrogen 2.864 N/A LYS 220.A N ASP 216.A O no hydrogen 3.124 N/A LYS 220.A N LEU 217.A O no hydrogen 2.987 N/A LEU 221.A N VAL 218.A O no hydrogen 3.136 N/A ILE 222.A N VAL 218.A O no hydrogen 3.093 N/A VAL 223.A N LEU 221.A O no hydrogen 2.894 N/A LYS 227.A N ASP 225.A OD1 no hydrogen 2.752 N/A LYS 228.A N ASP 225.A O no hydrogen 2.929 N/A ARG 229.A N PRO 226.A O no hydrogen 3.299 N/A ARG 229.A NE VAL 223.A O no hydrogen 2.776 N/A ARG 229.A NH1 GLU 152.A OE2 no hydrogen 2.804 N/A ARG 229.A NH1 GLU 162.A O no hydrogen 2.998 N/A ARG 229.A NH2 GLU 152.A OE1 no hydrogen 2.919 N/A ARG 229.A NH2 GLU 152.A OE2 no hydrogen 3.498 N/A ARG 229.A NH2 VAL 223.A O no hydrogen 3.034 N/A ARG 229.A NH2 LEU 224.A O no hydrogen 3.000 N/A LEU 230.A N LYS 220.A O no hydrogen 2.996 N/A THR 231.A N GLN 234.A OE1 no hydrogen 2.733 N/A THR 231.A OG1 GLN 234.A OE1 no hydrogen 3.335 N/A GLN 234.A N THR 231.A OG1 no hydrogen 3.130 N/A ALA 235.A N THR 231.A O no hydrogen 2.869 N/A LEU 236.A N THR 232.A O no hydrogen 2.974 N/A LEU 236.A N PHE 233.A O no hydrogen 3.105 N/A GLN 237.A N PHE 233.A O no hydrogen 3.247 N/A GLN 237.A N GLN 234.A O no hydrogen 3.127 N/A HIS 238.A N ALA 235.A O no hydrogen 3.210 N/A HIS 238.A NE2 ASP 216.A OD2 no hydrogen 2.552 N/A TRP 240.A N HIS 238.A ND1 no hydrogen 3.103 N/A TRP 240.A NE1 GLU 95.A OE1 no hydrogen 2.854 N/A THR 242.A N HIS 238.A O no hydrogen 2.862 N/A LYS 244.A N THR 242.A O no hydrogen 2.383 N/A ALA 245.A N PRO 239.A O no hydrogen 2.865 N/A ALA 246.A N GLY 243.A O no hydrogen 3.420 N/A ASN 247.A N GLU 95.A OE1 no hydrogen 3.387 N/A MET 251.A N TYR 93.A O no hydrogen 2.724 N/A THR 253.A N ASP 252.A OD1 no hydrogen 2.695 N/A GLN 255.A NE2 ILE 87.A O no hydrogen 2.732 N/A GLN 255.A NE2 LYS 90.A O no hydrogen 2.722 N/A LYS 257.A N THR 253.A O no hydrogen 3.068 N/A LYS 257.A NZ GLU 260.A OE1 no hydrogen 3.544 N/A LEU 258.A N ALA 254.A O no hydrogen 2.839 N/A GLN 259.A N GLN 255.A O no hydrogen 2.911 N/A GLU 260.A N LYS 256.A O no hydrogen 3.499 N/A PHE 261.A N LYS 257.A O no hydrogen 2.818 N/A ASN 262.A N LEU 258.A O no hydrogen 2.832 N/A ASN 262.A ND2 PHE 84.A O no hydrogen 2.916 N/A ALA 263.A N GLN 259.A O no hydrogen 3.250 N/A ARG 264.A N GLU 260.A O no hydrogen 2.890 N/A ARG 264.A NH1 GLU 180.A OE1 no hydrogen 3.095 N/A ARG 264.A NH2 GLU 180.A OE1 no hydrogen 3.174 N/A ARG 265.A N PHE 261.A O no hydrogen 2.741 N/A ARG 265.A NE ASN 262.A OD1 no hydrogen 2.815 N/A ARG 265.A NH1 GLU 82.A OE1 no hydrogen 3.019 N/A ARG 265.A NH1 GLU 125.A OE2 no hydrogen 2.904 N/A ARG 265.A NH2 GLU 82.A OE1 no hydrogen 2.825 N/A ARG 265.A NH2 ASN 262.A OD1 no hydrogen 2.994 N/A LYS 266.A N ASN 262.A O no hydrogen 2.965 N/A LYS 266.A NZ ASP 85.A OD1 no hydrogen 3.483 N/A LYS 266.A NZ ASP 85.A OD2 no hydrogen 3.009 N/A LEU 267.A N ALA 263.A O no hydrogen 2.986 N/A LYS 268.A N ARG 264.A O no hydrogen 3.013 N/A ALA 269.A N ARG 265.A O no hydrogen 3.111 N/A ALA 270.A N LYS 266.A O no hydrogen 3.020 N/A VAL 271.A N LEU 267.A O no hydrogen 2.784 N/A LYS 272.A N LYS 268.A O no hydrogen 2.919 N/A ALA 273.A N ALA 269.A O no hydrogen 3.041 N/A VAL 274.A N ALA 270.A O no hydrogen 2.940 N/A VAL 275.A N VAL 271.A O no hydrogen 2.860 N/A ALA 276.A N LYS 272.A O no hydrogen 2.809 N/A SER 277.A N VAL 274.A O no hydrogen 3.347 N/A SER 277.A OG ALA 273.A O no hydrogen 2.711 N/A