Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 2wd2_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLY 4.A N ASN 9.A O no hydrogen 2.934 N/A GLY 6.A N ASN 9.A OD1 no hydrogen 2.967 N/A ASN 9.A ND2 HIS 2.A O no hydrogen 3.070 N/A HIS 13.A N GLY 10.A O no hydrogen 2.766 N/A HIS 13.A NE2 LYS 7.A O no hydrogen 2.942 N/A TRP 14.A N PRO 11.A O no hydrogen 3.445 N/A TRP 14.A NE1 GLY 4.A O no hydrogen 3.035 N/A TRP 14.A NE1 ASN 9.A O no hydrogen 3.073 N/A LYS 16.A N HIS 13.A O no hydrogen 3.130 N/A LYS 16.A NZ HIS 13.A ND1 no hydrogen 2.779 N/A ASP 17.A N TRP 14.A O no hydrogen 3.124 N/A PHE 18.A N TRP 14.A O no hydrogen 2.890 N/A ALA 21.A N PHE 18.A O no hydrogen 2.882 N/A LYS 22.A N PRO 19.A O no hydrogen 3.051 N/A GLY 23.A N ILE 20.A O no hydrogen 2.680 N/A ARG 25.A N GLU 198.A OE2 no hydrogen 2.946 N/A ARG 25.A NE GLY 189.A O no hydrogen 3.018 N/A ARG 25.A NH1 PRO 131.A O no hydrogen 3.444 N/A ARG 25.A NH2 PRO 131.A O no hydrogen 2.944 N/A ARG 25.A NH2 GLY 189.A O no hydrogen 3.052 N/A ARG 25.A NH2 VAL 200.A O no hydrogen 2.896 N/A GLN 26.A NE2 LEU 196.A O no hydrogen 3.157 N/A GLN 26.A NE2 GLU 198.A OE2 no hydrogen 2.926 N/A SER 27.A N SER 190.A OG no hydrogen 2.863 N/A SER 27.A OG TYR 187.A OH no hydrogen 2.732 N/A SER 27.A OG SER 190.A O no hydrogen 3.510 N/A ILE 31.A N THR 102.A O no hydrogen 2.757 N/A THR 33.A N ASP 104.A OD1 no hydrogen 2.795 N/A THR 33.A OG1 ASP 104.A OD1 no hydrogen 3.300 N/A THR 33.A OG1 ASP 104.A OD2 no hydrogen 2.555 N/A HIS 34.A N ASP 32.A OD1 no hydrogen 2.852 N/A THR 35.A N ASP 32.A O no hydrogen 3.079 N/A THR 35.A OG1 ASP 32.A O no hydrogen 3.182 N/A ALA 36.A N ASP 32.A O no hydrogen 2.866 N/A LYS 37.A N ILE 249.A O no hydrogen 3.010 N/A ASP 39.A N ALA 251.A O no hydrogen 2.967 N/A SER 41.A N ASP 39.A OD1 no hydrogen 2.819 N/A SER 41.A OG ASP 39.A OD1 no hydrogen 2.559 N/A SER 41.A OG ASP 39.A OD2 no hydrogen 3.321 N/A LEU 42.A N ASP 39.A O no hydrogen 3.216 N/A LYS 43.A N GLY 76.A O no hydrogen 3.335 N/A SER 46.A N LYS 74.A O no hydrogen 2.961 N/A SER 48.A N VAL 72.A O no hydrogen 2.921 N/A TYR 49.A OH HIS 116.A NE2 no hydrogen 2.671 N/A ALA 52.A N TYR 49.A O no hydrogen 3.056 N/A THR 53.A OG1 GLN 51.A O no hydrogen 3.376 N/A SER 54.A OG PHE 169.A O no hydrogen 2.604 N/A LEU 55.A N GLU 67.A O no hydrogen 2.798 N/A ILE 57.A N ALA 167.A O no hydrogen 2.980 N/A LEU 58.A N ASN 65.A O no hydrogen 2.949 N/A ASN 59.A N LYS 165.A O no hydrogen 2.972 N/A ASN 59.A ND2 ILE 160.A O no hydrogen 3.187 N/A ASN 59.A ND2 ASN 223.A O no hydrogen 3.119 N/A ASN 60.A N ALA 63.A O no hydrogen 3.135 N/A GLY 61.A N ASN 59.A OD1 no hydrogen 2.828 N/A HIS 62.A N ASN 60.A OD1 no hydrogen 2.885 N/A ALA 63.A N ASN 60.A OD1 no hydrogen 2.955 N/A ASN 65.A N LEU 58.A O no hydrogen 2.924 N/A VAL 66.A N PHE 87.A O no hydrogen 2.926 N/A GLU 67.A N ARG 56.A O no hydrogen 2.932 N/A PHE 68.A N ILE 85.A O no hydrogen 2.854 N/A ASP 69.A N THR 53.A O no hydrogen 2.849 N/A VAL 72.A N SER 48.A O no hydrogen 3.013 N/A LEU 73.A N TYR 82.A O no hydrogen 2.773 N/A LYS 74.A N SER 46.A O no hydrogen 2.960 N/A GLY 76.A N PRO 44.A O no hydrogen 3.005 N/A LEU 78.A N GLY 75.A O no hydrogen 2.975 N/A THR 81.A OG1 THR 119.A OG1 no hydrogen 2.710 N/A TYR 82.A N LEU 73.A O no hydrogen 2.922 N/A TYR 82.A OH ASP 132.A O no hydrogen 3.139 N/A ARG 83.A N TRP 117.A O no hydrogen 2.836 N/A ARG 83.A NH1 ASP 70.A O no hydrogen 3.149 N/A LEU 84.A N ALA 71.A O no hydrogen 3.505 N/A ILE 85.A N VAL 115.A O no hydrogen 2.951 N/A GLN 86.A NE2 HIS 88.A ND1 no hydrogen 2.741 N/A PHE 87.A N VAL 66.A O no hydrogen 2.974 N/A HIS 88.A N HIS 113.A O no hydrogen 3.078 N/A HIS 90.A N GLU 111.A O no hydrogen 2.843 N/A HIS 90.A ND1 ASN 237.A O no hydrogen 2.840 N/A HIS 90.A NE2 HIS 113.A ND1 no hydrogen 3.063 N/A TRP 91.A N ASN 237.A OD1 no hydrogen 2.846 N/A TRP 91.A NE1 MET 234.A O no hydrogen 2.831 N/A SER 93.A N ASP 236.A OD1 no hydrogen 2.971 N/A SER 93.A OG ASP 236.A OD1 no hydrogen 3.373 N/A SER 93.A OG ASP 236.A OD2 no hydrogen 2.597 N/A GLN 97.A N LEU 94.A O no hydrogen 3.334 N/A GLN 97.A NE2 ASP 236.A OD1 no hydrogen 2.919 N/A SER 99.A N TYR 108.A O no hydrogen 2.992 N/A SER 99.A OG HIS 101.A O no hydrogen 2.793 N/A GLU 100.A N GLU 111.A OE1 no hydrogen 2.786 N/A HIS 101.A N GLU 111.A OE1 no hydrogen 2.810 N/A HIS 101.A ND1 GLU 111.A OE2 no hydrogen 2.823 N/A HIS 101.A NE2 TYR 187.A OH no hydrogen 2.635 N/A THR 102.A OG1 ASP 30.A OD1 no hydrogen 2.616 N/A VAL 103.A N LYS 106.A O no hydrogen 3.095 N/A ASP 104.A N ILE 31.A O no hydrogen 2.783 N/A LYS 105.A N ASP 30.A OD1 no hydrogen 2.762 N/A LYS 106.A N VAL 103.A O no hydrogen 2.935 N/A TYR 108.A N SER 99.A OG no hydrogen 2.985 N/A ALA 109.A N LEU 141.A O no hydrogen 3.123 N/A GLU 111.A N HIS 90.A O no hydrogen 2.933 N/A LEU 112.A N ILE 139.A O no hydrogen 2.820 N/A HIS 113.A N HIS 88.A O no hydrogen 2.810 N/A HIS 113.A NE2 GLU 111.A OE2 no hydrogen 2.690 N/A LEU 114.A N LEU 137.A O no hydrogen 2.918 N/A VAL 115.A N GLN 86.A O no hydrogen 2.858 N/A HIS 116.A N ALA 135.A O no hydrogen 2.956 N/A HIS 116.A ND1 ALA 135.A O no hydrogen 2.969 N/A HIS 116.A NE2 TYR 49.A OH no hydrogen 2.671 N/A TRP 117.A N ARG 83.A O no hydrogen 2.963 N/A TRP 117.A NE1 ASP 70.A OD2 no hydrogen 3.177 N/A ASN 118.A N GLY 133.A O no hydrogen 2.774 N/A ASN 118.A ND2 ASP 132.A O no hydrogen 3.131 N/A THR 119.A N THR 81.A O no hydrogen 2.951 N/A THR 119.A OG1 THR 81.A O no hydrogen 3.065 N/A THR 119.A OG1 THR 81.A OG1 no hydrogen 2.710 N/A LYS 120.A N ASN 118.A OD1 no hydrogen 2.991 N/A LYS 120.A NZ ASP 132.A OD2 no hydrogen 2.932 N/A TYR 121.A N ASN 118.A O no hydrogen 3.052 N/A TYR 121.A OH ASP 132.A OD1 no hydrogen 2.555 N/A GLY 122.A N THR 119.A O no hydrogen 3.089 N/A LYS 126.A N ASP 123.A OD2 no hydrogen 2.926 N/A LYS 126.A NZ ASP 123.A OD1 no hydrogen 2.749 N/A ALA 127.A N ASP 123.A O no hydrogen 3.019 N/A VAL 128.A N PHE 124.A O no hydrogen 3.057 N/A GLN 129.A N LYS 126.A O no hydrogen 3.220 N/A GLN 130.A N ALA 127.A O no hydrogen 3.049 N/A GLY 133.A N GLN 130.A O no hydrogen 3.062 N/A LEU 134.A N CYS 199.A O no hydrogen 2.801 N/A ALA 135.A N HIS 116.A O no hydrogen 2.882 N/A VAL 136.A N THR 201.A O no hydrogen 3.174 N/A LEU 137.A N LEU 114.A O no hydrogen 2.965 N/A GLY 138.A N ILE 203.A O no hydrogen 2.755 N/A ILE 139.A N LEU 112.A O no hydrogen 2.897 N/A LEU 141.A N ALA 110.A O no hydrogen 2.942 N/A LYS 142.A N ILE 209.A O no hydrogen 2.903 N/A GLY 144.A N VAL 211.A O no hydrogen 2.742 N/A LYS 147.A N GLN 215.A OE1 no hydrogen 3.062 N/A LYS 147.A NZ LEU 178.A O no hydrogen 3.047 N/A LEU 150.A N LYS 147.A O no hydrogen 2.969 N/A GLN 151.A N PRO 148.A O no hydrogen 3.068 N/A GLN 151.A NE2 ASP 155.A OD1 no hydrogen 3.008 N/A GLN 151.A NE2 ASP 155.A OD2 no hydrogen 3.329 N/A VAL 154.A N LEU 150.A O no hydrogen 3.056 N/A ASP 155.A N GLN 151.A O no hydrogen 2.952 N/A VAL 156.A N LYS 152.A O no hydrogen 3.321 N/A VAL 156.A N VAL 153.A O no hydrogen 3.272 N/A LEU 157.A N VAL 154.A O no hydrogen 3.268 N/A SER 159.A N VAL 156.A O no hydrogen 3.057 N/A SER 159.A OG VAL 156.A O no hydrogen 2.769 N/A ILE 160.A N LEU 157.A O no hydrogen 2.973 N/A LYS 163.A N ASN 225.A O no hydrogen 2.886 N/A GLY 164.A N ASN 59.A O no hydrogen 2.850 N/A LYS 165.A N THR 162.A O no hydrogen 3.132 N/A ALA 167.A N ILE 57.A O no hydrogen 2.889 N/A PHE 169.A N LEU 55.A O no hydrogen 3.115 N/A PHE 172.A N SER 54.A OG no hydrogen 2.984 N/A ARG 175.A N ASP 173.A OD1 no hydrogen 2.978 N/A ARG 175.A NE ASP 173.A OD1 no hydrogen 2.931 N/A ARG 175.A NE ASP 173.A OD2 no hydrogen 3.056 N/A ARG 175.A NH2 ASP 173.A OD2 no hydrogen 2.657 N/A GLY 176.A N ASP 173.A O no hydrogen 3.228 N/A LEU 177.A N PRO 174.A O no hydrogen 3.044 N/A LEU 178.A N ARG 175.A O no hydrogen 3.391 N/A SER 181.A N GLU 207.A OE1 no hydrogen 3.021 N/A ASP 183.A N SER 181.A OG no hydrogen 3.031 N/A TYR 184.A N SER 252.A OG no hydrogen 2.965 N/A TYR 184.A OH LYS 43.A O no hydrogen 2.711 N/A TRP 185.A N VAL 204.A O no hydrogen 2.795 N/A THR 186.A N LYS 250.A O no hydrogen 2.863 N/A THR 186.A OG1 TRP 202.A O no hydrogen 2.721 N/A TYR 187.A N TRP 202.A O no hydrogen 3.314 N/A TYR 187.A OH SER 27.A OG no hydrogen 2.732 N/A TYR 187.A OH HIS 101.A NE2 no hydrogen 2.635 N/A GLY 189.A N VAL 200.A O no hydrogen 2.776 N/A SER 190.A N SER 27.A OG no hydrogen 2.950 N/A SER 190.A OG LEU 191.A O no hydrogen 2.775 N/A LEU 191.A N LEU 197.A O no hydrogen 2.939 N/A THR 192.A OG1 GLU 100.A OE1 no hydrogen 2.589 N/A THR 192.A OG1 GLU 100.A OE2 no hydrogen 3.380 N/A THR 193.A OG1 PRO 194.A O no hydrogen 3.553 N/A LEU 196.A N THR 193.A O no hydrogen 2.810 N/A CYS 199.A SG LEU 197.A O no hydrogen 3.690 N/A VAL 200.A N GLY 189.A O no hydrogen 3.236 N/A THR 201.A N LEU 134.A O no hydrogen 2.873 N/A TRP 202.A N TYR 187.A O no hydrogen 2.967 N/A TRP 202.A NE1 SER 190.A O no hydrogen 2.890 N/A ILE 203.A N VAL 136.A O no hydrogen 2.980 N/A VAL 204.A N TRP 185.A O no hydrogen 2.845 N/A LEU 205.A N GLY 138.A O no hydrogen 2.934 N/A LYS 206.A N ASP 183.A O no hydrogen 2.925 N/A LYS 206.A NZ ASP 183.A OD2 no hydrogen 2.905 N/A ILE 209.A N PHE 140.A O no hydrogen 2.854 N/A VAL 211.A N LYS 142.A O no hydrogen 2.839 N/A SER 212.A N GLN 215.A OE1 no hydrogen 2.982 N/A GLN 215.A N SER 212.A OG no hydrogen 3.123 N/A GLN 215.A NE2 LYS 147.A O no hydrogen 2.941 N/A GLN 215.A NE2 GLN 151.A OE1 no hydrogen 2.919 N/A VAL 216.A N SER 212.A O no hydrogen 3.101 N/A LEU 217.A N SER 213.A O no hydrogen 2.974 N/A LYS 218.A N GLN 215.A O no hydrogen 3.112 N/A LYS 218.A NZ ASP 155.A OD1 no hydrogen 2.833 N/A PHE 219.A N VAL 216.A O no hydrogen 2.974 N/A ARG 220.A N LEU 217.A O no hydrogen 3.066 N/A ARG 220.A NE GLY 92.A O no hydrogen 2.882 N/A ARG 220.A NH2 ASP 95.A OD1 no hydrogen 2.714 N/A LYS 221.A N LYS 218.A O no hydrogen 3.214 N/A LEU 222.A N PHE 219.A O no hydrogen 3.300 N/A ASN 223.A N LYS 161.A O no hydrogen 2.735 N/A PHE 224.A N GLU 232.A O no hydrogen 2.735 N/A ASN 225.A ND2 GLY 226.A O no hydrogen 2.978 N/A GLU 232.A N ASN 225.A OD1 no hydrogen 2.639 N/A MET 234.A N LEU 222.A O no hydrogen 2.780 N/A ASN 237.A N TRP 91.A O no hydrogen 3.272 N/A ASN 237.A ND2 HIS 62.A O no hydrogen 2.933 N/A TRP 238.A NE1 ASP 236.A OD1 no hydrogen 3.007 N/A ARG 239.A N GLU 100.A OE2 no hydrogen 2.792 N/A ARG 239.A NH1 GLN 26.A OE1 no hydrogen 2.827 N/A ARG 239.A NH1 SER 27.A O no hydrogen 2.829 N/A ARG 239.A NH2 ALA 21.A O no hydrogen 3.264 N/A ARG 239.A NH2 GLN 26.A OE1 no hydrogen 3.360 N/A GLN 242.A N PRO 28.A O no hydrogen 2.803 N/A GLN 242.A NE2 PRO 240.A O no hydrogen 2.761 N/A LYS 245.A NZ GLY 23.A O no hydrogen 2.979 N/A LYS 245.A NZ GLU 24.A OE2 no hydrogen 3.422 N/A ARG 247.A N LEU 244.A O no hydrogen 3.358 N/A ARG 247.A NE LEU 244.A O no hydrogen 2.864 N/A ARG 247.A NH1 GLN 26.A O no hydrogen 2.986 N/A ARG 247.A NH1 PRO 188.A O no hydrogen 2.974 N/A ARG 247.A NH2 GLN 26.A O no hydrogen 2.792 N/A ARG 247.A NH2 PRO 243.A O no hydrogen 2.819 N/A LYS 250.A N THR 186.A O no hydrogen 3.003 N/A ALA 251.A N LYS 37.A O no hydrogen 2.794 N/A SER 252.A N TYR 184.A O no hydrogen 2.926 N/A SER 252.A OG TYR 184.A O no hydrogen 3.366 N/A