Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 5w7i_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): TYR 4.A N ASP 2.A OD1 no hydrogen 2.973 N/A SER 5.A N ASP 3.A OD1 no hydrogen 3.428 N/A SER 5.A OG ASP 3.A OD1 no hydrogen 2.749 N/A SER 5.A OG ASP 3.A OD2 no hydrogen 2.998 N/A TRP 7.A N TYR 4.A O no hydrogen 3.069 N/A TRP 7.A NE1 ASP 2.A OD2 no hydrogen 2.698 N/A LYS 11.A N ASP 8.A OD1 no hydrogen 2.882 N/A ALA 12.A N ASP 8.A O no hydrogen 2.944 N/A THR 13.A N ILE 9.A O no hydrogen 2.928 N/A THR 13.A OG1 ILE 9.A O no hydrogen 2.767 N/A THR 13.A OG1 TYR 57.A OH no hydrogen 2.598 N/A GLN 14.A N VAL 10.A O no hydrogen 2.947 N/A TYR 15.A N LYS 11.A O no hydrogen 3.107 N/A GLY 16.A N THR 13.A O no hydrogen 2.899 N/A ILE 17.A N ALA 12.A O no hydrogen 2.823 N/A ARG 20.A NE TRP 7.A O no hydrogen 2.963 N/A ARG 20.A NH1 GLU 23.A OE2 no hydrogen 2.395 N/A ARG 20.A NH2 TRP 7.A O no hydrogen 2.911 N/A CYS 21.A N ILE 17.A O no hydrogen 3.166 N/A CYS 21.A SG THR 13.A OG1 no hydrogen 3.501 N/A CYS 21.A SG ILE 17.A O no hydrogen 3.341 N/A CYS 21.A SG TYR 57.A OH no hydrogen 3.437 N/A ARG 22.A N TYR 18.A O no hydrogen 2.987 N/A GLU 23.A N GLU 19.A O no hydrogen 2.992 N/A LEU 24.A N ARG 20.A O no hydrogen 3.096 N/A VAL 25.A N CYS 21.A O no hydrogen 2.998 N/A GLU 26.A N ARG 22.A O no hydrogen 3.156 N/A ALA 27.A N GLU 23.A O no hydrogen 2.983 N/A GLY 28.A N VAL 25.A O no hydrogen 2.788 N/A TYR 29.A N LEU 24.A O no hydrogen 3.003 N/A ARG 32.A N ASP 30.A OD1 no hydrogen 2.919 N/A ARG 32.A NH2 GLY 61.A O no hydrogen 2.886 N/A GLN 33.A N ASP 30.A O no hydrogen 2.935 N/A ASP 35.A N VAL 39.A O no hydrogen 3.039 N/A GLU 37.A N ASP 35.A OD1 no hydrogen 2.999 N/A ASN 38.A N ASP 35.A O no hydrogen 2.806 N/A VAL 39.A N ASP 35.A OD1 no hydrogen 2.823 N/A THR 40.A N HIS 43.A ND1 no hydrogen 3.371 N/A THR 40.A OG1 HIS 43.A ND1 no hydrogen 2.808 N/A HIS 43.A N THR 40.A OG1 no hydrogen 3.407 N/A HIS 43.A ND1 THR 40.A OG1 no hydrogen 2.808 N/A HIS 43.A NE2 SER 73.A O no hydrogen 2.704 N/A TRP 44.A N THR 40.A O no hydrogen 3.389 N/A TRP 44.A NE1 ASP 35.A OD2 no hydrogen 2.937 N/A ALA 45.A N LEU 41.A O no hydrogen 2.904 N/A ALA 46.A N LEU 42.A O no hydrogen 2.824 N/A ILE 47.A N HIS 43.A O no hydrogen 2.955 N/A ASN 48.A N TRP 44.A O no hydrogen 3.220 N/A ASN 48.A N ALA 45.A O no hydrogen 3.247 N/A ASN 48.A ND2 TRP 44.A O no hydrogen 3.109 N/A ASN 49.A N ALA 46.A O no hydrogen 3.047 N/A ARG 50.A N ALA 45.A O no hydrogen 2.913 N/A ARG 50.A NE GLN 14.A O no hydrogen 3.217 N/A ARG 50.A NH2 GLN 14.A O no hydrogen 3.045 N/A ILE 51.A N ASN 49.A O no hydrogen 2.869 N/A VAL 54.A N ARG 50.A O no hydrogen 2.895 N/A LYS 55.A N ILE 51.A O no hydrogen 3.035 N/A TYR 56.A N ASP 52.A O no hydrogen 2.952 N/A TYR 57.A N LEU 53.A O no hydrogen 2.851 N/A TYR 57.A OH THR 13.A OG1 no hydrogen 2.598 N/A ILE 58.A N VAL 54.A O no hydrogen 3.011 N/A SER 59.A N LYS 55.A O no hydrogen 2.894 N/A SER 59.A OG LYS 55.A O no hydrogen 3.568 N/A SER 59.A OG TYR 56.A O no hydrogen 2.580 N/A LYS 60.A N TYR 56.A O no hydrogen 2.927 N/A LYS 60.A NZ GLU 26.A OE1 no hydrogen 3.431 N/A GLY 61.A N ILE 58.A O no hydrogen 2.791 N/A ALA 62.A N TYR 57.A O no hydrogen 2.893 N/A GLN 66.A N ILE 63.A O no hydrogen 3.494 N/A GLY 68.A N SER 73.A O no hydrogen 2.907 N/A GLY 69.A N ASN 38.A O no hydrogen 2.697 N/A ASN 72.A N GLY 69.A O no hydrogen 2.950 N/A SER 73.A N GLY 68.A O no hydrogen 2.971 N/A SER 73.A OG LEU 71.A O no hydrogen 3.146 N/A THR 74.A N HIS 77.A ND1 no hydrogen 2.960 N/A HIS 77.A N THR 74.A OG1 no hydrogen 2.874 N/A HIS 77.A NE2 LEU 100.A O no hydrogen 2.848 N/A TRP 78.A N THR 74.A O no hydrogen 3.156 N/A ALA 79.A N PRO 75.A O no hydrogen 2.971 N/A THR 80.A N LEU 76.A O no hydrogen 2.903 N/A THR 80.A OG1 LEU 76.A O no hydrogen 2.758 N/A ARG 81.A N HIS 77.A O no hydrogen 2.962 N/A ARG 81.A NH2 ASP 102.A OD2 no hydrogen 3.119 N/A ARG 81.A NH2 GLU 104.A OE1 no hydrogen 2.962 N/A GLN 82.A N TRP 78.A O no hydrogen 3.028 N/A GLY 83.A N ALA 79.A O no hydrogen 2.924 N/A GLY 83.A N THR 80.A O no hydrogen 3.151 N/A HIS 84.A N ALA 79.A O no hydrogen 3.114 N/A VAL 88.A N HIS 84.A O no hydrogen 2.854 N/A VAL 89.A N LEU 85.A O no hydrogen 2.790 N/A GLN 90.A N SER 86.A O no hydrogen 2.815 N/A LEU 91.A N MET 87.A O no hydrogen 2.787 N/A MET 92.A N VAL 88.A O no hydrogen 2.979 N/A LYS 93.A N VAL 89.A O no hydrogen 3.078 N/A TYR 94.A N GLN 90.A O no hydrogen 3.373 N/A TYR 94.A N LEU 91.A O no hydrogen 3.191 N/A GLY 95.A N MET 92.A O no hydrogen 3.083 N/A ALA 96.A N LEU 91.A O no hydrogen 3.048 N/A ASP 97.A N ASP 65.A OD2 no hydrogen 2.814 N/A SER 99.A N ASP 97.A OD1 no hydrogen 2.857 N/A SER 99.A OG GLN 129.A OE1 no hydrogen 3.017 N/A LEU 100.A N ASP 97.A O no hydrogen 3.163 N/A ASP 102.A N CYS 106.A O no hydrogen 2.879 N/A GLY 103.A N LEU 71.A O no hydrogen 2.781 N/A GLU 104.A N ASP 102.A OD1 no hydrogen 2.898 N/A GLY 105.A N ASP 102.A O no hydrogen 2.853 N/A CYS 106.A N ASP 102.A OD1 no hydrogen 2.956 N/A CYS 106.A SG GLU 104.A O no hydrogen 3.939 N/A CYS 106.A SG ASP 135.A OD2 no hydrogen 3.653 N/A SER 107.A N HIS 110.A ND1 no hydrogen 3.270 N/A SER 107.A OG HIS 110.A ND1 no hydrogen 3.162 N/A CYS 108.A N PRO 98.A O no hydrogen 2.983 N/A CYS 108.A SG THR 80.A OG1 no hydrogen 3.580 N/A HIS 110.A NE2 MET 133.A O no hydrogen 2.852 N/A LEU 111.A N SER 107.A O no hydrogen 3.083 N/A ALA 112.A N CYS 108.A O no hydrogen 2.835 N/A ALA 113.A N ILE 109.A O no hydrogen 2.928 N/A GLN 114.A N HIS 110.A O no hydrogen 2.857 N/A GLN 114.A NE2 HIS 110.A O no hydrogen 3.322 N/A PHE 115.A N LEU 111.A O no hydrogen 3.167 N/A GLY 116.A N ALA 113.A O no hydrogen 3.233 N/A HIS 117.A N ALA 112.A O no hydrogen 2.998 N/A HIS 117.A NE2 ARG 81.A O no hydrogen 2.877 N/A THR 118.A OG1 GLY 116.A O no hydrogen 3.530 N/A VAL 121.A N HIS 117.A O no hydrogen 3.078 N/A ALA 122.A N THR 118.A O no hydrogen 2.941 N/A TYR 123.A N SER 119.A O no hydrogen 2.889 N/A LEU 124.A N ILE 120.A O no hydrogen 2.886 N/A ILE 125.A N VAL 121.A O no hydrogen 3.051 N/A ALA 126.A N ALA 122.A O no hydrogen 2.908 N/A LYS 127.A N TYR 123.A O no hydrogen 2.914 N/A LYS 127.A N LEU 124.A O no hydrogen 3.210 N/A GLY 128.A N ILE 125.A O no hydrogen 3.182 N/A GLN 129.A N LEU 124.A O no hydrogen 2.905 N/A ASP 132.A N ASP 130.A OD2 no hydrogen 3.069 N/A MET 133.A N ASP 130.A O no hydrogen 2.952 N/A ASP 135.A N MET 139.A O no hydrogen 3.043 N/A GLN 136.A N GLY 105.A O no hydrogen 2.871 N/A ASN 137.A ND2 GLU 104.A O no hydrogen 3.388 N/A ASN 137.A ND2 ASP 135.A OD2 no hydrogen 3.138 N/A GLY 138.A N ASP 135.A O no hydrogen 2.904 N/A MET 139.A N ASP 135.A OD1 no hydrogen 2.934 N/A MET 143.A N THR 140.A OG1 no hydrogen 3.043 N/A TRP 144.A N THR 140.A O no hydrogen 3.039 N/A TRP 144.A NE1 ASP 135.A OD2 no hydrogen 2.846 N/A ALA 145.A N PRO 141.A O no hydrogen 2.879 N/A ALA 146.A N LEU 142.A O no hydrogen 2.910 N/A TYR 147.A N MET 143.A O no hydrogen 2.985 N/A ARG 148.A N TRP 144.A O no hydrogen 2.968 N/A THR 149.A N ALA 145.A O no hydrogen 2.895 N/A THR 149.A OG1 ALA 145.A O no hydrogen 2.645 N/A SER 151.A OG ASP 153.A O no hydrogen 2.632 N/A ARG 156.A N VAL 152.A O no hydrogen 2.837 N/A ARG 156.A NH2 ASP 153.A OD2 no hydrogen 3.101 N/A LEU 157.A N ASP 153.A OD1 no hydrogen 3.090 N/A LEU 158.A N PRO 154.A O no hydrogen 2.976 N/A LEU 159.A N THR 155.A O no hydrogen 3.033 N/A THR 160.A N LEU 157.A O no hydrogen 3.011 N/A THR 160.A OG1 LEU 157.A O no hydrogen 2.768 N/A PHE 161.A N LEU 158.A O no hydrogen 3.166 N/A VAL 163.A N PHE 161.A O no hydrogen 2.797 N/A SER 164.A N ASP 132.A OD2 no hydrogen 2.801 N/A ASN 166.A ND2 GLY 196.A O no hydrogen 3.412 N/A LEU 167.A N SER 164.A O no hydrogen 3.104 N/A ASP 169.A N ASN 174.A O no hydrogen 3.159 N/A HIS 172.A N ASP 169.A OD2 no hydrogen 2.811 N/A LYS 173.A N ASP 169.A O no hydrogen 2.968 N/A ASN 174.A N ASP 169.A OD1 no hydrogen 2.833 N/A THR 175.A N HIS 178.A ND1 no hydrogen 3.054 N/A THR 175.A OG1 HIS 178.A ND1 no hydrogen 2.900 N/A HIS 178.A N THR 175.A OG1 no hydrogen 3.326 N/A HIS 178.A ND1 THR 175.A OG1 no hydrogen 2.900 N/A HIS 178.A NE2 GLU 207.A O no hydrogen 2.887 N/A TRP 179.A N THR 175.A O no hydrogen 2.982 N/A ALA 180.A N ALA 176.A O no hydrogen 2.895 N/A VAL 181.A N LEU 177.A O no hydrogen 2.924 N/A LEU 182.A N HIS 178.A O no hydrogen 2.826 N/A ALA 183.A N TRP 179.A O no hydrogen 2.976 N/A GLY 184.A N VAL 181.A O no hydrogen 2.995 N/A ASN 185.A N ALA 180.A O no hydrogen 2.802 N/A ASN 185.A ND2 ALA 146.A O no hydrogen 2.807 N/A ASN 185.A ND2 THR 149.A O no hydrogen 2.913 N/A THR 186.A N GLY 184.A O no hydrogen 2.973 N/A VAL 188.A N ASN 185.A O no hydrogen 3.097 N/A VAL 188.A N ASN 185.A OD1 no hydrogen 3.447 N/A ILE 189.A N ASN 185.A O no hydrogen 3.160 N/A SER 190.A OG THR 186.A O no hydrogen 3.536 N/A LEU 192.A N VAL 188.A O no hydrogen 2.996 N/A LEU 193.A N ILE 189.A O no hydrogen 3.035 N/A GLU 194.A N SER 190.A O no hydrogen 2.949 N/A ALA 195.A N LEU 191.A O no hydrogen 2.956 N/A ALA 195.A N LEU 192.A O no hydrogen 2.923 N/A GLY 196.A N LEU 193.A O no hydrogen 2.922 N/A ALA 197.A N LEU 192.A O no hydrogen 2.904 N/A ASN 198.A N ASN 166.A OD1 no hydrogen 2.794 N/A ASP 200.A N ASN 198.A OD1 no hydrogen 2.775 N/A ASN 203.A N GLU 207.A O no hydrogen 2.971 N/A ASN 203.A ND2 ASN 174.A OD1 no hydrogen 2.848 N/A ASN 203.A ND2 GLU 207.A OE1 no hydrogen 3.365 N/A ILE 204.A N HIS 172.A O no hydrogen 2.949 N/A GLY 206.A N ASN 203.A O no hydrogen 2.995 N/A GLU 207.A N ASN 203.A OD1 no hydrogen 2.864 N/A SER 208.A N ASP 211.A OD2 no hydrogen 2.950 N/A SER 208.A OG VAL 199.A O no hydrogen 3.316 N/A LEU 210.A N VAL 199.A O no hydrogen 3.111 N/A ASP 211.A N SER 208.A OG no hydrogen 2.888 N/A LEU 212.A N SER 208.A O no hydrogen 3.025 N/A ALA 213.A N ALA 209.A O no hydrogen 2.927 N/A LYS 214.A N LEU 210.A O no hydrogen 2.787 N/A GLN 215.A N ASP 211.A O no hydrogen 2.742 N/A GLN 215.A NE2 GLU 207.A OE2 no hydrogen 2.991 N/A ARG 216.A N LEU 212.A O no hydrogen 2.983 N/A LYS 217.A N LYS 214.A O no hydrogen 3.051 N/A MET 221.A N ASN 218.A OD1 no hydrogen 3.178 N/A ILE 222.A N ASN 218.A O no hydrogen 2.929 N/A ASN 223.A N VAL 219.A O no hydrogen 2.967 N/A ASN 223.A ND2 GLU 227.A OE1 no hydrogen 3.113 N/A HIS 224.A N TRP 220.A O no hydrogen 3.034 N/A LEU 225.A N MET 221.A O no hydrogen 3.051 N/A GLN 226.A N ILE 222.A O no hydrogen 2.963 N/A GLU 227.A N ASN 223.A O no hydrogen 2.967 N/A ALA 228.A N LEU 225.A O no hydrogen 3.007 N/A ARG 229.A N GLN 226.A O no hydrogen 3.424 N/A ARG 229.A NE ASP 200.A OD2 no hydrogen 3.434 N/A ARG 229.A NH1 ASP 200.A OD2 no hydrogen 3.196 N/A