Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3wha_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLU 3.A N VAL 157.A O no hydrogen 2.929 N/A PHE 5.A N PHE 155.A O no hydrogen 2.862 N/A PHE 7.A N GLY 153.A O no hydrogen 2.947 N/A GLN 8.A N GLY 93.A O no hydrogen 2.863 N/A GLN 8.A NE2 GLU 10.A OE1 no hydrogen 3.299 N/A GLU 10.A N GLU 10.A OE1 no hydrogen 2.787 N/A ALA 12.A N GLN 8.A O no hydrogen 3.034 N/A GLN 13.A N ALA 9.A O no hydrogen 2.844 N/A LEU 14.A N GLU 10.A O no hydrogen 2.877 N/A MET 15.A N ILE 11.A O no hydrogen 2.890 N/A SER 16.A N ALA 12.A O no hydrogen 2.939 N/A LEU 17.A N GLN 13.A O no hydrogen 2.985 N/A ILE 18.A N LEU 14.A O no hydrogen 3.070 N/A ILE 19.A N MET 15.A O no hydrogen 2.944 N/A ASN 20.A N SER 16.A O no hydrogen 2.809 N/A ASN 20.A ND2 SER 16.A O no hydrogen 2.983 N/A ASN 20.A ND2 SER 16.A OG no hydrogen 3.076 N/A THR 21.A N LEU 17.A O no hydrogen 2.922 N/A THR 21.A OG1 LEU 17.A O no hydrogen 2.642 N/A TYR 23.A OH ASN 25.A O no hydrogen 2.823 N/A LYS 26.A N SER 24.A O no hydrogen 2.825 N/A LYS 26.A NZ LEU 128.A O no hydrogen 2.807 N/A PHE 29.A N LYS 26.A O no hydrogen 3.132 N/A LEU 30.A N GLU 27.A O no hydrogen 3.305 N/A ARG 31.A NE GLU 32.A OE2 no hydrogen 2.869 N/A ARG 31.A NH2 GLU 32.A OE2 no hydrogen 2.997 N/A GLU 32.A N ILE 28.A O no hydrogen 3.213 N/A LEU 33.A N PHE 29.A O no hydrogen 3.080 N/A ILE 34.A N LEU 30.A O no hydrogen 2.928 N/A SER 35.A N ARG 31.A O no hydrogen 2.914 N/A ASN 36.A N GLU 32.A O no hydrogen 3.094 N/A SER 37.A N LEU 33.A O no hydrogen 2.975 N/A SER 37.A OG LEU 33.A O no hydrogen 3.292 N/A SER 37.A OG ASP 78.A OD2 no hydrogen 2.813 N/A SER 38.A N ILE 34.A O no hydrogen 2.820 N/A ASP 39.A N SER 35.A O no hydrogen 2.932 N/A ALA 40.A N ASN 36.A O no hydrogen 2.976 N/A LEU 41.A N SER 37.A O no hydrogen 2.944 N/A ASP 42.A N SER 38.A O no hydrogen 2.871 N/A LYS 43.A N ASP 39.A O no hydrogen 3.084 N/A LYS 43.A NZ.B GLU 47.A OE1 no hydrogen 2.791 N/A ILE 44.A N ALA 40.A O no hydrogen 3.195 N/A ARG 45.A N LEU 41.A O no hydrogen 2.907 N/A TYR 46.A N ASP 42.A O no hydrogen 2.942 N/A GLU 47.A N LYS 43.A O no hydrogen 3.013 N/A SER 48.A N ILE 44.A O no hydrogen 2.931 N/A SER 48.A OG ILE 44.A O no hydrogen 3.277 N/A SER 48.A OG ARG 45.A O no hydrogen 2.669 N/A LEU 49.A N TYR 46.A O no hydrogen 3.113 N/A THR 50.A OG1 GLU 47.A O no hydrogen 3.464 N/A ASP 51.A N GLU 47.A O no hydrogen 3.149 N/A SER 53.A N ASP 51.A OD1 no hydrogen 3.269 N/A SER 53.A OG ASP 51.A OD1 no hydrogen 2.693 N/A LYS 54.A N ASP 51.A O no hydrogen 3.058 N/A LYS 54.A NZ GLU 47.A OE2 no hydrogen 2.840 N/A LEU 55.A N PRO 52.A O no hydrogen 3.109 N/A ASP 56.A N SER 53.A O no hydrogen 2.981 N/A SER 57.A OG LYS 54.A O no hydrogen 3.328 N/A SER 57.A OG ASN 140.A OD1 no hydrogen 2.668 N/A GLY 58.A N LEU 55.A O no hydrogen 2.831 N/A HIS 62.A N THR 79.A OG1 no hydrogen 3.092 N/A ILE 63.A N PRO 202.A O no hydrogen 2.933 N/A ASN 64.A N VAL 77.A O no hydrogen 2.756 N/A LEU 65.A N THR 204.A O no hydrogen 2.827 N/A ILE 66.A N THR 75.A O no hydrogen 2.804 N/A ASN 68.A N THR 73.A O no hydrogen 2.871 N/A LYS 69.A N GLU 208.A OE1 no hydrogen 2.838 N/A LYS 69.A NZ GLU 184.A OE1 no hydrogen 3.540 N/A LYS 69.A NZ GLU 184.A OE2 no hydrogen 3.404 N/A ASP 71.A N ASN 68.A OD1 no hydrogen 2.865 N/A ARG 72.A NE LEU 175.A O no hydrogen 2.845 N/A ARG 72.A NH2 LEU 175.A O no hydrogen 2.973 N/A THR 73.A N ASN 68.A O no hydrogen 3.099 N/A LEU 74.A N LEU 173.A O no hydrogen 3.046 N/A THR 75.A N ILE 66.A O no hydrogen 2.912 N/A ILE 76.A N VAL 171.A O no hydrogen 2.896 N/A VAL 77.A N ASN 64.A O no hydrogen 2.872 N/A ASP 78.A N THR 169.A O no hydrogen 2.868 N/A THR 79.A N HIS 62.A O no hydrogen 3.278 N/A THR 79.A OG1 GLU 60.A O no hydrogen 2.674 N/A GLY 80.A N ASP 78.A OD1 no hydrogen 2.778 N/A ILE 81.A N ALA 40.A O no hydrogen 3.038 N/A MET 83.A N THR 137.A OG1 no hydrogen 2.944 N/A THR 84.A N ASP 87.A OD2 no hydrogen 3.181 N/A LYS 85.A N ASP 142.A OD2 no hydrogen 2.948 N/A LYS 85.A NZ GLU 3.A OE1 no hydrogen 2.763 N/A ASP 87.A N THR 84.A OG1 no hydrogen 3.082 N/A LEU 88.A N THR 84.A O no hydrogen 2.878 N/A ILE 89.A N LYS 85.A O no hydrogen 3.088 N/A ASN 90.A N ALA 86.A O no hydrogen 2.995 N/A ASN 91.A N ASP 87.A O no hydrogen 2.771 N/A LEU 92.A N LEU 88.A O no hydrogen 3.083 N/A GLY 93.A N ILE 89.A O no hydrogen 2.835 N/A THR 94.A N ASN 90.A O no hydrogen 3.263 N/A THR 94.A OG1 ASN 90.A O no hydrogen 2.693 N/A ILE 95.A N GLN 8.A OE1 no hydrogen 2.920 N/A SER 98.A N ILE 95.A O no hydrogen 2.897 N/A SER 98.A OG ILE 95.A O no hydrogen 2.692 N/A SER 98.A OG THR 100.A OG1 no hydrogen 2.840 N/A GLY 99.A N PHE 119.A O no hydrogen 2.643 N/A THR 100.A N SER 98.A OG no hydrogen 3.307 N/A THR 100.A OG1 SER 98.A OG no hydrogen 2.840 N/A PHE 103.A N GLY 99.A O no hydrogen 2.845 N/A MET 104.A N THR 100.A O no hydrogen 3.098 N/A GLU 105.A N LYS 101.A O no hydrogen 3.114 N/A ALA 106.A N ALA 102.A O no hydrogen 2.816 N/A LEU 107.A N PHE 103.A O no hydrogen 2.951 N/A GLN 108.A N GLU 105.A O no hydrogen 3.034 N/A ALA 109.A N ALA 106.A O no hydrogen 2.873 N/A ALA 111.A N ALA 106.A O no hydrogen 2.958 N/A SER 114.A N ASP 112.A OD2 no hydrogen 2.932 N/A SER 114.A OG ASP 112.A OD2 no hydrogen 2.637 N/A MET 115.A N ASP 112.A O no hydrogen 3.004 N/A ILE 116.A N ILE 113.A O no hydrogen 3.025 N/A GLN 118.A N MET 115.A O no hydrogen 2.969 N/A PHE 119.A N ILE 116.A O no hydrogen 3.009 N/A TYR 124.A N VAL 121.A O no hydrogen 3.041 N/A TYR 124.A OH LEU 92.A O no hydrogen 2.648 N/A SER 125.A N GLY 122.A O no hydrogen 2.989 N/A SER 125.A OG GLY 122.A O no hydrogen 2.684 N/A ALA 126.A N PHE 123.A O no hydrogen 2.876 N/A TYR 127.A N TYR 124.A O no hydrogen 3.011 N/A TYR 127.A OH SER 149.A O no hydrogen 2.857 N/A LEU 128.A N SER 125.A O no hydrogen 2.865 N/A VAL 129.A N ALA 126.A O no hydrogen 3.076 N/A ALA 130.A N ALA 126.A O no hydrogen 2.909 N/A GLU 131.A N HIS 174.A O no hydrogen 2.808 N/A VAL 133.A N SER 149.A O no hydrogen 3.072 N/A THR 134.A N ILE 172.A O no hydrogen 2.967 N/A THR 134.A OG1 GLU 148.A OE2 no hydrogen 2.605 N/A THR 134.A OG1 HIS 174.A NE2 no hydrogen 2.893 N/A VAL 135.A N TRP 147.A O no hydrogen 2.752 N/A ILE 136.A N LYS 170.A O no hydrogen 2.844 N/A THR 137.A N TYR 145.A O no hydrogen 2.917 N/A THR 137.A OG1 GLY 168.A O no hydrogen 3.270 N/A THR 137.A OG1 THR 169.A OG1 no hydrogen 2.889 N/A LYS 138.A N GLY 168.A O no hydrogen 2.825 N/A LYS 138.A NZ HIS 139.A O no hydrogen 2.863 N/A LYS 138.A NZ ASP 142.A O no hydrogen 2.858 N/A ASN 140.A ND2 LYS 54.A O no hydrogen 2.870 N/A ASP 141.A N HIS 139.A ND1 no hydrogen 2.858 N/A ASP 142.A N HIS 139.A O no hydrogen 3.139 N/A GLU 143.A N ASP 142.A OD1 no hydrogen 2.810 N/A GLN 144.A NE2 ASP 160.A OD2 no hydrogen 2.884 N/A GLN 144.A NE2 GLU 163.A O no hydrogen 3.149 N/A TYR 145.A N THR 137.A O no hydrogen 3.027 N/A ALA 146.A N ARG 158.A O no hydrogen 2.853 N/A TRP 147.A N VAL 135.A O no hydrogen 2.778 N/A GLU 148.A N THR 156.A O no hydrogen 2.988 N/A SER 149.A N VAL 133.A O no hydrogen 3.009 N/A SER 149.A OG SER 154.A O no hydrogen 2.751 N/A ALA 151.A N SER 149.A OG no hydrogen 2.910 N/A PHE 155.A N PHE 5.A O no hydrogen 2.944 N/A THR 156.A N GLU 148.A O no hydrogen 2.898 N/A VAL 157.A N GLU 3.A O no hydrogen 2.879 N/A ARG 158.A N ALA 146.A O no hydrogen 2.983 N/A ARG 158.A NH1.A THR 159.A O no hydrogen 3.455 N/A ARG 158.A NH1.A ASP 160.A OD1 no hydrogen 2.908 N/A ARG 158.A NH2.B THR 156.A OG1 no hydrogen 3.217 N/A ASP 160.A N GLN 144.A O no hydrogen 2.897 N/A MET 165.A N GLN 144.A OE1 no hydrogen 2.803 N/A ARG 167.A NE THR 79.A O no hydrogen 3.114 N/A ARG 167.A NE GLY 80.A O no hydrogen 3.105 N/A ARG 167.A NH1 SER 57.A OG no hydrogen 2.913 N/A ARG 167.A NH1 GLY 58.A O no hydrogen 2.836 N/A ARG 167.A NH2 GLY 58.A O no hydrogen 2.951 N/A ARG 167.A NH2 THR 79.A O no hydrogen 2.802 N/A GLY 168.A N LYS 138.A O no hydrogen 2.854 N/A THR 169.A N ASP 78.A O no hydrogen 3.239 N/A THR 169.A N ASP 78.A OD1 no hydrogen 3.298 N/A THR 169.A OG1 THR 137.A OG1 no hydrogen 2.889 N/A LYS 170.A N ILE 136.A O no hydrogen 2.795 N/A VAL 171.A N ILE 76.A O no hydrogen 2.820 N/A ILE 172.A N THR 134.A O no hydrogen 2.734 N/A LEU 173.A N LEU 74.A O no hydrogen 2.832 N/A HIS 174.A N LYS 132.A O no hydrogen 2.894 N/A HIS 174.A NE2 THR 134.A OG1 no hydrogen 2.893 N/A LEU 175.A N ARG 72.A O no hydrogen 3.048 N/A LYS 176.A N VAL 129.A O no hydrogen 2.875 N/A LYS 176.A NZ TYR 127.A O no hydrogen 3.134 N/A LYS 176.A NZ LEU 128.A O no hydrogen 3.155 N/A GLN 179.A N LYS 176.A O no hydrogen 3.016 N/A GLN 179.A NE2 ASP 178.A OD1 no hydrogen 3.425 N/A TYR 182.A N GLN 179.A O no hydrogen 3.366 N/A LEU 183.A N THR 180.A O no hydrogen 3.001 N/A GLU 184.A N GLU 181.A O no hydrogen 3.057 N/A ARG 187.A NE GLU 181.A OE1 no hydrogen 2.751 N/A ARG 187.A NH1 GLU 27.A OE1 no hydrogen 2.930 N/A ARG 187.A NH1 GLU 190.A OE1 no hydrogen 2.891 N/A ARG 187.A NH2 GLU 27.A OE1 no hydrogen 2.857 N/A ARG 187.A NH2 GLU 181.A OE1 no hydrogen 3.222 N/A ILE 188.A N GLU 184.A O no hydrogen 3.022 N/A LYS 189.A N GLU 185.A O no hydrogen 2.931 N/A LYS 189.A NZ GLU 185.A OE2 no hydrogen 3.106 N/A GLU 190.A N ARG 186.A O no hydrogen 3.047 N/A ILE 191.A N ARG 187.A O no hydrogen 3.034 N/A VAL 192.A N ILE 188.A O no hydrogen 2.896 N/A LYS 193.A N LYS 189.A O no hydrogen 2.954 N/A LYS 194.A N GLU 190.A O no hydrogen 2.995 N/A LYS 194.A NZ GLU 27.A OE2 no hydrogen 3.018 N/A HIS 195.A N ILE 191.A O no hydrogen 2.971 N/A HIS 195.A NE2 GLU 27.A OE2 no hydrogen 2.965 N/A SER 196.A N VAL 192.A O no hydrogen 2.801 N/A ILE 199.A N SER 196.A O no hydrogen 3.407 N/A TYR 201.A OH ASP 42.A OD1 no hydrogen 2.587 N/A THR 204.A N ILE 63.A O no hydrogen 2.904 N/A PHE 206.A N LEU 65.A O no hydrogen 2.902 N/A