Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3wp6_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): CYS 7.A N GLN 4.A O no hydrogen 3.075 N/A SER 8.A N SER 5.A O no hydrogen 3.057 N/A ALA 10.A N PHE 6.A O no hydrogen 3.008 N/A HIS 12.A ND1 SER 50.A OG no hydrogen 2.667 N/A HIS 12.A NE2 ASP 218.A OD1 no hydrogen 2.603 N/A SER 13.A N ASP 48.A OD2 no hydrogen 2.870 N/A GLN 15.A N SER 47.A OG no hydrogen 3.224 N/A VAL 17.A N PHE 45.A O no hydrogen 2.915 N/A VAL 19.A N ALA 43.A O no hydrogen 2.899 N/A ASN 22.A ND2 ALA 36.A O no hydrogen 3.243 N/A LYS 23.A N LEU 34.A O no hydrogen 3.016 N/A LYS 23.A NZ VAL 24.A O no hydrogen 3.030 N/A GLY 25.A N TYR 32.A O no hydrogen 3.106 N/A ILE 27.A N VAL 30.A O no hydrogen 2.908 N/A VAL 30.A N ILE 27.A O no hydrogen 3.025 N/A GLY 31.A N GLY 66.A O no hydrogen 2.852 N/A TYR 32.A N GLY 25.A O no hydrogen 2.914 N/A GLU 33.A N ARG 64.A O no hydrogen 2.959 N/A LEU 34.A N LYS 23.A O no hydrogen 2.945 N/A TRP 35.A N LEU 62.A O no hydrogen 3.044 N/A ALA 36.A N ASN 22.A OD1 no hydrogen 2.941 N/A ASP 37.A N ASP 60.A O no hydrogen 3.063 N/A SER 38.A OG ASP 37.A OD1 no hydrogen 2.788 N/A ASN 40.A N GLN 56.A O no hydrogen 2.878 N/A ASN 41.A ND2 SER 38.A O no hydrogen 2.863 N/A SER 42.A N THR 54.A O no hydrogen 2.883 N/A SER 42.A OG THR 54.A OG1 no hydrogen 2.556 N/A ALA 43.A N VAL 19.A O no hydrogen 2.997 N/A THR 44.A N SER 52.A O no hydrogen 2.907 N/A PHE 45.A N VAL 17.A O no hydrogen 2.902 N/A TYR 46.A N SER 50.A O no hydrogen 2.928 N/A SER 47.A N GLN 15.A O no hydrogen 2.832 N/A SER 47.A OG GLN 15.A OE1 no hydrogen 3.039 N/A GLY 49.A N TYR 46.A O no hydrogen 2.947 N/A SER 50.A N ASP 48.A OD1 no hydrogen 2.880 N/A SER 50.A OG HIS 12.A ND1 no hydrogen 2.667 N/A SER 50.A OG ASP 48.A OD1 no hydrogen 2.597 N/A SER 50.A OG ASP 48.A OD2 no hydrogen 3.483 N/A PHE 51.A N PHE 219.A O no hydrogen 3.042 N/A SER 52.A N THR 44.A O no hydrogen 2.895 N/A CYS 53.A N ALA 217.A O no hydrogen 2.919 N/A THR 54.A N SER 42.A O no hydrogen 3.019 N/A THR 54.A OG1 SER 42.A OG no hydrogen 2.556 N/A PHE 55.A N GLY 215.A O no hydrogen 2.872 N/A GLN 56.A N ASN 41.A OD1 no hydrogen 2.948 N/A ASN 57.A N SER 214.A OG no hydrogen 2.840 N/A ALA 58.A N ALA 213.A O no hydrogen 2.883 N/A GLY 59.A N SER 38.A OG no hydrogen 2.835 N/A ASP 60.A N ASP 37.A OD1 no hydrogen 2.940 N/A TYR 61.A N ALA 206.A O no hydrogen 2.845 N/A TYR 61.A OH SER 42.A O no hydrogen 2.748 N/A LEU 62.A N TRP 35.A O no hydrogen 2.817 N/A CYS 63.A N GLY 204.A O no hydrogen 2.890 N/A CYS 63.A SG GLY 204.A O no hydrogen 3.413 N/A ARG 64.A N GLU 33.A O no hydrogen 3.101 N/A ARG 64.A NE GLU 199.A OE2 no hydrogen 2.893 N/A ARG 64.A NH2 GLU 199.A OE1 no hydrogen 2.814 N/A SER 65.A N VAL 202.A O no hydrogen 3.034 N/A SER 65.A OG GLY 49.A O no hydrogen 3.219 N/A GLY 66.A N GLY 31.A O no hydrogen 2.768 N/A LEU 67.A N ALA 200.A O no hydrogen 2.853 N/A PHE 69.A N HIS 198.A O no hydrogen 2.860 N/A SER 71.A N LEU 197.A O no hydrogen 3.202 N/A THR 72.A OG1 ASP 70.A OD1 no hydrogen 2.649 N/A THR 74.A N GLN 77.A OE1 no hydrogen 2.928 N/A THR 74.A OG1 SER 76.A OG no hydrogen 3.213 N/A SER 76.A OG THR 74.A OG1 no hydrogen 3.213 N/A GLN 77.A N THR 74.A OG1 no hydrogen 3.353 N/A ILE 78.A N THR 74.A O no hydrogen 3.027 N/A GLY 79.A N PRO 75.A O no hydrogen 2.991 N/A ARG 80.A NH1 ASP 185.A OD1 no hydrogen 3.048 N/A ARG 80.A NH1 ASP 185.A OD2 no hydrogen 3.427 N/A ARG 80.A NH2 ASP 185.A OD2 no hydrogen 2.902 N/A MET 81.A N SER 181.A OG no hydrogen 2.858 N/A LYS 82.A N TYR 225.A O no hydrogen 3.041 N/A LYS 82.A NZ GLY 227.A O no hydrogen 2.873 N/A ALA 83.A N ILE 178.A O no hydrogen 2.931 N/A ASP 84.A N LYS 223.A O no hydrogen 2.803 N/A PHE 85.A N GLY 176.A O no hydrogen 2.952 N/A LYS 86.A N TYR 221.A O no hydrogen 2.921 N/A LYS 86.A NZ CYS 7.A O no hydrogen 2.749 N/A LEU 87.A N ASP 174.A O no hydrogen 2.816 N/A VAL 88.A N ASP 218.A O no hydrogen 2.871 N/A LYS 89.A NZ ASN 118.A OD1 no hydrogen 2.890 N/A LYS 89.A NZ TRP 119.A O no hydrogen 2.869 N/A SER 93.A N SER 214.A O no hydrogen 2.749 N/A ASN 94.A ND2 GLY 212.A O no hydrogen 3.335 N/A GLY 96.A N GLY 207.A O no hydrogen 2.806 N/A TYR 97.A N GLY 207.A O no hydrogen 3.131 N/A SER 98.A OG GLU 205.A O no hydrogen 2.685 N/A TYR 99.A N GLU 205.A O no hydrogen 3.074 N/A VAL 100.A N ASN 118.A O no hydrogen 2.876 N/A GLY 101.A N LEU 203.A O no hydrogen 3.162 N/A VAL 102.A N ILE 115.A O no hydrogen 2.881 N/A TYR 103.A N LYS 201.A O no hydrogen 2.800 N/A GLY 104.A N TYR 113.A O no hydrogen 3.071 N/A TRP 105.A NE1 TYR 103.A OH no hydrogen 2.968 N/A THR 106.A N VAL 111.A O no hydrogen 2.825 N/A THR 106.A OG1 PRO 109.A O no hydrogen 2.773 N/A ARG 107.A N LYS 196.A O no hydrogen 2.839 N/A ARG 107.A NE ASP 157.A OD1 no hydrogen 2.904 N/A ARG 107.A NH1 SER 71.A OG no hydrogen 3.024 N/A ARG 107.A NH2 ASP 157.A OD1 no hydrogen 2.977 N/A VAL 111.A N THR 106.A O no hydrogen 3.054 N/A ALA 112.A N ASN 163.A O no hydrogen 3.106 N/A TYR 113.A N GLY 104.A O no hydrogen 2.859 N/A TYR 113.A OH GLU 199.A O no hydrogen 2.792 N/A TYR 114.A N TYR 165.A O no hydrogen 2.873 N/A TYR 114.A OH GLU 205.A OE1 no hydrogen 2.579 N/A ILE 115.A N VAL 102.A O no hydrogen 2.803 N/A VAL 116.A N SER 167.A O no hydrogen 2.775 N/A ASP 117.A N VAL 100.A O no hydrogen 2.878 N/A ASN 118.A N VAL 100.A O no hydrogen 3.131 N/A ASN 118.A ND2 ARG 173.A O no hydrogen 3.154 N/A TRP 119.A N ASN 118.A OD1 no hydrogen 2.821 N/A LEU 120.A N SER 98.A OG no hydrogen 2.764 N/A SER 121.A OG PHE 123.A O no hydrogen 2.721 N/A VAL 129.A N GLY 126.A O no hydrogen 3.088 N/A GLY 130.A N ASP 127.A O no hydrogen 3.437 N/A ASN 131.A N ASN 149.A OD1 no hydrogen 3.228 N/A LYS 132.A N GLU 148.A O no hydrogen 2.969 N/A LYS 133.A NZ ASP 127.A OD1 no hydrogen 3.100 N/A LYS 133.A NZ ASP 127.A OD2 no hydrogen 2.999 N/A HIS 134.A N VAL 146.A O no hydrogen 2.822 N/A PHE 137.A N TYR 144.A O no hydrogen 2.929 N/A THR 138.A OG1 GLN 143.A OE1 no hydrogen 2.677 N/A ILE 139.A N ALA 142.A O no hydrogen 2.861 N/A ALA 142.A N ILE 139.A O no hydrogen 3.117 N/A TYR 144.A N PHE 137.A O no hydrogen 2.957 N/A TYR 144.A OH ASP 117.A OD1 no hydrogen 2.487 N/A TYR 144.A OH ASP 117.A OD2 no hydrogen 3.395 N/A THR 145.A N ILE 168.A O no hydrogen 2.837 N/A VAL 146.A N GLY 135.A O no hydrogen 2.954 N/A TYR 147.A N PHE 166.A O no hydrogen 2.908 N/A TYR 147.A OH ASP 127.A OD1 no hydrogen 2.546 N/A GLU 148.A N LYS 132.A O no hydrogen 2.883 N/A ASN 149.A N GLN 164.A O no hydrogen 2.879 N/A ASN 149.A ND2 GLN 164.A OE1 no hydrogen 2.959 N/A THR 150.A OG1 ASN 163.A OD1 no hydrogen 3.092 N/A ARG 151.A N PHE 162.A O no hydrogen 2.904 N/A THR 152.A OG1 THR 161.A OG1 no hydrogen 2.740 N/A GLY 153.A N THR 160.A O no hydrogen 2.968 N/A SER 155.A OG GLY 158.A O no hydrogen 2.605 N/A ASP 157.A N SER 155.A OG no hydrogen 2.921 N/A GLY 158.A N SER 155.A O no hydrogen 3.063 N/A THR 160.A N GLY 153.A O no hydrogen 3.044 N/A THR 161.A OG1 THR 152.A OG1 no hydrogen 2.740 N/A PHE 162.A N ARG 151.A O no hydrogen 2.940 N/A GLN 164.A N ASN 149.A O no hydrogen 2.832 N/A TYR 165.A N ALA 112.A O no hydrogen 2.910 N/A TYR 165.A OH THR 193.A O no hydrogen 2.614 N/A PHE 166.A N TYR 147.A O no hydrogen 2.931 N/A SER 167.A N TYR 114.A O no hydrogen 2.943 N/A SER 167.A OG HIS 183.A ND1 no hydrogen 2.887 N/A ILE 168.A N THR 145.A O no hydrogen 2.789 N/A ARG 169.A N VAL 116.A O no hydrogen 2.793 N/A ARG 169.A NE GLN 171.A O no hydrogen 3.287 N/A ARG 169.A NH1 TYR 144.A OH no hydrogen 2.943 N/A GLN 170.A N GLN 143.A O no hydrogen 3.035 N/A GLN 170.A NE2 SER 136.A OG no hydrogen 2.915 N/A GLN 170.A NE2 THR 145.A OG1 no hydrogen 2.838 N/A ARG 173.A N ASP 117.A O no hydrogen 2.883 N/A ARG 173.A NE ASP 117.A OD2 no hydrogen 2.849 N/A ARG 173.A NH1 THR 177.A O no hydrogen 3.420 N/A ARG 173.A NH2 ASP 117.A OD2 no hydrogen 2.787 N/A ARG 173.A NH2 THR 177.A O no hydrogen 2.981 N/A CYS 175.A SG PHE 85.A O no hydrogen 3.416 N/A GLY 176.A N PHE 85.A O no hydrogen 3.052 N/A THR 177.A OG1 ASP 84.A OD1 no hydrogen 2.697 N/A ILE 178.A N ALA 83.A O no hydrogen 2.747 N/A ASP 179.A N ASP 140.A OD2 no hydrogen 2.964 N/A SER 181.A N MET 81.A O no hydrogen 3.360 N/A ALA 182.A N ASP 179.A OD1 no hydrogen 3.019 N/A HIS 183.A N ILE 180.A O no hydrogen 2.985 N/A HIS 183.A ND1 SER 167.A OG no hydrogen 2.887 N/A PHE 184.A N ILE 180.A O no hydrogen 3.158 N/A ASP 185.A N SER 181.A O no hydrogen 2.816 N/A GLN 186.A N ALA 182.A O no hydrogen 3.127 N/A GLN 186.A NE2 GLN 186.A O no hydrogen 3.086 N/A TRP 187.A N HIS 183.A O no hydrogen 2.843 N/A TRP 187.A NE1 SER 167.A OG no hydrogen 2.927 N/A GLU 188.A N PHE 184.A O no hydrogen 2.986 N/A LYS 189.A N ASP 185.A O no hydrogen 3.356 N/A LEU 190.A N TRP 187.A O no hydrogen 2.906 N/A GLY 191.A N GLU 188.A O no hydrogen 3.144 N/A MET 192.A N TRP 187.A O no hydrogen 2.960 N/A MET 194.A N GLU 188.A OE2 no hydrogen 2.992 N/A GLY 195.A N THR 106.A OG1 no hydrogen 3.379 N/A LYS 196.A N ARG 107.A O no hydrogen 2.849 N/A LEU 197.A N LYS 73.A O no hydrogen 2.792 N/A HIS 198.A N TRP 105.A O no hydrogen 2.859 N/A ALA 200.A N LEU 67.A O no hydrogen 3.105 N/A LYS 201.A N TYR 103.A O no hydrogen 2.901 N/A LYS 201.A NZ LEU 67.A O no hydrogen 3.104 N/A LYS 201.A NZ SER 68.A OG no hydrogen 2.784 N/A LYS 201.A NZ GLU 199.A OE2 no hydrogen 2.854 N/A VAL 202.A N SER 65.A O no hydrogen 2.834 N/A LEU 203.A N GLY 101.A O no hydrogen 2.832 N/A GLY 204.A N CYS 63.A O no hydrogen 2.936 N/A GLU 205.A N TYR 99.A O no hydrogen 2.861 N/A ALA 206.A N TYR 61.A O no hydrogen 2.921 N/A GLY 207.A N TYR 97.A O no hydrogen 2.951 N/A ASN 208.A N GLY 59.A O no hydrogen 2.681 N/A ASN 208.A ND2 ASN 94.A O no hydrogen 3.151 N/A ASN 210.A N ASN 208.A OD1 no hydrogen 2.779 N/A GLY 211.A N ASN 208.A OD1 no hydrogen 3.177 N/A GLY 211.A N ASN 210.A OD1 no hydrogen 2.371 N/A ALA 213.A N ALA 58.A O no hydrogen 2.665 N/A SER 214.A N SER 93.A O no hydrogen 3.083 N/A SER 214.A OG ASN 57.A OD1 no hydrogen 3.466 N/A GLY 215.A N PHE 55.A O no hydrogen 2.863 N/A THR 216.A N ASN 91.A O no hydrogen 3.158 N/A THR 216.A OG1 GLN 90.A OE1 no hydrogen 2.734 N/A ALA 217.A N CYS 53.A O no hydrogen 3.029 N/A ASP 218.A N VAL 88.A O no hydrogen 3.098 N/A PHE 219.A N PHE 51.A O no hydrogen 2.822 N/A LYS 223.A N ASP 84.A O no hydrogen 2.877 N/A LYS 223.A NZ ASP 48.A O no hydrogen 3.068 N/A TYR 225.A N LYS 82.A O no hydrogen 2.962 N/A TYR 225.A OH ASP 84.A OD1 no hydrogen 2.751 N/A GLY 227.A N ARG 80.A O no hydrogen 2.827 N/A