Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4wxs_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LEU 5.A N TYR 194.A OH no hydrogen 2.882 N/A VAL 6.A N LYS 257.A O no hydrogen 2.878 N/A GLY 9.A N ASP 255.A O no hydrogen 2.735 N/A LEU 12.A N THR 253.A O no hydrogen 2.904 N/A THR 13.A OG1 TYR 228.A OH no hydrogen 2.606 N/A LEU 14.A N MET 251.A O no hydrogen 2.852 N/A ARG 15.A NE PHE 64.A O no hydrogen 3.277 N/A THR 16.A OG1 ASN 250.A OD1 no hydrogen 2.744 N/A ALA 17.A N LEU 249.A O no hydrogen 2.785 N/A GLU 18.A N GLU 18.A OE1 no hydrogen 2.407 N/A THR 21.A N THR 19.A OG1 no hydrogen 3.311 N/A THR 21.A OG1 THR 19.A OG1 no hydrogen 3.273 N/A GLY 22.A N THR 19.A O no hydrogen 3.019 N/A LYS 23.A N ILE 20.A O no hydrogen 3.235 N/A LYS 23.A NZ ASN 248.A OD1 no hydrogen 2.921 N/A VAL 26.A N ILE 45.A O no hydrogen 3.047 N/A TRP 27.A NE1 ALA 245.A O no hydrogen 2.876 N/A MET 28.A N TRP 43.A O no hydrogen 2.811 N/A ARG 29.A NE THR 42.A OG1 no hydrogen 2.873 N/A ARG 29.A NH1 GLU 240.A OE2 no hydrogen 2.837 N/A LYS 32.A N ASP 30.A OD1 no hydrogen 2.895 N/A TYR 37.A N THR 34.A O no hydrogen 2.766 N/A THR 38.A N THR 41.A OG1 no hydrogen 2.959 N/A GLU 40.A N THR 38.A OG1 no hydrogen 3.050 N/A THR 41.A N THR 38.A O no hydrogen 3.144 N/A THR 41.A OG1 THR 38.A O no hydrogen 3.332 N/A THR 42.A N TYR 58.A O no hydrogen 2.803 N/A THR 42.A OG1 GLU 40.A O no hydrogen 2.964 N/A TRP 43.A N MET 28.A O no hydrogen 2.843 N/A TRP 43.A NE1 GLU 57.A OE1 no hydrogen 2.722 N/A ARG 44.A N PHE 56.A O no hydrogen 2.790 N/A ARG 44.A NE ASP 46.A OD1 no hydrogen 2.798 N/A ARG 44.A NH1 GLU 18.A OE1 no hydrogen 3.205 N/A ARG 44.A NH1 GLU 18.A OE2 no hydrogen 3.450 N/A ARG 44.A NH2 GLU 18.A OE1 no hydrogen 2.894 N/A ARG 44.A NH2 ASP 46.A OD1 no hydrogen 3.332 N/A ARG 44.A NH2 ASP 46.A OD2 no hydrogen 2.880 N/A ILE 45.A N VAL 26.A O no hydrogen 2.875 N/A THR 47.A N TYR 24.A O no hydrogen 3.195 N/A VAL 55.A N HIS 73.A O no hydrogen 2.875 N/A PHE 56.A N ARG 44.A O no hydrogen 2.817 N/A GLU 57.A N LYS 71.A O no hydrogen 2.839 N/A TYR 58.A N THR 42.A O no hydrogen 2.813 N/A ASP 59.A N GLN 63.A OE1 no hydrogen 3.052 N/A ASP 59.A N SER 70.A OG no hydrogen 3.257 N/A LEU 60.A N GLN 63.A OE1 no hydrogen 3.271 N/A ILE 61.A N GLU 40.A OE1 no hydrogen 2.858 N/A GLN 63.A NE2 TYR 68.A O no hydrogen 2.398 N/A GLN 63.A NE2 SER 70.A OG no hydrogen 2.979 N/A PHE 64.A N LEU 60.A O no hydrogen 2.909 N/A MET 65.A N ILE 61.A O no hydrogen 3.014 N/A GLN 66.A N SER 62.A O no hydrogen 3.031 N/A GLY 67.A N GLN 63.A O no hydrogen 2.740 N/A SER 70.A N GLU 57.A O no hydrogen 2.616 N/A SER 70.A OG ASP 59.A OD2 no hydrogen 2.656 N/A SER 70.A OG GLN 63.A OE1 no hydrogen 3.229 N/A LYS 71.A N GLU 57.A O no hydrogen 3.259 N/A HIS 73.A N VAL 55.A O no hydrogen 2.925 N/A HIS 73.A ND1 GLU 109.A OE2 no hydrogen 2.612 N/A HIS 73.A NE2 GLU 57.A OE1 no hydrogen 2.820 N/A LEU 75.A N ARG 53.A O no hydrogen 2.782 N/A LEU 79.A N VAL 52.A O no hydrogen 3.019 N/A GLU 80.A N GLN 94.A O no hydrogen 2.828 N/A SER 81.A OG GLY 132.A O no hydrogen 2.963 N/A SER 81.A OG TYR 133.A O no hydrogen 3.402 N/A THR 82.A OG1 SER 232.A O no hydrogen 2.712 N/A VAL 85.A N TYR 92.A O no hydrogen 2.966 N/A TYR 87.A N SER 90.A O no hydrogen 2.828 N/A SER 88.A N ASP 30.A OD1 no hydrogen 2.880 N/A GLY 89.A N ASP 30.A OD2 no hydrogen 2.771 N/A SER 90.A N TYR 87.A O no hydrogen 3.146 N/A LEU 91.A N TYR 104.A O no hydrogen 2.807 N/A TYR 92.A N VAL 85.A O no hydrogen 2.724 N/A TYR 92.A OH PRO 165.A O no hydrogen 2.497 N/A PHE 93.A N ILE 102.A O no hydrogen 3.108 N/A GLN 94.A NE2 SER 98.A O no hydrogen 2.682 N/A GLY 95.A N THR 100.A O no hydrogen 2.799 N/A ALA 96.A N PRO 78.A O no hydrogen 2.923 N/A GLU 97.A N GLU 80.A OE1 no hydrogen 2.717 N/A SER 98.A OG GLY 95.A O no hydrogen 2.573 N/A ARG 99.A NE ALA 120.A O no hydrogen 2.612 N/A ARG 99.A NH2 ALA 120.A O no hydrogen 2.962 N/A THR 100.A N SER 98.A OG no hydrogen 3.293 N/A THR 100.A OG1 GLU 116.A OE2 no hydrogen 2.839 N/A VAL 101.A N LYS 115.A O no hydrogen 2.876 N/A ILE 102.A N PHE 93.A O no hydrogen 2.716 N/A ARG 103.A N ALA 113.A O no hydrogen 2.839 N/A ARG 103.A NE SER 90.A OG no hydrogen 2.939 N/A ARG 103.A NH1 GLU 166.A O no hydrogen 2.976 N/A TYR 104.A N LEU 91.A O no hydrogen 2.839 N/A GLU 105.A N THR 110.A O no hydrogen 2.709 N/A LEU 106.A N GLY 89.A O no hydrogen 3.007 N/A THR 108.A OG1 GLU 105.A OE1 no hydrogen 2.404 N/A THR 110.A N GLU 105.A O no hydrogen 3.150 N/A THR 110.A OG1 THR 108.A O no hydrogen 3.349 N/A LYS 112.A N ARG 103.A O no hydrogen 2.790 N/A LYS 115.A N VAL 101.A O no hydrogen 2.937 N/A ILE 117.A N ARG 99.A O no hydrogen 3.016 N/A ALA 120.A N ILE 117.A O no hydrogen 2.982 N/A GLY 121.A N SER 150.A O no hydrogen 2.859 N/A TYR 122.A N GLN 125.A OE1 no hydrogen 2.995 N/A HIS 123.A ND1 GLU 80.A OE2 no hydrogen 2.700 N/A GLY 124.A N ASP 135.A OD1 no hydrogen 2.801 N/A PHE 126.A N ASP 135.A OD2 no hydrogen 2.704 N/A TYR 128.A N THR 134.A OG1 no hydrogen 2.840 N/A TYR 128.A OH ASP 137.A OD2 no hydrogen 2.732 N/A SER 129.A N VAL 183.A O no hydrogen 2.799 N/A TRP 130.A NE1 ALA 184.A O no hydrogen 2.677 N/A GLY 131.A N TYR 128.A O no hydrogen 2.928 N/A THR 134.A OG1 GLY 131.A O no hydrogen 2.620 N/A ASP 137.A N ILE 148.A O no hydrogen 2.813 N/A LEU 138.A N GLY 83.A O no hydrogen 2.959 N/A ALA 139.A N TRP 146.A O no hydrogen 3.006 N/A ASP 141.A N GLY 144.A O no hydrogen 3.045 N/A GLU 142.A N GLU 142.A OE1 no hydrogen 2.575 N/A ALA 143.A N ASP 141.A OD1 no hydrogen 3.058 N/A GLY 144.A N ASP 141.A O no hydrogen 3.070 N/A GLY 144.A N ASP 141.A OD1 no hydrogen 3.320 N/A TRP 146.A N ALA 139.A O no hydrogen 2.719 N/A TRP 146.A NE1 ASP 141.A OD1 no hydrogen 2.533 N/A VAL 147.A N SER 161.A O no hydrogen 2.962 N/A ILE 148.A N ASP 137.A O no hydrogen 2.692 N/A TYR 149.A N VAL 159.A O no hydrogen 2.908 N/A TYR 149.A OH SER 161.A OG no hydrogen 2.698 N/A SER 150.A OG ALA 157.A O no hydrogen 2.575 N/A ALA 154.A N THR 151.A OG1 no hydrogen 2.908 N/A LYS 155.A N ASP 152.A O no hydrogen 3.173 N/A GLY 156.A N THR 151.A O no hydrogen 3.301 N/A ALA 157.A N ALA 154.A O no hydrogen 3.230 N/A ILE 158.A N ILE 178.A O no hydrogen 2.763 N/A VAL 159.A N TYR 149.A O no hydrogen 2.680 N/A LEU 160.A N TRP 174.A O no hydrogen 2.986 N/A SER 161.A N VAL 147.A O no hydrogen 3.072 N/A SER 161.A OG TYR 149.A OH no hydrogen 2.698 N/A SER 161.A OG THR 173.A OG1 no hydrogen 2.826 N/A LYS 162.A N GLN 172.A O no hydrogen 2.822 N/A LYS 162.A NZ ALA 143.A O no hydrogen 3.468 N/A LEU 163.A N LEU 145.A O no hydrogen 2.861 N/A ASN 164.A N GLU 169.A O no hydrogen 2.829 N/A GLU 166.A N ASN 164.A OD1 no hydrogen 2.848 N/A ASN 167.A N ASN 164.A OD1 no hydrogen 3.190 N/A LEU 168.A N ASN 164.A O no hydrogen 2.666 N/A GLU 169.A N ASN 167.A OD1 no hydrogen 3.107 N/A GLU 171.A N LYS 162.A O no hydrogen 2.776 N/A THR 173.A OG1 SER 161.A OG no hydrogen 2.826 N/A TRP 174.A N LEU 160.A O no hydrogen 2.776 N/A TRP 174.A NE1 THR 212.A O no hydrogen 2.983 N/A THR 176.A N ILE 158.A O no hydrogen 2.987 N/A THR 176.A OG1 ILE 158.A O no hydrogen 2.643 N/A ARG 179.A NH1 SER 182.A OG no hydrogen 2.968 N/A LYS 180.A N GLY 156.A O no hydrogen 2.958 N/A LYS 180.A NZ PHE 126.A O no hydrogen 2.903 N/A LYS 180.A NZ THR 134.A O no hydrogen 2.654 N/A SER 182.A N ARG 179.A O no hydrogen 3.018 N/A VAL 183.A N LYS 180.A O no hydrogen 3.225 N/A ALA 184.A N VAL 196.A O no hydrogen 2.581 N/A ASN 185.A N VAL 196.A O no hydrogen 3.226 N/A ASN 185.A ND2 ALA 184.A O no hydrogen 3.615 N/A ALA 186.A N ASN 185.A OD1 no hydrogen 2.800 N/A PHE 187.A N TYR 194.A O no hydrogen 2.966 N/A ILE 189.A N THR 192.A O no hydrogen 2.873 N/A CYS 190.A N GLU 142.A OE1 no hydrogen 3.007 N/A CYS 190.A SG GLY 3.A O no hydrogen 4.017 N/A GLY 191.A N ASP 141.A OD2 no hydrogen 2.904 N/A THR 192.A N ILE 189.A O no hydrogen 2.965 N/A LEU 193.A N TYR 210.A O no hydrogen 2.856 N/A TYR 194.A N PHE 187.A O no hydrogen 2.766 N/A THR 195.A N PHE 208.A O no hydrogen 3.021 N/A THR 195.A OG1 ASN 207.A OD1 no hydrogen 2.796 N/A VAL 196.A N ASN 185.A O no hydrogen 2.914 N/A SER 197.A N THR 205.A O no hydrogen 2.969 N/A TYR 199.A N ASP 203.A O no hydrogen 2.939 N/A THR 200.A N ASP 203.A O no hydrogen 3.293 N/A THR 200.A OG1 ASP 203.A OD2 no hydrogen 3.123 N/A ALA 202.A N THR 200.A OG1 no hydrogen 3.265 N/A ASP 203.A N THR 200.A OG1 no hydrogen 3.121 N/A ALA 204.A N PHE 224.A O no hydrogen 2.995 N/A THR 205.A N SER 197.A O no hydrogen 2.945 N/A VAL 206.A N ILE 222.A O no hydrogen 2.745 N/A ASN 207.A N THR 195.A O no hydrogen 3.034 N/A ALA 209.A N LYS 218.A O no hydrogen 2.831 N/A TYR 210.A N LEU 193.A O no hydrogen 2.862 N/A ASP 211.A N ILE 216.A O no hydrogen 3.040 N/A THR 212.A N GLY 191.A O no hydrogen 3.039 N/A THR 212.A OG1 GLY 191.A O no hydrogen 2.509 N/A GLY 213.A N ASP 211.A OD1 no hydrogen 2.993 N/A THR 214.A N ASP 211.A O no hydrogen 3.290 N/A GLY 215.A N ASP 211.A O no hydrogen 2.576 N/A ILE 216.A N THR 214.A OG1 no hydrogen 3.192 N/A SER 217.A OG ASN 177.A OD1 no hydrogen 3.251 N/A LYS 218.A N ALA 209.A O no hydrogen 2.884 N/A LEU 220.A N ASN 207.A O no hydrogen 3.013 N/A ILE 222.A N VAL 206.A O no hydrogen 3.043 N/A PHE 224.A N ALA 204.A O no hydrogen 3.029 N/A ASN 226.A N ALA 202.A O no hydrogen 2.712 N/A ASN 226.A ND2 SER 201.A O no hydrogen 3.395 N/A ARG 227.A NH1 PRO 11.A O no hydrogen 2.726 N/A TYR 228.A N ASP 247.A OD2 no hydrogen 2.878 N/A TYR 228.A OH THR 13.A OG1 no hydrogen 2.606 N/A LYS 229.A N ASN 226.A O no hydrogen 2.986 N/A TYR 230.A N ASP 247.A OD1 no hydrogen 2.810 N/A SER 231.A OG TRP 246.A O no hydrogen 3.554 N/A SER 232.A N TRP 246.A O no hydrogen 2.941 N/A ASP 235.A N PHE 244.A O no hydrogen 2.778 N/A TYR 236.A OH GLU 142.A OE2 no hydrogen 2.604 N/A ASN 237.A N LYS 242.A O no hydrogen 2.935 N/A LEU 239.A N ASN 237.A OD1 no hydrogen 2.854 N/A GLU 240.A N ASN 237.A OD1 no hydrogen 2.987 N/A LYS 241.A N ASN 237.A O no hydrogen 2.752 N/A LYS 241.A NZ GLU 142.A OE2 no hydrogen 3.247 N/A LYS 241.A NZ PRO 238.A O no hydrogen 2.974 N/A LYS 242.A N ASN 237.A O no hydrogen 3.402 N/A LYS 242.A NZ ASP 255.A OD1 no hydrogen 2.343 N/A LEU 243.A N TYR 254.A O no hydrogen 3.058 N/A PHE 244.A N ASP 235.A O no hydrogen 2.753 N/A ALA 245.A N VAL 252.A O no hydrogen 2.922 N/A TRP 246.A N MET 233.A O no hydrogen 2.974 N/A TRP 246.A NE1 GLY 22.A O no hydrogen 2.825 N/A ASP 247.A N ASN 250.A O no hydrogen 2.743 N/A ASN 248.A N TYR 230.A O no hydrogen 2.875 N/A ASN 248.A ND2 TYR 228.A O no hydrogen 2.794 N/A LEU 249.A N LYS 23.A O no hydrogen 2.899 N/A ASN 250.A N ASP 247.A O no hydrogen 3.111 N/A ASN 250.A ND2 ASP 247.A O no hydrogen 3.447 N/A ASN 250.A ND2 ASN 248.A O no hydrogen 2.913 N/A MET 251.A N ARG 15.A O no hydrogen 2.857 N/A VAL 252.A N ALA 245.A O no hydrogen 2.960 N/A THR 253.A N LEU 12.A O no hydrogen 2.934 N/A THR 253.A OG1 LEU 243.A O no hydrogen 3.241 N/A TYR 254.A N LEU 243.A O no hydrogen 2.774 N/A TYR 254.A OH LYS 225.A O no hydrogen 2.728 N/A LYS 257.A N TRP 7.A O no hydrogen 2.895 N/A SER 259.A N GLU 4.A O no hydrogen 2.831 N/A