Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 8q1s_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ASP 5.A N ASP 1.A O no hydrogen 2.602 N/A VAL 7.A N ARG 3.A O no hydrogen 3.026 N/A TYR 8.A N GLU 4.A O no hydrogen 3.275 N/A GLN 9.A N ASP 5.A O no hydrogen 3.271 N/A ALA 10.A N LEU 6.A O no hydrogen 2.968 N/A LYS 11.A N VAL 7.A O no hydrogen 3.011 N/A LEU 12.A N TYR 8.A O no hydrogen 2.875 N/A ALA 13.A N GLN 9.A O no hydrogen 3.000 N/A GLU 14.A N ALA 10.A O no hydrogen 2.783 N/A GLN 15.A N LYS 11.A O no hydrogen 3.246 N/A ALA 16.A N LEU 12.A O no hydrogen 2.952 N/A GLU 17.A N GLU 14.A O no hydrogen 3.052 N/A ARG 18.A N ALA 13.A O no hydrogen 2.830 N/A ARG 18.A NE GLU 21.A OE2 no hydrogen 3.035 N/A ARG 18.A NH2 GLU 21.A OE2 no hydrogen 3.277 N/A GLU 21.A N ARG 18.A O no hydrogen 3.275 N/A VAL 23.A N TYR 19.A O no hydrogen 3.131 N/A SER 25.A N GLU 21.A O no hydrogen 3.267 N/A SER 25.A OG GLU 21.A O no hydrogen 3.104 N/A MET 26.A N MET 22.A O no hydrogen 3.050 N/A LYS 27.A N VAL 23.A O no hydrogen 2.561 N/A LYS 27.A N GLU 24.A O no hydrogen 3.017 N/A LYS 27.A NZ ASP 98.A OD1 no hydrogen 2.814 N/A LYS 28.A N GLU 24.A O no hydrogen 3.175 N/A ALA 30.A N MET 26.A O no hydrogen 3.266 N/A GLY 31.A N LYS 27.A O no hydrogen 2.945 N/A MET 32.A N LYS 28.A O no hydrogen 3.240 N/A THR 37.A N GLU 40.A OE1 no hydrogen 2.765 N/A ARG 41.A N THR 37.A O no hydrogen 2.810 N/A ASN 42.A N VAL 38.A O no hydrogen 3.016 N/A LEU 43.A N GLU 39.A O no hydrogen 2.924 N/A LEU 44.A N GLU 40.A O no hydrogen 2.981 N/A SER 45.A N ARG 41.A O no hydrogen 3.109 N/A VAL 46.A N ASN 42.A O no hydrogen 2.802 N/A ALA 47.A N LEU 43.A O no hydrogen 2.994 N/A TYR 48.A N LEU 44.A O no hydrogen 2.890 N/A LYS 49.A N SER 45.A O no hydrogen 2.745 N/A ASN 50.A N VAL 46.A O no hydrogen 3.089 N/A VAL 51.A N ALA 47.A O no hydrogen 3.281 N/A ILE 52.A N TYR 48.A O no hydrogen 3.283 N/A GLY 53.A N LYS 49.A O no hydrogen 2.680 N/A ALA 54.A N ASN 50.A O no hydrogen 3.092 N/A ARG 55.A NE GLU 91.A OE2 no hydrogen 2.827 N/A ARG 55.A NH1 VAL 51.A O no hydrogen 3.198 N/A ARG 55.A NH2 GLU 91.A OE2 no hydrogen 3.315 N/A ARG 56.A N ILE 52.A O no hydrogen 2.906 N/A ARG 56.A NE GLU 133.A OE1 no hydrogen 3.396 N/A ARG 56.A NH2 GLU 133.A OE2 no hydrogen 3.048 N/A ALA 57.A N GLY 53.A O no hydrogen 3.049 N/A SER 58.A N ALA 54.A O no hydrogen 3.166 N/A SER 58.A OG ALA 54.A O no hydrogen 2.942 N/A TRP 59.A N ARG 55.A O no hydrogen 2.675 N/A TRP 59.A NE1 GLU 89.A OE2 no hydrogen 3.355 N/A ARG 60.A N ARG 56.A O no hydrogen 3.020 N/A ILE 61.A N ALA 57.A O no hydrogen 3.089 N/A ILE 62.A N SER 58.A O no hydrogen 3.083 N/A SER 63.A N TRP 59.A O no hydrogen 2.889 N/A SER 64.A N ARG 60.A O no hydrogen 3.146 N/A SER 64.A N ILE 61.A O no hydrogen 3.192 N/A SER 64.A OG ILE 61.A O no hydrogen 2.712 N/A ILE 65.A N ILE 61.A O no hydrogen 2.901 N/A GLU 66.A N ILE 62.A O no hydrogen 2.739 N/A GLN 67.A N SER 63.A O no hydrogen 3.238 N/A LYS 68.A N SER 64.A O no hydrogen 3.182 N/A GLU 69.A N ILE 65.A O no hydrogen 2.926 N/A GLU 70.A N GLU 66.A O no hydrogen 2.771 N/A ASN 71.A N LYS 68.A O no hydrogen 3.261 N/A LYS 72.A N LYS 68.A O no hydrogen 3.478 N/A GLY 73.A N GLU 69.A O no hydrogen 3.143 N/A LEU 78.A N GLY 74.A O no hydrogen 2.906 N/A LYS 79.A N GLU 75.A O no hydrogen 3.347 N/A ILE 81.A N LYS 77.A O no hydrogen 2.927 N/A ARG 82.A N LEU 78.A O no hydrogen 2.972 N/A GLU 83.A N LYS 79.A O no hydrogen 3.092 N/A TYR 84.A N MET 80.A O no hydrogen 3.154 N/A ARG 85.A N ILE 81.A O no hydrogen 2.794 N/A ARG 85.A NH1 GLU 89.A OE2 no hydrogen 2.866 N/A GLN 86.A N ARG 82.A O no hydrogen 2.943 N/A MET 87.A N GLU 83.A O no hydrogen 3.129 N/A VAL 88.A N TYR 84.A O no hydrogen 3.268 N/A GLU 89.A N ARG 85.A O no hydrogen 2.861 N/A THR 90.A N GLN 86.A O no hydrogen 2.951 N/A THR 90.A OG1 GLN 86.A O no hydrogen 3.423 N/A THR 90.A OG1 MET 87.A O no hydrogen 2.597 N/A LEU 92.A N VAL 88.A O no hydrogen 2.905 N/A LYS 93.A N GLU 89.A O no hydrogen 2.917 N/A LEU 94.A N THR 90.A O no hydrogen 3.022 N/A ILE 95.A N GLU 91.A O no hydrogen 3.044 N/A CYS 96.A N LEU 92.A O no hydrogen 3.157 N/A CYS 96.A SG LEU 92.A O no hydrogen 2.832 N/A CYS 96.A SG TYR 127.A O no hydrogen 3.620 N/A CYS 97.A N LYS 93.A O no hydrogen 2.852 N/A CYS 97.A SG LYS 93.A O no hydrogen 3.229 N/A ASP 98.A N LEU 94.A O no hydrogen 2.979 N/A ILE 99.A N ILE 95.A O no hydrogen 3.401 N/A LEU 100.A N CYS 96.A O no hydrogen 3.056 N/A ASP 101.A N CYS 97.A O no hydrogen 3.269 N/A VAL 102.A N ASP 98.A O no hydrogen 3.040 N/A LEU 103.A N ILE 99.A O no hydrogen 2.880 N/A ASP 104.A N LEU 100.A O no hydrogen 2.996 N/A LYS 105.A N ASP 101.A O no hydrogen 2.838 N/A HIS 106.A N VAL 102.A O no hydrogen 3.408 N/A LEU 107.A N VAL 102.A O no hydrogen 3.257 N/A ILE 108.A N LEU 103.A O no hydrogen 2.699 N/A ALA 110.A N HIS 106.A O no hydrogen 3.264 N/A ALA 111.A N LEU 107.A O no hydrogen 2.661 N/A ASN 112.A N GLU 35.A OE2 no hydrogen 3.433 N/A THR 113.A OG1 GLU 35.A OE2 no hydrogen 3.124 N/A SER 116.A OG GLU 35.A OE2 no hydrogen 2.946 N/A SER 116.A OG THR 113.A OG1 no hydrogen 2.729 N/A LYS 117.A N THR 113.A O no hydrogen 3.207 N/A LYS 117.A NZ ILE 108.A O no hydrogen 2.951 N/A LYS 117.A NZ ALA 111.A O no hydrogen 3.457 N/A VAL 118.A N GLY 114.A O no hydrogen 3.377 N/A PHE 119.A N GLU 115.A O no hydrogen 3.265 N/A TYR 120.A N SER 116.A O no hydrogen 2.984 N/A TYR 121.A N LYS 117.A O no hydrogen 3.064 N/A LYS 122.A N VAL 118.A O no hydrogen 2.629 N/A LYS 122.A NZ ASP 126.A OD2 no hydrogen 3.216 N/A MET 123.A N PHE 119.A O no hydrogen 2.892 N/A LYS 124.A N TYR 120.A O no hydrogen 3.047 N/A LYS 124.A NZ ASP 104.A OD1 no hydrogen 2.785 N/A LYS 124.A NZ ASP 104.A OD2 no hydrogen 3.503 N/A GLY 125.A N TYR 121.A O no hydrogen 3.167 N/A ASP 126.A N LYS 122.A O no hydrogen 3.018 N/A TYR 127.A N MET 123.A O no hydrogen 3.177 N/A TYR 127.A N LYS 124.A O no hydrogen 3.211 N/A HIS 128.A N LYS 124.A O no hydrogen 3.001 N/A ARG 129.A N GLY 125.A O no hydrogen 2.793 N/A ARG 129.A NE TYR 151.A OH no hydrogen 2.902 N/A ARG 129.A NH2 ASP 126.A OD1 no hydrogen 3.561 N/A ARG 129.A NH2 TYR 151.A OH no hydrogen 3.471 N/A TYR 130.A N ASP 126.A O no hydrogen 2.985 N/A ALA 132.A N HIS 128.A O no hydrogen 3.066 N/A GLU 133.A N ARG 129.A O no hydrogen 2.967 N/A ALA 135.A N LEU 131.A O no hydrogen 3.009 N/A ASP 139.A N ASN 138.A OD1 no hydrogen 2.781 N/A ARG 140.A N THR 136.A O no hydrogen 3.329 N/A LYS 141.A N GLY 137.A O no hydrogen 3.309 N/A GLU 142.A N ASN 138.A O no hydrogen 2.954 N/A ALA 143.A N ASP 139.A O no hydrogen 3.020 N/A ALA 144.A N ARG 140.A O no hydrogen 2.829 N/A GLU 145.A N LYS 141.A O no hydrogen 3.042 N/A ASN 146.A N GLU 142.A O no hydrogen 3.041 N/A SER 147.A N ALA 143.A O no hydrogen 3.053 N/A SER 147.A OG GLY 125.A O no hydrogen 2.717 N/A LEU 148.A N ALA 144.A O no hydrogen 2.822 N/A VAL 149.A N GLU 145.A O no hydrogen 3.121 N/A ALA 150.A N ASN 146.A O no hydrogen 3.343 N/A TYR 151.A N SER 147.A O no hydrogen 2.836 N/A TYR 151.A OH ASP 126.A OD1 no hydrogen 2.611 N/A LYS 152.A N LEU 148.A O no hydrogen 2.646 N/A ALA 153.A N VAL 149.A O no hydrogen 3.000 N/A ALA 154.A N ALA 150.A O no hydrogen 2.978 N/A SER 155.A N TYR 151.A O no hydrogen 2.841 N/A ASP 156.A N LYS 152.A O no hydrogen 2.905 N/A ILE 157.A N ALA 153.A O no hydrogen 3.227 N/A ALA 158.A N ALA 154.A O no hydrogen 2.902 N/A MET 159.A N SER 155.A O no hydrogen 3.066 N/A THR 160.A N ILE 157.A O no hydrogen 3.372 N/A GLU 161.A N ILE 157.A O no hydrogen 3.043 N/A THR 165.A OG1 THR 207.A OG1 no hydrogen 3.418 N/A HIS 166.A N PRO 163.A O no hydrogen 3.194 N/A ILE 168.A N HIS 166.A ND1 no hydrogen 3.421 N/A ARG 169.A NH1 LEU 162.A O no hydrogen 3.200 N/A LEU 170.A N HIS 166.A O no hydrogen 3.202 N/A GLY 171.A N PRO 167.A O no hydrogen 2.971 N/A LEU 172.A N ILE 168.A O no hydrogen 3.100 N/A ALA 173.A N ARG 169.A O no hydrogen 2.959 N/A LEU 174.A N LEU 170.A O no hydrogen 2.908 N/A ASN 175.A N GLY 171.A O no hydrogen 2.968 N/A ASN 175.A ND2 ASP 126.A OD1 no hydrogen 3.053 N/A PHE 176.A N LEU 172.A O no hydrogen 2.648 N/A SER 177.A N ALA 173.A O no hydrogen 2.993 N/A SER 177.A OG ALA 173.A O no hydrogen 2.929 N/A SER 177.A OG LEU 174.A O no hydrogen 2.533 N/A VAL 178.A N LEU 174.A O no hydrogen 3.120 N/A PHE 179.A N ASN 175.A O no hydrogen 3.082 N/A TYR 180.A N PHE 176.A O no hydrogen 3.136 N/A TYR 181.A N SER 177.A O no hydrogen 3.137 N/A GLU 182.A N VAL 178.A O no hydrogen 2.829 N/A ILE 183.A N PHE 179.A O no hydrogen 2.871 N/A LEU 184.A N PHE 179.A O no hydrogen 3.282 N/A SER 186.A N TYR 180.A O no hydrogen 2.671 N/A ALA 190.A N SER 186.A O no hydrogen 3.151 N/A CYS 191.A N PRO 187.A O no hydrogen 3.148 N/A CYS 191.A SG PRO 187.A O no hydrogen 3.205 N/A ARG 192.A N ASP 188.A O no hydrogen 3.388 N/A LEU 193.A N ARG 189.A O no hydrogen 2.822 N/A ALA 194.A N ALA 190.A O no hydrogen 3.024 N/A LYS 195.A N CYS 191.A O no hydrogen 2.919 N/A LYS 195.A NZ ASP 199.A OD2 no hydrogen 2.971 N/A ALA 196.A N ARG 192.A O no hydrogen 3.152 N/A ALA 197.A N LEU 193.A O no hydrogen 3.033 N/A PHE 198.A N ALA 194.A O no hydrogen 3.241 N/A ASP 199.A N LYS 195.A O no hydrogen 2.849 N/A ASP 200.A N ALA 196.A O no hydrogen 3.128 N/A ALA 201.A N PHE 198.A O no hydrogen 3.017 N/A ILE 202.A N PHE 198.A O no hydrogen 3.210 N/A ALA 203.A N ASP 199.A O no hydrogen 3.171 N/A GLU 204.A N ALA 201.A O no hydrogen 2.943 N/A THR 207.A N GLU 204.A O no hydrogen 3.280 N/A THR 207.A OG1 THR 165.A OG1 no hydrogen 3.418 N/A THR 207.A OG1 GLU 204.A O no hydrogen 2.444 N/A SER 216.A OG SER 212.A O no hydrogen 2.977 N/A SER 216.A OG TYR 213.A O no hydrogen 2.767 N/A THR 217.A N TYR 213.A O no hydrogen 3.162 N/A THR 217.A OG1 TYR 213.A O no hydrogen 3.156 N/A THR 217.A OG1 LYS 214.A O no hydrogen 3.000 N/A LEU 218.A N LYS 214.A O no hydrogen 3.244 N/A MET 220.A N SER 216.A O no hydrogen 2.786 N/A GLN 221.A N THR 217.A O no hydrogen 2.868 N/A LEU 222.A N LEU 218.A O no hydrogen 2.971 N/A LEU 223.A N ILE 219.A O no hydrogen 2.985 N/A ARG 224.A N MET 220.A O no hydrogen 3.305 N/A ASP 225.A N GLN 221.A O no hydrogen 2.928 N/A ASN 226.A N LEU 222.A O no hydrogen 2.883 N/A LEU 227.A N LEU 223.A O no hydrogen 2.978 N/A THR 228.A N ARG 224.A O no hydrogen 2.877 N/A THR 228.A OG1 ARG 224.A O no hydrogen 2.774 N/A LEU 229.A N ASP 225.A O no hydrogen 3.083 N/A TRP 230.A N ASN 226.A O no hydrogen 2.796 N/A THR 231.A N THR 228.A O no hydrogen 3.292 N/A SER 232.A OG THR 228.A O no hydrogen 2.840 N/A