Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 7s85_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLN 3.A N ARG 20.A O no hydrogen 3.017 N/A VAL 5.A N LYS 18.A O no hydrogen 2.731 N/A GLU 6.A N LYS 18.A O no hydrogen 3.367 N/A ILE 8.A N VAL 16.A O no hydrogen 2.757 N/A GLY 9.A N VAL 16.A O no hydrogen 3.355 N/A GLY 14.A N GLY 11.A O no hydrogen 2.911 N/A VAL 15.A N LYS 32.A O no hydrogen 2.983 N/A VAL 16.A N GLY 9.A O no hydrogen 3.093 N/A TYR 17.A N LEU 30.A O no hydrogen 2.752 N/A LYS 18.A N GLU 6.A O no hydrogen 2.775 N/A ALA 19.A N VAL 28.A O no hydrogen 2.945 N/A ARG 20.A N GLN 3.A O no hydrogen 3.006 N/A ASN 21.A N GLU 26.A O no hydrogen 2.828 N/A LYS 22.A N ASN 1.A O no hydrogen 3.182 N/A LEU 23.A N ASN 21.A OD1 no hydrogen 2.672 N/A THR 24.A N ASN 21.A OD1 no hydrogen 2.609 N/A THR 24.A OG1 GLU 26.A OE2 no hydrogen 2.582 N/A GLY 25.A N ASN 21.A O no hydrogen 2.870 N/A GLU 26.A N THR 24.A OG1 no hydrogen 3.178 N/A VAL 28.A N ALA 19.A O no hydrogen 2.839 N/A ALA 29.A N PHE 69.A O no hydrogen 2.796 N/A LEU 30.A N TYR 17.A O no hydrogen 2.710 N/A LYS 31.A N LEU 67.A O no hydrogen 2.736 N/A LYS 31.A NZ TYR 13.A OH no hydrogen 3.326 N/A LYS 31.A NZ ASP 134.A OD1 no hydrogen 2.718 N/A LYS 32.A N VAL 15.A O no hydrogen 2.919 N/A ILE 33.A N LEU 65.A O no hydrogen 2.900 N/A LEU 35.A N ASN 63.A O no hydrogen 3.311 N/A ILE 41.A N ALA 37.A O no hydrogen 2.907 N/A SER 42.A N ILE 38.A O no hydrogen 3.261 N/A SER 42.A OG ILE 38.A O no hydrogen 3.152 N/A LEU 43.A N ARG 39.A O no hydrogen 3.165 N/A LEU 44.A N ILE 41.A O no hydrogen 2.712 N/A LYS 45.A N SER 42.A O no hydrogen 3.182 N/A GLU 46.A N LEU 43.A O no hydrogen 3.246 N/A LEU 47.A N LEU 44.A O no hydrogen 3.097 N/A ASN 48.A ND2 LYS 45.A O no hydrogen 2.905 N/A ASN 51.A N HIS 49.A ND1 no hydrogen 2.862 N/A ASN 51.A ND2 GLN 99.A OE1 no hydrogen 3.017 N/A ASN 51.A ND2 ILE 130.A O no hydrogen 2.995 N/A ILE 52.A N HIS 49.A O no hydrogen 3.128 N/A VAL 53.A N LEU 132.A O no hydrogen 2.950 N/A LYS 54.A N GLU 70.A OE2 no hydrogen 2.922 N/A LEU 56.A N VAL 68.A O no hydrogen 2.685 N/A ASP 57.A N VAL 68.A O no hydrogen 3.294 N/A ILE 59.A N TYR 66.A O no hydrogen 2.890 N/A LYS 64.A N THR 61.A O no hydrogen 3.340 N/A LEU 65.A N ILE 33.A O no hydrogen 2.776 N/A TYR 66.A N ILE 59.A O no hydrogen 3.007 N/A LEU 67.A N LYS 31.A O no hydrogen 2.757 N/A VAL 68.A N ASP 57.A O no hydrogen 2.908 N/A PHE 69.A N ALA 29.A O no hydrogen 2.718 N/A GLU 70.A N LYS 54.A O no hydrogen 3.049 N/A LEU 76.A N LEU 122.A O no hydrogen 2.721 N/A LYS 77.A N PRO 119.A O no hydrogen 3.317 N/A LYS 77.A NZ ASP 81.A OD2 no hydrogen 3.549 N/A LYS 78.A N ASP 75.A OD1 no hydrogen 2.780 N/A LYS 78.A NZ ASP 75.A OD1 no hydrogen 3.437 N/A LYS 78.A NZ ASP 75.A OD2 no hydrogen 2.750 N/A PHE 79.A N ASP 75.A O no hydrogen 3.046 N/A MET 80.A N LEU 76.A O no hydrogen 2.813 N/A ASP 81.A N LYS 77.A O no hydrogen 3.017 N/A ALA 82.A N LYS 78.A O no hydrogen 2.960 N/A SER 83.A N MET 80.A O no hydrogen 3.074 N/A SER 83.A OG PHE 79.A O no hydrogen 2.974 N/A ALA 84.A N ASP 81.A O no hydrogen 3.199 N/A THR 86.A OG1 SER 83.A O no hydrogen 3.372 N/A THR 86.A OG1 GLY 87.A O no hydrogen 3.281 N/A GLY 87.A N SER 83.A O no hydrogen 2.564 N/A LEU 92.A N PRO 89.A O no hydrogen 2.986 N/A ILE 93.A N PRO 89.A O no hydrogen 3.059 N/A LYS 94.A N LEU 90.A O no hydrogen 2.831 N/A LYS 94.A NZ PHE 268.A O no hydrogen 3.164 N/A LYS 94.A NZ ASP 271.A OD1 no hydrogen 2.822 N/A SER 95.A N PRO 91.A O no hydrogen 3.015 N/A TYR 96.A N LEU 92.A O no hydrogen 2.835 N/A LEU 97.A N ILE 93.A O no hydrogen 2.850 N/A PHE 98.A N LYS 94.A O no hydrogen 2.913 N/A GLN 99.A N SER 95.A O no hydrogen 2.915 N/A GLN 99.A NE2 SER 95.A O no hydrogen 3.527 N/A GLN 99.A NE2 SER 95.A OG no hydrogen 2.925 N/A GLN 99.A NE2 GLY 128.A O no hydrogen 2.822 N/A LEU 100.A N TYR 96.A O no hydrogen 2.901 N/A LEU 101.A N LEU 97.A O no hydrogen 2.889 N/A GLN 102.A N PHE 98.A O no hydrogen 2.900 N/A GLY 103.A N GLN 99.A O no hydrogen 2.864 N/A LEU 104.A N LEU 100.A O no hydrogen 2.881 N/A ALA 105.A N LEU 101.A O no hydrogen 2.871 N/A PHE 106.A N GLN 102.A O no hydrogen 3.061 N/A CYS 107.A N GLY 103.A O no hydrogen 3.060 N/A CYS 107.A SG GLY 103.A O no hydrogen 3.772 N/A CYS 107.A SG LEU 104.A O no hydrogen 3.676 N/A CYS 107.A SG VAL 112.A O no hydrogen 3.437 N/A HIS 108.A N LEU 104.A O no hydrogen 2.659 N/A HIS 108.A NE2 ASP 168.A OD2 no hydrogen 2.952 N/A SER 109.A N ALA 105.A O no hydrogen 2.797 N/A SER 109.A OG ALA 105.A O no hydrogen 3.217 N/A SER 109.A OG PHE 106.A O no hydrogen 2.335 N/A HIS 110.A N PHE 106.A O no hydrogen 3.101 N/A ARG 111.A N HIS 108.A O no hydrogen 2.852 N/A VAL 112.A N CYS 107.A O no hydrogen 2.649 N/A HIS 114.A N ASP 168.A OD2 no hydrogen 2.808 N/A HIS 114.A NE2 ALA 133.A O no hydrogen 2.726 N/A ARG 115.A N ASP 168.A OD1 no hydrogen 2.812 N/A ASP 116.A N HIS 114.A ND1 no hydrogen 3.159 N/A LYS 118.A NZ ASP 116.A OD1 no hydrogen 3.399 N/A LYS 118.A NZ ASP 116.A OD2 no hydrogen 3.140 N/A LYS 118.A NZ ASN 121.A OD1 no hydrogen 3.080 N/A GLN 120.A N GLN 120.A OE1 no hydrogen 2.829 N/A ASN 121.A N LYS 118.A O no hydrogen 2.892 N/A ASN 121.A ND2 ASP 134.A OD2 no hydrogen 2.979 N/A LEU 122.A N PRO 119.A O no hydrogen 3.083 N/A LEU 123.A N LYS 131.A O no hydrogen 3.040 N/A ILE 124.A N GLN 74.A O no hydrogen 2.888 N/A ASN 125.A N ALA 129.A O no hydrogen 3.231 N/A GLU 127.A N ASN 125.A OD1 no hydrogen 3.013 N/A GLY 128.A N ASN 125.A O no hydrogen 3.357 N/A ALA 129.A N ASN 125.A OD1 no hydrogen 3.021 N/A ILE 130.A N GLN 99.A OE1 no hydrogen 3.138 N/A LYS 131.A N LEU 123.A O no hydrogen 2.733 N/A LYS 131.A NZ GLU 70.A OE1 no hydrogen 3.508 N/A LYS 131.A NZ GLU 70.A OE2 no hydrogen 3.536 N/A LEU 132.A N ASN 51.A O no hydrogen 2.826 N/A ALA 133.A N ASN 121.A O no hydrogen 2.947 N/A GLY 136.A N HIS 114.A O no hydrogen 2.862 N/A PHE 141.A N LEU 137.A O no hydrogen 3.016 N/A GLY 142.A N ALA 138.A O no hydrogen 2.897 N/A GLY 142.A N ARG 139.A O no hydrogen 2.837 N/A VAL 143.A N ALA 138.A O no hydrogen 2.974 N/A VAL 145.A N VAL 143.A O no hydrogen 2.969 N/A TYR 151.A OH GLU 178.A OE1 no hydrogen 2.625 N/A TYR 151.A OH GLU 178.A OE2 no hydrogen 3.427 N/A ARG 152.A N LEU 149.A O no hydrogen 3.024 N/A ARG 152.A NH1 ASP 116.A OD1 no hydrogen 3.125 N/A GLU 155.A N GLU 155.A OE1 no hydrogen 2.707 N/A ILE 156.A N ALA 153.A O no hydrogen 3.115 N/A LEU 157.A N ALA 153.A O no hydrogen 3.240 N/A LEU 158.A N PRO 154.A O no hydrogen 2.880 N/A GLY 159.A N ILE 156.A O no hydrogen 2.988 N/A CYS 160.A N GLU 155.A O no hydrogen 2.877 N/A ALA 166.A N SER 164.A OG no hydrogen 3.148 N/A VAL 167.A N SER 164.A O no hydrogen 3.009 N/A ASP 168.A N THR 165.A O no hydrogen 3.029 N/A TRP 170.A N ALA 166.A O no hydrogen 3.090 N/A SER 171.A N VAL 167.A O no hydrogen 3.143 N/A SER 171.A OG TYR 151.A O no hydrogen 2.705 N/A SER 171.A OG VAL 167.A O no hydrogen 3.121 N/A LEU 172.A N ASP 168.A O no hydrogen 2.929 N/A GLY 173.A N ILE 169.A O no hydrogen 2.833 N/A CYS 174.A N TRP 170.A O no hydrogen 3.045 N/A CYS 174.A SG TRP 170.A O no hydrogen 3.587 N/A ILE 175.A N SER 171.A O no hydrogen 3.071 N/A PHE 176.A N LEU 172.A O no hydrogen 2.861 N/A ALA 177.A N GLY 173.A O no hydrogen 2.984 N/A GLU 178.A N CYS 174.A O no hydrogen 3.111 N/A MET 179.A N ILE 175.A O no hydrogen 2.857 N/A VAL 180.A N PHE 176.A O no hydrogen 3.069 N/A THR 181.A N ALA 177.A O no hydrogen 2.954 N/A THR 181.A OG1 ALA 177.A O no hydrogen 2.867 N/A THR 181.A OG1 ARG 183.A O no hydrogen 3.195 N/A ARG 182.A N GLU 178.A O no hydrogen 2.795 N/A ARG 182.A NE ALA 84.A O no hydrogen 2.706 N/A ARG 183.A N THR 181.A OG1 no hydrogen 3.415 N/A GLY 188.A N PHE 186.A O no hydrogen 2.991 N/A GLY 188.A N GLN 194.A OE1 no hydrogen 2.868 N/A ASP 189.A N ASP 193.A OD2 no hydrogen 3.038 N/A ASP 193.A N SER 190.A OG no hydrogen 2.848 N/A GLN 194.A N SER 190.A O no hydrogen 2.764 N/A GLN 194.A NE2 TRP 150.A O no hydrogen 3.189 N/A GLN 194.A NE2 PHE 186.A O no hydrogen 2.898 N/A LEU 195.A N GLU 191.A O no hydrogen 3.002 N/A PHE 196.A N ILE 192.A O no hydrogen 2.948 N/A ARG 197.A N ASP 193.A O no hydrogen 2.957 N/A ARG 197.A NE ASP 193.A OD2 no hydrogen 3.063 N/A ILE 198.A N GLN 194.A O no hydrogen 3.135 N/A PHE 199.A N LEU 195.A O no hydrogen 2.946 N/A ARG 200.A N PHE 196.A O no hydrogen 2.810 N/A THR 201.A N ARG 197.A O no hydrogen 3.349 N/A THR 201.A N ILE 198.A O no hydrogen 3.126 N/A THR 201.A OG1 ARG 197.A O no hydrogen 3.356 N/A LEU 202.A N ILE 198.A O no hydrogen 2.829 N/A GLY 203.A N PHE 199.A O no hydrogen 2.756 N/A THR 204.A N TRP 226.A O no hydrogen 2.937 N/A THR 204.A OG1 PRO 224.A O no hydrogen 2.609 N/A VAL 208.A N ASP 206.A OD1 no hydrogen 2.846 N/A VAL 209.A N ASP 206.A OD1 no hydrogen 3.248 N/A TRP 210.A N ASP 206.A O no hydrogen 2.926 N/A GLY 212.A N GLU 207.A OE1 no hydrogen 2.613 N/A VAL 213.A N TRP 210.A O no hydrogen 2.989 N/A THR 214.A N GLU 207.A OE2 no hydrogen 3.060 N/A THR 214.A OG1 GLU 207.A OE2 no hydrogen 2.407 N/A SER 215.A N GLY 212.A O no hydrogen 3.091 N/A MET 216.A N VAL 213.A O no hydrogen 3.172 N/A ASP 218.A N LEU 158.A O no hydrogen 2.951 N/A TYR 219.A N MET 216.A O no hydrogen 3.044 N/A PHE 223.A N LYS 220.A O no hydrogen 2.989 N/A LYS 225.A NZ PRO 221.A O no hydrogen 3.085 N/A LYS 225.A NZ PHE 223.A O no hydrogen 2.632 N/A TRP 226.A N THR 204.A OG1 no hydrogen 2.824 N/A ARG 228.A NH1 LEU 202.A O no hydrogen 3.123 N/A GLN 229.A N THR 201.A O no hydrogen 3.227 N/A LYS 233.A N ASP 230.A O no hydrogen 3.213 N/A VAL 234.A N PHE 231.A O no hydrogen 3.124 N/A LEU 238.A N VAL 235.A O no hydrogen 2.956 N/A GLY 242.A N ASP 239.A OD1 no hydrogen 2.822 N/A ARG 243.A N ASP 239.A O no hydrogen 2.902 N/A ARG 243.A NH1 LEU 238.A O no hydrogen 3.104 N/A SER 244.A N GLU 240.A O no hydrogen 2.825 N/A SER 244.A OG HIS 266.A NE2 no hydrogen 3.356 N/A LEU 245.A N ASP 241.A O no hydrogen 3.046 N/A LEU 246.A N GLY 242.A O no hydrogen 2.911 N/A SER 247.A N ARG 243.A O no hydrogen 2.825 N/A SER 247.A OG SER 244.A O no hydrogen 3.023 N/A GLN 248.A N SER 244.A O no hydrogen 3.175 N/A MET 249.A N LEU 245.A O no hydrogen 3.000 N/A LEU 250.A N LEU 246.A O no hydrogen 2.893 N/A LEU 250.A N SER 247.A O no hydrogen 3.268 N/A TYR 252.A OH GLY 203.A O no hydrogen 2.636 N/A ASN 255.A N ASP 253.A OD1 no hydrogen 2.966 N/A LYS 256.A N ASP 253.A O no hydrogen 2.707 N/A ARG 257.A N ASP 253.A O no hydrogen 2.960 N/A ARG 257.A NE HIS 251.A O no hydrogen 2.854 N/A ARG 257.A NH1 GLU 155.A OE1 no hydrogen 3.421 N/A ARG 257.A NH1 GLU 155.A OE2 no hydrogen 2.774 N/A ARG 257.A NH1 ALA 166.A O no hydrogen 2.832 N/A ARG 257.A NH2 GLU 155.A OE1 no hydrogen 2.826 N/A ARG 257.A NH2 HIS 251.A O no hydrogen 3.213 N/A ARG 257.A NH2 TYR 252.A O no hydrogen 3.043 N/A ILE 258.A N GLN 248.A O no hydrogen 3.084 N/A ALA 262.A N SER 259.A OG no hydrogen 2.940 N/A ALA 263.A N SER 259.A O no hydrogen 2.854 N/A LEU 264.A N ALA 260.A O no hydrogen 3.089 N/A ALA 265.A N ALA 262.A O no hydrogen 2.995 N/A HIS 266.A N ALA 263.A O no hydrogen 2.968 N/A HIS 266.A NE2 SER 244.A OG no hydrogen 3.356 N/A PHE 268.A N HIS 266.A ND1 no hydrogen 2.969 N/A PHE 269.A N HIS 266.A O no hydrogen 3.074 N/A GLN 270.A N PRO 267.A O no hydrogen 3.086 N/A VAL 272.A N PHE 269.A O no hydrogen 3.300 N/A