Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4qkq_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): HIS 2.A NE2 ASP 12.A OD2 no hydrogen 2.764 N/A LEU 5.A N HIS 2.A O no hydrogen 2.895 N/A GLY 6.A N MET 3.A O no hydrogen 2.980 N/A PHE 7.A N HIS 2.A O no hydrogen 3.030 N/A LYS 8.A NZ ASP 189.A OD1 no hydrogen 3.257 N/A LYS 8.A NZ ASP 189.A OD2 no hydrogen 3.033 N/A SER 9.A N ASP 12.A OD2 no hydrogen 2.759 N/A SER 9.A OG ASP 12.A OD2 no hydrogen 2.972 N/A ASP 12.A N SER 9.A OG no hydrogen 2.910 N/A LEU 13.A N SER 9.A O no hydrogen 3.099 N/A LEU 14.A N GLY 10.A O no hydrogen 3.209 N/A LYS 15.A N ILE 11.A O no hydrogen 2.851 N/A GLN 16.A N ASP 12.A O no hydrogen 2.820 N/A ARG 17.A N LEU 13.A O no hydrogen 3.172 N/A SER 18.A OG LYS 15.A O no hydrogen 2.781 N/A THR 19.A N GLN 16.A O no hydrogen 3.172 N/A THR 19.A OG1 GLN 16.A O no hydrogen 2.839 N/A TRP 21.A N SER 40.A OG no hydrogen 3.060 N/A TRP 21.A NE1 ASN 192.A O no hydrogen 2.914 N/A LYS 22.A N PHE 72.A O no hydrogen 2.834 N/A LYS 22.A NZ GLY 35.A O no hydrogen 2.686 N/A LEU 23.A N LEU 38.A O no hydrogen 2.854 N/A SER 24.A N PHE 70.A O no hydrogen 2.920 N/A SER 24.A OG ASP 31.A OD1 no hydrogen 2.709 N/A THR 25.A N ASP 31.A OD2 no hydrogen 2.852 N/A THR 25.A OG1 ASP 31.A OD2 no hydrogen 2.737 N/A SER 26.A N SER 24.A OG no hydrogen 3.268 N/A SER 27.A N THR 25.A OG1 no hydrogen 3.253 N/A SER 27.A OG ASP 257.A OXT no hydrogen 3.100 N/A SER 28.A N ASP 257.A O no hydrogen 3.062 N/A SER 28.A OG ASP 257.A O no hydrogen 3.280 N/A LEU 30.A N SER 27.A OG no hydrogen 2.921 N/A ASP 31.A N SER 27.A O no hydrogen 2.917 N/A SER 32.A N SER 28.A O no hydrogen 2.999 N/A VAL 33.A N GLU 29.A O no hydrogen 2.970 N/A LEU 34.A N LEU 30.A O no hydrogen 3.051 N/A LEU 34.A N ASP 31.A O no hydrogen 3.253 N/A GLY 35.A N SER 32.A O no hydrogen 3.129 N/A GLY 36.A N ASP 31.A O no hydrogen 2.854 N/A LEU 38.A N LEU 23.A O no hydrogen 2.887 N/A SER 40.A N TRP 21.A O no hydrogen 2.945 N/A SER 40.A OG TRP 21.A O no hydrogen 3.425 N/A SER 40.A OG ASN 192.A OD1 no hydrogen 2.755 N/A GLN 41.A N CYS 193.A O no hydrogen 2.811 N/A GLN 41.A NE2 GLN 16.A O no hydrogen 3.368 N/A GLN 41.A NE2 THR 19.A OG1 no hydrogen 3.011 N/A GLN 41.A NE2 ASN 192.A OD1 no hydrogen 2.980 N/A THR 44.A N VAL 195.A O no hydrogen 2.846 N/A GLU 45.A N PHE 219.A O no hydrogen 2.853 N/A PHE 46.A N VAL 197.A O no hydrogen 2.907 N/A ALA 47.A N PHE 221.A O no hydrogen 2.936 N/A GLY 48.A N ASN 199.A O no hydrogen 2.964 N/A SER 52.A N VAL 49.A O no hydrogen 3.109 N/A SER 52.A OG VAL 49.A O no hydrogen 2.872 N/A LYS 54.A NZ GLY 48.A O no hydrogen 2.750 N/A LYS 54.A NZ ASN 199.A O no hydrogen 3.223 N/A LYS 54.A NZ GLN 200.A OE1 no hydrogen 3.238 N/A THR 55.A OG1 ASP 154.A OD2 no hydrogen 3.025 N/A ILE 57.A N GLY 53.A O no hydrogen 2.976 N/A MET 58.A N LYS 54.A O no hydrogen 3.088 N/A HIS 59.A N THR 55.A O no hydrogen 2.954 N/A HIS 59.A NE2 THR 96.A O no hydrogen 3.207 N/A GLN 60.A N GLN 56.A O no hydrogen 2.830 N/A GLN 60.A NE2 GLN 60.A O no hydrogen 3.468 N/A GLN 60.A NE2 ASN 64.A OD1 no hydrogen 2.896 N/A SER 61.A N ILE 57.A O no hydrogen 2.991 N/A SER 61.A OG ILE 57.A O no hydrogen 2.934 N/A CYS 62.A N MET 58.A O no hydrogen 3.249 N/A CYS 62.A SG MET 58.A O no hydrogen 3.527 N/A VAL 63.A N HIS 59.A O no hydrogen 3.120 N/A ASN 64.A N GLN 60.A O no hydrogen 2.809 N/A ASN 64.A ND2 SER 24.A O no hydrogen 2.907 N/A ASN 64.A ND2 SER 26.A OG no hydrogen 2.945 N/A LEU 65.A N SER 61.A O no hydrogen 3.070 N/A GLN 66.A N VAL 63.A O no hydrogen 3.040 N/A GLN 66.A NE2 PRO 86.A O no hydrogen 3.011 N/A ASN 67.A N ASN 64.A O no hydrogen 3.085 N/A GLU 69.A N ASN 67.A OD1 no hydrogen 2.890 N/A PHE 70.A N ASN 67.A O no hydrogen 2.776 N/A LEU 71.A N PRO 68.A O no hydrogen 3.280 N/A PHE 72.A N LYS 22.A O no hydrogen 2.720 N/A GLU 76.A N ASP 74.A OD1 no hydrogen 2.800 N/A ALA 77.A N ASP 74.A O no hydrogen 2.993 N/A VAL 78.A N ASP 74.A O no hydrogen 2.879 N/A GLU 82.A N SER 79.A O no hydrogen 2.909 N/A GLU 82.A N SER 79.A OG no hydrogen 3.154 N/A VAL 83.A N LYS 80.A O no hydrogen 3.293 N/A ALA 84.A N GLY 81.A O no hydrogen 3.357 N/A LYS 87.A N ASN 147.A O no hydrogen 2.860 N/A LYS 87.A NZ ASN 146.A OD1 no hydrogen 3.241 N/A ALA 88.A N ASN 119.A O no hydrogen 3.008 N/A VAL 89.A N LEU 150.A O no hydrogen 2.863 N/A TYR 90.A N PHE 121.A O no hydrogen 2.710 N/A TYR 90.A OH ASP 154.A OD2 no hydrogen 2.952 N/A ILE 91.A N VAL 152.A O no hydrogen 2.818 N/A ASP 92.A N ALA 123.A O no hydrogen 2.729 N/A THR 93.A N ASP 154.A O no hydrogen 2.793 N/A THR 93.A OG1 GLN 131.A OE1 no hydrogen 3.390 N/A THR 93.A OG1 SER 155.A O no hydrogen 3.526 N/A GLU 94.A N ASP 92.A OD1 no hydrogen 3.435 N/A THR 96.A N ASP 92.A OD1 no hydrogen 2.743 N/A THR 96.A OG1 ASP 92.A OD1 no hydrogen 3.236 N/A THR 96.A OG1 ASP 154.A OD2 no hydrogen 2.649 N/A PHE 97.A N ASP 92.A OD2 no hydrogen 2.918 N/A ARG 98.A NH1 GLY 95.A O no hydrogen 2.709 N/A ARG 98.A NH1 PHE 97.A O no hydrogen 2.968 N/A ARG 98.A NH2 GLY 95.A O no hydrogen 3.359 N/A GLU 100.A N GLU 100.A OE2 no hydrogen 2.464 N/A ARG 101.A N ARG 98.A O no hydrogen 2.938 N/A ARG 101.A NE GLN 56.A OE1 no hydrogen 2.732 N/A ARG 101.A NH1 GLN 56.A OE1 no hydrogen 2.967 N/A ARG 101.A NH1 THR 251.A O no hydrogen 2.810 N/A ARG 101.A NH2 GLN 104.A OE1 no hydrogen 2.773 N/A ARG 101.A NH2 THR 251.A O no hydrogen 3.168 N/A ILE 102.A N ARG 98.A O no hydrogen 3.102 N/A MET 103.A N PRO 99.A O no hydrogen 2.925 N/A GLN 104.A N GLU 100.A O no hydrogen 3.024 N/A MET 105.A N ARG 101.A O no hydrogen 2.981 N/A ALA 106.A N ILE 102.A O no hydrogen 2.893 N/A GLU 107.A N MET 103.A O no hydrogen 2.814 N/A HIS 108.A N GLN 104.A O no hydrogen 3.053 N/A ALA 109.A N ALA 106.A O no hydrogen 2.889 N/A GLY 110.A N GLU 107.A O no hydrogen 3.201 N/A ILE 111.A N ALA 106.A O no hydrogen 2.959 N/A THR 115.A N ASP 112.A OD2 no hydrogen 2.925 N/A THR 115.A OG1 ASP 112.A OD2 no hydrogen 2.758 N/A VAL 116.A N ASP 112.A O no hydrogen 3.268 N/A LEU 117.A N GLY 113.A O no hydrogen 2.940 N/A ASP 118.A N GLN 114.A O no hydrogen 2.757 N/A ASN 119.A N THR 115.A O no hydrogen 3.048 N/A ASN 119.A N VAL 116.A O no hydrogen 3.051 N/A THR 120.A N LEU 117.A O no hydrogen 3.495 N/A THR 120.A OG1 VAL 116.A O no hydrogen 2.824 N/A PHE 121.A N ALA 88.A O no hydrogen 2.787 N/A ALA 123.A N TYR 90.A O no hydrogen 2.893 N/A ARG 124.A NH2 ASP 92.A O no hydrogen 3.113 N/A ALA 125.A N ASP 92.A O no hydrogen 2.824 N/A SER 128.A N GLU 163.A OE1 no hydrogen 2.735 N/A SER 128.A OG GLU 163.A OE1 no hydrogen 3.385 N/A SER 128.A OG GLU 163.A OE2 no hydrogen 2.509 N/A GLN 131.A N ASN 127.A O no hydrogen 3.117 N/A GLN 131.A NE2 LEU 156.A O no hydrogen 2.910 N/A MET 132.A N SER 128.A O no hydrogen 2.843 N/A LEU 133.A N ASP 129.A O no hydrogen 2.819 N/A PHE 134.A N MET 130.A O no hydrogen 2.823 N/A ALA 135.A N GLN 131.A O no hydrogen 3.333 N/A GLU 136.A N MET 132.A O no hydrogen 3.241 N/A LYS 137.A N LEU 133.A O no hydrogen 2.819 N/A ILE 138.A N ALA 135.A O no hydrogen 3.154 N/A GLU 139.A N GLU 136.A O no hydrogen 3.325 N/A LEU 141.A N LYS 137.A O no hydrogen 3.092 N/A ILE 142.A N ILE 138.A O no hydrogen 3.073 N/A GLN 143.A N GLU 139.A O no hydrogen 2.888 N/A GLU 144.A N ASP 140.A O no hydrogen 3.022 N/A GLY 145.A N ILE 142.A O no hydrogen 2.886 N/A ASN 146.A N LEU 141.A O no hydrogen 3.198 N/A ASN 146.A ND2 LEU 141.A O no hydrogen 2.790 N/A ASN 147.A ND2 GLU 82.A O no hydrogen 2.920 N/A ASN 147.A ND2 ALA 84.A O no hydrogen 2.902 N/A ILE 148.A N ASN 146.A O no hydrogen 2.912 N/A LYS 149.A N LYS 87.A O no hydrogen 2.817 N/A LYS 149.A NZ GLU 82.A O no hydrogen 3.535 N/A LYS 149.A NZ ASN 147.A OD1 no hydrogen 2.841 N/A LYS 149.A NZ PHE 191.A O no hydrogen 3.529 N/A VAL 151.A N VAL 194.A O no hydrogen 2.900 N/A VAL 152.A N VAL 89.A O no hydrogen 2.805 N/A ILE 153.A N LEU 196.A O no hydrogen 2.852 N/A ASP 154.A N ILE 91.A O no hydrogen 3.002 N/A LEU 156.A N THR 198.A O no hydrogen 2.889 N/A THR 157.A OG1 ASN 199.A OD1 no hydrogen 2.791 N/A SER 158.A N SER 155.A OG no hydrogen 3.205 N/A SER 158.A OG GLU 94.A OE2 no hydrogen 3.160 N/A THR 159.A OG1 GLN 131.A OE1 no hydrogen 2.763 N/A ARG 161.A N THR 157.A O no hydrogen 2.875 N/A ASN 162.A N SER 158.A O no hydrogen 2.927 N/A GLU 163.A N THR 159.A O no hydrogen 2.913 N/A TYR 164.A N PHE 160.A O no hydrogen 3.017 N/A LYS 169.A N GLY 166.A O no hydrogen 3.018 N/A ARG 173.A N LYS 169.A O no hydrogen 3.147 N/A ARG 173.A NH1 GLN 174.A OE1 no hydrogen 2.829 N/A GLN 174.A N LEU 170.A O no hydrogen 3.010 N/A GLN 174.A NE2 GLY 209.A O no hydrogen 2.826 N/A GLN 175.A N ALA 171.A O no hydrogen 3.103 N/A GLN 175.A NE2 ALA 171.A O no hydrogen 2.936 N/A LYS 176.A N GLU 172.A O no hydrogen 3.020 N/A LYS 176.A NZ SER 128.A OG no hydrogen 2.743 N/A LYS 176.A NZ ASP 129.A OD1 no hydrogen 2.555 N/A LEU 177.A N ARG 173.A O no hydrogen 2.956 N/A GLY 178.A N GLN 174.A O no hydrogen 2.882 N/A ARG 179.A N GLN 175.A O no hydrogen 3.092 N/A HIS 180.A N LYS 176.A O no hydrogen 2.978 N/A MET 181.A N LEU 177.A O no hydrogen 2.846 N/A ALA 182.A N GLY 178.A O no hydrogen 3.095 N/A THR 183.A N ARG 179.A O no hydrogen 3.196 N/A THR 183.A OG1 ARG 179.A O no hydrogen 3.264 N/A LEU 184.A N HIS 180.A O no hydrogen 3.023 N/A ASN 185.A N MET 181.A O no hydrogen 2.985 N/A ASN 185.A ND2 MET 181.A O no hydrogen 3.165 N/A ASN 185.A ND2 ALA 216.A O no hydrogen 2.818 N/A LYS 186.A N ALA 182.A O no hydrogen 2.895 N/A LYS 186.A NZ GLU 139.A OE1 no hydrogen 3.207 N/A LEU 187.A N THR 183.A O no hydrogen 2.957 N/A ALA 188.A N LEU 184.A O no hydrogen 3.065 N/A ASP 189.A N ASN 185.A O no hydrogen 2.938 N/A LEU 190.A N LYS 186.A O no hydrogen 2.865 N/A PHE 191.A N LEU 187.A O no hydrogen 3.144 N/A ASN 192.A ND2 THR 19.A O no hydrogen 3.026 N/A ASN 192.A ND2 GLU 82.A OE2 no hydrogen 3.225 N/A CYS 193.A N ALA 188.A O no hydrogen 3.079 N/A CYS 193.A SG LEU 187.A O no hydrogen 3.491 N/A VAL 194.A N LYS 149.A O no hydrogen 3.061 N/A VAL 195.A N SER 42.A O no hydrogen 3.294 N/A LEU 196.A N VAL 151.A O no hydrogen 2.841 N/A VAL 197.A N THR 44.A O no hydrogen 2.907 N/A THR 198.A N ILE 153.A O no hydrogen 3.043 N/A THR 198.A OG1 ASP 154.A OD1 no hydrogen 2.708 N/A ASN 199.A N PHE 46.A O no hydrogen 2.975 N/A ASN 199.A ND2 GLU 45.A OE2 no hydrogen 2.761 N/A ASN 199.A ND2 ILE 208.A O no hydrogen 2.896 N/A GLN 200.A N ASN 199.A OD1 no hydrogen 2.780 N/A SER 202.A N GLN 206.A O no hydrogen 2.842 N/A GLN 206.A N SER 202.A O no hydrogen 3.321 N/A ILE 208.A N GLN 200.A O no hydrogen 2.909 N/A GLY 214.A N GLY 210.A O no hydrogen 3.010 N/A HIS 215.A N HIS 211.A O no hydrogen 2.671 N/A ALA 216.A N VAL 213.A O no hydrogen 2.850 N/A ALA 217.A N GLY 214.A O no hydrogen 3.309 N/A PHE 219.A N VAL 43.A O no hydrogen 3.262 N/A ARG 220.A N ASP 237.A O no hydrogen 2.870 N/A ARG 220.A NE GLU 45.A OE1 no hydrogen 2.837 N/A ARG 220.A NH2 GLU 45.A OE1 no hydrogen 2.884 N/A PHE 221.A N GLU 45.A O no hydrogen 2.801 N/A PHE 222.A N LYS 234.A O no hydrogen 3.039 N/A VAL 223.A N ALA 47.A O no hydrogen 2.774 N/A ARG 224.A N VAL 232.A O no hydrogen 2.817 N/A ARG 224.A NH1 GLU 245.A OE1 no hydrogen 3.046 N/A ARG 224.A NH2 GLU 245.A OE1 no hydrogen 2.962 N/A GLY 226.A N LYS 230.A O no hydrogen 2.823 N/A LYS 230.A N LYS 227.A O no hydrogen 2.959 N/A ARG 231.A N PHE 248.A O no hydrogen 2.830 N/A ARG 231.A NE GLY 51.A O no hydrogen 2.962 N/A ARG 231.A NH1 GLY 228.A O no hydrogen 2.886 N/A ARG 231.A NH1 LYS 230.A O no hydrogen 2.760 N/A ARG 231.A NH2 GLY 51.A O no hydrogen 3.160 N/A VAL 232.A N ARG 224.A O no hydrogen 2.871 N/A ALA 233.A N ALA 246.A O no hydrogen 2.839 N/A LYS 234.A N PHE 222.A O no hydrogen 2.831 N/A LEU 235.A N ALA 244.A O no hydrogen 2.766 N/A TYR 236.A N ARG 220.A O no hydrogen 2.994 N/A LEU 241.A N SER 238.A OG no hydrogen 3.026 N/A ALA 244.A N LEU 235.A O no hydrogen 3.247 N/A ALA 246.A N ALA 233.A O no hydrogen 2.757 N/A ILE 247.A N GLU 29.A OE1 no hydrogen 2.773 N/A PHE 248.A N ARG 231.A O no hydrogen 2.928 N/A ARG 249.A N GLN 256.A O no hydrogen 2.966 N/A ARG 249.A NE ASP 257.A OD1 no hydrogen 3.027 N/A ARG 249.A NE ASP 257.A OD2 no hydrogen 2.942 N/A ARG 249.A NH1 ASP 257.A OD1 no hydrogen 2.813 N/A ARG 249.A NH2 ASP 229.A OD2 no hydrogen 2.852 N/A ILE 250.A N ASP 229.A O no hydrogen 3.059 N/A THR 251.A N GLY 254.A O no hydrogen 2.601 N/A THR 251.A OG1 GLY 254.A O no hydrogen 3.491 N/A THR 251.A OG1 GLN 256.A OE1 no hydrogen 2.609 N/A LYS 253.A N THR 251.A OG1 no hydrogen 3.156 N/A LYS 253.A NZ HIS 108.A ND1 no hydrogen 3.131 N/A LYS 253.A NZ HIS 108.A O no hydrogen 3.549 N/A GLY 254.A N THR 251.A O no hydrogen 2.762 N/A ILE 255.A N GLN 60.A OE1 no hydrogen 2.995 N/A GLN 256.A N ARG 249.A O no hydrogen 3.031 N/A