Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4wtq_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLU 2.A N ASP 40.A OD1 no hydrogen 3.271 N/A ARG 4.A N THR 41.A O no hydrogen 2.840 N/A ARG 5.A NE GLU 45.A OE1 no hydrogen 2.488 N/A ILE 6.A N HIS 43.A O no hydrogen 2.984 N/A LEU 8.A N GLU 45.A O no hydrogen 2.921 N/A TYR 9.A N GLY 21.A O no hydrogen 2.671 N/A ALA 10.A N GLU 47.A O no hydrogen 3.047 N/A GLU 11.A N GLY 19.A O no hydrogen 2.937 N/A ARG 12.A NH2 ASP 51.A OD1 no hydrogen 2.768 N/A LEU 13.A N GLN 17.A O no hydrogen 2.662 N/A GLY 16.A N LEU 13.A O no hydrogen 2.942 N/A GLN 17.A N ASP 15.A OD1 no hydrogen 3.153 N/A GLN 17.A NE2 ASP 15.A OD2 no hydrogen 3.059 N/A GLN 17.A NE2 ASN 157.A O no hydrogen 3.662 N/A MET 18.A N LYS 126.A O no hydrogen 2.844 N/A GLY 19.A N GLU 11.A O no hydrogen 2.852 N/A TYR 20.A OH SER 55.A O no hydrogen 2.799 N/A GLY 21.A N TYR 9.A O no hydrogen 2.783 N/A GLY 25.A N GLU 11.A OE1 no hydrogen 2.382 N/A ARG 26.A N GLU 23.A O no hydrogen 3.209 N/A ALA 27.A N GLU 11.A OE2 no hydrogen 3.319 N/A THR 28.A N TYR 20.A O no hydrogen 2.996 N/A THR 28.A OG1 PRO 30.A O no hydrogen 2.799 N/A GLY 31.A N TYR 129.A O no hydrogen 2.755 N/A ILE 34.A N PRO 131.A O no hydrogen 3.164 N/A LEU 36.A N ILE 133.A O no hydrogen 2.934 N/A ASN 37.A N ASP 40.A OD2 no hydrogen 2.781 N/A GLU 38.A N ARG 135.A O no hydrogen 2.897 N/A ASP 40.A N ASN 37.A O no hydrogen 2.905 N/A THR 41.A N GLU 2.A O no hydrogen 2.938 N/A LEU 42.A N TRP 87.A O no hydrogen 2.908 N/A HIS 43.A N ARG 4.A O no hydrogen 2.903 N/A HIS 43.A ND1 THR 86.A OG1 no hydrogen 2.987 N/A ILE 44.A N TYR 85.A O no hydrogen 2.672 N/A GLU 45.A N ILE 6.A O no hydrogen 2.836 N/A PHE 46.A N ARG 83.A O no hydrogen 2.851 N/A GLU 47.A N LEU 8.A O no hydrogen 2.847 N/A ASN 48.A N GLY 81.A O no hydrogen 2.986 N/A ASN 48.A ND2 VAL 52.A O no hydrogen 2.813 N/A ASN 48.A ND2 VAL 77.A O no hydrogen 3.292 N/A ASN 48.A ND2 GLU 78.A O no hydrogen 3.320 N/A THR 49.A N ALA 10.A O no hydrogen 3.120 N/A THR 49.A OG1 ALA 10.A O no hydrogen 2.685 N/A MET 50.A N ASN 48.A OD1 no hydrogen 3.000 N/A ASP 51.A N ASP 51.A OD1 no hydrogen 2.682 N/A ARG 53.A NE ASP 76.A OD2 no hydrogen 2.844 N/A ARG 53.A NH2 ASP 76.A OD1 no hydrogen 2.931 N/A ARG 53.A NH2 ASP 76.A OD2 no hydrogen 3.469 N/A ALA 54.A N VAL 77.A O no hydrogen 2.950 N/A SER 55.A N ASP 112.A OD1 no hydrogen 2.958 N/A SER 55.A OG GLY 69.A O no hydrogen 2.617 N/A SER 55.A OG ASP 112.A OD1 no hydrogen 3.422 N/A HIS 57.A N HIS 111.A O no hydrogen 2.871 N/A HIS 57.A ND1 ASP 68.A O no hydrogen 3.112 N/A HIS 59.A N HIS 109.A O no hydrogen 2.917 N/A ASP 62.A N ARG 88.A O no hydrogen 2.941 N/A SER 67.A N GLU 64.A O no hydrogen 2.676 N/A ASP 68.A N VAL 65.A O no hydrogen 3.088 N/A GLY 69.A N SER 75.A OG no hydrogen 2.794 N/A THR 70.A N SER 75.A OG no hydrogen 3.254 N/A THR 70.A OG1 ASP 68.A OD2 no hydrogen 2.920 N/A ASN 73.A N THR 70.A OG1 no hydrogen 3.223 N/A ASN 73.A ND2 ASP 68.A OD2 no hydrogen 2.808 N/A LYS 74.A N THR 71.A O no hydrogen 2.966 N/A SER 75.A N THR 70.A O no hydrogen 2.877 N/A SER 75.A OG VAL 65.A O no hydrogen 3.529 N/A SER 75.A OG THR 70.A O no hydrogen 3.412 N/A VAL 77.A N ALA 54.A O no hydrogen 2.835 N/A GLU 78.A N GLU 78.A OE1 no hydrogen 2.910 N/A GLY 81.A N GLU 78.A O no hydrogen 2.835 N/A THR 82.A OG1 PHE 46.A O no hydrogen 3.400 N/A ARG 83.A N PHE 46.A O no hydrogen 2.847 N/A ARG 83.A NH2 SER 66.A O no hydrogen 3.057 N/A TYR 85.A N ILE 44.A O no hydrogen 2.734 N/A TYR 85.A OH SER 75.A O no hydrogen 2.519 N/A THR 86.A N SER 67.A OG no hydrogen 2.952 N/A THR 86.A OG1 HIS 43.A ND1 no hydrogen 2.987 N/A TRP 87.A N LEU 42.A O no hydrogen 2.936 N/A ARG 88.A N ASP 62.A O no hydrogen 2.728 N/A THR 89.A N ASP 40.A O no hydrogen 3.209 N/A THR 89.A OG1 ASN 37.A O no hydrogen 3.262 N/A THR 89.A OG1 ASP 40.A O no hydrogen 2.915 N/A HIS 90.A N SER 104.A OG no hydrogen 2.965 N/A HIS 90.A ND1 ASP 62.A OD2 no hydrogen 2.678 N/A HIS 90.A NE2 ALA 102.A O no hydrogen 2.761 N/A GLY 93.A N ARG 101.A O no hydrogen 3.159 N/A ARG 94.A NH1 GLY 98.A O no hydrogen 3.025 N/A ARG 95.A N THR 99.A O no hydrogen 2.798 N/A ARG 95.A NH1 THR 99.A OG1 no hydrogen 2.746 N/A GLY 98.A N ARG 95.A O no hydrogen 2.749 N/A THR 99.A N ASP 97.A OD1 no hydrogen 2.728 N/A THR 99.A OG1 ASP 97.A OD1 no hydrogen 2.420 N/A THR 99.A OG1 ASP 97.A OD2 no hydrogen 3.106 N/A ARG 101.A N GLY 93.A O no hydrogen 2.726 N/A SER 104.A N HIS 90.A O no hydrogen 2.969 N/A SER 104.A OG HIS 90.A ND1 no hydrogen 3.221 N/A SER 104.A OG HIS 90.A O no hydrogen 3.488 N/A ALA 105.A N GLU 38.A OE2 no hydrogen 2.814 N/A GLY 106.A N VAL 134.A O no hydrogen 2.931 N/A TYR 107.A OH GLU 175.A OE2 no hydrogen 2.520 N/A TRP 108.A N VAL 132.A O no hydrogen 2.803 N/A TRP 108.A NE1 SER 104.A O no hydrogen 2.859 N/A HIS 109.A NE2 ALA 221.A O no hydrogen 2.901 N/A TYR 110.A N GLY 130.A O no hydrogen 2.890 N/A TYR 110.A OH PRO 32.A O no hydrogen 2.662 N/A HIS 111.A N HIS 57.A O no hydrogen 2.835 N/A HIS 111.A ND1 ASP 112.A O no hydrogen 2.776 N/A ASP 112.A N LEU 128.A O no hydrogen 3.083 N/A HIS 113.A N SER 55.A OG no hydrogen 2.980 N/A HIS 113.A ND1 HIS 113.A O no hydrogen 2.827 N/A HIS 113.A ND1 GLU 118.A O no hydrogen 2.892 N/A VAL 114.A N ASP 112.A OD1 no hydrogen 3.157 N/A VAL 115.A N ASP 112.A OD2 no hydrogen 2.815 N/A THR 117.A OG1 THR 121.A OG1 no hydrogen 3.173 N/A GLU 118.A N GLU 118.A OE1 no hydrogen 3.109 N/A HIS 119.A N THR 117.A OG1 no hydrogen 3.088 N/A GLY 120.A N THR 117.A O no hydrogen 2.959 N/A THR 121.A N THR 117.A OG1 no hydrogen 3.342 N/A THR 121.A OG1 THR 117.A OG1 no hydrogen 3.173 N/A GLY 123.A N VAL 115.A O no hydrogen 3.091 N/A ILE 124.A N GLY 120.A O no hydrogen 2.965 N/A ARG 125.A N THR 121.A O no hydrogen 3.001 N/A LYS 126.A N GLY 122.A O no hydrogen 3.012 N/A GLY 127.A N GLY 123.A O no hydrogen 2.968 N/A GLY 127.A N ILE 124.A O no hydrogen 3.066 N/A LEU 128.A N GLY 123.A O no hydrogen 2.977 N/A TYR 129.A N GLY 127.A O no hydrogen 2.953 N/A TYR 129.A OH ASN 157.A OD1 no hydrogen 2.501 N/A GLY 130.A N TYR 110.A O no hydrogen 2.922 N/A VAL 132.A N TRP 108.A O no hydrogen 3.032 N/A ILE 133.A N ILE 34.A O no hydrogen 2.777 N/A VAL 134.A N GLY 106.A O no hydrogen 2.921 N/A ARG 135.A N LEU 36.A O no hydrogen 2.852 N/A ARG 135.A NH1 GLU 175.A OE2 no hydrogen 2.940 N/A ARG 135.A NH2 GLU 35.A OE2 no hydrogen 3.183 N/A ARG 135.A NH2 GLU 175.A OE1 no hydrogen 2.844 N/A ARG 136.A N ASP 139.A OD2 no hydrogen 2.886 N/A ARG 136.A NE GLU 38.A OE1 no hydrogen 3.049 N/A ARG 136.A NH2 GLU 38.A OE2 no hydrogen 2.821 N/A ASP 139.A N ARG 136.A O no hydrogen 2.918 N/A ASP 143.A N ARG 173.A O no hydrogen 2.760 N/A THR 145.A OG1 GLU 175.A OE1 no hydrogen 2.790 N/A HIS 146.A N GLU 175.A O no hydrogen 2.701 N/A ILE 148.A N VAL 177.A O no hydrogen 2.821 N/A VAL 149.A N ASN 156.A OD1 no hydrogen 2.772 N/A PHE 150.A N ILE 179.A O no hydrogen 2.928 N/A ASN 151.A N LEU 154.A O no hydrogen 2.892 N/A ASN 151.A ND2 ILE 124.A O no hydrogen 3.107 N/A ASN 151.A ND2 ARG 125.A O no hydrogen 3.409 N/A ASN 151.A ND2 ASN 157.A OD1 no hydrogen 2.922 N/A ASP 152.A N HIS 181.A O no hydrogen 3.030 N/A LEU 154.A N ASN 151.A O no hydrogen 2.964 N/A ILE 155.A N SER 162.A OG no hydrogen 2.574 N/A ASN 156.A N VAL 149.A O no hydrogen 2.899 N/A ASN 156.A ND2 THR 147.A O no hydrogen 3.064 N/A ASN 157.A ND2 GLN 17.A OE1 no hydrogen 2.906 N/A ASN 157.A ND2 ARG 125.A O no hydrogen 2.949 N/A ARG 158.A N ILE 155.A O no hydrogen 2.928 N/A SER 162.A N GLY 252.A O no hydrogen 3.084 N/A SER 162.A OG ILE 155.A O no hydrogen 3.454 N/A SER 162.A OG ARG 158.A O no hydrogen 2.804 N/A PHE 166.A N LEU 256.A O no hydrogen 2.858 N/A ALA 168.A N LEU 258.A O no hydrogen 2.838 N/A THR 169.A N ASP 172.A OD2 no hydrogen 2.876 N/A VAL 170.A N LYS 260.A O no hydrogen 2.856 N/A GLY 171.A N ALA 230.A O no hydrogen 2.868 N/A ASP 172.A N THR 169.A O no hydrogen 2.965 N/A ARG 173.A N ASP 143.A OD2 no hydrogen 2.804 N/A ARG 173.A NH1 GLN 227.A OE1 no hydrogen 2.951 N/A VAL 174.A N VAL 228.A O no hydrogen 2.950 N/A GLU 175.A N ALA 144.A O no hydrogen 2.875 N/A PHE 176.A N PHE 226.A O no hydrogen 2.884 N/A VAL 177.A N HIS 146.A O no hydrogen 2.846 N/A MET 178.A N PHE 224.A O no hydrogen 2.846 N/A ILE 179.A N ILE 148.A O no hydrogen 3.062 N/A THR 180.A N ASP 222.A O no hydrogen 3.076 N/A HIS 181.A N PHE 150.A O no hydrogen 2.899 N/A GLU 183.A N ASP 152.A OD1 no hydrogen 3.044 N/A HIS 186.A N VAL 218.A O no hydrogen 2.912 N/A PHE 188.A N LYS 216.A O no hydrogen 2.882 N/A HIS 189.A N HIS 242.A O no hydrogen 2.967 N/A HIS 189.A ND1 ASP 214.A O no hydrogen 2.904 N/A MET 190.A N ASP 214.A O no hydrogen 3.384 N/A HIS 191.A N MET 240.A O no hydrogen 2.894 N/A HIS 193.A ND1 HIS 191.A O no hydrogen 2.952 N/A TRP 195.A N VAL 213.A O no hydrogen 2.882 N/A ALA 196.A N GLY 201.A O no hydrogen 2.986 N/A ASP 197.A N GLN 211.A O no hydrogen 2.814 N/A ASN 198.A N ALA 196.A O no hydrogen 2.962 N/A ASN 198.A ND2 MET 202.A O no hydrogen 2.940 N/A ASN 198.A ND2 ASP 208.A OD2 no hydrogen 3.087 N/A ARG 199.A NH1 ASP 139.A OD2 no hydrogen 2.985 N/A ARG 199.A NH2 ASP 139.A OD1 no hydrogen 2.899 N/A GLY 201.A N ASN 198.A O no hydrogen 3.404 N/A MET 202.A N THR 200.A OG1 no hydrogen 3.135 N/A THR 204.A N ASP 208.A OD2 no hydrogen 3.107 N/A ASP 208.A N GLY 205.A O no hydrogen 3.207 N/A SER 210.A N ASP 208.A OD1 no hydrogen 2.966 N/A SER 210.A OG ASP 208.A OD1 no hydrogen 2.501 N/A VAL 213.A N TRP 195.A O no hydrogen 2.857 N/A LYS 216.A N PHE 188.A O no hydrogen 3.039 N/A LYS 216.A NZ ASP 197.A OD1 no hydrogen 2.806 N/A VAL 218.A N HIS 186.A O no hydrogen 2.915 N/A GLY 219.A N ASP 222.A OD2 no hydrogen 2.830 N/A ALA 221.A N THR 180.A O no hydrogen 2.578 N/A ASP 222.A N GLY 219.A O no hydrogen 2.945 N/A SER 223.A OG TYR 107.A O no hydrogen 2.795 N/A PHE 224.A N MET 178.A O no hydrogen 2.922 N/A PHE 226.A N PHE 176.A O no hydrogen 3.080 N/A GLN 227.A NE2 VAL 140.A O no hydrogen 3.127 N/A GLN 227.A NE2 GLU 175.A OE2 no hydrogen 3.128 N/A VAL 228.A N VAL 174.A O no hydrogen 2.929 N/A ALA 230.A N ASP 172.A O no hydrogen 2.816 N/A GLY 231.A N HIS 193.A NE2 no hydrogen 3.038 N/A GLU 232.A N ILE 229.A O no hydrogen 3.056 N/A VAL 234.A N GLY 231.A O no hydrogen 3.037 N/A GLY 235.A N GLY 231.A O no hydrogen 2.818 N/A GLY 237.A N VAL 259.A O no hydrogen 2.844 N/A TRP 239.A N PHE 257.A O no hydrogen 2.883 N/A TRP 239.A NE1 GLY 235.A O no hydrogen 3.030 N/A TYR 241.A N GLY 255.A O no hydrogen 2.885 N/A TYR 241.A OH PRO 164.A O no hydrogen 2.662 N/A HIS 242.A N HIS 189.A O no hydrogen 2.947 N/A HIS 242.A ND1 CYS 243.A O no hydrogen 2.783 N/A CYS 243.A N LEU 253.A O no hydrogen 3.173 N/A CYS 243.A SG HIS 186.A ND1 no hydrogen 3.910 N/A CYS 243.A SG THR 187.A O no hydrogen 3.658 N/A CYS 243.A SG HIS 248.A ND1 no hydrogen 3.699 N/A HIS 244.A N THR 187.A O no hydrogen 2.845 N/A HIS 244.A N THR 187.A OG1 no hydrogen 3.221 N/A HIS 244.A ND1 HIS 244.A O no hydrogen 2.809 N/A SER 249.A N VAL 245.A O no hydrogen 3.074 N/A SER 249.A OG VAL 245.A O no hydrogen 3.478 N/A SER 249.A OG GLN 246.A O no hydrogen 3.013 N/A ASP 250.A N GLN 246.A O no hydrogen 3.063 N/A MET 251.A N HIS 248.A O no hydrogen 3.043 N/A GLY 252.A N SER 249.A O no hydrogen 2.847 N/A LEU 253.A N HIS 248.A O no hydrogen 3.197 N/A GLY 255.A N TYR 241.A O no hydrogen 2.846 N/A LEU 256.A N ASN 165.A OD1 no hydrogen 3.021 N/A PHE 257.A N TRP 239.A O no hydrogen 2.730 N/A LEU 258.A N PHE 166.A O no hydrogen 2.748 N/A VAL 259.A N GLY 237.A O no hydrogen 2.861 N/A LYS 260.A N ALA 168.A O no hydrogen 2.787 N/A LYS 260.A NZ GLU 167.A OE1 no hydrogen 3.311 N/A LYS 260.A NZ ALA 168.A O no hydrogen 3.550 N/A LYS 261.A N THR 265.A O no hydrogen 2.805 N/A GLY 264.A N LYS 261.A O no hydrogen 2.824 N/A THR 265.A N ASP 263.A OD1 no hydrogen 2.967 N/A THR 265.A OG1 ASP 263.A OD1 no hydrogen 2.553 N/A THR 265.A OG1 ASP 263.A OD2 no hydrogen 3.556 N/A