Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 2q6k_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): HIS 3.A N ALA 143.A O no hydrogen 2.928 N/A HIS 3.A ND1 MET 1.A O no hydrogen 2.716 N/A HIS 3.A NE2 GLY 89.A O no hydrogen 2.757 N/A LEU 5.A N HIS 64.A O no hydrogen 3.373 N/A ILE 6.A N THR 34.A O no hydrogen 2.795 N/A ALA 7.A N VAL 66.A O no hydrogen 2.879 N/A PHE 8.A N VAL 36.A O no hydrogen 2.895 N/A LEU 9.A N CYS 68.A O no hydrogen 2.900 N/A SER 10.A N THR 39.A O no hydrogen 3.110 N/A SER 10.A OG HIS 40.A ND1 no hydrogen 2.685 N/A VAL 12.A N SER 10.A OG no hydrogen 3.151 N/A GLY 13.A N HIS 40.A O no hydrogen 2.762 N/A GLU 17.A N GLU 17.A OE1 no hydrogen 2.724 N/A ALA 18.A N ASP 16.A OD1 no hydrogen 3.127 N/A LEU 21.A N GLU 17.A O no hydrogen 2.879 N/A CYS 22.A N ALA 18.A O no hydrogen 3.394 N/A CYS 22.A SG ALA 18.A O no hydrogen 3.689 N/A CYS 22.A SG TYR 70.A OH no hydrogen 3.269 N/A LYS 23.A N HIS 19.A O no hydrogen 3.331 N/A LYS 23.A NZ ASP 37.A OD1 no hydrogen 3.147 N/A LYS 23.A NZ ASP 37.A OD2 no hydrogen 2.806 N/A GLY 24.A N ALA 20.A O no hydrogen 2.838 N/A VAL 25.A N LEU 21.A O no hydrogen 3.016 N/A MET 26.A N CYS 22.A O no hydrogen 2.977 N/A TYR 27.A N LYS 23.A O no hydrogen 2.753 N/A GLY 28.A N GLY 24.A O no hydrogen 3.021 N/A VAL 29.A N VAL 25.A O no hydrogen 3.164 N/A ALA 30.A N MET 26.A O no hydrogen 2.811 N/A ALA 33.A N ALA 30.A O no hydrogen 3.082 N/A THR 34.A N ASN 4.A O.A no hydrogen 2.837 N/A THR 34.A N ASN 4.A O.B no hydrogen 2.641 N/A VAL 36.A N ILE 6.A O no hydrogen 2.850 N/A ILE 38.A N PHE 8.A O no hydrogen 2.734 N/A HIS 40.A ND1 SER 10.A OG no hydrogen 2.685 N/A HIS 40.A NE2 ASP 37.A OD1 no hydrogen 2.795 N/A ASP 41.A N THR 39.A OG1 no hydrogen 3.004 N/A ALA 43.A N GLU 49.A OE1 no hydrogen 2.804 N/A PHE 45.A N ASP 11.A OD2 no hydrogen 2.921 N/A ASP 46.A N ALA 43.A O no hydrogen 2.960 N/A VAL 47.A N PHE 45.A O no hydrogen 2.978 N/A ARG 48.A NH1 PRO 164.A O no hydrogen 2.889 N/A ARG 48.A NH2 PRO 164.A O no hydrogen 2.897 N/A GLU 49.A N ASP 46.A OD1 no hydrogen 3.040 N/A GLY 50.A N ASP 46.A O no hydrogen 3.067 N/A ALA 51.A N VAL 47.A O no hydrogen 2.814 N/A LEU 52.A N ARG 48.A O no hydrogen 2.927 N/A PHE 53.A N GLU 49.A O no hydrogen 2.998 N/A LEU 54.A N GLY 50.A O no hydrogen 3.125 N/A LEU 54.A N ALA 51.A O no hydrogen 3.236 N/A ALA 55.A N LEU 52.A O no hydrogen 3.215 N/A VAL 57.A N LEU 54.A O no hydrogen 3.024 N/A SER 60.A N ASP 56.A O no hydrogen 3.247 N/A SER 60.A OG ASP 56.A O no hydrogen 3.439 N/A SER 60.A OG ASP 56.A OD2.B no hydrogen 3.073 N/A PHE 61.A N VAL 57.A O no hydrogen 3.002 N/A THR 65.A OG1 PRO 62.A O no hydrogen 2.755 N/A VAL 66.A N LEU 5.A O no hydrogen 2.756 N/A ILE 67.A N LEU 91.A O no hydrogen 2.740 N/A CYS 68.A N ALA 7.A O no hydrogen 2.784 N/A CYS 68.A SG VAL 135.A O no hydrogen 3.971 N/A ALA 69.A N VAL 93.A O no hydrogen 2.973 N/A TYR 70.A N LEU 9.A O no hydrogen 2.970 N/A TYR 72.A OH THR 79.A O no hydrogen 2.815 N/A TYR 72.A OH THR 81.A OG1 no hydrogen 3.000 N/A GLU 74.A N GLU 74.A OE1 no hydrogen 2.772 N/A THR 75.A N TYR 72.A O no hydrogen 2.912 N/A THR 75.A OG1 PRO 127.A O no hydrogen 2.726 N/A THR 77.A N GLU 74.A O no hydrogen 3.151 N/A THR 77.A OG1 GLU 74.A O no hydrogen 2.583 N/A THR 79.A N THR 77.A OG1 no hydrogen 3.309 N/A THR 81.A OG1 TYR 72.A OH no hydrogen 3.000 N/A ILE 82.A N GLY 94.A O no hydrogen 2.788 N/A ALA 83.A N HIS 113.A O no hydrogen 2.843 N/A VAL 84.A N LEU 92.A O no hydrogen 2.797 N/A ARG 85.A N GLU 111.A O no hydrogen 2.915 N/A ARG 85.A NH1 GLU 111.A OE1 no hydrogen 3.124 N/A ASN 86.A N GLN 90.A O no hydrogen 2.971 N/A ASN 86.A ND2 GLN 90.A OE1 no hydrogen 2.912 N/A GLU 87.A N PRO 108.A O no hydrogen 3.028 N/A LYS 88.A N SER 107.A OG no hydrogen 3.173 N/A LYS 88.A NZ PRO 58.A O no hydrogen 2.969 N/A LYS 88.A NZ PHE 61.A O no hydrogen 2.876 N/A GLY 89.A N ASN 86.A O no hydrogen 3.008 N/A GLN 90.A N ASN 86.A OD1 no hydrogen 2.937 N/A GLN 90.A NE2 PRO 58.A O no hydrogen 2.952 N/A GLN 90.A NE2 PRO 62.A O no hydrogen 3.008 N/A LEU 91.A N THR 65.A O no hydrogen 3.080 N/A LEU 92.A N VAL 84.A O no hydrogen 2.782 N/A VAL 93.A N ILE 67.A O no hydrogen 2.864 N/A GLY 94.A N ILE 82.A O no hydrogen 3.113 N/A ASN 96.A N HIS 80.A O no hydrogen 2.821 N/A ASN 96.A ND2 GLN 159.A O no hydrogen 2.949 N/A ASN 97.A ND2 VAL 71.A O no hydrogen 2.863 N/A ASN 97.A ND2 GLU 74.A OE1 no hydrogen 2.940 N/A ASN 97.A ND2 GLU 74.A OE2 no hydrogen 3.488 N/A LEU 99.A N ASN 97.A OD1 no hydrogen 3.075 N/A SER 101.A N GLY 98.A O no hydrogen 3.022 N/A SER 101.A OG GLY 98.A O no hydrogen 2.559 N/A LEU 104.A N LEU 100.A O no hydrogen 2.930 N/A ASP 105.A N SER 101.A O no hydrogen 3.000 N/A ALA 106.A N PHE 102.A O no hydrogen 3.235 N/A SER 107.A N ALA 103.A O no hydrogen 3.134 N/A VAL 110.A N ARG 85.A O no hydrogen 2.800 N/A GLU 111.A N ARG 85.A O no hydrogen 3.384 N/A CYS 112.A SG.A ALA 83.A O no hydrogen 3.870 N/A CYS 112.A SG.A HIS 113.A O no hydrogen 4.033 N/A HIS 113.A N ALA 83.A O no hydrogen 2.881 N/A HIS 113.A ND1 GLY 152.A O no hydrogen 2.811 N/A HIS 113.A NE2 GLU 111.A OE2 no hydrogen 2.718 N/A GLU 114.A N PRO 153.A O no hydrogen 2.909 N/A VAL 115.A N THR 81.A O no hydrogen 2.826 N/A LEU 116.A N VAL 151.A O no hydrogen 2.831 N/A SER 117.A N VAL 151.A O no hydrogen 2.906 N/A ASP 119.A N SER 117.A OG no hydrogen 3.266 N/A VAL 120.A N SER 117.A O no hydrogen 3.273 N/A MET 121.A N PRO 118.A O no hydrogen 3.063 N/A ASN 122.A N ASP 133.A O no hydrogen 2.790 N/A ASN 122.A ND2 ASP 133.A OD2 no hydrogen 2.958 N/A GLN 123.A NE2 PRO 118.A O no hydrogen 3.163 N/A THR 126.A N ASP 133.A OD1 no hydrogen 2.990 N/A THR 126.A OG1.A ASP 133.A OD1 no hydrogen 3.392 N/A THR 126.A OG1.B ASP 133.A OD1 no hydrogen 3.039 N/A TRP 129.A N THR 126.A O no hydrogen 2.965 N/A TRP 129.A NE1 TYR 70.A OH no hydrogen 3.161 N/A TYR 130.A N THR 75.A OG1 no hydrogen 2.967 N/A LYS 132.A N TRP 129.A O no hydrogen 3.174 N/A LYS 132.A NZ ASP 133.A OD2 no hydrogen 2.715 N/A ASP 133.A N TRP 129.A O no hydrogen 3.077 N/A ILE 134.A N TYR 130.A O no hydrogen 2.893 N/A VAL 135.A N TYR 130.A O no hydrogen 2.940 N/A ALA 136.A N GLY 131.A O no hydrogen 2.880 N/A ALA 137.A N LYS 132.A O no hydrogen 3.230 N/A CYS 138.A N ILE 134.A O no hydrogen 2.898 N/A ALA 139.A N VAL 135.A O no hydrogen 2.979 N/A ALA 140.A N ALA 136.A O no hydrogen 3.019 N/A HIS 141.A N ALA 137.A O no hydrogen 3.047 N/A LEU 142.A N CYS 138.A O no hydrogen 2.946 N/A ALA 143.A N ALA 139.A O no hydrogen 2.878 N/A ALA 144.A N ALA 140.A O no hydrogen 2.891 N/A GLY 145.A N LEU 142.A O no hydrogen 3.005 N/A THR 146.A N HIS 141.A O no hydrogen 2.978 N/A THR 146.A OG1 HIS 141.A O no hydrogen 2.955 N/A ALA 149.A N ASP 147.A OD1 no hydrogen 3.319 N/A ALA 150.A N ASP 147.A O no hydrogen 2.954 N/A VAL 151.A N LEU 148.A O no hydrogen 3.170 N/A ILE 155.A N CYS 112.A O.A no hydrogen 2.891 N/A ILE 155.A N CYS 112.A O.B no hydrogen 2.897 N/A ASP 156.A N.A GLN 159.A OE1 no hydrogen 2.869 N/A ASP 156.A N.B GLN 159.A OE1 no hydrogen 2.867 N/A LYS 158.A N ASP 156.A OD2.B no hydrogen 2.890 N/A GLN 159.A N ASP 156.A O.A no hydrogen 2.807 N/A GLN 159.A N ASP 156.A O.B no hydrogen 2.821 N/A ILE 160.A N PRO 157.A O no hydrogen 2.997 N/A VAL 161.A N ASN 96.A OD1 no hydrogen 2.806 N/A ARG 162.A NH2 ASP 105.A OD2 no hydrogen 2.867 N/A LEU 163.A N SER 101.A OG no hydrogen 2.944 N/A SER 169.A N ARG 171.A O no hydrogen 3.001 N/A ARG 171.A N SER 169.A O no hydrogen 2.755 N/A GLY 172.A N ILE 253.A O no hydrogen 2.808 N/A GLU 173.A N ASN 187.A OD1 no hydrogen 2.825 N/A VAL 174.A N ASP 251.A O no hydrogen 2.911 N/A VAL 175.A N TRP 185.A O no hydrogen 2.814 N/A ARG 176.A N TRP 185.A O no hydrogen 3.421 N/A ASP 178.A N ASN 183.A O no hydrogen 2.935 N/A PHE 181.A N ASP 178.A O no hydrogen 3.042 N/A GLY 182.A N ASP 178.A O no hydrogen 2.590 N/A VAL 184.A N LEU 234.A O no hydrogen 2.780 N/A TRP 185.A N ARG 176.A O no hydrogen 2.942 N/A THR 186.A N LEU 232.A O no hydrogen 2.988 N/A THR 186.A OG1 LEU 232.A O no hydrogen 2.734 N/A ASN 187.A N GLU 173.A O no hydrogen 3.188 N/A ASN 187.A ND2 ALA 166.A O no hydrogen 2.880 N/A ILE 188.A N THR 186.A OG1 no hydrogen 3.085 N/A THR 190.A N GLY 230.A O no hydrogen 2.993 N/A THR 190.A OG1 GLY 230.A O no hydrogen 3.111 N/A LEU 192.A N PRO 189.A O no hydrogen 3.424 N/A LEU 196.A N LEU 208.A O no hydrogen 2.894 N/A GLU 197.A N SER 256.A O no hydrogen 2.774 N/A VAL 198.A N LEU 206.A O no hydrogen 2.853 N/A LYS 199.A N THR 254.A O no hydrogen 2.791 N/A LYS 199.A NZ ASP 203.A OD1 no hydrogen 2.768 N/A ILE 200.A N THR 204.A O no hydrogen 2.835 N/A THR 204.A N ILE 200.A O no hydrogen 3.254 N/A THR 204.A OG1 LEU 201.A O no hydrogen 2.615 N/A LEU 206.A N VAL 198.A O no hydrogen 2.896 N/A LEU 208.A N LEU 196.A O no hydrogen 2.922 N/A CYS 211.A N LEU 224.A O no hydrogen 2.747 N/A CYS 211.A SG PRO 209.A O no hydrogen 3.881 N/A LYS 212.A N GLU 216.A OE1 no hydrogen 2.962 N/A GLU 216.A N THR 213.A O no hydrogen 3.300 N/A VAL 217.A N PHE 214.A O no hydrogen 3.512 N/A GLY 220.A N ASN 237.A O no hydrogen 2.704 N/A GLN 221.A N ASP 218.A O no hydrogen 3.074 N/A LEU 223.A N GLY 235.A O no hydrogen 2.875 N/A LEU 224.A N PRO 209.A O no hydrogen 2.939 N/A TYR 225.A N ALA 233.A O no hydrogen 3.024 N/A ASN 227.A N ARG 231.A O no hydrogen 2.770 N/A ARG 229.A N ASN 227.A OD1 no hydrogen 3.273 N/A GLY 230.A N ASN 227.A O no hydrogen 3.301 N/A ARG 231.A N ASN 227.A OD1 no hydrogen 3.157 N/A LEU 232.A N ILE 188.A O no hydrogen 2.778 N/A ALA 233.A N TYR 225.A O no hydrogen 2.649 N/A LEU 234.A N VAL 184.A O no hydrogen 2.842 N/A GLY 235.A N LEU 223.A O no hydrogen 3.198 N/A ASN 237.A N GLN 221.A O no hydrogen 3.005 N/A ASN 237.A ND2 VAL 217.A O no hydrogen 2.733 N/A SER 239.A N LEU 236.A O no hydrogen 3.303 N/A ASN 240.A N SER 239.A OG no hydrogen 2.831 N/A GLU 243.A N ASN 240.A O no hydrogen 3.222 N/A GLU 243.A N ASN 240.A OD1 no hydrogen 3.182 N/A LYS 244.A N PHE 241.A O no hydrogen 3.011 N/A TRP 245.A N PHE 241.A O no hydrogen 2.782 N/A VAL 247.A N TRP 245.A O no hydrogen 2.801 N/A VAL 248.A N ASP 251.A OD2 no hydrogen 2.953 N/A GLY 250.A N VAL 174.A O no hydrogen 2.829 N/A ASP 251.A N VAL 248.A O no hydrogen 3.195 N/A ILE 253.A N GLY 172.A O no hydrogen 2.895 N/A THR 254.A N LYS 199.A O no hydrogen 2.972 N/A VAL 255.A N ILE 170.A O no hydrogen 2.861 N/A SER 256.A N GLU 197.A O no hydrogen 2.892 N/A