Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3u7j_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): MET 2.A N GLU 221.A OE1 no hydrogen 3.027 N/A THR 3.A N GLU 6.A OE1 no hydrogen 2.733 N/A THR 3.A OG1 GLU 6.A OE1 no hydrogen 3.221 N/A GLN 4.A NE2 ASP 123.A OD2 no hydrogen 3.002 N/A GLU 6.A N THR 3.A OG1 no hydrogen 3.125 N/A LEU 7.A N THR 3.A O no hydrogen 2.979 N/A LYS 8.A N GLN 4.A O no hydrogen 2.855 N/A LYS 8.A NZ SER 35.A OG no hydrogen 2.723 N/A ARG 9.A N ASP 5.A O no hydrogen 3.039 N/A LEU 10.A N GLU 6.A O no hydrogen 3.032 N/A VAL 11.A N LEU 7.A O no hydrogen 2.995 N/A GLY 12.A N LYS 8.A O no hydrogen 2.943 N/A GLU 13.A N ARG 9.A O no hydrogen 2.876 N/A ALA 14.A N LEU 10.A O no hydrogen 2.984 N/A ALA 15.A N VAL 11.A O no hydrogen 2.820 N/A ALA 16.A N GLY 12.A O no hydrogen 3.056 N/A ARG 17.A N GLU 13.A O no hydrogen 2.991 N/A TYR 18.A N ALA 14.A O no hydrogen 2.856 N/A VAL 19.A N ALA 15.A O no hydrogen 2.886 N/A THR 20.A N ALA 16.A O no hydrogen 3.023 N/A THR 20.A OG1 ALA 16.A O no hydrogen 3.511 N/A THR 20.A OG1 ARG 17.A O no hydrogen 3.243 N/A ASP 21.A N ARG 17.A O no hydrogen 2.878 N/A ASN 22.A N TYR 18.A O no hydrogen 2.951 N/A ASN 22.A N VAL 19.A O no hydrogen 3.270 N/A ASN 22.A ND2 TYR 18.A O no hydrogen 2.868 N/A VAL 23.A N VAL 19.A O no hydrogen 2.745 N/A GLY 26.A N ARG 50.A O no hydrogen 2.761 N/A ALA 27.A N PRO 24.A O no hydrogen 3.257 N/A ILE 29.A N GLY 53.A O no hydrogen 2.865 N/A GLY 30.A N VAL 83.A O no hydrogen 3.047 N/A VAL 31.A N VAL 55.A O no hydrogen 2.896 N/A GLY 32.A N VAL 85.A O no hydrogen 2.719 N/A THR 33.A N ASP 86.A OD1 no hydrogen 2.909 N/A THR 33.A OG1 SER 57.A OG no hydrogen 2.734 N/A THR 33.A OG1 SER 58.A OG no hydrogen 2.696 N/A THR 33.A OG1 THR 61.A OG1 no hydrogen 3.228 N/A ASN 38.A N GLY 34.A O no hydrogen 2.841 N/A CYS 39.A N SER 35.A O no hydrogen 3.280 N/A CYS 39.A N THR 36.A O no hydrogen 2.969 N/A CYS 39.A SG SER 35.A O no hydrogen 3.588 N/A PHE 40.A N THR 36.A O no hydrogen 3.237 N/A ILE 41.A N ALA 37.A O no hydrogen 2.843 N/A ASP 42.A N ASN 38.A O no hydrogen 3.006 N/A ALA 43.A N CYS 39.A O no hydrogen 3.018 N/A LEU 44.A N PHE 40.A O no hydrogen 2.791 N/A ALA 45.A N ILE 41.A O no hydrogen 2.940 N/A ALA 46.A N ALA 43.A O no hydrogen 3.254 N/A VAL 47.A N LEU 44.A O no hydrogen 2.926 N/A LYS 48.A N ALA 45.A O no hydrogen 3.275 N/A LYS 48.A NZ HIS 68.A O no hydrogen 2.569 N/A ARG 50.A N VAL 47.A O no hydrogen 3.011 N/A TYR 51.A N LYS 48.A O no hydrogen 3.123 N/A TYR 51.A OH VAL 23.A O no hydrogen 2.776 N/A ARG 52.A N ALA 27.A O no hydrogen 2.838 N/A ALA 54.A N ARG 71.A O no hydrogen 2.834 N/A VAL 55.A N ILE 29.A O no hydrogen 2.887 N/A SER 56.A OG SER 58.A O no hydrogen 2.737 N/A SER 56.A OG THR 62.A OG1 no hydrogen 2.819 N/A SER 57.A N VAL 31.A O no hydrogen 3.134 N/A SER 57.A OG VAL 31.A O no hydrogen 2.775 N/A SER 57.A OG THR 33.A OG1 no hydrogen 2.734 N/A SER 57.A OG TYR 84.A OH no hydrogen 3.386 N/A SER 58.A N SER 56.A OG no hydrogen 3.205 N/A SER 58.A OG THR 33.A OG1 no hydrogen 2.696 N/A SER 58.A OG THR 61.A OG1 no hydrogen 3.107 N/A THR 61.A N SER 58.A OG no hydrogen 2.943 N/A THR 61.A OG1 GLY 32.A O no hydrogen 2.617 N/A THR 61.A OG1 THR 33.A OG1 no hydrogen 3.228 N/A THR 61.A OG1 SER 58.A OG no hydrogen 3.107 N/A THR 62.A N SER 58.A O no hydrogen 2.935 N/A THR 62.A OG1 SER 56.A OG no hydrogen 2.819 N/A THR 62.A OG1 SER 58.A O no hydrogen 2.981 N/A GLU 63.A N VAL 59.A O no hydrogen 2.922 N/A ARG 64.A N ALA 60.A O no hydrogen 3.063 N/A ARG 64.A NE ASP 42.A OD1 no hydrogen 2.878 N/A ARG 64.A NH1 ASP 42.A OD1 no hydrogen 3.390 N/A ARG 64.A NH1 ASP 42.A OD2 no hydrogen 2.842 N/A LEU 65.A N THR 61.A O no hydrogen 2.812 N/A LYS 66.A N THR 62.A O no hydrogen 2.917 N/A SER 67.A N GLU 63.A O no hydrogen 2.943 N/A SER 67.A OG ARG 64.A O no hydrogen 2.613 N/A HIS 68.A N LEU 65.A O no hydrogen 2.959 N/A HIS 68.A NE2 ASP 42.A OD1 no hydrogen 2.846 N/A GLY 69.A N LYS 66.A O no hydrogen 2.924 N/A ILE 70.A N LEU 65.A O no hydrogen 3.069 N/A PHE 73.A N ALA 54.A O no hydrogen 2.782 N/A ASP 74.A N GLU 77.A OE2 no hydrogen 3.153 N/A ASN 76.A N ASP 74.A OD2 no hydrogen 2.914 N/A ASN 76.A ND2 ASP 74.A OD2 no hydrogen 3.065 N/A GLU 77.A N ASP 74.A O no hydrogen 2.828 N/A ILE 78.A N LEU 75.A O no hydrogen 2.890 N/A GLN 82.A NE2 ASN 22.A O no hydrogen 2.864 N/A TYR 84.A N THR 117.A O no hydrogen 2.843 N/A TYR 84.A OH ASP 86.A OD2 no hydrogen 2.714 N/A VAL 85.A N GLY 30.A O no hydrogen 3.065 N/A ASP 86.A N VAL 119.A O no hydrogen 3.081 N/A GLY 87.A N ASP 86.A OD1 no hydrogen 2.787 N/A ASP 89.A N ILE 98.A O no hydrogen 2.863 N/A GLU 90.A N ILE 98.A O no hydrogen 3.234 N/A ILE 91.A N LYS 126.A O no hydrogen 2.907 N/A ASP 92.A N ALA 96.A O no hydrogen 2.989 N/A SER 94.A N ASP 92.A OD1 no hydrogen 2.917 N/A SER 94.A OG ASP 92.A OD1 no hydrogen 2.667 N/A GLY 95.A N ASP 92.A O no hydrogen 3.048 N/A ALA 96.A N ASP 92.A OD1 no hydrogen 3.219 N/A ALA 96.A N SER 94.A OG no hydrogen 3.331 N/A MET 97.A N PHE 208.A O no hydrogen 3.032 N/A ILE 98.A N GLU 90.A O no hydrogen 2.992 N/A LYS 99.A N GLY 206.A O no hydrogen 2.903 N/A LYS 99.A NZ ASP 86.A OD2 no hydrogen 2.734 N/A LYS 99.A NZ GLY 87.A O no hydrogen 2.729 N/A LYS 99.A NZ GLU 108.A OE1 no hydrogen 3.212 N/A GLY 101.A N ASP 89.A OD2 no hydrogen 2.865 N/A GLY 103.A N GLY 100.A O no hydrogen 2.755 N/A THR 106.A OG1 GLU 139.A OE1 no hydrogen 2.656 N/A THR 106.A OG1 THR 204.A OG1 no hydrogen 2.623 N/A ARG 107.A NH2 SER 56.A O no hydrogen 2.986 N/A GLU 108.A N ALA 104.A O no hydrogen 3.149 N/A LYS 109.A N LEU 105.A O no hydrogen 2.984 N/A LYS 109.A NZ GLU 193.A OE2 no hydrogen 2.767 N/A LYS 109.A NZ VAL 205.A O no hydrogen 2.808 N/A LYS 109.A NZ LEU 207.A O no hydrogen 2.896 N/A ILE 110.A N THR 106.A O no hydrogen 2.986 N/A VAL 111.A N ARG 107.A O no hydrogen 2.940 N/A ALA 112.A N GLU 108.A O no hydrogen 2.899 N/A SER 113.A N LYS 109.A O no hydrogen 2.929 N/A SER 113.A OG ILE 110.A O no hydrogen 2.591 N/A VAL 114.A N VAL 111.A O no hydrogen 3.017 N/A ALA 115.A N VAL 111.A O no hydrogen 3.149 N/A GLU 116.A N LEU 81.A O no hydrogen 2.850 N/A THR 117.A N GLN 82.A O no hydrogen 2.838 N/A PHE 118.A N ASP 214.A OD2 no hydrogen 2.828 N/A VAL 119.A N TYR 84.A O no hydrogen 2.802 N/A CYS 120.A N LEU 215.A O no hydrogen 2.796 N/A ILE 121.A N ASP 86.A O no hydrogen 2.883 N/A ALA 122.A N LEU 217.A O no hydrogen 3.229 N/A ALA 124.A N GLY 219.A O no hydrogen 2.829 N/A SER 125.A N ASP 123.A OD1 no hydrogen 2.993 N/A SER 125.A OG ASP 123.A OD1 no hydrogen 2.461 N/A LYS 126.A N ASP 123.A O no hydrogen 3.047 N/A LYS 126.A NZ ALA 88.A O no hydrogen 2.921 N/A ARG 127.A N ALA 124.A O no hydrogen 3.319 N/A ARG 127.A NE GLU 93.A OE2 no hydrogen 2.919 N/A ARG 127.A NH1 GLU 225.A OE1 no hydrogen 3.504 N/A VAL 128.A N ILE 91.A O no hydrogen 2.999 N/A GLY 132.A N GLU 90.A OE1 no hydrogen 3.020 N/A PHE 134.A N GLU 90.A OE2 no hydrogen 3.005 N/A LEU 136.A N VAL 181.A O no hydrogen 2.865 N/A VAL 138.A N LEU 179.A O no hydrogen 2.739 N/A GLU 139.A N THR 204.A O no hydrogen 2.850 N/A VAL 140.A N GLU 177.A O no hydrogen 2.838 N/A VAL 141.A N GLY 201.A O no hydrogen 2.813 N/A ALA 144.A N VAL 141.A O no hydrogen 2.887 N/A ARG 145.A N PRO 142.A O no hydrogen 3.012 N/A ILE 148.A N ALA 144.A O no hydrogen 2.939 N/A GLY 149.A N ARG 145.A O no hydrogen 2.979 N/A ARG 150.A N THR 146.A O no hydrogen 2.799 N/A ARG 151.A N ALA 147.A O no hydrogen 3.155 N/A LEU 152.A N ILE 148.A O no hydrogen 2.872 N/A ALA 153.A N GLY 149.A O no hydrogen 2.843 N/A ALA 154.A N ARG 150.A O no hydrogen 3.043 N/A LEU 155.A N LEU 152.A O no hydrogen 2.945 N/A GLY 156.A N ALA 153.A O no hydrogen 2.808 N/A GLY 157.A N LEU 152.A O no hydrogen 3.057 N/A VAL 158.A N LYS 182.A O no hydrogen 2.822 N/A VAL 160.A N ASP 180.A O no hydrogen 2.905 N/A ARG 162.A N ILE 178.A O no hydrogen 2.777 N/A ARG 162.A NE ASP 180.A OD2 no hydrogen 2.945 N/A ARG 162.A NH1 GLY 100.A O no hydrogen 3.470 N/A ARG 162.A NH2 GLY 100.A O no hydrogen 3.070 N/A ARG 162.A NH2 ASP 180.A OD1 no hydrogen 2.809 N/A ARG 162.A NH2 ASP 180.A OD2 no hydrogen 3.522 N/A LYS 164.A N THR 168.A O no hydrogen 2.893 N/A LYS 164.A NZ THR 168.A OG1 no hydrogen 3.209 N/A GLY 167.A N LYS 164.A O no hydrogen 2.955 N/A THR 168.A N ASP 166.A OD1 no hydrogen 2.880 N/A THR 168.A OG1 ASP 166.A OD1 no hydrogen 2.539 N/A THR 168.A OG1 ASP 166.A OD2 no hydrogen 3.339 N/A TYR 170.A N ARG 162.A O no hydrogen 2.921 N/A THR 172.A N ASN 176.A O no hydrogen 2.704 N/A THR 172.A OG1 GLU 139.A OE2 no hydrogen 2.865 N/A THR 172.A OG1 ASN 176.A O no hydrogen 3.522 N/A ASP 173.A N ASP 173.A OD1 no hydrogen 2.293 N/A ASN 174.A N THR 172.A OG1 no hydrogen 3.334 N/A GLY 175.A N THR 172.A O no hydrogen 2.737 N/A ASN 176.A N THR 172.A OG1 no hydrogen 3.372 N/A ASN 176.A ND2 GLU 139.A OE2 no hydrogen 3.340 N/A GLU 177.A N VAL 140.A O no hydrogen 3.038 N/A LEU 179.A N VAL 138.A O no hydrogen 2.831 N/A ASP 180.A N VAL 160.A O no hydrogen 2.826 N/A VAL 181.A N LEU 136.A O no hydrogen 2.805 N/A LYS 182.A N VAL 158.A O no hydrogen 3.021 N/A ARG 185.A NH1.A LEU 184.A O no hydrogen 2.853 N/A ILE 186.A N LEU 131.A O no hydrogen 2.801 N/A ASP 187.A N ARG 185.A O no hydrogen 3.090 N/A ALA 191.A N ASP 188.A OD1 no hydrogen 3.171 N/A LEU 192.A N ASP 188.A O no hydrogen 2.997 N/A GLU 193.A N PRO 189.A O no hydrogen 2.809 N/A ALA 194.A N ARG 190.A O no hydrogen 3.055 N/A ALA 195.A N ALA 191.A O no hydrogen 3.056 N/A ILE 196.A N LEU 192.A O no hydrogen 2.945 N/A ASN 197.A N GLU 193.A O no hydrogen 2.862 N/A GLY 198.A N ALA 194.A O no hydrogen 3.186 N/A GLY 198.A N ALA 195.A O no hydrogen 3.112 N/A TRP 199.A N ILE 196.A O no hydrogen 3.010 N/A VAL 202.A N TRP 199.A O no hydrogen 3.034 N/A VAL 203.A N GLU 139.A O no hydrogen 2.781 N/A THR 204.A N GLU 139.A O no hydrogen 3.434 N/A THR 204.A OG1 THR 106.A OG1 no hydrogen 2.623 N/A GLY 206.A N PRO 137.A O no hydrogen 2.912 N/A PHE 208.A N MET 97.A O no hydrogen 2.805 N/A ALA 209.A N GLU 193.A OE1 no hydrogen 3.023 N/A GLN 210.A N GLU 193.A OE1 no hydrogen 2.753 N/A ARG 211.A NE ALA 112.A O no hydrogen 2.927 N/A ARG 211.A NH1 GLY 212.A O no hydrogen 2.880 N/A ARG 211.A NH1 ASP 214.A OD2 no hydrogen 2.743 N/A ARG 211.A NH2 ALA 115.A O no hydrogen 2.898 N/A ARG 211.A NH2 GLU 116.A O no hydrogen 3.038 N/A ARG 211.A NH2 ASP 214.A OD2 no hydrogen 3.088 N/A ALA 213.A N GLY 95.A O no hydrogen 2.890 N/A ASP 214.A N PHE 118.A O no hydrogen 2.939 N/A LEU 215.A N PHE 118.A O no hydrogen 3.246 N/A CYS 216.A N LEU 227.A O no hydrogen 2.801 N/A CYS 216.A SG CYS 120.A O no hydrogen 3.613 N/A LEU 217.A N CYS 120.A O no hydrogen 2.831 N/A LEU 218.A N GLU 225.A O no hydrogen 2.854 N/A GLY 219.A N ALA 122.A O no hydrogen 2.809 N/A THR 220.A N GLY 223.A O no hydrogen 2.929 N/A THR 220.A OG1 GLY 223.A O no hydrogen 2.681 N/A HIS 222.A N THR 220.A OG1 no hydrogen 2.935 N/A HIS 222.A NE2 GLU 225.A OE2 no hydrogen 2.552 N/A GLY 223.A N THR 220.A O no hydrogen 2.852 N/A GLU 225.A N LEU 218.A O no hydrogen 2.849 N/A LEU 227.A N CYS 216.A O no hydrogen 2.811 N/A TYR 229.A N ASP 214.A O no hydrogen 3.092 N/A