Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3k9c_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ARG 1.A NE GLU 54.A OE1 no hydrogen 3.290 N/A ARG 1.A NE GLU 54.A OE2 no hydrogen 2.996 N/A ARG 1.A NH2 GLU 54.A OE1 no hydrogen 2.821 N/A LEU 3.A N ASP 31.A O no hydrogen 2.909 N/A GLY 4.A N ALA 55.A O no hydrogen 2.896 N/A VAL 6.A N ILE 57.A O no hydrogen 3.000 N/A GLU 8.A N HIS 14.A ND1 no hydrogen 2.818 N/A LEU 9.A N VAL 36.A O no hydrogen 3.063 N/A GLN 11.A N GLU 8.A O no hydrogen 3.170 N/A GLY 15.A N GLN 11.A O no hydrogen 2.974 N/A ASP 16.A N PRO 12.A O no hydrogen 3.073 N/A LEU 17.A N PHE 13.A O no hydrogen 2.993 N/A VAL 18.A N HIS 14.A O no hydrogen 2.784 N/A GLU 19.A N GLY 15.A O no hydrogen 3.035 N/A GLN 20.A N ASP 16.A O no hydrogen 3.028 N/A ILE 21.A N LEU 17.A O no hydrogen 2.763 N/A TYR 22.A N VAL 18.A O no hydrogen 2.974 N/A ALA 23.A N GLU 19.A O no hydrogen 3.378 N/A ALA 24.A N GLN 20.A O no hydrogen 2.963 N/A ALA 25.A N ILE 21.A O no hydrogen 2.793 N/A THR 26.A N TYR 22.A O no hydrogen 3.012 N/A THR 26.A OG1 TYR 22.A O no hydrogen 3.003 N/A ARG 27.A N ALA 23.A O no hydrogen 3.024 N/A ARG 28.A N ALA 24.A O no hydrogen 3.082 N/A ARG 28.A N ALA 25.A O no hydrogen 3.031 N/A ARG 28.A NE ASP 230.A OD1 no hydrogen 2.781 N/A ARG 28.A NH2 ASP 230.A OD2 no hydrogen 3.215 N/A GLY 29.A N THR 26.A O no hydrogen 2.949 N/A TYR 30.A N ALA 25.A O no hydrogen 2.757 N/A ASP 31.A N ARG 1.A O no hydrogen 3.056 N/A SER 34.A N VAL 5.A O no hydrogen 2.927 N/A SER 34.A OG ALA 45.A O no hydrogen 2.689 N/A VAL 36.A N PHE 7.A O no hydrogen 2.838 N/A ALA 37.A N ARG 40.A O no hydrogen 3.001 N/A ARG 40.A N ALA 37.A O no hydrogen 2.899 N/A ARG 40.A NH1 SER 34.A OG no hydrogen 2.936 N/A ARG 40.A NH1 ALA 35.A O no hydrogen 2.724 N/A ALA 45.A N ALA 41.A O no hydrogen 3.049 N/A VAL 46.A N GLU 42.A O no hydrogen 2.825 N/A GLN 47.A N LYS 43.A O no hydrogen 2.904 N/A ALA 48.A N VAL 44.A O no hydrogen 2.937 N/A ALA 48.A N ALA 45.A O no hydrogen 3.187 N/A LEU 49.A N VAL 46.A O no hydrogen 3.101 N/A GLU 51.A N LEU 49.A O no hydrogen 3.049 N/A CYS 53.A SG LEU 49.A O no hydrogen 3.585 N/A GLU 54.A N LEU 2.A O no hydrogen 2.961 N/A ALA 56.A N PRO 76.A O no hydrogen 3.054 N/A ILE 57.A N GLY 4.A O no hydrogen 2.717 N/A LEU 58.A N LEU 78.A O no hydrogen 2.973 N/A LEU 59.A N VAL 6.A O no hydrogen 3.005 N/A GLY 60.A N VAL 80.A O no hydrogen 2.790 N/A THR 61.A OG1 GLU 42.A OE2 no hydrogen 2.535 N/A ARG 62.A N GLU 42.A OE1 no hydrogen 2.990 N/A PHE 63.A N THR 61.A OG1 no hydrogen 2.995 N/A ASP 64.A N GLU 67.A OE1 no hydrogen 2.474 N/A GLU 67.A N ASP 64.A OD1 no hydrogen 2.603 N/A LEU 68.A N ASP 64.A O no hydrogen 2.887 N/A GLY 69.A N THR 65.A O no hydrogen 2.918 N/A ALA 70.A N ASP 66.A O no hydrogen 2.853 N/A LEU 71.A N GLU 67.A O no hydrogen 3.053 N/A ALA 72.A N LEU 68.A O no hydrogen 2.735 N/A ASP 73.A N GLY 69.A O no hydrogen 2.917 N/A ARG 74.A N LEU 71.A O no hydrogen 2.839 N/A VAL 75.A N LEU 71.A O no hydrogen 3.031 N/A LEU 78.A N ALA 56.A O no hydrogen 3.000 N/A VAL 79.A N GLY 90.A O no hydrogen 2.820 N/A VAL 80.A N LEU 58.A O no hydrogen 2.832 N/A ALA 81.A N VAL 92.A O no hydrogen 2.976 N/A ARG 82.A NE ALA 83.A O no hydrogen 2.725 N/A ARG 82.A NH1 THR 61.A O no hydrogen 2.718 N/A ARG 82.A NH1 PHE 63.A O no hydrogen 3.203 N/A ARG 82.A NH2 ALA 83.A O no hydrogen 3.099 N/A SER 84.A OG LEU 86.A O no hydrogen 2.835 N/A SER 84.A OG VAL 89.A O no hydrogen 2.517 N/A LEU 86.A N SER 84.A OG no hydrogen 3.313 N/A VAL 89.A N LEU 86.A O no hydrogen 3.222 N/A GLY 90.A N ALA 77.A O no hydrogen 3.135 N/A ALA 91.A N VAL 242.A O no hydrogen 2.820 N/A VAL 92.A N VAL 79.A O no hydrogen 3.000 N/A ARG 93.A N LEU 244.A O no hydrogen 3.023 N/A ARG 93.A NH1 ASP 243.A OD1 no hydrogen 3.417 N/A ASP 95.A N LEU 246.A O no hydrogen 2.838 N/A ALA 98.A N ASP 95.A OD1 no hydrogen 3.134 N/A GLY 99.A N ASP 95.A O no hydrogen 2.836 N/A ILE 100.A N ASP 96.A O no hydrogen 3.042 N/A THR 101.A N VAL 97.A O no hydrogen 3.172 N/A THR 101.A OG1 VAL 97.A O no hydrogen 2.672 N/A LEU 102.A N ALA 98.A O no hydrogen 3.010 N/A ALA 103.A N GLY 99.A O no hydrogen 3.277 N/A VAL 104.A N ILE 100.A O no hydrogen 2.943 N/A ASP 105.A N THR 101.A O no hydrogen 2.815 N/A HIS 106.A N LEU 102.A O no hydrogen 2.865 N/A HIS 106.A NE2 THR 256.A OG1 no hydrogen 2.775 N/A LEU 107.A N ALA 103.A O no hydrogen 2.974 N/A THR 108.A N VAL 104.A O no hydrogen 2.772 N/A THR 108.A OG1 VAL 104.A O no hydrogen 3.317 N/A THR 108.A OG1 ASP 105.A O no hydrogen 3.096 N/A THR 108.A OG1 HIS 139.A NE2 no hydrogen 3.043 N/A GLU 109.A N ASP 105.A O no hydrogen 2.964 N/A LEU 110.A N LEU 107.A O no hydrogen 2.988 N/A GLY 111.A N THR 108.A O no hydrogen 2.943 N/A HIS 112.A N LEU 107.A O no hydrogen 3.140 N/A HIS 112.A ND1 THR 170.A OG1 no hydrogen 2.669 N/A HIS 112.A NE2 GLY 257.A O no hydrogen 2.859 N/A ARG 113.A NH1 THR 108.A O no hydrogen 3.131 N/A ARG 113.A NH1 HIS 112.A O no hydrogen 2.967 N/A ILE 115.A N SER 144.A O no hydrogen 3.284 N/A ALA 116.A N ALA 171.A O no hydrogen 2.922 N/A HIS 117.A N THR 146.A O no hydrogen 2.726 N/A HIS 117.A ND1 VAL 173.A O no hydrogen 2.696 N/A ILE 118.A N VAL 173.A O no hydrogen 3.041 N/A ASP 119.A N VAL 148.A O no hydrogen 3.076 N/A ALA 121.A N ASP 119.A OD1 no hydrogen 2.647 N/A ALA 123.A N GLY 120.A O no hydrogen 2.929 N/A GLY 126.A N ALA 123.A O no hydrogen 2.765 N/A ARG 129.A N GLY 125.A O no hydrogen 3.204 N/A ARG 129.A NE ASP 96.A OD1 no hydrogen 3.205 N/A ARG 129.A NH1 PHE 175.A O no hydrogen 2.738 N/A ARG 129.A NH2 ASP 96.A OD1 no hydrogen 3.040 N/A ARG 130.A N GLY 126.A O no hydrogen 3.053 N/A ARG 130.A NE ASP 119.A OD2 no hydrogen 3.100 N/A ARG 130.A NH2 ALA 121.A O no hydrogen 2.718 N/A ALA 131.A N ALA 127.A O no hydrogen 2.929 N/A GLY 132.A N ASP 128.A O no hydrogen 2.644 N/A PHE 133.A N ARG 129.A O no hydrogen 2.719 N/A LEU 134.A N ARG 130.A O no hydrogen 3.157 N/A ALA 135.A N ALA 131.A O no hydrogen 3.027 N/A ALA 136.A N GLY 132.A O no hydrogen 2.808 N/A ARG 138.A N ALA 135.A O no hydrogen 2.921 N/A HIS 139.A N ALA 136.A O no hydrogen 3.305 N/A HIS 139.A ND1 ALA 136.A O no hydrogen 3.293 N/A GLY 140.A N ASP 137.A O no hydrogen 2.623 N/A SER 142.A OG ASP 137.A OD1 no hydrogen 2.574 N/A SER 144.A N LEU 141.A O no hydrogen 2.816 N/A SER 144.A OG ARG 113.A O no hydrogen 2.709 N/A SER 144.A OG LEU 141.A O no hydrogen 3.431 N/A THR 146.A N ILE 115.A O no hydrogen 3.233 N/A VAL 148.A N HIS 117.A O no hydrogen 2.914 N/A GLY 150.A N ASP 119.A OD1 no hydrogen 3.115 N/A THR 153.A N GLU 156.A OE1 no hydrogen 2.813 N/A THR 153.A OG1 GLU 156.A OE1 no hydrogen 2.481 N/A GLU 154.A N GLU 154.A OE1 no hydrogen 2.770 N/A GLY 157.A N THR 153.A O no hydrogen 3.337 N/A ALA 158.A N GLU 154.A O no hydrogen 2.917 N/A GLU 159.A N THR 155.A O no hydrogen 2.730 N/A GLY 160.A N GLU 156.A O no hydrogen 2.904 N/A THR 162.A N GLU 159.A O no hydrogen 2.912 N/A THR 162.A OG1 GLU 159.A O no hydrogen 2.978 N/A LEU 163.A N GLY 160.A O no hydrogen 3.005 N/A GLU 165.A N HIS 161.A O no hydrogen 3.253 N/A GLU 165.A N THR 162.A O no hydrogen 3.127 N/A THR 167.A OG1 ASN 114.A OD1 no hydrogen 3.386 N/A THR 170.A N ASN 114.A O no hydrogen 2.819 N/A THR 170.A OG1 HIS 112.A ND1 no hydrogen 2.669 N/A THR 170.A OG1 ASN 114.A O no hydrogen 3.412 N/A VAL 172.A N SER 199.A O no hydrogen 2.864 N/A VAL 173.A N ALA 116.A O no hydrogen 2.893 N/A ALA 174.A N VAL 201.A O no hydrogen 2.924 N/A ASP 177.A N TYR 203.A O no hydrogen 2.935 N/A ARG 178.A NH1 GLN 10.A O no hydrogen 2.645 N/A ARG 178.A NH2 GLN 10.A O no hydrogen 2.753 N/A CYS 179.A N ASN 176.A OD1 no hydrogen 2.925 N/A CYS 179.A SG GLY 151.A O no hydrogen 4.023 N/A ALA 180.A N ASN 176.A O no hydrogen 2.912 N/A THR 181.A N ASP 177.A O no hydrogen 2.799 N/A THR 181.A OG1 ASP 177.A O no hydrogen 3.041 N/A GLY 182.A N ARG 178.A O no hydrogen 3.343 N/A VAL 183.A N CYS 179.A O no hydrogen 3.160 N/A LEU 184.A N ALA 180.A O no hydrogen 2.794 N/A ASP 185.A N THR 181.A O no hydrogen 2.853 N/A LEU 186.A N GLY 182.A O no hydrogen 3.122 N/A LEU 187.A N VAL 183.A O no hydrogen 3.032 N/A VAL 188.A N LEU 184.A O no hydrogen 3.043 N/A ARG 189.A N ASP 185.A O no hydrogen 3.202 N/A SER 190.A N LEU 186.A O no hydrogen 2.976 N/A SER 190.A N LEU 187.A O no hydrogen 3.130 N/A SER 190.A OG LEU 186.A O no hydrogen 3.149 N/A SER 190.A OG LEU 187.A O no hydrogen 2.674 N/A GLY 191.A N VAL 188.A O no hydrogen 3.142 N/A ARG 192.A N LEU 187.A O no hydrogen 2.922 N/A ASP 193.A N ASP 197.A OD2 no hydrogen 3.018 N/A ASP 197.A N ASP 193.A O no hydrogen 2.755 N/A ILE 198.A N ASP 193.A O no hydrogen 3.314 N/A SER 199.A N THR 170.A O no hydrogen 3.019 N/A SER 199.A OG HIS 112.A NE2 no hydrogen 3.356 N/A SER 199.A OG GLY 257.A O no hydrogen 3.362 N/A VAL 200.A N THR 255.A O no hydrogen 2.852 N/A VAL 201.A N VAL 172.A O no hydrogen 2.883 N/A GLY 202.A N THR 216.A O no hydrogen 2.944 N/A ASP 204.A N ILE 218.A O no hydrogen 2.655 N/A SER 206.A N ASP 177.A OD2 no hydrogen 2.786 N/A SER 206.A OG ASP 177.A OD2 no hydrogen 3.058 N/A LEU 208.A N SER 206.A OG no hydrogen 3.331 N/A ALA 209.A N SER 206.A O no hydrogen 3.065 N/A VAL 214.A N ILE 211.A O no hydrogen 2.820 N/A GLN 215.A N ILE 211.A O no hydrogen 2.951 N/A GLN 215.A NE2 ARG 210.A O no hydrogen 3.231 N/A GLN 215.A NE2 ILE 211.A O no hydrogen 3.188 N/A THR 216.A OG1 THR 256.A OG1 no hydrogen 3.408 N/A THR 217.A N VAL 251.A O no hydrogen 2.885 N/A THR 217.A OG1 ASP 177.A OD1 no hydrogen 2.728 N/A SER 219.A N HIS 249.A O no hydrogen 2.817 N/A ASP 221.A N SER 219.A OG no hydrogen 3.138 N/A HIS 224.A N ASP 221.A OD1 no hydrogen 3.481 N/A GLU 226.A N THR 223.A O no hydrogen 3.043 N/A ALA 227.A N HIS 224.A O no hydrogen 2.758 N/A VAL 229.A N ALA 225.A O no hydrogen 2.971 N/A ASP 230.A N GLU 226.A O no hydrogen 2.935 N/A GLY 231.A N ALA 227.A O no hydrogen 2.702 N/A ALA 232.A N ALA 228.A O no hydrogen 2.940 N/A LEU 233.A N VAL 229.A O no hydrogen 2.976 N/A ALA 234.A N ASP 230.A O no hydrogen 2.941 N/A GLN 235.A N GLY 231.A O no hydrogen 3.150 N/A ILE 236.A N ALA 232.A O no hydrogen 2.956 N/A SER 237.A N LEU 233.A O no hydrogen 3.158 N/A SER 237.A OG LEU 233.A O no hydrogen 2.951 N/A GLY 238.A N GLN 235.A O no hydrogen 3.072 N/A ASP 239.A N ALA 234.A O no hydrogen 3.003 N/A LEU 244.A N ALA 91.A O no hydrogen 2.828 N/A LEU 246.A N ARG 93.A O no hydrogen 2.861 N/A HIS 249.A N SER 219.A O no hydrogen 2.958 N/A VAL 251.A N THR 217.A O no hydrogen 2.723 N/A ARG 253.A N THR 216.A OG1 no hydrogen 3.066 N/A ARG 253.A NH1 ASP 205.A OD1 no hydrogen 2.987 N/A ARG 253.A NH2 ASP 205.A OD1 no hydrogen 2.825 N/A ALA 254.A N GLN 215.A O no hydrogen 2.825 N/A THR 255.A OG1 VAL 200.A O no hydrogen 2.811 N/A THR 256.A OG1 HIS 106.A NE2 no hydrogen 2.775 N/A THR 256.A OG1 THR 216.A OG1 no hydrogen 3.408 N/A GLY 257.A N SER 199.A OG no hydrogen 2.878 N/A VAL 259.A N LEU 110.A O no hydrogen 3.290 N/A