Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4ake_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): MET 1.A N ASN 79.A O no hydrogen 2.512 N/A ARG 2.A N ASP 104.A OD2 no hydrogen 2.914 N/A ARG 2.A NH1 ASN 102.A O no hydrogen 3.110 N/A ILE 3.A N PHE 81.A O no hydrogen 2.984 N/A ILE 4.A N TYR 105.A O no hydrogen 2.758 N/A LEU 5.A N LEU 83.A O no hydrogen 2.875 N/A LEU 6.A N LEU 107.A O no hydrogen 2.759 N/A ALA 11.A N ALA 8.A O no hydrogen 3.255 N/A THR 15.A N GLY 12.A O no hydrogen 3.372 N/A THR 15.A OG1 GLY 12.A O no hydrogen 2.974 N/A GLN 16.A N LYS 13.A O no hydrogen 3.246 N/A ALA 17.A N GLY 14.A O no hydrogen 2.981 N/A ILE 20.A N GLN 16.A O no hydrogen 3.211 N/A MET 21.A N ALA 17.A O no hydrogen 2.975 N/A GLU 22.A N GLN 18.A O no hydrogen 2.872 N/A LYS 23.A N PHE 19.A O no hydrogen 2.707 N/A LYS 23.A N ILE 20.A O no hydrogen 3.212 N/A TYR 24.A N ILE 20.A O no hydrogen 3.063 N/A TYR 24.A OH GLY 214.A O no hydrogen 3.149 N/A GLY 25.A N MET 21.A O no hydrogen 2.558 N/A ILE 29.A N LEU 82.A O no hydrogen 2.732 N/A ASP 33.A N SER 30.A OG no hydrogen 3.374 N/A MET 34.A N SER 30.A O no hydrogen 2.980 N/A LEU 35.A N THR 31.A O no hydrogen 2.898 N/A ARG 36.A N GLY 32.A O no hydrogen 3.243 N/A ALA 37.A N MET 34.A O no hydrogen 3.129 N/A ALA 38.A N MET 34.A O no hydrogen 3.082 N/A ALA 38.A N LEU 35.A O no hydrogen 2.895 N/A VAL 39.A N LEU 35.A O no hydrogen 3.373 N/A GLY 42.A N LYS 40.A O no hydrogen 2.716 N/A SER 43.A OG SER 41.A O no hydrogen 2.832 N/A LYS 47.A N SER 43.A O no hydrogen 2.932 N/A GLN 48.A N GLU 44.A O no hydrogen 3.153 N/A GLN 48.A NE2 GLU 44.A O no hydrogen 3.424 N/A ALA 49.A N LEU 45.A O no hydrogen 2.784 N/A LYS 50.A N GLY 46.A O no hydrogen 2.829 N/A ASP 51.A N LYS 47.A O no hydrogen 3.208 N/A ILE 52.A N GLN 48.A O no hydrogen 3.442 N/A MET 53.A N ALA 49.A O no hydrogen 3.173 N/A ASP 54.A N LYS 50.A O no hydrogen 2.913 N/A ALA 55.A N ASP 51.A O no hydrogen 2.792 N/A GLY 56.A N MET 53.A O no hydrogen 2.868 N/A LYS 57.A N ILE 52.A O no hydrogen 2.733 N/A VAL 64.A N THR 60.A O no hydrogen 2.922 N/A ILE 65.A N ASP 61.A O no hydrogen 2.769 N/A ALA 66.A N GLU 62.A O no hydrogen 3.261 N/A LEU 67.A N LEU 63.A O no hydrogen 3.031 N/A VAL 68.A N VAL 64.A O no hydrogen 3.097 N/A LYS 69.A N ILE 65.A O no hydrogen 2.977 N/A GLU 70.A N ALA 66.A O no hydrogen 3.013 N/A ARG 71.A N LEU 67.A O no hydrogen 2.796 N/A ARG 71.A NH1 ARG 71.A O no hydrogen 3.048 N/A ARG 71.A NH1 ASP 76.A OD1 no hydrogen 2.867 N/A ARG 71.A NH2 ASP 76.A OD1 no hydrogen 3.436 N/A ARG 71.A NH2 ASP 76.A OD2 no hydrogen 2.812 N/A ILE 72.A N VAL 68.A O no hydrogen 2.978 N/A ALA 73.A N GLU 70.A O no hydrogen 2.955 N/A GLN 74.A N ARG 71.A O no hydrogen 2.779 N/A GLU 75.A N GLU 75.A OE1 no hydrogen 3.325 N/A CYS 77.A N GLN 74.A O no hydrogen 3.140 N/A CYS 77.A SG ARG 71.A O no hydrogen 4.039 N/A CYS 77.A SG ASP 76.A OD1 no hydrogen 3.460 N/A ARG 78.A N GLU 75.A O no hydrogen 3.077 N/A ARG 78.A NH1 GLU 75.A O no hydrogen 3.363 N/A ASN 79.A ND2 GLY 25.A O no hydrogen 3.198 N/A GLY 80.A N CYS 77.A O no hydrogen 3.306 N/A PHE 81.A N MET 1.A O no hydrogen 2.821 N/A LEU 82.A N PRO 27.A O no hydrogen 2.858 N/A LEU 83.A N ILE 3.A O no hydrogen 2.933 N/A ASP 84.A N ILE 29.A O no hydrogen 2.976 N/A GLY 85.A N LEU 5.A O no hydrogen 2.969 N/A GLN 92.A N THR 89.A OG1 no hydrogen 3.134 N/A ALA 93.A N THR 89.A O no hydrogen 2.930 N/A ASP 94.A N ILE 90.A O no hydrogen 2.774 N/A ALA 95.A N PRO 91.A O no hydrogen 3.318 N/A MET 96.A N GLN 92.A O no hydrogen 3.206 N/A LYS 97.A N ALA 93.A O no hydrogen 3.258 N/A LYS 97.A NZ GLU 185.A OE2 no hydrogen 3.227 N/A GLU 98.A N ASP 94.A O no hydrogen 3.048 N/A ALA 99.A N ALA 95.A O no hydrogen 2.945 N/A GLY 100.A N LYS 97.A O no hydrogen 2.997 N/A ILE 101.A N MET 96.A O no hydrogen 2.940 N/A TYR 105.A N ARG 2.A O no hydrogen 2.970 N/A VAL 106.A N LYS 192.A O no hydrogen 2.922 N/A LEU 107.A N ILE 4.A O no hydrogen 2.909 N/A GLU 108.A N ALA 194.A O no hydrogen 2.945 N/A PHE 109.A N LEU 6.A O no hydrogen 2.789 N/A ASP 110.A N VAL 196.A O no hydrogen 2.653 N/A ILE 116.A N PRO 112.A O no hydrogen 3.014 N/A VAL 117.A N ASP 113.A O no hydrogen 2.743 N/A ASP 118.A N GLU 114.A O no hydrogen 2.940 N/A ARG 119.A N LEU 115.A O no hydrogen 2.885 N/A ILE 120.A N VAL 117.A O no hydrogen 3.139 N/A VAL 121.A N VAL 117.A O no hydrogen 2.862 N/A ARG 123.A NE ASP 159.A OD2 no hydrogen 3.194 N/A ARG 124.A N TYR 133.A O no hydrogen 3.141 N/A VAL 125.A N THR 154.A O no hydrogen 2.616 N/A HIS 126.A N ARG 131.A O no hydrogen 2.747 N/A SER 129.A N ALA 127.A O no hydrogen 2.928 N/A SER 129.A OG HIS 126.A O no hydrogen 3.004 N/A GLY 130.A N HIS 126.A O no hydrogen 2.927 N/A ARG 131.A N SER 129.A OG no hydrogen 3.226 N/A ARG 131.A NE ASP 146.A OD1 no hydrogen 3.380 N/A ARG 131.A NH2 ASP 146.A OD1 no hydrogen 3.470 N/A ARG 131.A NH2 ASP 146.A OD2 no hydrogen 2.589 N/A TYR 133.A N ARG 124.A O no hydrogen 2.718 N/A TYR 133.A OH ASP 146.A OD1 no hydrogen 2.583 N/A HIS 134.A N ASN 138.A O no hydrogen 3.247 N/A HIS 134.A NE2 ASP 118.A O no hydrogen 2.773 N/A VAL 135.A N GLY 122.A O no hydrogen 3.148 N/A LYS 136.A N HIS 134.A ND1 no hydrogen 3.112 N/A PHE 137.A N HIS 134.A ND1 no hydrogen 3.030 N/A ASN 138.A N HIS 134.A O no hydrogen 2.894 N/A ASN 138.A ND2 VAL 132.A O no hydrogen 2.792 N/A LYS 141.A N ASP 147.A OD1 no hydrogen 2.845 N/A LYS 141.A N ASP 147.A OD2 no hydrogen 3.173 N/A LYS 145.A N VAL 142.A O no hydrogen 2.791 N/A ASP 146.A N GLU 151.A O no hydrogen 2.653 N/A THR 149.A N ASP 146.A OD2 no hydrogen 3.100 N/A THR 149.A OG1 ASP 146.A OD2 no hydrogen 2.661 N/A GLY 150.A N ASP 146.A O no hydrogen 2.677 N/A LEU 153.A N GLY 144.A O no hydrogen 3.254 N/A THR 154.A N VAL 125.A O no hydrogen 2.758 N/A THR 154.A OG1 VAL 125.A O no hydrogen 2.954 N/A ARG 156.A N ASP 159.A OD2 no hydrogen 3.380 N/A GLN 160.A N LYS 157.A O no hydrogen 3.072 N/A VAL 164.A N GLN 160.A O no hydrogen 2.860 N/A ARG 165.A N GLU 161.A O no hydrogen 2.914 N/A ARG 165.A NH2 GLU 114.A OE2 no hydrogen 2.820 N/A LYS 166.A N GLU 162.A O no hydrogen 3.253 N/A LYS 166.A NZ GLU 162.A OE1 no hydrogen 3.123 N/A ARG 167.A N THR 163.A O no hydrogen 2.982 N/A LEU 168.A N VAL 164.A O no hydrogen 3.110 N/A VAL 169.A N ARG 165.A O no hydrogen 3.222 N/A GLU 170.A N LYS 166.A O no hydrogen 3.060 N/A TYR 171.A N ARG 167.A O no hydrogen 2.917 N/A HIS 172.A N LEU 168.A O no hydrogen 2.948 N/A HIS 172.A NE2 ASP 113.A OD1 no hydrogen 3.057 N/A GLN 173.A N VAL 169.A O no hydrogen 2.884 N/A MET 174.A N GLU 170.A O no hydrogen 3.418 N/A THR 175.A N TYR 171.A O no hydrogen 2.868 N/A THR 175.A OG1 TYR 171.A O no hydrogen 2.784 N/A ALA 176.A N HIS 172.A O no hydrogen 3.005 N/A LEU 178.A N THR 175.A O no hydrogen 3.135 N/A ILE 179.A N THR 175.A O no hydrogen 3.047 N/A GLY 180.A N ALA 176.A O no hydrogen 3.191 N/A TYR 181.A N PRO 177.A O no hydrogen 2.734 N/A TYR 181.A OH ASP 94.A OD1 no hydrogen 3.184 N/A TYR 182.A N LEU 178.A O no hydrogen 2.834 N/A SER 183.A N ILE 179.A O no hydrogen 2.932 N/A SER 183.A OG ILE 179.A O no hydrogen 3.214 N/A LYS 184.A N GLY 180.A O no hydrogen 3.161 N/A GLU 185.A N TYR 181.A O no hydrogen 3.023 N/A ALA 186.A N TYR 182.A O no hydrogen 2.959 N/A GLU 187.A N SER 183.A O no hydrogen 2.859 N/A ALA 188.A N LYS 184.A O no hydrogen 2.933 N/A GLY 189.A N ALA 186.A O no hydrogen 2.907 N/A ASN 190.A N GLU 185.A O no hydrogen 3.011 N/A THR 191.A OG1 VAL 103.A O no hydrogen 2.729 N/A LYS 192.A N ASP 104.A O no hydrogen 3.004 N/A TYR 193.A OH GLU 108.A OE1 no hydrogen 2.587 N/A ALA 194.A N VAL 106.A O no hydrogen 2.921 N/A LYS 195.A NZ TYR 193.A OH no hydrogen 3.047 N/A VAL 196.A N GLU 108.A O no hydrogen 2.790 N/A GLY 198.A N ASP 110.A O no hydrogen 2.695 N/A THR 199.A OG1 ASP 197.A OD1 no hydrogen 2.649 N/A THR 199.A OG1 ASP 197.A OD2 no hydrogen 2.753 N/A LYS 200.A NZ GLU 204.A OE2 no hydrogen 3.264 N/A LYS 200.A NZ ASP 208.A OD2 no hydrogen 2.935 N/A GLU 204.A N PRO 201.A O no hydrogen 2.530 N/A VAL 205.A N PRO 201.A O no hydrogen 2.851 N/A ARG 206.A N VAL 202.A O no hydrogen 2.937 N/A ALA 207.A N ALA 203.A O no hydrogen 3.255 N/A ASP 208.A N GLU 204.A O no hydrogen 2.814 N/A LEU 209.A N VAL 205.A O no hydrogen 2.797 N/A GLU 210.A N ARG 206.A O no hydrogen 3.186 N/A GLU 210.A N ALA 207.A O no hydrogen 3.248 N/A LYS 211.A N ALA 207.A O no hydrogen 3.339 N/A LYS 211.A NZ ASP 208.A OD1 no hydrogen 3.120 N/A ILE 212.A N LEU 209.A O no hydrogen 3.207 N/A LEU 213.A N LEU 209.A O no hydrogen 2.953 N/A GLY 214.A N GLU 210.A O no hydrogen 3.043 N/A