Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4biu_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LYS 5.A NZ PRO 22.A O no hydrogen 2.959 N/A LEU 6.A N PRO 2.A O no hydrogen 2.994 N/A LYS 7.A N ALA 3.A O no hydrogen 2.903 N/A ASN 8.A N ARG 4.A O no hydrogen 2.934 N/A ALA 9.A N LYS 5.A O no hydrogen 2.966 N/A ALA 10.A N LEU 6.A O no hydrogen 2.940 N/A ASP 11.A N LYS 7.A O no hydrogen 2.918 N/A GLU 12.A N ASN 8.A O no hydrogen 2.969 N/A VAL 13.A N ALA 9.A O no hydrogen 2.915 N/A ALA 14.A N ALA 10.A O no hydrogen 3.055 N/A GLN 15.A N GLU 12.A O no hydrogen 2.791 N/A GLY 16.A N GLU 12.A O no hydrogen 3.190 N/A GLY 29.A N PHE 25.A O no hydrogen 3.093 N/A ALA 30.A N LEU 26.A O no hydrogen 2.968 N/A SER 31.A N ALA 27.A O no hydrogen 2.963 N/A SER 31.A OG ALA 27.A O no hydrogen 3.055 N/A SER 31.A OG ALA 28.A O no hydrogen 2.798 N/A PHE 32.A N ALA 28.A O no hydrogen 2.999 N/A ASN 33.A N GLY 29.A O no hydrogen 3.055 N/A GLN 34.A N ALA 30.A O no hydrogen 3.070 N/A MET 35.A N SER 31.A O no hydrogen 3.008 N/A VAL 36.A N PHE 32.A O no hydrogen 3.000 N/A THR 37.A N ASN 33.A O no hydrogen 3.071 N/A THR 37.A OG1 ASN 33.A O no hydrogen 2.885 N/A ALA 38.A N GLN 34.A O no hydrogen 2.997 N/A LEU 39.A N MET 35.A O no hydrogen 2.855 N/A GLU 40.A N VAL 36.A O no hydrogen 2.992 N/A ARG 41.A N THR 37.A O no hydrogen 3.111 N/A MET 42.A N ALA 38.A O no hydrogen 2.923 N/A MET 43.A N LEU 39.A O no hydrogen 2.912 N/A MET 43.A N GLU 40.A O no hydrogen 3.239 N/A THR 44.A N GLU 40.A O no hydrogen 3.010 N/A THR 44.A OG1 GLU 40.A O no hydrogen 3.262 N/A THR 44.A OG1 ARG 41.A O no hydrogen 2.881 N/A SER 45.A N ARG 41.A O no hydrogen 3.149 N/A SER 45.A OG MET 42.A O no hydrogen 2.639 N/A ARG 48.A N THR 44.A O no hydrogen 3.048 N/A LEU 49.A N SER 45.A O no hydrogen 2.946 N/A LEU 50.A N GLN 46.A O no hydrogen 3.243 N/A SER 51.A N GLN 47.A O no hydrogen 3.025 N/A SER 51.A OG GLN 47.A O no hydrogen 3.406 N/A SER 51.A OG ARG 48.A O no hydrogen 3.177 N/A ASP 52.A N ARG 48.A O no hydrogen 2.787 N/A ILE 53.A N LEU 49.A O no hydrogen 2.880 N/A SER 54.A N LEU 50.A O no hydrogen 3.057 N/A SER 54.A OG LEU 50.A O no hydrogen 2.589 N/A HIS 55.A N SER 51.A O no hydrogen 3.232 N/A HIS 55.A ND1 SER 51.A O no hydrogen 2.850 N/A GLU 56.A N ASP 52.A O no hydrogen 2.832 N/A LEU 57.A N ILE 53.A O no hydrogen 2.922 N/A ARG 58.A NH1 ASP 92.A OD1 no hydrogen 2.738 N/A ARG 58.A NH2 ASP 92.A O no hydrogen 3.125 N/A ARG 58.A NH2 ASP 92.A OD1 no hydrogen 2.852 N/A THR 59.A OG1 GLU 56.A O no hydrogen 3.317 N/A THR 62.A N ARG 58.A O no hydrogen 3.102 N/A THR 62.A OG1 ARG 58.A O no hydrogen 2.996 N/A ARG 63.A N THR 59.A O no hydrogen 3.382 N/A LEU 64.A N PRO 60.A O no hydrogen 2.817 N/A GLN 65.A N LEU 61.A O no hydrogen 2.876 N/A LEU 66.A N THR 62.A O no hydrogen 2.936 N/A GLY 67.A N ARG 63.A O no hydrogen 2.914 N/A THR 68.A N LEU 64.A O no hydrogen 3.025 N/A THR 68.A OG1 GLN 65.A O no hydrogen 2.776 N/A ALA 69.A N GLN 65.A O no hydrogen 3.309 N/A LEU 70.A N LEU 66.A O no hydrogen 3.112 N/A LEU 70.A N GLY 67.A O no hydrogen 3.083 N/A LEU 71.A N GLY 67.A O no hydrogen 3.237 N/A LEU 71.A N THR 68.A O no hydrogen 3.101 N/A ARG 72.A N THR 68.A O no hydrogen 3.238 N/A ARG 72.A NE GLU 85.A OE1 no hydrogen 3.205 N/A ARG 72.A NH2 GLU 85.A OE1 no hydrogen 2.685 N/A ARG 73.A N LEU 70.A O no hydrogen 3.202 N/A ARG 74.A N LEU 70.A O no hydrogen 3.003 N/A SER 75.A N LEU 71.A O no hydrogen 2.802 N/A GLU 80.A N GLU 80.A OE1 no hydrogen 2.685 N/A LEU 81.A N SER 78.A OG no hydrogen 3.021 N/A ARG 83.A N LYS 79.A O no hydrogen 3.073 N/A ILE 84.A N GLU 80.A O no hydrogen 2.962 N/A GLU 85.A N LEU 81.A O no hydrogen 2.901 N/A THR 86.A N GLU 82.A O no hydrogen 3.026 N/A THR 86.A OG1 GLU 82.A O no hydrogen 2.430 N/A GLU 87.A N ARG 83.A O no hydrogen 3.005 N/A ALA 88.A N ILE 84.A O no hydrogen 2.821 N/A GLN 89.A N GLU 85.A O no hydrogen 2.991 N/A ARG 90.A N THR 86.A O no hydrogen 3.037 N/A ARG 90.A NH2 PHE 210.A O no hydrogen 2.976 N/A LEU 91.A N GLU 87.A O no hydrogen 2.938 N/A ASP 92.A N ALA 88.A O no hydrogen 2.857 N/A SER 93.A N GLN 89.A O no hydrogen 2.969 N/A SER 93.A OG ARG 90.A O no hydrogen 3.161 N/A MET 94.A N ARG 90.A O no hydrogen 3.175 N/A ILE 95.A N LEU 91.A O no hydrogen 2.899 N/A ASN 96.A N ASP 92.A O no hydrogen 3.073 N/A ASP 97.A N SER 93.A O no hydrogen 2.983 N/A LEU 98.A N MET 94.A O no hydrogen 2.908 N/A LEU 99.A N ILE 95.A O no hydrogen 2.853 N/A VAL 100.A N ASN 96.A O no hydrogen 3.023 N/A MET 101.A N ASP 97.A O no hydrogen 2.771 N/A SER 102.A N LEU 99.A O no hydrogen 3.337 N/A SER 102.A OG LEU 98.A O no hydrogen 3.157 N/A SER 102.A OG LEU 99.A O no hydrogen 3.002 N/A ARG 103.A N LEU 99.A O no hydrogen 3.011 N/A ARG 103.A N VAL 100.A O no hydrogen 3.044 N/A ASN 104.A N VAL 100.A O no hydrogen 3.062 N/A GLN 105.A NE2 MET 101.A O no hydrogen 2.443 N/A GLN 106.A N SER 102.A O no hydrogen 3.061 N/A LYS 107.A N ASN 104.A O no hydrogen 3.280 N/A ASN 108.A N GLN 105.A O no hydrogen 3.209 N/A SER 112.A OG GLN 15.A O no hydrogen 2.636 N/A ILE 115.A N LEU 150.A O no hydrogen 2.900 N/A LYS 116.A NZ PRO 147.A O no hydrogen 3.231 N/A ALA 117.A N TRP 148.A O no hydrogen 2.876 N/A ASN 118.A N GLY 146.A O no hydrogen 3.073 N/A GLN 119.A N ASN 118.A OD1 no hydrogen 2.650 N/A LEU 120.A N LYS 116.A O no hydrogen 2.882 N/A TRP 121.A N ALA 117.A O no hydrogen 2.932 N/A TRP 121.A NE1 LEU 157.A O no hydrogen 3.116 N/A SER 122.A N ASN 118.A O no hydrogen 2.911 N/A SER 122.A OG ASN 118.A O no hydrogen 2.858 N/A LEU 125.A N TRP 121.A O no hydrogen 3.005 N/A ASP 126.A N SER 122.A O no hydrogen 2.959 N/A ASN 127.A N GLU 123.A O no hydrogen 2.968 N/A ALA 128.A N VAL 124.A O no hydrogen 2.906 N/A ALA 129.A N LEU 125.A O no hydrogen 2.925 N/A PHE 130.A N ASP 126.A O no hydrogen 3.010 N/A GLU 131.A N ASN 127.A O no hydrogen 2.961 N/A ALA 132.A N ALA 128.A O no hydrogen 2.880 N/A GLU 133.A N ALA 129.A O no hydrogen 2.985 N/A GLN 134.A N PHE 130.A O no hydrogen 2.979 N/A MET 135.A N GLU 131.A O no hydrogen 3.170 N/A MET 135.A N ALA 132.A O no hydrogen 3.092 N/A GLY 136.A N GLU 133.A O no hydrogen 3.309 N/A LYS 137.A N ALA 132.A O no hydrogen 2.918 N/A LYS 137.A NZ LEU 169.A O no hydrogen 2.784 N/A LYS 137.A NZ SER 172.A O no hydrogen 2.862 N/A LYS 137.A NZ SER 172.A OG no hydrogen 3.365 N/A SER 138.A N THR 174.A O no hydrogen 2.843 N/A THR 140.A N ILE 176.A O no hydrogen 2.969 N/A TRP 148.A N GLY 146.A O no hydrogen 2.644 N/A LEU 150.A N ILE 115.A O no hydrogen 2.786 N/A TYR 151.A OH GLN 15.A OE1 no hydrogen 3.009 N/A GLY 152.A N GLU 113.A O no hydrogen 2.710 N/A ASN 153.A N HIS 228.A NE2 no hydrogen 2.936 N/A ASN 153.A ND2 VAL 111.A O no hydrogen 3.069 N/A ALA 156.A N ASN 153.A OD1 no hydrogen 2.739 N/A LEU 157.A N ASN 153.A O no hydrogen 3.198 N/A GLU 158.A N PRO 154.A O no hydrogen 2.906 N/A SER 159.A N ASN 155.A O no hydrogen 2.951 N/A ALA 160.A N ALA 156.A O no hydrogen 2.901 N/A LEU 161.A N LEU 157.A O no hydrogen 3.015 N/A GLU 162.A N GLU 158.A O no hydrogen 2.932 N/A ASN 163.A N SER 159.A O no hydrogen 2.854 N/A ASN 163.A ND2 GLY 217.A O no hydrogen 3.577 N/A ILE 164.A N ALA 160.A O no hydrogen 3.125 N/A VAL 165.A N LEU 161.A O no hydrogen 2.887 N/A ARG 166.A N GLU 162.A O no hydrogen 2.940 N/A ASN 167.A N ASN 163.A O no hydrogen 2.926 N/A ALA 168.A N ILE 164.A O no hydrogen 2.962 N/A LEU 169.A N VAL 165.A O no hydrogen 2.824 N/A ARG 170.A N ARG 166.A O no hydrogen 2.933 N/A TYR 171.A N ASN 167.A O no hydrogen 3.103 N/A SER 172.A N ALA 168.A O no hydrogen 3.138 N/A SER 172.A OG LEU 169.A O no hydrogen 3.097 N/A HIS 173.A N ASP 194.A OD1 no hydrogen 2.856 N/A THR 174.A N ASP 194.A OD1 no hydrogen 2.780 N/A THR 174.A N ASP 194.A OD2 no hydrogen 2.767 N/A THR 174.A OG1 ASP 194.A OD2 no hydrogen 2.465 N/A LYS 175.A N ASP 194.A OD1 no hydrogen 2.785 N/A ILE 176.A N SER 138.A O no hydrogen 2.927 N/A GLU 177.A N ASP 192.A O no hydrogen 2.889 N/A VAL 178.A N THR 140.A O no hydrogen 2.969 N/A GLY 179.A N THR 190.A O no hydrogen 2.868 N/A PHE 180.A N PHE 143.A O no hydrogen 2.986 N/A ASP 185.A N ASP 183.A OD1 no hydrogen 3.292 N/A GLY 186.A N ASP 183.A OD1 no hydrogen 2.890 N/A ILE 187.A N LEU 248.A O no hydrogen 2.901 N/A THR 188.A N ALA 181.A O no hydrogen 2.772 N/A ILE 189.A N ILE 246.A O no hydrogen 2.816 N/A THR 190.A N GLY 179.A O no hydrogen 2.874 N/A VAL 191.A N LEU 244.A O no hydrogen 2.866 N/A ASP 192.A N GLU 177.A O no hydrogen 2.842 N/A ASP 194.A N LYS 175.A O no hydrogen 3.101 N/A GLY 195.A N ASP 193.A OD2 no hydrogen 3.059 N/A SER 199.A OG ASP 202.A OD2 no hydrogen 2.681 N/A ARG 203.A N SER 199.A O no hydrogen 2.924 N/A ARG 203.A NE VAL 198.A O no hydrogen 3.347 N/A ARG 203.A NH1 ALA 234.A O no hydrogen 3.136 N/A GLN 205.A N ASP 202.A O no hydrogen 3.123 N/A TYR 211.A N ARG 208.A O no hydrogen 3.265 N/A ILE 220.A N LEU 216.A O no hydrogen 3.284 N/A VAL 221.A N GLY 217.A O no hydrogen 2.873 N/A GLU 222.A N LEU 218.A O no hydrogen 2.946 N/A THR 223.A N ALA 219.A O no hydrogen 3.063 N/A THR 223.A OG1 ALA 219.A O no hydrogen 2.957 N/A THR 223.A OG1 ILE 220.A O no hydrogen 2.931 N/A ALA 224.A N ILE 220.A O no hydrogen 2.804 N/A ILE 225.A N VAL 221.A O no hydrogen 2.873 N/A GLN 226.A N GLU 222.A O no hydrogen 2.905 N/A GLN 227.A N THR 223.A O no hydrogen 2.979 N/A HIS 228.A N ILE 225.A O no hydrogen 2.983 N/A HIS 228.A ND1 ALA 224.A O no hydrogen 2.691 N/A ARG 229.A N GLN 226.A O no hydrogen 3.219 N/A ARG 229.A NH2 TYR 151.A O no hydrogen 2.749 N/A GLY 230.A N ILE 225.A O no hydrogen 2.956 N/A TRP 231.A N TRP 247.A O no hydrogen 3.019 N/A LYS 233.A N VAL 245.A O no hydrogen 2.876 N/A GLU 235.A N ARG 243.A O no hydrogen 2.869 N/A SER 237.A N GLY 241.A O no hydrogen 3.111 N/A SER 237.A OG ASP 192.A OD1 no hydrogen 3.082 N/A LEU 239.A N SER 237.A OG no hydrogen 3.096 N/A GLY 240.A N SER 237.A O no hydrogen 2.863 N/A GLY 241.A N ASP 193.A O no hydrogen 2.899 N/A LEU 242.A N ASP 193.A OD1 no hydrogen 2.908 N/A LEU 242.A N ASP 193.A OD2 no hydrogen 3.382 N/A ARG 243.A N GLU 235.A O no hydrogen 2.883 N/A ARG 243.A NE ASP 192.A OD1 no hydrogen 2.694 N/A ARG 243.A NH2 ASP 192.A OD1 no hydrogen 3.435 N/A ARG 243.A NH2 ASP 192.A OD2 no hydrogen 3.219 N/A LEU 244.A N VAL 191.A O no hydrogen 2.886 N/A VAL 245.A N LYS 233.A O no hydrogen 2.905 N/A ILE 246.A N ILE 189.A O no hydrogen 2.881 N/A TRP 247.A N TRP 231.A O no hydrogen 2.939 N/A LEU 248.A N ILE 187.A O no hydrogen 2.964 N/A LEU 250.A N ASP 185.A O no hydrogen 2.995 N/A TYR 251.A N PRO 149.A O no hydrogen 3.036 N/A