Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 8aye_D.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): TYR 3.A OH PRO 6.A O no hydrogen 2.881 N/A LYS 7.A NZ GLY 5.A O no hydrogen 3.386 N/A ARG 12.A N LEU 8.A O no hydrogen 2.889 N/A ARG 12.A NE LYS 32.A O no hydrogen 3.024 N/A ARG 12.A NE GLN 35.A O no hydrogen 2.731 N/A ARG 12.A NH2 GLN 35.A O no hydrogen 3.254 N/A ARG 13.A N LYS 9.A O no hydrogen 2.890 N/A GLU 14.A N LEU 10.A O no hydrogen 2.978 N/A GLY 15.A N ARG 12.A O no hydrogen 3.168 N/A THR 16.A N SER 11.A O no hydrogen 3.079 N/A ARG 25.A NE THR 29.A OG1 no hydrogen 2.903 N/A THR 29.A N ALA 26.A O no hydrogen 2.865 N/A THR 29.A OG1 ALA 26.A O no hydrogen 2.371 N/A LYS 30.A N ILE 27.A O no hydrogen 3.118 N/A CYS 31.A N ILE 27.A O no hydrogen 3.178 N/A CYS 31.A SG ILE 27.A O no hydrogen 3.669 N/A LYS 32.A NZ GLN 35.A OE1 no hydrogen 2.916 N/A GLN 35.A N LYS 32.A O no hydrogen 3.115 N/A ALA 36.A N GLY 41.A O no hydrogen 3.274 N/A GLY 41.A N GLY 38.A O no hydrogen 3.153 N/A GLY 51.A N SER 48.A OG no hydrogen 3.068 N/A VAL 52.A N SER 48.A O no hydrogen 2.807 N/A GLN 53.A N ASP 49.A O no hydrogen 3.023 N/A GLN 53.A NE2 ASP 49.A OD1 no hydrogen 2.384 N/A LEU 54.A N TYR 50.A O no hydrogen 2.885 N/A ARG 55.A N GLY 51.A O no hydrogen 2.899 N/A ARG 55.A NE GLU 14.A OE1 no hydrogen 3.257 N/A ARG 55.A NE GLU 14.A OE2 no hydrogen 3.332 N/A ARG 55.A NH2 GLU 14.A OE2 no hydrogen 2.636 N/A GLU 56.A N VAL 52.A O no hydrogen 3.029 N/A LYS 57.A N GLN 53.A O no hydrogen 3.036 N/A LYS 57.A NZ GLN 58.A OE1 no hydrogen 3.132 N/A LYS 57.A NZ GLU 68.A OE1 no hydrogen 2.704 N/A GLN 58.A N LEU 54.A O no hydrogen 2.847 N/A LYS 59.A N ARG 55.A O no hydrogen 2.926 N/A LYS 59.A NZ GLU 56.A OE1 no hydrogen 3.549 N/A VAL 60.A N GLU 56.A O no hydrogen 3.075 N/A ARG 61.A N LYS 57.A O no hydrogen 2.918 N/A ARG 61.A NE VAL 66.A O no hydrogen 2.886 N/A ARG 61.A NH1 GLU 68.A OE1 no hydrogen 2.751 N/A ARG 61.A NH2 VAL 66.A O no hydrogen 3.564 N/A ARG 62.A N GLN 58.A O no hydrogen 2.885 N/A ILE 63.A N LYS 59.A O no hydrogen 2.963 N/A TYR 64.A N VAL 60.A O no hydrogen 3.431 N/A TYR 64.A OH GLU 94.A OE2 no hydrogen 2.432 N/A VAL 66.A N ARG 61.A O no hydrogen 3.135 N/A PHE 71.A N LEU 67.A O no hydrogen 2.792 N/A ARG 72.A N GLU 68.A O no hydrogen 2.831 N/A ASN 73.A N ARG 69.A O no hydrogen 3.014 N/A TYR 74.A N GLN 70.A O no hydrogen 2.932 N/A TYR 75.A N PHE 71.A O no hydrogen 2.893 N/A LYS 76.A N ARG 72.A O no hydrogen 2.906 N/A GLU 77.A N ASN 73.A O no hydrogen 2.946 N/A ALA 78.A N TYR 74.A O no hydrogen 2.831 N/A ALA 79.A N TYR 75.A O no hydrogen 2.848 N/A ARG 80.A N LYS 76.A O no hydrogen 2.942 N/A ARG 80.A NE GLU 77.A OE1 no hydrogen 3.097 N/A ARG 80.A NH2 GLU 77.A OE2 no hydrogen 2.878 N/A LEU 81.A N GLU 77.A O no hydrogen 2.753 N/A GLU 87.A N ASN 84.A OD1 no hydrogen 3.356 N/A ASN 88.A N ASN 84.A O no hydrogen 2.878 N/A ASN 88.A ND2 ALA 78.A O no hydrogen 3.175 N/A ASN 88.A ND2 LYS 82.A O no hydrogen 2.952 N/A LEU 89.A N THR 85.A O no hydrogen 2.884 N/A LEU 90.A N GLY 86.A O no hydrogen 3.038 N/A ALA 91.A N GLU 87.A O no hydrogen 2.917 N/A LEU 92.A N ASN 88.A O no hydrogen 2.844 N/A LEU 93.A N LEU 89.A O no hydrogen 2.987 N/A GLU 94.A N LEU 90.A O no hydrogen 2.925 N/A GLY 95.A N ALA 91.A O no hydrogen 3.155 N/A ARG 96.A N LEU 93.A O no hydrogen 3.268 N/A ARG 96.A NE ASP 98.A OD1 no hydrogen 3.213 N/A ARG 96.A NH1 GLN 70.A OE1 no hydrogen 3.376 N/A ARG 96.A NH1 TYR 74.A OH no hydrogen 2.636 N/A ARG 96.A NH2 ASP 98.A OD2 no hydrogen 2.971 N/A ASP 98.A N ALA 132.A O no hydrogen 3.072 N/A ASN 99.A N ASP 98.A OD1 no hydrogen 2.494 N/A ASN 99.A ND2 GLU 94.A O no hydrogen 2.825 N/A ASN 99.A ND2 GLU 94.A OE1 no hydrogen 2.757 N/A VAL 100.A N ARG 96.A O no hydrogen 2.888 N/A VAL 101.A N LEU 97.A O no hydrogen 2.858 N/A TYR 102.A N ASP 98.A O no hydrogen 2.994 N/A ARG 103.A N ASN 99.A O no hydrogen 2.813 N/A ARG 103.A NE GLU 94.A OE1 no hydrogen 3.090 N/A ARG 103.A NH2 GLU 94.A OE2 no hydrogen 2.988 N/A MET 104.A N VAL 100.A O no hydrogen 2.918 N/A GLY 105.A N TYR 102.A O no hydrogen 3.176 N/A PHE 106.A N VAL 101.A O no hydrogen 3.260 N/A ALA 108.A N GLU 112.A OE2 no hydrogen 3.243 N/A ARG 110.A NE ASN 99.A OD1 no hydrogen 2.432 N/A ARG 110.A NH2 ASN 99.A OD1 no hydrogen 2.874 N/A GLU 112.A N THR 109.A OG1 no hydrogen 3.044 N/A ALA 113.A N THR 109.A O no hydrogen 2.860 N/A ARG 114.A N ARG 110.A O no hydrogen 2.887 N/A ARG 114.A NH1 GLY 65.A O no hydrogen 3.160 N/A GLN 115.A N ALA 111.A O no hydrogen 2.934 N/A LEU 116.A N GLU 112.A O no hydrogen 2.932 N/A VAL 117.A N ALA 113.A O no hydrogen 2.906 N/A SER 118.A N ARG 114.A O no hydrogen 2.859 N/A HIS 119.A N GLN 115.A O no hydrogen 2.927 N/A LYS 120.A N VAL 117.A O no hydrogen 3.060 N/A ALA 121.A N LEU 116.A O no hydrogen 3.143 N/A MET 123.A N SER 143.A O no hydrogen 2.861 N/A VAL 124.A N ARG 127.A O no hydrogen 2.836 N/A ASN 125.A N VAL 141.A O no hydrogen 2.808 N/A ARG 127.A N VAL 124.A O no hydrogen 3.353 N/A VAL 129.A N ILE 122.A O no hydrogen 3.140 N/A ASN 130.A ND2 SER 118.A O no hydrogen 3.127 N/A TYR 134.A N ILE 131.A O no hydrogen 3.221 N/A GLN 135.A NE2 LEU 92.A O no hydrogen 2.966 N/A VAL 136.A N GLY 95.A O no hydrogen 2.809 N/A SER 137.A N ASP 140.A OD2 no hydrogen 3.257 N/A SER 137.A OG PRO 138.A O no hydrogen 3.416 N/A ASN 139.A N PHE 181.A O no hydrogen 2.687 N/A ASP 140.A N SER 137.A O no hydrogen 3.157 N/A VAL 141.A N ASN 125.A OD1 no hydrogen 3.057 N/A VAL 142.A N GLY 179.A O no hydrogen 2.589 N/A SER 143.A N MET 123.A O no hydrogen 3.047 N/A ILE 144.A N MET 177.A O no hydrogen 2.984 N/A ARG 145.A N ALA 121.A O no hydrogen 2.854 N/A ARG 145.A NH1 LYS 120.A O no hydrogen 2.795 N/A ALA 148.A N ARG 145.A O no hydrogen 2.974 N/A LYS 149.A N GLU 146.A O no hydrogen 3.287 N/A LYS 149.A NZ ILE 144.A O no hydrogen 2.956 N/A LYS 149.A NZ LYS 176.A O no hydrogen 3.214 N/A GLN 151.A N ALA 148.A O no hydrogen 3.318 N/A VAL 154.A N GLN 151.A O no hydrogen 3.222 N/A LYS 155.A NZ LYS 149.A O no hydrogen 3.516 N/A LYS 155.A NZ GLN 151.A O no hydrogen 3.078 N/A ALA 156.A N SER 152.A O no hydrogen 2.909 N/A ALA 157.A N ARG 153.A O no hydrogen 2.886 N/A LEU 158.A N VAL 154.A O no hydrogen 2.937 N/A GLU 159.A N LYS 155.A O no hydrogen 2.980 N/A LEU 160.A N ALA 156.A O no hydrogen 2.950 N/A ALA 161.A N ALA 157.A O no hydrogen 2.848 N/A GLU 162.A N LEU 158.A O no hydrogen 2.937 N/A GLU 162.A N GLU 159.A O no hydrogen 2.982 N/A GLN 163.A N LEU 160.A O no hydrogen 3.001 N/A ARG 164.A NH2 TYR 102.A O no hydrogen 3.273 N/A LYS 166.A NZ ALA 161.A O no hydrogen 2.687 N/A LYS 166.A NZ GLU 162.A OE1 no hydrogen 2.905 N/A GLU 171.A N THR 180.A O no hydrogen 3.119 N/A ASP 173.A N GLU 178.A O no hydrogen 2.960 N/A LYS 176.A N ASP 173.A OD1 no hydrogen 2.643 N/A GLY 179.A N VAL 142.A O no hydrogen 2.514 N/A THR 180.A N GLU 171.A O no hydrogen 2.959 N/A PHE 181.A N ASP 140.A O no hydrogen 2.889 N/A LYS 182.A N TRP 169.A O no hydrogen 3.127 N/A LYS 182.A NZ THR 168.A O no hydrogen 3.290 N/A ARG 183.A NH1 ASP 189.A OD2 no hydrogen 3.346 N/A GLU 186.A N ASP 189.A OD2 no hydrogen 2.782 N/A ARG 187.A NE GLU 196.A OE1 no hydrogen 3.290 N/A ARG 187.A NE GLU 196.A OE2 no hydrogen 2.693 N/A ARG 187.A NH1 ARG 187.A O no hydrogen 2.697 N/A ARG 187.A NH1 LEU 190.A O no hydrogen 3.272 N/A ARG 187.A NH1 SER 191.A O no hydrogen 3.454 N/A ARG 187.A NH2 SER 191.A O no hydrogen 3.444 N/A ARG 187.A NH2 GLU 196.A OE1 no hydrogen 2.972 N/A ASP 189.A N GLU 186.A O no hydrogen 2.854 N/A LEU 190.A N ARG 187.A O no hydrogen 3.070 N/A ASP 193.A N SER 191.A OG no hydrogen 3.133 N/A ASN 195.A N GLU 56.A OE2 no hydrogen 2.361 N/A GLU 196.A N GLU 196.A OE1 no hydrogen 2.719 N/A HIS 197.A ND1 GLU 201.A OE1 no hydrogen 3.280 N/A LEU 198.A N ASN 195.A O no hydrogen 3.110 N/A VAL 200.A N GLU 196.A O no hydrogen 2.902 N/A GLU 201.A N HIS 197.A O no hydrogen 2.879 N/A LEU 202.A N LEU 198.A O no hydrogen 2.876 N/A TYR 203.A N ILE 199.A O no hydrogen 3.000 N/A TYR 203.A OH GLU 68.A OE2 no hydrogen 2.797 N/A SER 204.A N VAL 200.A O no hydrogen 3.092 N/A SER 204.A N GLU 201.A O no hydrogen 2.988 N/A SER 204.A OG VAL 200.A O no hydrogen 2.594 N/A LYS 205.A N LEU 202.A O no hydrogen 3.481 N/A