Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 2a8c_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LYS 5.A N MET 1.A O no hydrogen 3.439 N/A GLN 6.A N ASP 2.A O no hydrogen 2.900 N/A GLN 6.A NE2 GLN 6.A O no hydrogen 3.109 N/A GLN 6.A NE2 ASN 10.A OD1 no hydrogen 2.816 N/A LEU 7.A N LYS 3.A O no hydrogen 3.051 N/A PHE 8.A N ILE 4.A O no hydrogen 3.113 N/A ALA 9.A N LYS 5.A O no hydrogen 3.091 N/A ASN 10.A N GLN 6.A O no hydrogen 2.988 N/A ASN 11.A N LEU 7.A O no hydrogen 2.920 N/A TYR 12.A N PHE 8.A O no hydrogen 2.968 N/A SER 13.A N ALA 9.A O no hydrogen 3.028 N/A TRP 14.A N ASN 10.A O no hydrogen 2.872 N/A ALA 15.A N ASN 11.A O no hydrogen 2.850 N/A GLN 16.A N TYR 12.A O no hydrogen 2.812 N/A GLN 16.A NE2 TYR 12.A OH no hydrogen 2.615 N/A ARG 17.A N SER 13.A O no hydrogen 3.174 N/A LYS 19.A NZ GLN 16.A OE1 no hydrogen 3.248 N/A GLU 20.A N GLN 16.A O no hydrogen 3.158 N/A ASN 22.A N LYS 19.A O no hydrogen 3.289 N/A SER 23.A N MET 18.A O no hydrogen 3.322 N/A GLU 28.A N THR 24.A O no hydrogen 2.787 N/A LEU 29.A N PHE 26.A O no hydrogen 2.921 N/A ALA 30.A N PHE 26.A O no hydrogen 3.125 N/A ASP 31.A N LYS 27.A O no hydrogen 3.399 N/A HIS 36.A N GLU 59.A O no hydrogen 2.924 N/A HIS 36.A ND1 GLU 59.A OE1 no hydrogen 2.791 N/A TYR 37.A N GLU 59.A O no hydrogen 3.356 N/A LEU 38.A N HIS 92.A O no hydrogen 2.845 N/A TRP 39.A N PHE 61.A O no hydrogen 2.689 N/A ILE 40.A N ILE 94.A O no hydrogen 2.880 N/A GLY 41.A N HIS 63.A O no hydrogen 2.928 N/A CYS 42.A SG ASP 44.A OD2 no hydrogen 3.171 N/A CYS 42.A SG ASN 65.A O no hydrogen 3.988 N/A CYS 42.A SG HIS 98.A NE2 no hydrogen 3.428 N/A SER 43.A N ASN 65.A O no hydrogen 2.974 N/A SER 45.A N CYS 42.A O no hydrogen 2.948 N/A SER 45.A OG CYS 42.A O no hydrogen 3.122 N/A SER 45.A OG SER 43.A O no hydrogen 3.558 N/A VAL 47.A N TYR 181.A OH no hydrogen 3.302 N/A LYS 51.A N PRO 48.A O no hydrogen 3.244 N/A LEU 52.A N PRO 48.A O no hydrogen 3.141 N/A THR 53.A N ALA 49.A O no hydrogen 3.096 N/A THR 53.A OG1 ALA 49.A O no hydrogen 2.515 N/A ASN 54.A N GLU 50.A O no hydrogen 2.856 N/A GLU 56.A N GLU 56.A OE1 no hydrogen 2.513 N/A GLU 59.A N GLU 56.A O no hydrogen 2.919 N/A PHE 61.A N TYR 37.A O no hydrogen 2.830 N/A HIS 63.A N TRP 39.A O no hydrogen 2.796 N/A ARG 64.A NH1 CYS 42.A O no hydrogen 2.703 N/A ASN 65.A N GLY 41.A O no hydrogen 3.235 N/A ASN 65.A ND2 HIS 63.A NE2 no hydrogen 3.130 N/A ASN 65.A ND2 GLN 69.A O no hydrogen 2.783 N/A ASN 68.A N ASN 65.A O no hydrogen 3.243 N/A ASN 68.A ND2 ASN 68.A O no hydrogen 2.786 N/A GLN 69.A N ASN 65.A OD1 no hydrogen 2.667 N/A GLN 69.A NE2 TRP 119.A O no hydrogen 3.326 N/A VAL 70.A N GLN 154.A OE1 no hydrogen 2.771 N/A ASP 74.A N ILE 71.A O no hydrogen 3.048 N/A ASN 76.A N ASP 74.A OD1 no hydrogen 3.182 N/A CYS 77.A N ASP 74.A OD2 no hydrogen 3.088 N/A CYS 77.A SG GLN 69.A O no hydrogen 3.988 N/A LEU 78.A N ASP 74.A O no hydrogen 2.946 N/A SER 79.A N PHE 75.A O no hydrogen 2.870 N/A SER 79.A OG PHE 75.A O no hydrogen 2.838 N/A VAL 80.A N ASN 76.A O no hydrogen 3.250 N/A VAL 81.A N CYS 77.A O no hydrogen 3.020 N/A GLN 82.A N LEU 78.A O no hydrogen 2.909 N/A GLN 82.A NE2 ASP 86.A OD2 no hydrogen 3.164 N/A TYR 83.A N SER 79.A O no hydrogen 2.960 N/A ALA 84.A N VAL 80.A O no hydrogen 2.954 N/A VAL 85.A N VAL 81.A O no hydrogen 2.867 N/A ASP 86.A N GLN 82.A O no hydrogen 2.776 N/A VAL 87.A N TYR 83.A O no hydrogen 2.772 N/A LEU 88.A N TYR 83.A O no hydrogen 2.959 N/A LYS 89.A NZ ASP 86.A O no hydrogen 2.781 N/A ILE 90.A N ALA 84.A O no hydrogen 2.904 N/A HIS 92.A ND1 SER 175.A OG no hydrogen 2.712 N/A ILE 93.A N SER 175.A O no hydrogen 3.009 N/A ILE 94.A N LEU 38.A O no hydrogen 2.816 N/A ILE 95.A N HIS 177.A O no hydrogen 2.842 N/A CYS 96.A N ILE 40.A O no hydrogen 2.978 N/A CYS 96.A SG GLY 97.A O no hydrogen 3.482 N/A CYS 96.A SG TRP 179.A O no hydrogen 3.820 N/A GLY 97.A N TRP 179.A O no hydrogen 2.899 N/A THR 99.A N TYR 181.A O no hydrogen 3.088 N/A THR 99.A OG1 ASP 182.A OD1 no hydrogen 3.149 N/A CYS 101.A SG ASP 44.A OD2 no hydrogen 3.034 N/A CYS 101.A SG HIS 98.A NE2 no hydrogen 3.554 N/A GLY 103.A N ASP 44.A OD2 no hydrogen 3.413 N/A HIS 105.A N CYS 101.A O no hydrogen 3.009 N/A HIS 105.A ND1 CYS 101.A O no hydrogen 2.602 N/A ALA 106.A N GLY 102.A O no hydrogen 2.727 N/A ALA 107.A N GLY 103.A O no hydrogen 2.898 N/A MET 108.A N ILE 104.A O no hydrogen 2.920 N/A ALA 109.A N HIS 105.A O no hydrogen 2.928 N/A LEU 113.A N ASN 117.A OD1 no hydrogen 2.562 N/A GLY 114.A N ASN 117.A OD1 no hydrogen 3.147 N/A ASN 117.A N GLY 114.A O no hydrogen 2.888 N/A ASN 117.A ND2 LYS 111.A O no hydrogen 3.626 N/A ASN 118.A N LEU 115.A O no hydrogen 2.980 N/A ASN 118.A ND2 LEU 115.A O no hydrogen 2.980 N/A TRP 119.A NE1 VAL 66.A O no hydrogen 3.061 N/A LEU 120.A N ILE 116.A O no hydrogen 2.807 N/A LEU 121.A N ASN 118.A O no hydrogen 3.219 N/A ILE 123.A N LEU 120.A O no hydrogen 3.048 N/A ARG 124.A N LEU 120.A O no hydrogen 3.234 N/A ARG 124.A NH1 ALA 107.A O no hydrogen 2.747 N/A ASP 125.A N LEU 121.A O no hydrogen 2.907 N/A ILE 126.A N HIS 122.A O no hydrogen 3.107 N/A TRP 127.A N ILE 123.A O no hydrogen 2.776 N/A PHE 128.A N ARG 124.A O no hydrogen 2.879 N/A LYS 129.A N ASP 125.A O no hydrogen 2.935 N/A LYS 129.A NZ GLU 153.A OE1 no hydrogen 3.049 N/A LYS 129.A NZ TYR 205.A OH no hydrogen 3.161 N/A HIS 130.A N ILE 126.A O no hydrogen 3.320 N/A HIS 130.A N TRP 127.A O no hydrogen 3.177 N/A HIS 130.A NE2 GLU 153.A OE2 no hydrogen 2.661 N/A GLY 131.A N PHE 128.A O no hydrogen 2.728 N/A LEU 134.A N HIS 130.A O no hydrogen 2.971 N/A GLY 135.A N GLY 131.A O no hydrogen 2.824 N/A LYS 136.A N HIS 132.A O no hydrogen 3.222 N/A LYS 136.A N LEU 133.A O no hydrogen 3.050 N/A LEU 137.A N LEU 134.A O no hydrogen 3.231 N/A SER 138.A N ASN 219.A O no hydrogen 2.862 N/A SER 138.A OG GLU 140.A OE1 no hydrogen 2.761 N/A SER 138.A OG GLU 140.A OE2 no hydrogen 2.970 N/A GLU 140.A N GLU 140.A OE1 no hydrogen 2.848 N/A LYS 141.A N SER 138.A O no hydrogen 3.076 N/A LYS 141.A NZ ASN 219.A OD1 no hydrogen 3.422 N/A ARG 142.A N PRO 139.A O no hydrogen 2.877 N/A ARG 142.A NE LEU 134.A O no hydrogen 3.004 N/A ARG 142.A NE LEU 137.A O no hydrogen 2.971 N/A ARG 142.A NH2 GLY 135.A O no hydrogen 3.297 N/A ARG 142.A NH2 LEU 137.A O no hydrogen 2.996 N/A MET 145.A N LYS 141.A O no hydrogen 3.191 N/A LEU 146.A N ARG 142.A O no hydrogen 2.768 N/A THR 147.A N ALA 143.A O no hydrogen 2.985 N/A THR 147.A OG1 ALA 143.A O no hydrogen 2.762 N/A LYS 148.A N ASP 144.A O no hydrogen 3.188 N/A ILE 149.A N MET 145.A O no hydrogen 2.899 N/A ASN 150.A N LEU 146.A O no hydrogen 2.733 N/A ASN 150.A ND2 ALA 67.A O no hydrogen 3.071 N/A VAL 151.A N THR 147.A O no hydrogen 3.356 N/A ALA 152.A N LYS 148.A O no hydrogen 3.355 N/A GLU 153.A N ILE 149.A O no hydrogen 2.873 N/A GLN 154.A N ASN 150.A O no hydrogen 2.841 N/A GLN 154.A NE2 ASN 150.A O no hydrogen 3.609 N/A GLN 154.A NE2 ASN 150.A OD1 no hydrogen 2.776 N/A VAL 155.A N VAL 151.A O no hydrogen 3.054 N/A TYR 156.A N ALA 152.A O no hydrogen 3.042 N/A TYR 156.A OH GLU 202.A OE1 no hydrogen 2.361 N/A TYR 156.A OH GLU 202.A OE2 no hydrogen 3.259 N/A ASN 157.A N GLU 153.A O no hydrogen 2.690 N/A ASN 157.A ND2 VAL 70.A O no hydrogen 3.353 N/A ASN 157.A ND2 GLN 154.A OE1 no hydrogen 3.435 N/A LEU 158.A N GLN 154.A O no hydrogen 2.769 N/A GLY 159.A N VAL 155.A O no hydrogen 2.837 N/A ARG 160.A N TYR 156.A O no hydrogen 3.115 N/A ARG 160.A N ASN 157.A O no hydrogen 3.129 N/A THR 161.A N LEU 158.A O no hydrogen 3.178 N/A THR 161.A OG1 LEU 158.A O no hydrogen 3.055 N/A VAL 164.A N THR 161.A OG1 no hydrogen 3.086 N/A LYS 165.A N THR 161.A O no hydrogen 3.124 N/A SER 166.A N SER 162.A O no hydrogen 3.025 N/A SER 166.A OG SER 162.A O no hydrogen 3.039 N/A ALA 167.A N ILE 163.A O no hydrogen 3.133 N/A TRP 168.A N VAL 164.A O no hydrogen 2.983 N/A TRP 168.A NE1 LEU 174.A O no hydrogen 2.695 N/A GLU 169.A N LYS 165.A O no hydrogen 2.807 N/A ARG 170.A N SER 166.A O no hydrogen 2.871 N/A ARG 170.A NE GLN 172.A OE1 no hydrogen 3.131 N/A ARG 170.A NH2 ASP 86.A OD1 no hydrogen 2.814 N/A ARG 170.A NH2 GLN 172.A OE1 no hydrogen 2.770 N/A GLY 171.A N TRP 168.A O no hydrogen 2.629 N/A GLN 172.A N ALA 167.A O no hydrogen 2.907 N/A GLN 172.A NE2 VAL 85.A O no hydrogen 2.866 N/A LYS 173.A NZ GLU 91.A OE2 no hydrogen 2.748 N/A SER 175.A N GLU 91.A O no hydrogen 3.003 N/A SER 175.A OG GLU 91.A O no hydrogen 3.284 N/A SER 175.A OG HIS 177.A NE2 no hydrogen 2.927 N/A LEU 176.A N ALA 195.A O no hydrogen 2.720 N/A HIS 177.A N ILE 93.A O no hydrogen 2.871 N/A HIS 177.A NE2 SER 175.A OG no hydrogen 2.927 N/A TRP 179.A N ILE 95.A O no hydrogen 2.859 N/A VAL 180.A N VAL 189.A O no hydrogen 3.068 N/A TYR 181.A N GLY 97.A O no hydrogen 3.362 N/A VAL 183.A N THR 99.A OG1 no hydrogen 2.775 N/A GLY 186.A N ASP 182.A O no hydrogen 2.987 N/A PHE 187.A N ASP 185.A OD1 no hydrogen 2.750 N/A VAL 189.A N VAL 180.A O no hydrogen 2.685 N/A GLN 191.A N GLY 178.A O no hydrogen 2.993 N/A GLN 191.A NE2 VAL 189.A O no hydrogen 2.707 N/A GLY 192.A N ASP 190.A OD1 no hydrogen 2.651 N/A MET 194.A N SER 204.A OG no hydrogen 3.317 N/A ALA 195.A N LEU 176.A O no hydrogen 3.030 N/A THR 196.A N THR 200.A OG1 no hydrogen 2.911 N/A THR 196.A OG1 THR 200.A OG1 no hydrogen 3.423 N/A SER 197.A OG THR 200.A OG1 no hydrogen 2.853 N/A ARG 198.A NH2 GLU 202.A OE1 no hydrogen 2.964 N/A THR 200.A N SER 197.A OG no hydrogen 3.318 N/A THR 200.A OG1 THR 196.A OG1 no hydrogen 3.423 N/A THR 200.A OG1 SER 197.A O no hydrogen 2.982 N/A THR 200.A OG1 SER 197.A OG no hydrogen 2.853 N/A LEU 201.A N SER 197.A O no hydrogen 2.922 N/A GLU 202.A N ARG 198.A O no hydrogen 3.040 N/A ILE 203.A N GLU 199.A O no hydrogen 2.988 N/A SER 204.A N THR 200.A O no hydrogen 2.959 N/A SER 204.A OG MET 194.A O no hydrogen 3.497 N/A SER 204.A OG THR 200.A O no hydrogen 2.817 N/A SER 204.A OG LEU 201.A O no hydrogen 3.384 N/A TYR 205.A N LEU 201.A O no hydrogen 2.977 N/A TYR 205.A OH GLU 153.A OE1 no hydrogen 3.377 N/A TYR 205.A OH GLU 153.A OE2 no hydrogen 2.454 N/A ARG 206.A N GLU 202.A O no hydrogen 2.994 N/A ASN 207.A N ILE 203.A O no hydrogen 2.930 N/A ALA 208.A N SER 204.A O no hydrogen 2.845 N/A ILE 209.A N TYR 205.A O no hydrogen 2.952 N/A ALA 210.A N ARG 206.A O no hydrogen 2.945 N/A ARG 211.A N ASN 207.A O no hydrogen 2.837 N/A ARG 211.A NH1 ARG 211.A O no hydrogen 2.883 N/A LEU 212.A N ALA 208.A O no hydrogen 2.907 N/A SER 213.A N ILE 209.A O no hydrogen 2.934 N/A SER 213.A N ALA 210.A O no hydrogen 3.172 N/A SER 213.A OG ILE 209.A O no hydrogen 2.619 N/A ILE 214.A N ARG 211.A O no hydrogen 3.270 N/A GLU 218.A N GLU 218.A OE2 no hydrogen 2.500 N/A ASN 219.A N ASP 216.A O no hydrogen 3.060 N/A LEU 221.A N LYS 136.A O no hydrogen 2.754 N/A