Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 7die_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): SER 1.A OG ASP 69.A OD2 no hydrogen 2.985 N/A PHE 3.A N SER 1.A OG no hydrogen 2.968 N/A ASN 4.A N SER 1.A O no hydrogen 3.212 N/A LYS 5.A NZ ASP 118.A OD1 no hydrogen 2.787 N/A LYS 5.A NZ ASP 118.A OD2 no hydrogen 3.514 N/A LYS 5.A NZ GLU 120.A OE1 no hydrogen 2.678 N/A ARG 8.A N ASP 6.A OD1.B no hydrogen 3.009 N/A MET 10.A N ASP 6.A O.A no hydrogen 2.980 N/A MET 10.A N ASP 6.A O.B no hydrogen 3.073 N/A ASP 11.A N GLU 7.A O no hydrogen 2.873 N/A LEU 12.A N ARG 8.A O no hydrogen 3.242 N/A VAL 13.A N ILE 9.A O no hydrogen 2.965 N/A SER 14.A N MET 10.A O no hydrogen 2.888 N/A SER 14.A OG LYS 73.A O no hydrogen 3.324 N/A LYS 15.A N ASP 11.A O no hydrogen 2.759 N/A HIS 16.A N LEU 12.A O no hydrogen 2.866 N/A HIS 16.A ND1 SER 105.A OG no hydrogen 2.857 N/A HIS 16.A NE2 GLU 20.A OE2 no hydrogen 2.747 N/A TYR 17.A N VAL 13.A O no hydrogen 2.955 N/A ASN 18.A N SER 14.A O no hydrogen 3.103 N/A ASN 18.A ND2 SER 14.A O no hydrogen 2.822 N/A ASN 18.A ND2 LYS 73.A O no hydrogen 2.821 N/A VAL 19.A N LYS 15.A O no hydrogen 2.959 N/A GLU 20.A N HIS 16.A O no hydrogen 2.887 N/A LEU 21.A N TYR 17.A O no hydrogen 2.886 N/A CYS 22.A N ASN 18.A O no hydrogen 2.767 N/A ALA 23.A N VAL 19.A O no hydrogen 3.039 N/A ALA 24.A N GLU 20.A O no hydrogen 2.931 N/A ASN 25.A N LEU 21.A O no hydrogen 2.777 N/A ASN 25.A ND2 SER 78.A O no hydrogen 2.830 N/A LEU 26.A N CYS 22.A O no hydrogen 2.832 N/A TYR 27.A N ALA 23.A O no hydrogen 2.802 N/A TYR 27.A OH GLU 99.A OE1 no hydrogen 2.542 N/A PHE 28.A N ALA 24.A O no hydrogen 2.933 N/A HIS 29.A N ASN 25.A O no hydrogen 3.147 N/A LEU 30.A N LEU 26.A O no hydrogen 2.720 N/A ALA 31.A N TYR 27.A O no hydrogen 2.772 N/A THR 32.A N PHE 28.A O no hydrogen 3.353 N/A THR 32.A OG1 HIS 29.A O no hydrogen 2.729 N/A VAL 33.A N HIS 29.A O no hydrogen 3.024 N/A SER 34.A N LEU 30.A O no hydrogen 2.818 N/A SER 34.A OG LEU 30.A O no hydrogen 2.774 N/A LYS 35.A N ALA 31.A O no hydrogen 2.982 N/A LYS 35.A NZ ASP 40.A OD1 no hydrogen 2.728 N/A ALA 36.A N THR 32.A O no hydrogen 3.040 N/A LEU 37.A N VAL 33.A O no hydrogen 2.960 N/A GLY 38.A N LYS 35.A O no hydrogen 2.867 N/A TYR 39.A N SER 34.A O no hydrogen 2.922 N/A ASN 41.A N GLU 157.A OE1 no hydrogen 2.685 N/A ASN 41.A N GLU 157.A OE2 no hydrogen 3.152 N/A ASN 41.A ND2 GLU 157.A O no hydrogen 2.872 N/A VAL 42.A N GLU 157.A OE2 no hydrogen 3.158 N/A ALA 43.A N TYR 39.A O no hydrogen 2.909 N/A ALA 44.A N ASP 40.A O no hydrogen 2.999 N/A PHE 45.A N ASN 41.A O no hydrogen 2.851 N/A PHE 46.A N VAL 42.A O no hydrogen 3.009 N/A VAL 47.A N ALA 43.A O no hydrogen 2.999 N/A LYS 48.A N ALA 44.A O no hydrogen 2.902 N/A LYS 48.A NZ LYS 163.A O.A no hydrogen 3.092 N/A LYS 48.A NZ LYS 163.A O.B no hydrogen 3.087 N/A MET 49.A N PHE 45.A O no hydrogen 2.910 N/A GLY 50.A N PHE 46.A O no hydrogen 2.914 N/A SER 51.A N VAL 47.A O no hydrogen 2.866 N/A SER 51.A OG VAL 47.A O no hydrogen 2.819 N/A ASP 52.A N.A LYS 48.A O no hydrogen 2.893 N/A ASP 52.A N.B LYS 48.A O no hydrogen 2.936 N/A LYS 53.A N MET 49.A O no hydrogen 3.021 N/A LYS 53.A NZ GLU 20.A OE1 no hydrogen 3.027 N/A LYS 53.A NZ GLU 99.A OE1 no hydrogen 3.442 N/A LYS 53.A NZ GLU 99.A OE2 no hydrogen 2.749 N/A LYS 53.A NZ ASP 135.A OD2 no hydrogen 2.873 N/A GLN 54.A N GLY 50.A O no hydrogen 3.167 N/A SER 55.A N SER 51.A O no hydrogen 2.868 N/A SER 55.A OG SER 51.A O no hydrogen 3.232 N/A ALA 56.A N ASP 52.A O.A no hydrogen 2.832 N/A ALA 56.A N ASP 52.A O.B no hydrogen 2.886 N/A HIS 57.A N LYS 53.A O no hydrogen 3.187 N/A HIS 57.A ND1 GLU 20.A OE2 no hydrogen 2.912 N/A MET 58.A N LYS 53.A O no hydrogen 2.853 N/A SER 59.A N GLN 54.A O no hydrogen 3.302 N/A SER 59.A OG SER 55.A O no hydrogen 2.598 N/A ARG 60.A NH1 ALA 56.A O no hydrogen 2.947 N/A LEU 61.A N HIS 57.A O no hydrogen 3.072 N/A VAL 62.A N MET 58.A O no hydrogen 2.957 N/A LYS 63.A N SER 59.A O no hydrogen 3.029 N/A TYR 64.A N ARG 60.A O no hydrogen 2.971 N/A TYR 64.A OH THR 121.A OG1 no hydrogen 2.693 N/A MET 65.A N LEU 61.A O no hydrogen 3.003 N/A MET 66.A N VAL 62.A O no hydrogen 3.078 N/A LYS 67.A N LYS 63.A O no hydrogen 3.016 N/A VAL 68.A N TYR 64.A O no hydrogen 3.202 N/A VAL 68.A N MET 65.A O no hydrogen 3.177 N/A ASP 69.A N MET 66.A O no hydrogen 3.097 N/A SER 70.A N MET 65.A O no hydrogen 2.863 N/A SER 70.A OG VAL 68.A O no hydrogen 3.311 N/A LYS 73.A N SER 14.A OG no hydrogen 2.683 N/A LYS 73.A NZ ASP 11.A OD1 no hydrogen 2.664 N/A ASN 75.A N ASN 18.A OD1 no hydrogen 2.879 N/A ILE 77.A N ASN 75.A OD1 no hydrogen 2.932 N/A SER 78.A N ASN 75.A O no hydrogen 3.028 N/A SER 78.A OG ASN 75.A O no hydrogen 2.901 N/A VAL 79.A N GLN 76.A O no hydrogen 3.135 N/A GLU 86.A N GLU 90.A OE1 no hydrogen 2.734 N/A GLN 89.A NE2 VAL 146.A O no hydrogen 2.837 N/A GLU 90.A N THR 87.A OG1 no hydrogen 3.039 N/A VAL 91.A N THR 87.A O no hydrogen 3.182 N/A LEU 92.A N ILE 88.A O no hydrogen 3.085 N/A ASP 93.A N GLN 89.A O no hydrogen 2.932 N/A ALA 94.A N GLU 90.A O no hydrogen 3.153 N/A ALA 95.A N VAL 91.A O no hydrogen 3.081 N/A LEU 96.A N LEU 92.A O no hydrogen 2.835 N/A LYS 97.A N ASP 93.A O no hydrogen 3.051 N/A MET 98.A N ALA 94.A O no hydrogen 2.991 N/A GLU 99.A N ALA 95.A O no hydrogen 2.928 N/A SER 100.A N LEU 96.A O no hydrogen 3.003 N/A LYS 101.A N LYS 97.A O no hydrogen 3.082 N/A VAL 102.A N MET 98.A O no hydrogen 2.964 N/A ARG 103.A N GLU 99.A O no hydrogen 2.979 N/A GLU 104.A N SER 100.A O no hydrogen 3.001 N/A SER 105.A N LYS 101.A O no hydrogen 2.905 N/A SER 105.A OG HIS 16.A ND1 no hydrogen 2.857 N/A VAL 106.A N VAL 102.A O no hydrogen 2.910 N/A LYS 107.A N ARG 103.A O no hydrogen 3.050 N/A ASN 108.A N.A GLU 104.A O no hydrogen 2.950 N/A ASN 108.A N.A SER 105.A O no hydrogen 3.072 N/A ASN 108.A N.B GLU 104.A O no hydrogen 2.947 N/A VAL 109.A N SER 105.A O no hydrogen 2.997 N/A THR 110.A N VAL 106.A O no hydrogen 2.884 N/A THR 110.A OG1 VAL 106.A O no hydrogen 2.796 N/A GLU 111.A N LYS 107.A O no hydrogen 2.848 N/A ILE 112.A N ASN 108.A O.A no hydrogen 2.917 N/A ILE 112.A N ASN 108.A O.B no hydrogen 2.876 N/A SER 113.A N VAL 109.A O no hydrogen 2.893 N/A SER 113.A OG VAL 109.A O no hydrogen 2.902 N/A SER 113.A OG THR 110.A O no hydrogen 2.948 N/A LEU 114.A N THR 110.A O no hydrogen 3.153 N/A LEU 115.A N GLU 111.A O no hydrogen 2.925 N/A ALA 116.A N ILE 112.A O no hydrogen 2.890 N/A LYS 117.A N LEU 114.A O no hydrogen 2.907 N/A ASP 118.A N SER 113.A O no hydrogen 2.808 N/A THR 121.A N ASP 118.A OD1 no hydrogen 3.012 N/A THR 121.A OG1 TYR 64.A OH no hydrogen 2.693 N/A THR 121.A OG1 ASP 118.A OD2 no hydrogen 2.693 N/A PHE 122.A N ASP 118.A O no hydrogen 3.028 N/A GLU 123.A N PHE 119.A O no hydrogen 2.925 N/A ARG 124.A N GLU 120.A O no hydrogen 3.069 N/A ARG 124.A NE ARG 124.A O no hydrogen 2.685 N/A MET 125.A N THR 121.A O no hydrogen 2.915 N/A GLN 126.A N GLU 123.A O no hydrogen 3.115 N/A GLN 126.A NE2 PHE 122.A O no hydrogen 2.937 N/A VAL 129.A N MET 125.A O no hydrogen 2.876 N/A LYS 130.A N GLN 126.A O no hydrogen 3.103 N/A ASP 131.A N TRP 127.A O no hydrogen 2.882 N/A SER 132.A N PHE 128.A O no hydrogen 2.794 N/A ILE 133.A N LYS 130.A O no hydrogen 3.258 N/A ASP 135.A N ASP 131.A O no hydrogen 2.935 N/A LEU 136.A N SER 132.A O no hydrogen 2.968 N/A GLU 137.A N ILE 133.A O no hydrogen 2.884 N/A GLU 138.A N GLU 134.A O no hydrogen 2.968 N/A ILE 139.A N ASP 135.A O no hydrogen 3.139 N/A SER 140.A N LEU 136.A O no hydrogen 2.767 N/A ASP 141.A N GLU 137.A O no hydrogen 2.776 N/A VAL 142.A N GLU 138.A O no hydrogen 3.279 N/A TRP 143.A N ILE 139.A O no hydrogen 2.826 N/A TRP 143.A NE1 ASP 93.A OD1 no hydrogen 2.760 N/A THR 144.A N SER 140.A O no hydrogen 2.909 N/A THR 144.A OG1 SER 140.A O no hydrogen 3.061 N/A TYR 145.A N ASP 141.A O no hydrogen 2.988 N/A VAL 146.A N VAL 142.A O no hydrogen 3.021 N/A HIS 147.A N TRP 143.A O no hydrogen 3.002 N/A HIS 147.A ND1 TRP 143.A O no hydrogen 3.148 N/A SER 148.A N TYR 145.A O no hydrogen 3.374 N/A SER 148.A OG THR 144.A O no hydrogen 2.819 N/A ILE 156.A N ASN 152.A O no hydrogen 3.154 N/A GLU 157.A N LEU 153.A O no hydrogen 2.942 N/A ASN 158.A N ILE 154.A O no hydrogen 2.825 N/A ILE 159.A N ASN 155.A O no hydrogen 3.104 N/A VAL 160.A N ILE 156.A O no hydrogen 2.953 N/A GLY 161.A N GLU 157.A O no hydrogen 2.939 N/A LYS 162.A N ILE 159.A O no hydrogen 3.099 N/A LYS 163.A N.A VAL 160.A O no hydrogen 2.932 N/A LYS 163.A N.B VAL 160.A O no hydrogen 2.925 N/A LYS 163.A NZ.A GLU 138.A O no hydrogen 3.041 N/A LYS 163.A NZ.A GLU 138.A OE1 no hydrogen 2.712 N/A LEU 164.A N GLY 161.A O no hydrogen 3.264 N/A