Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4to9_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): VAL 5.A N ASP 2.A OD2 no hydrogen 2.844 N/A ILE 6.A N ASP 2.A O no hydrogen 3.076 N/A GLN 7.A N LYS 3.A O no hydrogen 2.999 N/A HIS 8.A N LYS 4.A O no hydrogen 2.877 N/A LEU 9.A N VAL 5.A O no hydrogen 2.788 N/A ASN 10.A N ILE 6.A O no hydrogen 2.854 N/A ASN 10.A ND2 LEU 66.A O no hydrogen 2.983 N/A LYS 11.A N GLN 7.A O no hydrogen 2.926 N/A ILE 12.A N HIS 8.A O no hydrogen 2.881 N/A LEU 13.A N LEU 9.A O no hydrogen 2.767 N/A GLY 14.A N ASN 10.A O no hydrogen 2.906 N/A ASN 15.A N LYS 11.A O no hydrogen 3.052 N/A ASN 15.A ND2 ASP 98.A OD2 no hydrogen 2.905 N/A GLU 16.A N ILE 12.A O no hydrogen 2.945 N/A LEU 17.A N LEU 13.A O no hydrogen 2.924 N/A ILE 18.A N GLY 14.A O no hydrogen 3.176 N/A ALA 19.A N ASN 15.A O no hydrogen 3.063 N/A ILE 20.A N GLU 16.A O no hydrogen 2.813 N/A ASN 21.A N LEU 17.A O no hydrogen 3.423 N/A GLN 22.A N ILE 18.A O no hydrogen 2.907 N/A GLN 22.A NE2 ASP 88.A OD1 no hydrogen 3.003 N/A TYR 23.A N ALA 19.A O no hydrogen 2.850 N/A TYR 23.A OH GLU 92.A OE2 no hydrogen 2.689 N/A PHE 24.A N ILE 20.A O no hydrogen 2.929 N/A LEU 25.A N ASN 21.A O no hydrogen 2.976 N/A HIS 26.A N GLN 22.A O no hydrogen 2.887 N/A HIS 26.A ND1 ASP 88.A OD1 no hydrogen 2.969 N/A SER 27.A N TYR 23.A O no hydrogen 2.746 N/A SER 27.A OG GLY 39.A O no hydrogen 2.675 N/A ARG 28.A N PHE 24.A O no hydrogen 3.100 N/A ARG 28.A NH1 SER 27.A OG no hydrogen 2.841 N/A MET 29.A N LEU 25.A O no hydrogen 2.883 N/A TRP 30.A N HIS 26.A O no hydrogen 2.991 N/A TRP 30.A NE1 THR 81.A OG1 no hydrogen 2.879 N/A ASN 31.A N SER 27.A O no hydrogen 3.011 N/A ASP 32.A N ARG 28.A O no hydrogen 2.876 N/A TRP 33.A N MET 29.A O no hydrogen 3.027 N/A GLY 34.A N ASN 31.A O no hydrogen 2.905 N/A LEU 35.A N TRP 30.A O no hydrogen 2.815 N/A LYS 36.A N MET 152.A O no hydrogen 3.090 N/A ARG 37.A N HIS 151.A O no hydrogen 3.028 N/A ARG 37.A NH1 HIS 153.A O no hydrogen 3.538 N/A GLY 39.A N LEU 35.A O no hydrogen 3.006 N/A ALA 40.A N LYS 36.A O no hydrogen 2.950 N/A HIS 41.A N ARG 37.A O no hydrogen 3.111 N/A HIS 41.A NE2 GLU 45.A OE2 no hydrogen 2.881 N/A GLU 42.A N LEU 38.A O no hydrogen 2.923 N/A TYR 43.A N GLY 39.A O no hydrogen 3.019 N/A HIS 44.A N ALA 40.A O no hydrogen 3.101 N/A GLU 45.A N HIS 41.A O no hydrogen 3.008 N/A SER 46.A N GLU 42.A O no hydrogen 3.036 N/A SER 46.A OG ILE 20.A O no hydrogen 2.865 N/A ILE 47.A N TYR 43.A O no hydrogen 2.982 N/A ASP 48.A N HIS 44.A O no hydrogen 2.990 N/A GLU 49.A N GLU 45.A O no hydrogen 3.104 N/A MET 50.A N SER 46.A O no hydrogen 2.992 N/A LYS 51.A N ILE 47.A O no hydrogen 3.066 N/A HIS 52.A N ASP 48.A O no hydrogen 3.132 N/A HIS 52.A ND1 GLU 49.A OE1 no hydrogen 3.080 N/A ALA 53.A N GLU 49.A O no hydrogen 2.894 N/A ASP 54.A N MET 50.A O no hydrogen 2.983 N/A LYS 55.A N LYS 51.A O no hydrogen 3.095 N/A LEU 56.A N HIS 52.A O no hydrogen 2.935 N/A ILE 57.A N ALA 53.A O no hydrogen 2.859 N/A GLU 58.A N ASP 54.A O no hydrogen 2.964 N/A ARG 59.A N LYS 55.A O no hydrogen 3.058 N/A ARG 59.A NE SER 114.A OG no hydrogen 2.962 N/A ARG 59.A NH2 ASP 111.A OD1 no hydrogen 2.891 N/A ARG 59.A NH2 SER 114.A OG no hydrogen 3.251 N/A ILE 60.A N LEU 56.A O no hydrogen 2.926 N/A LEU 61.A N ILE 57.A O no hydrogen 3.052 N/A PHE 62.A N GLU 58.A O no hydrogen 3.063 N/A LEU 63.A N ARG 59.A O no hydrogen 3.014 N/A GLU 64.A N LEU 61.A O no hydrogen 2.945 N/A GLY 65.A N ILE 60.A O no hydrogen 2.913 N/A ASN 68.A N ASN 10.A OD1 no hydrogen 2.869 N/A ASN 68.A ND2 ASP 71.A OD2 no hydrogen 2.932 N/A GLN 70.A N ASN 68.A OD1 no hydrogen 2.895 N/A GLN 70.A NE2 GLN 70.A O no hydrogen 3.052 N/A ASP 71.A N ASN 68.A OD1 no hydrogen 3.127 N/A LEU 76.A N GLN 22.A OE1 no hydrogen 2.882 N/A GLY 78.A N HIS 26.A NE2 no hydrogen 3.046 N/A GLU 79.A N GLU 83.A OE2 no hydrogen 3.094 N/A GLU 83.A N ASN 80.A OD1 no hydrogen 2.833 N/A MET 84.A N ASN 80.A O no hydrogen 2.837 N/A LEU 85.A N THR 81.A O no hydrogen 3.022 N/A GLN 86.A N GLN 82.A O no hydrogen 3.102 N/A GLN 86.A NE2 ASN 90.A OD1 no hydrogen 2.914 N/A CYS 87.A N GLU 83.A O no hydrogen 2.744 N/A CYS 87.A SG GLU 83.A O no hydrogen 3.278 N/A ASP 88.A N MET 84.A O no hydrogen 2.859 N/A LEU 89.A N LEU 85.A O no hydrogen 2.921 N/A ASN 90.A N GLN 86.A O no hydrogen 2.860 N/A LEU 91.A N CYS 87.A O no hydrogen 3.053 N/A GLU 92.A N ASP 88.A O no hydrogen 2.993 N/A LEU 93.A N LEU 89.A O no hydrogen 2.894 N/A LYS 94.A N ASN 90.A O no hydrogen 3.191 N/A LYS 94.A NZ ASP 98.A OD2 no hydrogen 2.625 N/A ALA 95.A N LEU 91.A O no hydrogen 2.822 N/A THR 96.A N GLU 92.A O no hydrogen 2.868 N/A THR 96.A OG1 GLU 92.A O no hydrogen 3.222 N/A THR 96.A OG1 LEU 93.A O no hydrogen 3.137 N/A LYS 97.A N LEU 93.A O no hydrogen 3.158 N/A LYS 97.A NZ GLU 101.A OE1 no hydrogen 3.307 N/A ASP 98.A N LYS 94.A O no hydrogen 3.048 N/A LEU 99.A N ALA 95.A O no hydrogen 2.968 N/A ARG 100.A N THR 96.A O no hydrogen 3.024 N/A ARG 100.A NH1 GLU 126.A OE2 no hydrogen 3.366 N/A ARG 100.A NH2 GLU 126.A OE2 no hydrogen 2.799 N/A GLU 101.A N LYS 97.A O no hydrogen 3.194 N/A ALA 102.A N ASP 98.A O no hydrogen 2.893 N/A ILE 103.A N LEU 99.A O no hydrogen 2.864 N/A VAL 104.A N ARG 100.A O no hydrogen 2.962 N/A HIS 105.A N GLU 101.A O no hydrogen 3.245 N/A HIS 105.A NE2 ASP 2.A OD2 no hydrogen 2.848 N/A CYS 106.A N ALA 102.A O no hydrogen 2.981 N/A CYS 106.A SG ALA 102.A O no hydrogen 3.436 N/A GLU 107.A N ILE 103.A O no hydrogen 2.921 N/A GLN 108.A N VAL 104.A O no hydrogen 3.058 N/A VAL 109.A N HIS 105.A O no hydrogen 3.106 N/A HIS 110.A N GLU 107.A O no hydrogen 3.133 N/A ASP 111.A N CYS 106.A O no hydrogen 2.830 N/A SER 114.A N ASP 111.A OD1 no hydrogen 3.138 N/A SER 114.A OG ASP 111.A OD1 no hydrogen 3.027 N/A SER 114.A OG ASP 111.A OD2 no hydrogen 2.514 N/A ARG 115.A N ASP 111.A O no hydrogen 3.069 N/A ASP 116.A N TYR 112.A O no hydrogen 2.959 N/A LEU 117.A N VAL 113.A O no hydrogen 3.015 N/A LEU 118.A N SER 114.A O no hydrogen 2.939 N/A LYS 119.A N ARG 115.A O no hydrogen 2.851 N/A ASP 120.A N ASP 116.A O no hydrogen 3.094 N/A ILE 121.A N LEU 117.A O no hydrogen 3.166 N/A LEU 122.A N LEU 118.A O no hydrogen 2.827 N/A GLU 123.A N LYS 119.A O no hydrogen 2.900 N/A SER 124.A N ASP 120.A O no hydrogen 3.253 N/A GLU 125.A N ILE 121.A O no hydrogen 2.850 N/A GLU 126.A N LEU 122.A O no hydrogen 2.824 N/A GLU 127.A N GLU 123.A O no hydrogen 2.900 N/A HIS 128.A N SER 124.A O no hydrogen 3.049 N/A HIS 128.A ND1 GLU 92.A OE2 no hydrogen 2.617 N/A ILE 129.A N GLU 125.A O no hydrogen 2.845 N/A ASP 130.A N GLU 126.A O no hydrogen 2.902 N/A TYR 131.A N GLU 127.A O no hydrogen 3.049 N/A LEU 132.A N HIS 128.A O no hydrogen 2.964 N/A GLU 133.A N ILE 129.A O no hydrogen 2.946 N/A THR 134.A N ASP 130.A O no hydrogen 3.006 N/A THR 134.A OG1 ASP 130.A O no hydrogen 2.947 N/A GLN 135.A N TYR 131.A O no hydrogen 2.902 N/A GLN 135.A NE2 TYR 147.A OH no hydrogen 2.709 N/A LEU 136.A N LEU 132.A O no hydrogen 2.951 N/A GLY 137.A N GLU 133.A O no hydrogen 2.799 N/A LEU 138.A N THR 134.A O no hydrogen 2.824 N/A ILE 139.A N GLN 135.A O no hydrogen 2.973 N/A GLN 140.A N LEU 136.A O no hydrogen 3.310 N/A LYS 141.A N GLY 137.A O no hydrogen 2.966 N/A VAL 142.A N LEU 138.A O no hydrogen 2.881 N/A GLY 143.A N ILE 139.A O no hydrogen 2.804 N/A GLU 145.A N GLU 145.A OE1 no hydrogen 2.861 N/A TYR 147.A N GLY 143.A O no hydrogen 2.998 N/A LEU 148.A N LEU 144.A O no hydrogen 2.779 N/A GLN 149.A N GLU 145.A O no hydrogen 2.851 N/A SER 150.A N LEU 146.A O no hydrogen 2.970 N/A SER 150.A OG LEU 146.A O no hydrogen 3.228 N/A HIS 151.A N LEU 148.A O no hydrogen 2.796 N/A HIS 151.A ND1 TYR 147.A O no hydrogen 2.871 N/A MET 152.A N GLN 149.A O no hydrogen 3.222 N/A