Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4toa_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): VAL 5.A N ASP 2.A OD2 no hydrogen 2.985 N/A ILE 6.A N ASP 2.A O no hydrogen 2.962 N/A GLN 7.A N LYS 3.A O no hydrogen 3.049 N/A HIS 8.A N LYS 4.A O no hydrogen 2.993 N/A LEU 9.A N VAL 5.A O no hydrogen 2.797 N/A ASN 10.A N ILE 6.A O no hydrogen 2.794 N/A ASN 10.A ND2 LEU 66.A O no hydrogen 2.935 N/A LYS 11.A N GLN 7.A O no hydrogen 2.897 N/A ILE 12.A N HIS 8.A O no hydrogen 2.920 N/A LEU 13.A N LEU 9.A O no hydrogen 2.887 N/A GLY 14.A N ASN 10.A O no hydrogen 2.896 N/A ASN 15.A N LYS 11.A O no hydrogen 3.053 N/A ASN 15.A ND2 ASP 98.A OD2 no hydrogen 2.831 N/A GLU 16.A N ILE 12.A O no hydrogen 2.906 N/A LEU 17.A N LEU 13.A O no hydrogen 2.910 N/A ILE 18.A N GLY 14.A O no hydrogen 3.165 N/A ALA 19.A N ASN 15.A O no hydrogen 3.041 N/A ILE 20.A N GLU 16.A O no hydrogen 2.835 N/A ASN 21.A N LEU 17.A O no hydrogen 3.482 N/A GLN 22.A N ILE 18.A O no hydrogen 2.919 N/A GLN 22.A NE2 ASP 88.A OD1 no hydrogen 2.991 N/A TYR 23.A N ALA 19.A O no hydrogen 2.849 N/A TYR 23.A OH GLU 92.A OE2 no hydrogen 2.409 N/A PHE 24.A N ILE 20.A O no hydrogen 2.903 N/A LEU 25.A N ASN 21.A O no hydrogen 2.947 N/A HIS 26.A N GLN 22.A O no hydrogen 2.867 N/A HIS 26.A ND1 ASP 88.A OD1 no hydrogen 2.911 N/A SER 27.A N TYR 23.A O no hydrogen 2.835 N/A SER 27.A OG GLY 39.A O no hydrogen 2.628 N/A ARG 28.A N PHE 24.A O no hydrogen 3.139 N/A ARG 28.A NH1 SER 27.A OG no hydrogen 2.928 N/A MET 29.A N LEU 25.A O no hydrogen 2.874 N/A TRP 30.A N HIS 26.A O no hydrogen 2.963 N/A TRP 30.A NE1 THR 81.A OG1 no hydrogen 2.800 N/A ASN 31.A N SER 27.A O no hydrogen 2.944 N/A ASP 32.A N ARG 28.A O no hydrogen 2.881 N/A TRP 33.A N MET 29.A O no hydrogen 2.946 N/A GLY 34.A N ASN 31.A O no hydrogen 2.947 N/A LEU 35.A N TRP 30.A O no hydrogen 2.844 N/A LYS 36.A N MET 152.A O no hydrogen 3.079 N/A ARG 37.A N HIS 151.A O no hydrogen 2.985 N/A GLY 39.A N LEU 35.A O no hydrogen 2.912 N/A ALA 40.A N LYS 36.A O no hydrogen 2.968 N/A HIS 41.A N ARG 37.A O no hydrogen 3.080 N/A HIS 41.A NE2 GLU 45.A OE2 no hydrogen 2.966 N/A GLU 42.A N LEU 38.A O no hydrogen 2.884 N/A TYR 43.A N GLY 39.A O no hydrogen 2.948 N/A HIS 44.A N ALA 40.A O no hydrogen 3.098 N/A GLU 45.A N HIS 41.A O no hydrogen 3.020 N/A SER 46.A N GLU 42.A O no hydrogen 2.956 N/A SER 46.A OG ILE 20.A O no hydrogen 2.888 N/A ILE 47.A N TYR 43.A O no hydrogen 2.955 N/A ASP 48.A N HIS 44.A O no hydrogen 2.947 N/A GLU 49.A N GLU 45.A O no hydrogen 3.139 N/A MET 50.A N SER 46.A O no hydrogen 3.009 N/A LYS 51.A N ILE 47.A O no hydrogen 3.010 N/A HIS 52.A N ASP 48.A O no hydrogen 3.103 N/A ALA 53.A N GLU 49.A O no hydrogen 2.889 N/A ASP 54.A N MET 50.A O no hydrogen 2.961 N/A LYS 55.A N LYS 51.A O no hydrogen 3.084 N/A LEU 56.A N HIS 52.A O no hydrogen 2.992 N/A ILE 57.A N ALA 53.A O no hydrogen 2.904 N/A GLU 58.A N ASP 54.A O no hydrogen 2.959 N/A ARG 59.A N LYS 55.A O no hydrogen 2.990 N/A ARG 59.A NE SER 114.A OG no hydrogen 2.886 N/A ARG 59.A NH2 ASP 111.A OD1 no hydrogen 2.920 N/A ARG 59.A NH2 SER 114.A OG no hydrogen 3.308 N/A ILE 60.A N LEU 56.A O no hydrogen 2.936 N/A LEU 61.A N ILE 57.A O no hydrogen 2.982 N/A PHE 62.A N GLU 58.A O no hydrogen 2.972 N/A LEU 63.A N ARG 59.A O no hydrogen 2.941 N/A GLU 64.A N LEU 61.A O no hydrogen 3.026 N/A GLY 65.A N ILE 60.A O no hydrogen 2.853 N/A ASN 68.A N ASN 10.A OD1 no hydrogen 2.778 N/A ASN 68.A ND2 ASP 71.A OD2 no hydrogen 2.798 N/A GLN 70.A N ASN 68.A OD1 no hydrogen 2.879 N/A GLN 70.A NE2 GLN 70.A O no hydrogen 3.031 N/A ASP 71.A N ASN 68.A OD1 no hydrogen 3.197 N/A LEU 76.A N GLN 22.A OE1 no hydrogen 2.889 N/A GLY 78.A N HIS 26.A NE2 no hydrogen 3.024 N/A GLU 79.A N GLU 83.A OE2 no hydrogen 3.107 N/A GLU 83.A N ASN 80.A OD1 no hydrogen 2.972 N/A MET 84.A N ASN 80.A O no hydrogen 2.786 N/A LEU 85.A N THR 81.A O no hydrogen 2.959 N/A GLN 86.A N GLN 82.A O no hydrogen 2.994 N/A GLN 86.A NE2 ASN 90.A OD1 no hydrogen 3.026 N/A CYS 87.A N GLU 83.A O no hydrogen 2.782 N/A CYS 87.A SG GLU 83.A O no hydrogen 3.314 N/A ASP 88.A N MET 84.A O no hydrogen 2.955 N/A LEU 89.A N LEU 85.A O no hydrogen 2.956 N/A ASN 90.A N GLN 86.A O no hydrogen 2.831 N/A LEU 91.A N CYS 87.A O no hydrogen 3.034 N/A GLU 92.A N ASP 88.A O no hydrogen 2.906 N/A LEU 93.A N LEU 89.A O no hydrogen 2.940 N/A LYS 94.A N ASN 90.A O no hydrogen 3.198 N/A LYS 94.A NZ ASP 98.A OD2 no hydrogen 2.798 N/A ALA 95.A N LEU 91.A O no hydrogen 2.877 N/A THR 96.A N GLU 92.A O no hydrogen 2.922 N/A THR 96.A OG1 GLU 92.A O no hydrogen 3.416 N/A THR 96.A OG1 LEU 93.A O no hydrogen 2.825 N/A LYS 97.A N LEU 93.A O no hydrogen 3.136 N/A ASP 98.A N LYS 94.A O no hydrogen 3.106 N/A LEU 99.A N ALA 95.A O no hydrogen 2.953 N/A ARG 100.A N THR 96.A O no hydrogen 2.955 N/A ARG 100.A NH1 GLU 126.A OE2 no hydrogen 3.505 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 3.180 N/A ALA 102.A N ASP 98.A O no hydrogen 2.912 N/A ILE 103.A N LEU 99.A O no hydrogen 2.918 N/A VAL 104.A N ARG 100.A O no hydrogen 3.018 N/A HIS 105.A N GLU 101.A O no hydrogen 3.189 N/A CYS 106.A N ALA 102.A O no hydrogen 2.925 N/A CYS 106.A SG ALA 102.A O no hydrogen 3.318 N/A GLU 107.A N ILE 103.A O no hydrogen 2.889 N/A GLN 108.A N VAL 104.A O no hydrogen 3.036 N/A VAL 109.A N HIS 105.A O no hydrogen 3.154 N/A HIS 110.A N GLU 107.A O no hydrogen 3.144 N/A ASP 111.A N CYS 106.A O no hydrogen 2.869 N/A SER 114.A N ASP 111.A OD1 no hydrogen 3.021 N/A SER 114.A OG ASP 111.A OD1 no hydrogen 3.069 N/A SER 114.A OG ASP 111.A OD2 no hydrogen 2.612 N/A ARG 115.A N ASP 111.A O no hydrogen 3.083 N/A ARG 115.A NH1 GLU 107.A OE2 no hydrogen 2.790 N/A ASP 116.A N TYR 112.A O no hydrogen 2.960 N/A LEU 117.A N VAL 113.A O no hydrogen 3.041 N/A LEU 118.A N SER 114.A O no hydrogen 2.982 N/A LYS 119.A N ARG 115.A O no hydrogen 2.859 N/A LYS 119.A NZ ASP 116.A OD1 no hydrogen 3.497 N/A ASP 120.A N ASP 116.A O no hydrogen 2.963 N/A ILE 121.A N LEU 117.A O no hydrogen 2.977 N/A LEU 122.A N LEU 118.A O no hydrogen 2.722 N/A GLU 123.A N LYS 119.A O no hydrogen 2.846 N/A SER 124.A N ASP 120.A O no hydrogen 3.321 N/A GLU 125.A N ILE 121.A O no hydrogen 2.918 N/A GLU 126.A N LEU 122.A O no hydrogen 2.907 N/A GLU 127.A N GLU 123.A O no hydrogen 3.008 N/A HIS 128.A N SER 124.A O no hydrogen 2.961 N/A ILE 129.A N GLU 125.A O no hydrogen 2.881 N/A ASP 130.A N GLU 126.A O no hydrogen 2.912 N/A TYR 131.A N GLU 127.A O no hydrogen 2.987 N/A LEU 132.A N HIS 128.A O no hydrogen 2.884 N/A GLU 133.A N ILE 129.A O no hydrogen 2.794 N/A THR 134.A N ASP 130.A O no hydrogen 2.985 N/A THR 134.A OG1 ASP 130.A O no hydrogen 2.827 N/A THR 134.A OG1 ASP 130.A OD1 no hydrogen 3.532 N/A GLN 135.A N TYR 131.A O no hydrogen 2.926 N/A GLN 135.A NE2 TYR 147.A OH no hydrogen 2.476 N/A LEU 136.A N LEU 132.A O no hydrogen 3.064 N/A GLY 137.A N GLU 133.A O no hydrogen 2.898 N/A LEU 138.A N THR 134.A O no hydrogen 2.864 N/A ILE 139.A N GLN 135.A O no hydrogen 2.999 N/A GLN 140.A N LEU 136.A O no hydrogen 3.237 N/A LYS 141.A N GLY 137.A O no hydrogen 2.939 N/A VAL 142.A N LEU 138.A O no hydrogen 2.894 N/A GLY 143.A N ILE 139.A O no hydrogen 2.855 N/A TYR 147.A N GLY 143.A O no hydrogen 3.011 N/A LEU 148.A N LEU 144.A O no hydrogen 2.823 N/A GLN 149.A N GLU 145.A O no hydrogen 2.838 N/A SER 150.A N LEU 146.A O no hydrogen 2.945 N/A SER 150.A OG LEU 146.A O no hydrogen 3.258 N/A HIS 151.A N LEU 148.A O no hydrogen 2.910 N/A HIS 151.A ND1 TYR 147.A O no hydrogen 2.919 N/A MET 152.A N GLN 149.A O no hydrogen 3.303 N/A