Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 2j8k_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ARG 3.A NE SER 24.A O no hydrogen 2.836 N/A ARG 3.A NH2 ASP 22.A O no hydrogen 2.927 N/A ARG 3.A NH2 SER 24.A O no hydrogen 3.034 N/A HIS 6.A NE2 ARG 29.A O no hydrogen 2.765 N/A MET 7.A N ASP 27.A O no hydrogen 2.877 N/A LYS 11.A N ASP 8.A OD2 no hydrogen 3.043 N/A LEU 12.A N ASP 8.A O no hydrogen 3.034 N/A ARG 13.A N VAL 9.A O no hydrogen 2.961 N/A GLN 14.A N GLU 10.A O no hydrogen 3.009 N/A GLN 14.A NE2 GLU 10.A OE2 no hydrogen 3.320 N/A LEU 15.A N LYS 11.A O no hydrogen 2.879 N/A TYR 16.A N LEU 12.A O no hydrogen 2.922 N/A TYR 16.A OH SER 39.A O no hydrogen 2.641 N/A ALA 17.A N ARG 13.A O no hydrogen 2.872 N/A ALA 18.A N GLN 14.A O no hydrogen 2.913 N/A GLY 19.A N TYR 16.A O no hydrogen 2.894 N/A GLU 20.A N LEU 15.A O no hydrogen 3.016 N/A ARG 21.A NH1 TYR 16.A O no hydrogen 2.908 N/A ARG 21.A NH1 GLU 20.A O no hydrogen 2.891 N/A ASP 22.A N GLU 20.A OE2 no hydrogen 2.936 N/A PHE 23.A N ILE 42.A O no hydrogen 2.732 N/A SER 24.A N ASP 22.A OD1 no hydrogen 2.974 N/A SER 24.A OG ASP 22.A OD1 no hydrogen 2.652 N/A ILE 25.A N HIS 44.A O no hydrogen 2.864 N/A VAL 26.A N PHE 23.A O no hydrogen 3.284 N/A LEU 28.A N MET 47.A O no hydrogen 2.852 N/A ARG 29.A N ASP 27.A OD1 no hydrogen 3.128 N/A ARG 29.A NE ASP 27.A OD1 no hydrogen 2.848 N/A ARG 29.A NE ASP 27.A OD2 no hydrogen 3.427 N/A ARG 29.A NH2 ASP 27.A OD2 no hydrogen 2.910 N/A GLY 30.A N ASP 49.A O no hydrogen 2.848 N/A ALA 31.A N LEU 28.A O no hydrogen 2.987 N/A LEU 33.A N ASN 52.A O no hydrogen 2.694 N/A ASN 35.A N GLN 54.A O no hydrogen 2.805 N/A ILE 36.A N LEU 33.A O no hydrogen 2.999 N/A LEU 38.A N ASN 57.A O no hydrogen 2.844 N/A SER 39.A N ASN 37.A OD1 no hydrogen 3.104 N/A SER 39.A OG TYR 16.A OH no hydrogen 3.188 N/A SER 39.A OG ASN 37.A OD1 no hydrogen 3.194 N/A GLY 40.A N SER 59.A O no hydrogen 2.848 N/A ALA 41.A N LEU 38.A O no hydrogen 2.927 N/A ILE 42.A N ARG 21.A O no hydrogen 2.698 N/A LEU 43.A N ASP 62.A O no hydrogen 2.638 N/A HIS 44.A ND1 SER 64.A OG no hydrogen 2.741 N/A GLY 45.A N SER 64.A O no hydrogen 2.936 N/A ALA 46.A N LEU 43.A O no hydrogen 2.913 N/A MET 47.A N VAL 26.A O no hydrogen 2.869 N/A LEU 48.A N THR 67.A O no hydrogen 2.755 N/A GLU 50.A N ASN 69.A O no hydrogen 2.919 N/A ALA 51.A N LEU 48.A O no hydrogen 3.045 N/A ASN 52.A N ALA 31.A O no hydrogen 2.886 N/A ASN 52.A ND2 GLU 34.A OE1 no hydrogen 3.106 N/A LEU 53.A N ASP 72.A O no hydrogen 2.689 N/A GLN 54.A N ASN 52.A OD1 no hydrogen 2.961 N/A GLN 54.A NE2 ASP 72.A OD2 no hydrogen 2.865 N/A GLN 55.A N ARG 74.A O no hydrogen 2.909 N/A ALA 56.A N LEU 53.A O no hydrogen 3.056 N/A ASN 57.A N ILE 36.A O no hydrogen 2.795 N/A LEU 58.A N ASN 77.A O no hydrogen 2.679 N/A SER 59.A N ASN 57.A OD1 no hydrogen 3.017 N/A SER 59.A OG ASN 57.A OD1 no hydrogen 2.855 N/A ARG 60.A N SER 79.A O no hydrogen 2.828 N/A ALA 61.A N LEU 58.A O no hydrogen 2.988 N/A ASP 62.A N ALA 41.A O no hydrogen 2.893 N/A LEU 63.A N ASP 82.A O no hydrogen 2.667 N/A SER 64.A N ASP 62.A OD1 no hydrogen 2.920 N/A SER 64.A OG HIS 44.A ND1 no hydrogen 2.741 N/A SER 64.A OG ASP 62.A OD1 no hydrogen 2.568 N/A GLY 65.A N SER 84.A O no hydrogen 2.868 N/A ALA 66.A N LEU 63.A O no hydrogen 2.951 N/A THR 67.A N ALA 46.A O no hydrogen 2.968 N/A THR 67.A OG1 ASP 49.A OD1 no hydrogen 2.678 N/A THR 67.A OG1 ASP 49.A OD2 no hydrogen 3.475 N/A LEU 68.A N ILE 87.A O no hydrogen 2.703 N/A ASN 69.A N ASP 49.A OD2 no hydrogen 3.031 N/A ASN 69.A ND2 ASP 49.A OD2 no hydrogen 2.809 N/A GLY 70.A N ASP 89.A O no hydrogen 3.143 N/A ALA 71.A N LEU 68.A O no hydrogen 3.032 N/A ASP 72.A N ALA 51.A O no hydrogen 2.876 N/A LEU 73.A N ILE 92.A O.A no hydrogen 2.700 N/A LEU 73.A N ILE 92.A O.B no hydrogen 2.757 N/A ARG 74.A N ASP 72.A OD1 no hydrogen 3.116 N/A ARG 74.A NE ASP 72.A OD1 no hydrogen 2.887 N/A ARG 74.A NE ASP 72.A OD2 no hydrogen 3.327 N/A ARG 74.A NH2 ASP 72.A OD2 no hydrogen 2.773 N/A GLY 75.A N GLU 94.A O.A no hydrogen 2.952 N/A GLY 75.A N GLU 94.A O.B no hydrogen 3.074 N/A ALA 76.A N LEU 73.A O no hydrogen 2.935 N/A ASN 77.A N ALA 56.A O no hydrogen 2.793 N/A LEU 78.A N ILE 97.A O no hydrogen 2.608 N/A SER 79.A N ASN 77.A OD1 no hydrogen 2.884 N/A SER 79.A OG ASN 77.A OD1 no hydrogen 2.842 N/A LYS 80.A N ASP 99.A O no hydrogen 2.839 N/A LYS 80.A NZ ASP 99.A OD2 no hydrogen 2.811 N/A ALA 81.A N LEU 78.A O no hydrogen 2.956 N/A ASP 82.A N ALA 61.A O no hydrogen 2.955 N/A LEU 83.A N VAL 102.A O.A no hydrogen 2.717 N/A LEU 83.A N VAL 102.A O.B no hydrogen 2.639 N/A SER 84.A N ASP 82.A OD1 no hydrogen 2.828 N/A SER 84.A OG.A ASP 82.A OD1 no hydrogen 2.730 N/A SER 84.A OG.B ASP 82.A OD1 no hydrogen 2.672 N/A SER 84.A OG.B ASN 104.A OD1.A no hydrogen 2.993 N/A ASP 85.A N ASN 104.A O.A no hydrogen 3.093 N/A ASP 85.A N ASN 104.A O.B no hydrogen 2.894 N/A ALA 86.A N LEU 83.A O no hydrogen 2.966 N/A ILE 87.A N ALA 66.A O no hydrogen 2.945 N/A LEU 88.A N ASN 107.A O no hydrogen 2.622 N/A ASN 90.A N LYS 109.A O no hydrogen 2.903 N/A ALA 91.A N LEU 88.A O no hydrogen 2.911 N/A ILE 92.A N.A ALA 71.A O no hydrogen 2.801 N/A ILE 92.A N.B ALA 71.A O no hydrogen 2.837 N/A LEU 93.A N ASN 112.A O no hydrogen 2.597 N/A GLY 95.A N GLU 114.A O no hydrogen 2.920 N/A ALA 96.A N LEU 93.A O no hydrogen 2.923 N/A ILE 97.A N ALA 76.A O no hydrogen 2.844 N/A LEU 98.A N ILE 117.A O no hydrogen 2.609 N/A GLU 100.A N SER 119.A O no hydrogen 2.844 N/A ALA 101.A N LEU 98.A O no hydrogen 3.065 N/A VAL 102.A N.A ALA 81.A O no hydrogen 2.919 N/A VAL 102.A N.B ALA 81.A O no hydrogen 2.921 N/A LEU 103.A N ASN 122.A O no hydrogen 2.618 N/A ASN 104.A ND2.A GLN 105.A OE1.B no hydrogen 2.693 N/A GLN 105.A N.A ARG 124.A O no hydrogen 2.885 N/A GLN 105.A N.B ARG 124.A O no hydrogen 2.915 N/A GLN 105.A NE2.A GLU 125.A OE1 no hydrogen 2.884 N/A ALA 106.A N LEU 103.A O no hydrogen 2.989 N/A ASN 107.A N ALA 86.A O no hydrogen 2.921 N/A LEU 108.A N ASP 127.A O no hydrogen 2.731 N/A LYS 109.A N ASP 89.A OD1 no hydrogen 2.811 N/A LYS 109.A NZ GLU 130.A OE2 no hydrogen 2.735 N/A ALA 110.A N SER 129.A O no hydrogen 2.904 N/A ALA 111.A N LEU 108.A O no hydrogen 3.095 N/A ASN 112.A N ALA 91.A O no hydrogen 3.006 N/A LEU 113.A N ASN 132.A O no hydrogen 2.674 N/A GLU 114.A N ASN 112.A OD1 no hydrogen 2.983 N/A GLN 115.A N GLU 134.A O no hydrogen 2.856 N/A ALA 116.A N LEU 113.A O no hydrogen 2.954 N/A ILE 117.A N ALA 96.A O no hydrogen 2.925 N/A LEU 118.A N ASP 137.A O no hydrogen 2.642 N/A SER 119.A OG ASP 99.A OD1 no hydrogen 2.647 N/A HIS 120.A N SER 139.A O no hydrogen 2.815 N/A ALA 121.A N LEU 118.A O no hydrogen 3.078 N/A ASN 122.A N ALA 101.A O no hydrogen 3.028 N/A ILE 123.A N ASP 142.A O no hydrogen 2.684 N/A ARG 124.A N ASN 122.A OD1 no hydrogen 3.047 N/A ARG 124.A NH1 ASP 142.A OD2 no hydrogen 2.837 N/A GLU 125.A N ALA 144.A O no hydrogen 2.855 N/A ALA 126.A N ILE 123.A O no hydrogen 3.365 N/A ASP 127.A N ALA 106.A O no hydrogen 2.990 N/A LEU 128.A N ASP 147.A O no hydrogen 2.731 N/A SER 129.A N ASP 127.A OD1 no hydrogen 3.011 N/A SER 129.A OG ASP 127.A OD1 no hydrogen 2.884 N/A GLU 130.A N HIS 149.A O no hydrogen 2.933 N/A ALA 131.A N LEU 128.A O no hydrogen 3.043 N/A ASN 132.A N ALA 111.A O no hydrogen 2.944 N/A ASN 132.A ND2 ASN 112.A OD1 no hydrogen 3.373 N/A ASN 132.A ND2 GLU 114.A OE1 no hydrogen 3.209 N/A LEU 133.A N ASN 152.A O no hydrogen 2.739 N/A GLU 134.A N ASN 132.A OD1 no hydrogen 3.087 N/A ALA 135.A N HIS 154.A O no hydrogen 2.898 N/A ALA 136.A N LEU 133.A O no hydrogen 2.945 N/A ASP 137.A N ALA 116.A O no hydrogen 2.901 N/A LEU 138.A N ALA 157.A O no hydrogen 2.802 N/A SER 139.A N ASP 137.A OD1 no hydrogen 2.966 N/A SER 139.A OG ASP 137.A OD1 no hydrogen 2.603 N/A GLY 140.A N GLU 159.A O no hydrogen 2.968 N/A ALA 141.A N LEU 138.A O no hydrogen 2.913 N/A ASP 142.A N ALA 121.A O no hydrogen 2.867 N/A LEU 143.A N ASN 162.A O no hydrogen 2.772 N/A ALA 144.A N ASP 142.A OD1 no hydrogen 2.975 N/A ILE 145.A N THR 164.A O no hydrogen 2.978 N/A ALA 146.A N LEU 143.A O no hydrogen 2.976 N/A ASP 147.A N ALA 126.A O no hydrogen 2.925 N/A LEU 148.A N ASN 167.A O no hydrogen 2.821 N/A HIS 149.A N ASP 147.A OD1 no hydrogen 3.009 N/A HIS 149.A ND1 ASP 147.A OD1 no hydrogen 2.642 N/A GLN 150.A N GLU 169.A O no hydrogen 2.883 N/A ALA 151.A N LEU 148.A O no hydrogen 2.953 N/A ASN 152.A N ALA 131.A O no hydrogen 2.940 N/A ASN 152.A ND2 ASN 132.A OD1 no hydrogen 3.107 N/A ASN 152.A ND2 GLU 134.A OE1 no hydrogen 2.901 N/A LEU 153.A N ASN 172.A O no hydrogen 2.849 N/A HIS 154.A N ASN 152.A OD1 no hydrogen 3.009 N/A GLN 155.A N GLU 174.A O no hydrogen 2.827 N/A ALA 156.A N LEU 153.A O no hydrogen 2.845 N/A ALA 157.A N ALA 136.A O no hydrogen 2.875 N/A ALA 161.A N LEU 158.A O no hydrogen 2.941 N/A ASN 162.A N ALA 141.A O no hydrogen 2.912 N/A ASN 162.A ND2 ASP 142.A OD1 no hydrogen 2.776 N/A THR 164.A N ASN 162.A OD1 no hydrogen 3.095 N/A THR 164.A OG1 ASN 162.A OD1 no hydrogen 2.640 N/A ALA 166.A N LEU 163.A O no hydrogen 2.967 N/A ASN 167.A N ALA 146.A O no hydrogen 2.930 N/A GLU 169.A N ASN 167.A OD1 no hydrogen 2.984 N/A ALA 171.A N LEU 168.A O no hydrogen 3.008 N/A ASN 172.A N ALA 151.A O no hydrogen 2.984 N/A ASN 172.A ND2 ASN 152.A OD1 no hydrogen 3.427 N/A GLU 174.A N ASN 172.A OD1 no hydrogen 3.004 N/A GLY 175.A N GLU 179.A OE1 no hydrogen 2.776 N/A THR 176.A N LEU 173.A O no hydrogen 3.114 N/A THR 176.A OG1 LEU 173.A O no hydrogen 2.759 N/A LEU 178.A N THR 176.A OG1 no hydrogen 3.049 N/A GLU 179.A N THR 176.A O no hydrogen 3.048 N/A GLY 181.A N LEU 178.A O no hydrogen 3.222 N/A