Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4ksh_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ALA 4.A N GLY 1.A O no hydrogen 3.102 N/A ARG 6.A N LEU 2.A O no hydrogen 3.249 N/A ARG 6.A NH1 ASP 140.A OD2 no hydrogen 2.902 N/A ARG 6.A NH2 ALA 93.A O no hydrogen 2.831 N/A ARG 6.A NH2 ASP 140.A OD2 no hydrogen 2.907 N/A LYS 7.A N GLU 3.A O no hydrogen 3.178 N/A LYS 7.A N ALA 4.A O no hydrogen 3.303 N/A ARG 8.A N ALA 4.A O no hydrogen 2.801 N/A MET 11.A N ARG 8.A O no hydrogen 3.047 N/A TYR 12.A N PRO 9.A O no hydrogen 2.957 N/A ILE 13.A N PRO 9.A O no hydrogen 2.928 N/A GLY 14.A N GLY 10.A O no hydrogen 3.197 N/A SER 15.A OG SER 17.A OG no hydrogen 2.903 N/A SER 17.A N SER 15.A OG no hydrogen 3.265 N/A SER 17.A OG SER 15.A OG no hydrogen 2.903 N/A GLU 19.A N SER 17.A OG no hydrogen 3.198 N/A LEU 21.A N SER 17.A O no hydrogen 3.150 N/A HIS 22.A N GLY 18.A O no hydrogen 3.075 N/A HIS 22.A ND1 GLY 18.A O no hydrogen 2.750 N/A HIS 23.A N GLU 19.A O no hydrogen 2.950 N/A LEU 24.A N GLY 20.A O no hydrogen 3.185 N/A GLU 27.A N HIS 23.A O no hydrogen 3.020 N/A ILE 28.A N LEU 24.A O no hydrogen 3.307 N/A VAL 29.A N VAL 25.A O no hydrogen 2.838 N/A ASP 30.A N TRP 26.A O no hydrogen 2.755 N/A ASN 31.A ND2 GLU 27.A O no hydrogen 2.670 N/A SER 32.A N ILE 28.A O no hydrogen 3.362 N/A SER 32.A OG ASP 58.A OD1 no hydrogen 2.737 N/A ILE 33.A N VAL 29.A O no hydrogen 2.854 N/A ASP 34.A N ASP 30.A O no hydrogen 2.940 N/A GLU 35.A N ASN 31.A O no hydrogen 3.284 N/A ALA 36.A N SER 32.A O no hydrogen 2.963 N/A LEU 37.A N ILE 33.A O no hydrogen 2.795 N/A ALA 38.A N ASP 34.A O no hydrogen 2.922 N/A GLY 39.A N ALA 36.A O no hydrogen 2.964 N/A PHE 40.A N GLU 35.A O no hydrogen 3.155 N/A ALA 41.A N GLU 35.A O no hydrogen 3.124 N/A LYS 42.A N ASP 59.A OD1 no hydrogen 2.759 N/A SER 43.A N ASP 59.A OD1 no hydrogen 2.943 N/A ILE 44.A N HIS 170.A O no hydrogen 2.888 N/A GLN 45.A N ILE 57.A O no hydrogen 2.810 N/A VAL 46.A N SER 172.A O no hydrogen 2.957 N/A ILE 47.A N THR 55.A O no hydrogen 2.794 N/A ILE 48.A N GLU 174.A O no hydrogen 2.752 N/A GLU 49.A N SER 53.A O no hydrogen 2.823 N/A ASP 52.A N GLU 49.A O no hydrogen 3.024 N/A SER 53.A N ASP 51.A OD1 no hydrogen 3.040 N/A SER 53.A OG ASP 51.A OD1 no hydrogen 2.672 N/A SER 53.A OG ASP 51.A OD2 no hydrogen 3.460 N/A SER 53.A OG HIS 136.A NE2 no hydrogen 2.713 N/A ILE 54.A N PHE 137.A O no hydrogen 2.926 N/A THR 55.A N ILE 47.A O no hydrogen 2.950 N/A THR 55.A OG1 GLU 49.A OE2 no hydrogen 2.639 N/A VAL 56.A N VAL 135.A O no hydrogen 2.768 N/A ILE 57.A N GLN 45.A O no hydrogen 2.878 N/A ASP 58.A N THR 133.A O no hydrogen 2.902 N/A GLY 60.A N ASP 58.A OD2 no hydrogen 2.972 N/A ARG 61.A N GLU 35.A OE2 no hydrogen 2.950 N/A ARG 61.A NE GLU 35.A OE2 no hydrogen 2.763 N/A ARG 61.A NH1 GLU 35.A OE1 no hydrogen 2.926 N/A ILE 63.A N THR 133.A OG1 no hydrogen 3.081 N/A GLN 68.A N ARG 73.A O no hydrogen 3.012 N/A GLN 68.A NE2 ARG 73.A O no hydrogen 3.270 N/A GLN 68.A NE2 THR 78.A OG1 no hydrogen 2.782 N/A THR 71.A N GLN 68.A O no hydrogen 3.332 N/A THR 71.A OG1 ARG 73.A O no hydrogen 3.319 N/A GLY 72.A N GLN 68.A O no hydrogen 2.758 N/A ARG 73.A N THR 71.A OG1 no hydrogen 3.059 N/A ARG 73.A NE GLU 77.A OE2 no hydrogen 2.735 N/A ARG 73.A NH2 GLU 77.A OE1 no hydrogen 2.846 N/A ARG 73.A NH2 GLU 77.A OE2 no hydrogen 3.335 N/A ARG 73.A NH2 ASP 121.A OD1 no hydrogen 2.899 N/A ALA 75.A N GLY 66.A O no hydrogen 2.893 N/A THR 78.A N PRO 74.A O no hydrogen 3.314 N/A VAL 79.A N ALA 75.A O no hydrogen 3.065 N/A PHE 80.A N GLU 77.A O no hydrogen 3.046 N/A THR 81.A N THR 78.A O no hydrogen 3.286 N/A THR 81.A OG1 GLU 77.A O no hydrogen 2.806 N/A VAL 82.A N THR 78.A O no hydrogen 3.071 N/A SER 89.A OG VAL 82.A O no hydrogen 2.957 N/A VAL 91.A N GLY 87.A O no hydrogen 3.150 N/A ASN 92.A N SER 88.A O no hydrogen 2.951 N/A ASN 92.A ND2 PHE 80.A O no hydrogen 2.735 N/A ASN 92.A ND2 GLY 116.A O no hydrogen 3.476 N/A ALA 93.A N SER 89.A O no hydrogen 2.888 N/A LEU 94.A N VAL 90.A O no hydrogen 3.099 N/A LEU 94.A N VAL 91.A O no hydrogen 3.225 N/A SER 95.A N ASN 92.A O no hydrogen 3.124 N/A SER 95.A OG VAL 91.A O no hydrogen 2.809 N/A THR 96.A N ILE 138.A O no hydrogen 2.781 N/A THR 96.A OG1 ILE 138.A O no hydrogen 3.514 N/A SER 97.A OG TYR 113.A O no hydrogen 3.473 N/A LEU 98.A N TYR 113.A O no hydrogen 3.129 N/A ASP 99.A N HIS 136.A O no hydrogen 2.836 N/A VAL 100.A N GLN 111.A O no hydrogen 2.870 N/A ARG 101.A N THR 134.A O no hydrogen 2.851 N/A VAL 102.A N TYR 109.A O no hydrogen 2.833 N/A TYR 103.A N GLY 132.A O no hydrogen 2.837 N/A LYS 104.A N LYS 107.A O no hydrogen 2.972 N/A LYS 104.A NZ ARG 61.A O no hydrogen 3.439 N/A LYS 104.A NZ GLY 62.A O no hydrogen 2.879 N/A LYS 107.A N LYS 104.A O no hydrogen 2.955 N/A VAL 108.A N GLU 126.A O no hydrogen 2.926 N/A TYR 109.A N VAL 102.A O no hydrogen 2.805 N/A TYR 110.A N LYS 123.A O no hydrogen 2.799 N/A TYR 110.A OH GLU 112.A OE2 no hydrogen 2.430 N/A GLN 111.A N VAL 100.A O no hydrogen 3.125 N/A GLN 111.A NE2 GLU 77.A OE1 no hydrogen 2.858 N/A GLN 111.A NE2 ASP 120.A O no hydrogen 2.961 N/A TYR 113.A N LEU 98.A O no hydrogen 2.882 N/A TYR 113.A OH GLN 111.A OE1 no hydrogen 2.609 N/A ARG 114.A N ALA 117.A O no hydrogen 2.799 N/A ARG 114.A NE GLU 112.A OE1 no hydrogen 3.124 N/A ARG 114.A NH1 GLU 112.A OE1 no hydrogen 2.582 N/A ARG 115.A N THR 96.A O no hydrogen 3.042 N/A ARG 115.A NE ASP 140.A OD2 no hydrogen 2.807 N/A ARG 115.A NH2 ASP 140.A OD1 no hydrogen 2.923 N/A ALA 117.A N ARG 114.A O no hydrogen 2.932 N/A VAL 119.A N GLU 112.A O no hydrogen 2.933 N/A ASP 121.A N ASP 120.A OD2 no hydrogen 2.914 N/A LYS 123.A N TYR 110.A O no hydrogen 3.111 N/A ILE 125.A N VAL 108.A O no hydrogen 2.883 N/A THR 128.A N GLY 106.A O no hydrogen 2.973 N/A ARG 130.A N THR 128.A OG1 no hydrogen 3.109 N/A ARG 130.A NH1 ASP 58.A O no hydrogen 3.160 N/A HIS 131.A ND1 GLY 60.A O no hydrogen 2.885 N/A GLY 132.A N TYR 103.A O no hydrogen 2.988 N/A THR 133.A N ASP 58.A OD2 no hydrogen 3.091 N/A THR 134.A N ARG 101.A O no hydrogen 2.850 N/A VAL 135.A N VAL 56.A O no hydrogen 2.919 N/A HIS 136.A N ASP 99.A O no hydrogen 2.959 N/A HIS 136.A ND1 ASP 99.A OD2 no hydrogen 2.731 N/A HIS 136.A NE2 SER 53.A OG no hydrogen 2.713 N/A PHE 137.A N ILE 54.A O no hydrogen 2.903 N/A ILE 138.A N SER 97.A O no hydrogen 2.957 N/A ASP 140.A N LEU 94.A O no hydrogen 2.900 N/A GLU 142.A N ASP 140.A OD1 no hydrogen 2.954 N/A ILE 143.A N ASP 140.A O no hydrogen 2.917 N/A PHE 144.A N ASP 140.A O no hydrogen 2.838 N/A VAL 149.A N THR 147.A OG1 no hydrogen 3.062 N/A TYR 150.A N ASP 52.A OD1 no hydrogen 3.128 N/A TYR 150.A OH LEU 21.A O no hydrogen 2.859 N/A ASP 151.A N HIS 22.A NE2 no hydrogen 2.914 N/A LYS 154.A N ASP 151.A OD2 no hydrogen 3.022 N/A LYS 154.A NZ GLU 19.A OE1 no hydrogen 2.643 N/A LYS 154.A NZ GLU 19.A OE2 no hydrogen 3.275 N/A LEU 155.A N ASP 151.A O no hydrogen 3.060 N/A ALA 156.A N PHE 152.A O no hydrogen 2.816 N/A THR 157.A N ASP 153.A O no hydrogen 2.857 N/A THR 157.A OG1 ASP 153.A O no hydrogen 2.902 N/A ARG 158.A N LYS 154.A O no hydrogen 3.331 N/A ARG 158.A NH2 GLU 161.A OE1 no hydrogen 3.434 N/A VAL 159.A N LEU 155.A O no hydrogen 2.841 N/A ARG 160.A N ALA 156.A O no hydrogen 2.935 N/A GLU 161.A N THR 157.A O no hydrogen 3.158 N/A LEU 162.A N ARG 158.A O no hydrogen 2.800 N/A ALA 163.A N VAL 159.A O no hydrogen 2.891 N/A PHE 164.A N ARG 160.A O no hydrogen 3.044 N/A LEU 165.A N GLU 161.A O no hydrogen 2.919 N/A ASN 166.A N LEU 162.A O no hydrogen 2.926 N/A ASN 166.A ND2 LEU 162.A O no hydrogen 2.802 N/A ARG 167.A NH1 GLU 189.A O no hydrogen 2.839 N/A GLY 168.A N TYR 188.A O no hydrogen 2.832 N/A LEU 169.A N ASN 166.A O no hydrogen 2.948 N/A HIS 170.A N LYS 42.A O no hydrogen 3.034 N/A ILE 171.A N TYR 186.A O no hydrogen 2.985 N/A SER 172.A N ILE 44.A O no hydrogen 2.990 N/A ILE 173.A N LYS 184.A O no hydrogen 2.908 N/A GLU 174.A N VAL 46.A O no hydrogen 2.849 N/A ASP 175.A N ASP 182.A O no hydrogen 2.811 N/A ARG 176.A N ILE 48.A O no hydrogen 2.873 N/A ARG 176.A NE GLU 174.A OE1 no hydrogen 3.358 N/A ARG 176.A NH1 GLU 49.A OE1 no hydrogen 3.083 N/A ARG 177.A N ASP 175.A OD1 no hydrogen 3.020 N/A ARG 177.A NE ASP 175.A OD1 no hydrogen 2.831 N/A ARG 177.A NE ASP 175.A OD2 no hydrogen 3.468 N/A ARG 177.A NH1 ASP 52.A OD1 no hydrogen 2.749 N/A ARG 177.A NH1 TYR 150.A O no hydrogen 2.820 N/A ARG 177.A NH2 TYR 150.A O no hydrogen 3.065 N/A ARG 177.A NH2 ASP 175.A OD2 no hydrogen 3.007 N/A GLN 180.A N ARG 177.A O no hydrogen 3.280 N/A GLN 180.A NE2 ASP 175.A OD2 no hydrogen 2.980 N/A GLU 181.A N GLU 181.A OE2 no hydrogen 2.816 N/A ASP 182.A N ASP 175.A O no hydrogen 3.072 N/A LYS 183.A N ASP 182.A OD1 no hydrogen 2.970 N/A LYS 184.A N ILE 173.A O no hydrogen 2.901 N/A TYR 186.A N ILE 171.A O no hydrogen 2.819 N/A GLY 190.A N GLU 192.A OE1 no hydrogen 3.015 N/A GLU 192.A N GLU 192.A OE2 no hydrogen 2.758 N/A HIS 193.A N GLY 190.A O no hydrogen 3.198 N/A