Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 2ibd_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LYS 2.A NZ HIS 44.A ND1 no hydrogen 2.875 N/A ARG 5.A N GLY 1.A O no hydrogen 3.062 N/A ARG 5.A NH1 GLU 8.A OE1 no hydrogen 2.846 N/A ARG 5.A NH2 ALA 34.A O no hydrogen 3.215 N/A ARG 6.A N LYS 2.A O no hydrogen 2.869 N/A ARG 6.A NE HIS 44.A O no hydrogen 3.307 N/A ARG 6.A NH1 GLU 53.A OE1 no hydrogen 3.177 N/A ARG 6.A NH1 GLU 53.A OE2 no hydrogen 2.657 N/A ARG 6.A NH2 GLU 53.A OE1 no hydrogen 2.926 N/A THR 7.A N SER 3.A O no hydrogen 3.133 N/A THR 7.A OG1 SER 3.A O no hydrogen 3.123 N/A GLU 8.A N GLY 4.A O no hydrogen 2.968 N/A LEU 9.A N ARG 5.A O no hydrogen 2.908 N/A LEU 10.A N ARG 6.A O no hydrogen 2.970 N/A ASP 11.A N.A THR 7.A O no hydrogen 2.985 N/A ASP 11.A N.B THR 7.A O no hydrogen 2.973 N/A ILE 12.A N GLU 8.A O no hydrogen 2.973 N/A ALA 13.A N LEU 9.A O no hydrogen 2.917 N/A ALA 14.A N LEU 10.A O no hydrogen 2.872 N/A THR 15.A N ASP 11.A O.A no hydrogen 3.048 N/A THR 15.A N ASP 11.A O.B no hydrogen 3.070 N/A THR 15.A OG1 ASP 11.A O.A no hydrogen 2.985 N/A THR 15.A OG1 ASP 11.A O.B no hydrogen 2.999 N/A LEU 16.A N ILE 12.A O no hydrogen 3.086 N/A PHE 17.A N ALA 13.A O no hydrogen 2.824 N/A ALA 18.A N ALA 14.A O no hydrogen 2.886 N/A GLU 19.A N THR 15.A O no hydrogen 3.046 N/A ARG 20.A N.A LEU 16.A O no hydrogen 2.800 N/A ARG 20.A N.B LEU 16.A O no hydrogen 2.817 N/A ARG 20.A NH1.B ALA 24.A O no hydrogen 2.998 N/A ARG 20.A NH1.B ASP 29.A OD2 no hydrogen 3.142 N/A ARG 20.A NH2.B ASP 29.A OD2 no hydrogen 2.953 N/A GLY 21.A N PHE 17.A O no hydrogen 2.868 N/A LEU 22.A N GLU 104.A OE1 no hydrogen 2.819 N/A THR 25.A N LEU 22.A O no hydrogen 3.367 N/A THR 25.A OG1 GLY 21.A O no hydrogen 2.815 N/A THR 26.A N ASP 29.A OD2 no hydrogen 2.957 N/A ASP 29.A N THR 26.A OG1 no hydrogen 3.025 N/A ILE 30.A N THR 26.A O no hydrogen 3.142 N/A ALA 31.A N VAL 27.A O no hydrogen 2.830 N/A ASP 32.A N ARG 28.A O no hydrogen 2.762 N/A ALA 33.A N ASP 29.A O no hydrogen 3.120 N/A ALA 34.A N ILE 30.A O no hydrogen 2.987 N/A ALA 34.A N ALA 31.A O no hydrogen 3.004 N/A GLY 35.A N ASP 32.A O no hydrogen 3.115 N/A ILE 36.A N ALA 31.A O no hydrogen 2.943 N/A SER 40.A N LEU 37.A O no hydrogen 2.931 N/A TYR 42.A N SER 38.A O no hydrogen 3.043 N/A HIS 43.A N GLY 39.A O no hydrogen 3.200 N/A HIS 44.A N LEU 41.A O no hydrogen 3.002 N/A PHE 45.A N LEU 41.A O no hydrogen 2.944 N/A SER 47.A N SER 50.A OG no hydrogen 3.238 N/A LYS 48.A NZ LEU 22.A O no hydrogen 2.686 N/A LYS 48.A NZ THR 25.A O no hydrogen 2.742 N/A GLU 49.A N.B GLU 49.A OE1.B no hydrogen 2.787 N/A SER 50.A N SER 47.A OG no hydrogen 2.937 N/A SER 50.A OG SER 47.A O no hydrogen 2.882 N/A ASP 52.A N GLU 49.A O.A no hydrogen 2.911 N/A ASP 52.A N GLU 49.A O.B no hydrogen 2.956 N/A GLU 53.A N SER 50.A O no hydrogen 2.956 N/A LEU 55.A N VAL 51.A O no hydrogen 2.895 N/A ARG 56.A N ASP 52.A O no hydrogen 2.843 N/A ARG 56.A NE ASP 52.A OD1 no hydrogen 2.841 N/A GLY 57.A N GLU 53.A O no hydrogen 2.947 N/A PHE 58.A N ILE 54.A O no hydrogen 3.335 N/A LEU 59.A N LEU 55.A O no hydrogen 2.819 N/A ASP 60.A N ARG 56.A O no hydrogen 2.820 N/A LEU 62.A N PHE 58.A O no hydrogen 2.946 N/A PHE 63.A N LEU 59.A O no hydrogen 2.828 N/A GLY 64.A N ASP 60.A O no hydrogen 3.009 N/A LYS 65.A N ASP 61.A O no hydrogen 3.045 N/A LYS 65.A NZ ASP 61.A OD1 no hydrogen 3.353 N/A LYS 65.A NZ ASP 61.A OD2 no hydrogen 2.621 N/A TYR 66.A N LEU 62.A O no hydrogen 2.899 N/A TYR 66.A OH SER 87.A OG no hydrogen 2.725 N/A ARG 67.A N PHE 63.A O no hydrogen 2.870 N/A ARG 67.A NE GLU 123.A OE2 no hydrogen 2.832 N/A ARG 67.A NH2 GLU 123.A OE1 no hydrogen 2.836 N/A ARG 67.A NH2 GLU 123.A OE2 no hydrogen 3.517 N/A GLU 68.A N GLY 64.A O no hydrogen 3.089 N/A ILE 69.A N LYS 65.A O no hydrogen 2.826 N/A VAL 70.A N TYR 66.A O no hydrogen 3.018 N/A ALA 71.A N ARG 67.A O no hydrogen 3.125 N/A SER 72.A N ILE 69.A O no hydrogen 3.128 N/A SER 72.A OG ILE 69.A O no hydrogen 2.717 N/A SER 76.A OG ASP 137.A OD2 no hydrogen 2.696 N/A ARG 77.A NE GLU 81.A OE2 no hydrogen 2.855 N/A ARG 77.A NH1 ASP 185.A OD1 no hydrogen 2.903 N/A ARG 77.A NH2 ASP 185.A OD1 no hydrogen 3.566 N/A ARG 77.A NH2 ASP 185.A OD2 no hydrogen 2.909 N/A ALA 78.A N ASP 75.A OD1 no hydrogen 2.844 N/A THR 79.A N ASP 75.A O no hydrogen 2.821 N/A THR 79.A OG1 LEU 74.A O no hydrogen 3.092 N/A THR 79.A OG1 ASP 75.A O no hydrogen 2.706 N/A LEU 80.A N SER 76.A O no hydrogen 3.051 N/A GLU 81.A N ARG 77.A O no hydrogen 2.851 N/A ALA 82.A N ALA 78.A O no hydrogen 2.901 N/A LEU 83.A N THR 79.A O no hydrogen 2.908 N/A VAL 84.A N LEU 80.A O no hydrogen 3.020 N/A THR 85.A N GLU 81.A O no hydrogen 2.917 N/A THR 85.A OG1 GLU 81.A O no hydrogen 2.796 N/A THR 86.A N ALA 82.A O no hydrogen 2.962 N/A THR 86.A OG1 ALA 82.A O no hydrogen 2.815 N/A SER 87.A N LEU 83.A O no hydrogen 3.077 N/A SER 87.A OG TYR 66.A OH no hydrogen 2.725 N/A SER 87.A OG LEU 83.A O no hydrogen 3.136 N/A TYR 88.A N VAL 84.A O no hydrogen 2.991 N/A GLU 89.A N THR 85.A O no hydrogen 2.864 N/A ALA 90.A N THR 86.A O no hydrogen 3.116 N/A ILE 91.A N SER 87.A O no hydrogen 3.099 N/A ASP 92.A N TYR 88.A O no hydrogen 3.212 N/A ALA 93.A N GLU 89.A O no hydrogen 2.873 N/A SER 94.A N ALA 90.A O no hydrogen 2.753 N/A VAL 98.A N SER 94.A O no hydrogen 2.877 N/A ALA 99.A N HIS 95.A O no hydrogen 2.945 N/A ILE 100.A N SER 96.A O no hydrogen 2.963 N/A TYR 101.A N ALA 97.A O no hydrogen 2.846 N/A GLN 102.A N VAL 98.A O no hydrogen 2.787 N/A ASP 103.A N ALA 99.A O no hydrogen 2.983 N/A GLU 104.A N ILE 100.A O no hydrogen 2.839 N/A LEU 108.A N VAL 105.A O no hydrogen 3.043 N/A ASN 111.A N LEU 108.A O no hydrogen 2.962 N/A ASN 111.A ND2 GLU 49.A OE2.A no hydrogen 2.656 N/A ARG 113.A N ASN 111.A OD1 no hydrogen 2.854 N/A ARG 113.A NE ASP 52.A OD2 no hydrogen 2.785 N/A ARG 113.A NH1 GLU 49.A OE1.A no hydrogen 2.838 N/A ARG 113.A NH2 ASP 52.A OD2 no hydrogen 3.186 N/A PHE 114.A N ASN 111.A O no hydrogen 2.859 N/A THR 115.A N GLU 112.A O no hydrogen 3.250 N/A THR 115.A OG1 GLU 112.A O no hydrogen 2.966 N/A TYR 116.A OH ASP 52.A OD1 no hydrogen 2.775 N/A LEU 117.A N PHE 114.A O no hydrogen 2.910 N/A SER 118.A N THR 115.A O no hydrogen 2.935 N/A SER 118.A OG.A THR 115.A O no hydrogen 2.798 N/A GLU 119.A N THR 115.A O no hydrogen 3.259 N/A LEU 120.A N TYR 116.A O no hydrogen 2.819 N/A ASN 121.A N LEU 117.A O no hydrogen 2.955 N/A THR 122.A N SER 118.A O no hydrogen 3.029 N/A THR 122.A OG1 SER 118.A O no hydrogen 3.235 N/A GLU 123.A N GLU 119.A O no hydrogen 2.903 N/A PHE 124.A N LEU 120.A O no hydrogen 2.753 N/A ARG 125.A N ASN 121.A O no hydrogen 3.149 N/A ARG 125.A NE GLU 147.A OE1 no hydrogen 3.248 N/A ARG 125.A NE GLU 147.A OE2 no hydrogen 3.436 N/A ARG 125.A NH2 GLU 147.A OE1 no hydrogen 2.910 N/A GLU 126.A N THR 122.A O no hydrogen 3.027 N/A LEU 127.A N GLU 123.A O no hydrogen 2.829 N/A TRP 128.A N PHE 124.A O no hydrogen 2.872 N/A VAL 130.A N LEU 127.A O no hydrogen 3.164 N/A LEU 131.A N TRP 128.A O no hydrogen 3.025 N/A ALA 133.A N GLY 129.A O no hydrogen 2.969 N/A GLY 134.A N VAL 130.A O no hydrogen 2.943 N/A VAL 135.A N LEU 131.A O no hydrogen 2.879 N/A LYS 136.A N GLU 132.A O no hydrogen 2.996 N/A ASP 137.A N ALA 133.A O no hydrogen 2.979 N/A GLY 138.A N VAL 135.A O no hydrogen 3.096 N/A SER 139.A N ASP 137.A OD1 no hydrogen 2.980 N/A SER 139.A OG ASP 137.A OD1 no hydrogen 2.656 N/A PHE 140.A N GLY 134.A O no hydrogen 2.937 N/A ARG 141.A NE ASP 143.A OD1 no hydrogen 2.942 N/A ARG 141.A NH2 ASP 143.A OD1 no hydrogen 3.280 N/A ARG 141.A NH2 ASP 143.A OD2 no hydrogen 3.239 N/A LEU 148.A N ASP 145.A OD2 no hydrogen 2.898 N/A ALA 149.A N ASP 145.A O no hydrogen 2.950 N/A PHE 150.A N VAL 146.A O no hydrogen 2.802 N/A ARG 151.A N GLU 147.A O no hydrogen 2.789 N/A ARG 151.A NE GLU 147.A OE2 no hydrogen 2.843 N/A ARG 151.A NH2 GLU 147.A OE2 no hydrogen 3.299 N/A PHE 152.A N LEU 148.A O no hydrogen 2.908 N/A LEU 153.A N ALA 149.A O no hydrogen 3.023 N/A ARG 154.A N PHE 150.A O no hydrogen 2.787 N/A ARG 154.A NE ASP 155.A OD1.A no hydrogen 2.722 N/A ARG 154.A NH2 ASP 155.A OD1.A no hydrogen 3.375 N/A ARG 154.A NH2 ASP 155.A OD2.A no hydrogen 2.890 N/A ASP 155.A N ARG 151.A O no hydrogen 2.857 N/A THR 156.A N PHE 152.A O no hydrogen 2.981 N/A THR 156.A OG1 PHE 152.A O no hydrogen 2.690 N/A THR 156.A OG1 TYR 179.A OH no hydrogen 2.645 N/A ALA 157.A N ARG 154.A O no hydrogen 3.320 N/A VAL 161.A N TRP 158.A O no hydrogen 2.887 N/A ARG 162.A N VAL 159.A O no hydrogen 3.176 N/A ARG 162.A NE ASP 103.A OD2 no hydrogen 2.957 N/A ARG 162.A NH2 ASP 103.A OD1 no hydrogen 2.961 N/A ARG 162.A NH2 ASP 103.A OD2 no hydrogen 3.526 N/A TRP 163.A N ALA 160.A O no hydrogen 3.055 N/A TYR 164.A N ALA 160.A O no hydrogen 2.792 N/A TYR 164.A OH ASP 92.A OD1 no hydrogen 2.671 N/A GLY 168.A N ARG 165.A O no hydrogen 3.184 N/A THR 171.A OG1 THR 174.A OG1 no hydrogen 3.004 N/A THR 174.A N THR 171.A OG1 no hydrogen 3.110 N/A THR 174.A OG1 THR 171.A OG1 no hydrogen 3.004 N/A VAL 175.A N THR 171.A O no hydrogen 3.199 N/A ALA 176.A N VAL 172.A O no hydrogen 2.797 N/A LYS 177.A N ASP 173.A O no hydrogen 2.869 N/A GLN 178.A N THR 174.A O no hydrogen 3.051 N/A TYR 179.A N VAL 175.A O no hydrogen 2.961 N/A TYR 179.A OH THR 156.A OG1 no hydrogen 2.645 N/A LEU 180.A N ALA 176.A O no hydrogen 2.911 N/A SER 181.A N LYS 177.A O no hydrogen 2.890 N/A ILE 182.A N GLN 178.A O no hydrogen 2.987 N/A VAL 183.A N TYR 179.A O no hydrogen 2.886 N/A LEU 184.A N LEU 180.A O no hydrogen 2.826 N/A ASP 185.A N SER 181.A O no hydrogen 2.849 N/A GLY 186.A N ILE 182.A O no hydrogen 2.733 N/A