Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4gt9_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ILE 4.A N VAL 12.A O no hydrogen 2.836 N/A ILE 6.A N GLY 10.A O no hydrogen 2.980 N/A LYS 9.A N TYR 153.A OH no hydrogen 3.337 N/A LYS 9.A NZ ASP 8.A OD2 no hydrogen 3.236 N/A LYS 9.A NZ PHE 96.A O no hydrogen 2.690 N/A GLY 10.A N ILE 6.A O no hydrogen 2.835 N/A PHE 11.A N LYS 65.A O no hydrogen 3.134 N/A VAL 12.A N ILE 4.A O no hydrogen 2.887 N/A GLU 13.A N HIS 63.A O no hydrogen 2.877 N/A LEU 14.A N MET 2.A O no hydrogen 2.818 N/A VAL 15.A N THR 61.A O no hydrogen 2.761 N/A ASP 16.A N THR 61.A O no hydrogen 3.246 N/A VAL 17.A N ASP 16.A OD1 no hydrogen 2.927 N/A MET 18.A N VAL 59.A O no hydrogen 2.794 N/A ASN 20.A N SER 23.A OG no hydrogen 3.014 N/A SER 23.A N ASN 20.A O no hydrogen 2.935 N/A SER 23.A N ASN 20.A OD1 no hydrogen 3.332 N/A SER 23.A OG ASN 20.A O no hydrogen 3.367 N/A ALA 24.A N ASP 21.A O no hydrogen 3.153 N/A VAL 25.A N ASP 21.A O no hydrogen 3.443 N/A ARG 26.A N LEU 22.A O no hydrogen 2.859 N/A ARG 26.A NH2 GLY 35.A O no hydrogen 3.217 N/A ALA 27.A N SER 23.A O no hydrogen 3.059 N/A ALA 28.A N ALA 24.A O no hydrogen 2.923 N/A ARG 29.A N VAL 25.A O no hydrogen 2.985 N/A ARG 29.A NH1 ASP 39.A OD1 no hydrogen 2.853 N/A ARG 29.A NH2 ASP 39.A OD1 no hydrogen 3.080 N/A VAL 30.A N ALA 27.A O no hydrogen 3.125 N/A SER 31.A N.A ARG 26.A O no hydrogen 2.980 N/A SER 31.A N.B ARG 26.A O no hydrogen 2.984 N/A SER 31.A OG.B ASP 33.A O no hydrogen 3.196 N/A ASP 33.A N SER 31.A OG.B no hydrogen 3.024 N/A ARG 38.A N GLU 36.A OE1 no hydrogen 3.442 N/A ARG 40.A N GLU 36.A O no hydrogen 3.008 N/A HIS 41.A N GLU 37.A O no hydrogen 3.013 N/A HIS 41.A ND1 GLU 44.A OE1 no hydrogen 3.329 N/A LEU 42.A N ARG 38.A O no hydrogen 3.021 N/A ILE 43.A N.A ASP 39.A O no hydrogen 3.140 N/A ILE 43.A N.B ASP 39.A O no hydrogen 3.108 N/A GLU 44.A N ARG 40.A O no hydrogen 3.006 N/A TYR 45.A N HIS 41.A O no hydrogen 2.887 N/A LEU 46.A N LEU 42.A O no hydrogen 2.893 N/A MET 47.A N ILE 43.A O.A no hydrogen 3.015 N/A MET 47.A N ILE 43.A O.B no hydrogen 3.067 N/A LYS 48.A N GLU 44.A O no hydrogen 2.840 N/A LYS 48.A NZ TYR 206.A OH no hydrogen 3.431 N/A HIS 49.A N TYR 45.A O no hydrogen 3.145 N/A HIS 49.A ND1 TYR 45.A O no hydrogen 2.906 N/A GLY 50.A N MET 47.A O no hydrogen 3.341 N/A HIS 51.A N LEU 46.A O no hydrogen 2.895 N/A PHE 55.A N GLU 52.A O no hydrogen 3.073 N/A GLU 56.A N THR 53.A O no hydrogen 2.952 N/A HIS 57.A N PRO 54.A O no hydrogen 3.275 N/A ILE 58.A N PHE 55.A O no hydrogen 3.306 N/A VAL 59.A N MET 18.A O no hydrogen 3.075 N/A PHE 60.A N VAL 160.A O no hydrogen 2.893 N/A THR 61.A N ASP 16.A O no hydrogen 2.874 N/A THR 61.A OG1 THR 159.A OG1 no hydrogen 2.715 N/A PHE 62.A N TRP 158.A O no hydrogen 2.823 N/A HIS 63.A N GLU 13.A O no hydrogen 2.838 N/A VAL 64.A N PHE 156.A O no hydrogen 2.908 N/A LYS 65.A N PHE 11.A O no hydrogen 2.958 N/A LYS 65.A NZ LYS 9.A O no hydrogen 2.902 N/A LYS 65.A NZ GLU 95.A OE1 no hydrogen 2.744 N/A LYS 65.A NZ GLU 95.A OE2 no hydrogen 3.330 N/A ALA 66.A N THR 154.A O no hydrogen 2.961 N/A ILE 68.A N LEU 152.A O no hydrogen 2.868 N/A PHE 69.A N LEU 150.A O no hydrogen 2.985 N/A ALA 71.A N PRO 67.A O no hydrogen 2.975 N/A ARG 72.A N ILE 68.A O no hydrogen 2.807 N/A GLN 73.A NE2 GLN 178.A OE1 no hydrogen 3.210 N/A TRP 74.A N VAL 70.A O no hydrogen 2.972 N/A PHE 75.A N ALA 71.A O no hydrogen 2.851 N/A ARG 76.A N GLN 73.A O no hydrogen 3.136 N/A HIS 77.A N TRP 74.A O no hydrogen 3.077 N/A SER 81.A N THR 159.A O no hydrogen 2.879 N/A TYR 82.A OH HIS 77.A O no hydrogen 2.622 N/A ASN 83.A N PHE 157.A O no hydrogen 3.059 N/A LEU 85.A N ARG 155.A O no hydrogen 3.071 N/A ARG 88.A N SER 86.A OG no hydrogen 3.040 N/A ARG 88.A NE GLU 142.A OE1 no hydrogen 2.811 N/A ARG 88.A NH2 GLU 142.A OE1 no hydrogen 2.917 N/A TYR 89.A N SER 86.A OG no hydrogen 3.174 N/A SER 90.A N.A SER 86.A O no hydrogen 3.031 N/A SER 90.A N.B SER 86.A O no hydrogen 3.058 N/A SER 90.A OG.B SER 86.A O no hydrogen 2.626 N/A LYS 91.A NZ TYR 128.A OH no hydrogen 2.725 N/A LEU 92.A N TYR 131.A OH no hydrogen 2.957 N/A TYR 94.A OH ASP 125.A OD1 no hydrogen 2.652 N/A TYR 97.A N ASN 151.A O no hydrogen 2.903 N/A TYR 97.A OH GLU 180.A OE2 no hydrogen 2.599 N/A ILE 98.A N ASP 8.A OD2 no hydrogen 2.976 N/A SER 100.A OG GLU 102.A OE1 no hydrogen 3.277 N/A GLU 102.A N GLU 102.A OE1 no hydrogen 2.812 N/A ARG 103.A N SER 100.A O no hydrogen 2.934 N/A ARG 103.A NE GLU 180.A OE1 no hydrogen 3.501 N/A ARG 103.A NE GLU 180.A OE2 no hydrogen 2.726 N/A ARG 103.A NH1 ARG 103.A O no hydrogen 3.117 N/A ARG 103.A NH2 GLU 180.A OE1 no hydrogen 3.010 N/A LEU 104.A N PRO 101.A O no hydrogen 3.171 N/A GLU 105.A N GLU 102.A O no hydrogen 3.106 N/A TYR 107.A N LEU 104.A O no hydrogen 2.982 N/A THR 109.A OG1 ILE 111.A O no hydrogen 2.672 N/A ARG 115.A NH1 GLU 118.A OE1 no hydrogen 2.926 N/A ARG 115.A NH1 GLU 122.A OE2 no hydrogen 3.289 N/A ARG 115.A NH2 GLU 122.A OE1 no hydrogen 3.569 N/A VAL 116.A N PRO 112.A O no hydrogen 3.063 N/A THR 117.A N PRO 113.A O no hydrogen 3.091 N/A THR 117.A OG1 PRO 99.A O no hydrogen 3.002 N/A THR 117.A OG1 PRO 113.A O no hydrogen 3.470 N/A GLU 118.A N GLU 114.A O no hydrogen 3.073 N/A LYS 119.A N ARG 115.A O no hydrogen 2.850 N/A ILE 120.A N VAL 116.A O no hydrogen 3.026 N/A SER 121.A N THR 117.A O no hydrogen 3.043 N/A SER 121.A OG THR 117.A O no hydrogen 3.330 N/A GLU 122.A N GLU 118.A O no hydrogen 2.862 N/A ILE 123.A N LYS 119.A O no hydrogen 3.101 N/A VAL 124.A N ILE 120.A O no hydrogen 3.134 N/A ASP 125.A N SER 121.A O no hydrogen 3.083 N/A LYS 126.A N GLU 122.A O no hydrogen 3.104 N/A ALA 127.A N ILE 123.A O no hydrogen 2.929 N/A TYR 128.A N VAL 124.A O no hydrogen 2.922 N/A TYR 128.A OH LEU 92.A O no hydrogen 2.645 N/A ARG 129.A N ASP 125.A O no hydrogen 2.953 N/A ARG 129.A NH2 ASP 125.A OD2 no hydrogen 2.385 N/A THR 130.A N LYS 126.A O no hydrogen 2.996 N/A THR 130.A OG1 LYS 126.A O no hydrogen 3.282 N/A TYR 131.A N ALA 127.A O no hydrogen 2.929 N/A LEU 132.A N.A TYR 128.A O no hydrogen 2.888 N/A LEU 132.A N.B TYR 128.A O no hydrogen 2.886 N/A GLU 133.A N ARG 129.A O no hydrogen 2.948 N/A LEU 134.A N THR 130.A O no hydrogen 2.903 N/A ILE 135.A N TYR 131.A O no hydrogen 2.933 N/A GLU 136.A N LEU 132.A O.A no hydrogen 2.811 N/A GLU 136.A N LEU 132.A O.B no hydrogen 2.791 N/A SER 137.A N.A LEU 134.A O no hydrogen 3.061 N/A SER 137.A N.B GLU 133.A O no hydrogen 3.087 N/A SER 137.A N.B LEU 134.A O no hydrogen 3.039 N/A SER 137.A OG.A LEU 134.A O no hydrogen 2.834 N/A SER 137.A OG.B GLU 133.A O no hydrogen 2.618 N/A GLY 138.A N ILE 135.A O no hydrogen 3.078 N/A VAL 139.A N LEU 134.A O no hydrogen 3.116 N/A ARG 141.A NH1.A ARG 88.A O no hydrogen 3.094 N/A VAL 143.A N PRO 140.A O no hydrogen 2.992 N/A ALA 144.A N PRO 140.A O no hydrogen 2.941 N/A ARG 145.A N ARG 141.A O.A no hydrogen 3.036 N/A ARG 145.A N ARG 141.A O.B no hydrogen 3.043 N/A ARG 145.A NE GLU 142.A O no hydrogen 2.882 N/A ILE 146.A N VAL 143.A O no hydrogen 3.105 N/A LEU 148.A N ARG 145.A O no hydrogen 3.060 N/A ASN 151.A ND2 TYR 97.A O no hydrogen 2.884 N/A LEU 152.A N PRO 149.A O no hydrogen 3.059 N/A TYR 153.A N GLU 95.A O no hydrogen 2.889 N/A TYR 153.A OH ASP 8.A OD1 no hydrogen 2.627 N/A THR 154.A N ALA 66.A O no hydrogen 2.837 N/A THR 154.A OG1 GLU 84.A OE2 no hydrogen 2.664 N/A ARG 155.A NH1 HIS 63.A NE2 no hydrogen 2.954 N/A PHE 156.A N VAL 64.A O no hydrogen 2.916 N/A PHE 157.A N ASN 83.A O no hydrogen 2.859 N/A TRP 158.A N PHE 62.A O no hydrogen 2.857 N/A TRP 158.A NE1 TYR 82.A OH no hydrogen 3.055 N/A THR 159.A N SER 81.A O no hydrogen 2.919 N/A THR 159.A OG1 THR 61.A OG1 no hydrogen 2.715 N/A VAL 160.A N PHE 60.A O no hydrogen 2.958 N/A ALA 162.A N ILE 58.A O no hydrogen 2.918 N/A ARG 163.A NH1 GLU 56.A OE2 no hydrogen 2.799 N/A SER 164.A N ASN 161.A OD1 no hydrogen 2.996 N/A SER 164.A OG ILE 79.A O no hydrogen 2.746 N/A LEU 165.A N ASN 161.A O no hydrogen 2.863 N/A MET 166.A N ALA 162.A O no hydrogen 2.909 N/A ASN 167.A N ARG 163.A O no hydrogen 3.078 N/A PHE 168.A N SER 164.A O no hydrogen 2.882 N/A LEU 169.A N LEU 165.A O no hydrogen 2.855 N/A ASN 170.A N MET 166.A O no hydrogen 2.899 N/A LEU 171.A N ASN 167.A O no hydrogen 3.152 N/A ARG 172.A N PHE 168.A O no hydrogen 2.779 N/A ARG 172.A NE HIS 77.A NE2 no hydrogen 3.012 N/A ARG 172.A NH2 HIS 77.A NE2 no hydrogen 3.471 N/A ALA 173.A N LEU 169.A O no hydrogen 2.930 N/A SER 175.A N ASP 211.A OD1 no hydrogen 2.780 N/A SER 175.A OG ASP 211.A OD1 no hydrogen 3.396 N/A SER 175.A OG ASP 211.A OD2 no hydrogen 2.591 N/A HIS 176.A N ASP 174.A OD2 no hydrogen 3.046 N/A HIS 176.A ND1 ASP 174.A OD2 no hydrogen 2.712 N/A ALA 177.A N ASP 174.A O no hydrogen 3.060 N/A GLN 178.A NE2 GLU 180.A OE1 no hydrogen 3.020 N/A GLU 180.A N GLU 180.A OE1 no hydrogen 2.878 N/A GLN 182.A N GLN 178.A O no hydrogen 2.992 N/A GLN 182.A NE2 ALA 177.A O no hydrogen 2.814 N/A GLN 183.A N TRP 179.A O no hydrogen 3.138 N/A GLN 183.A N GLU 180.A O no hydrogen 3.210 N/A TYR 184.A OH LYS 65.A O no hydrogen 2.724 N/A ALA 185.A N ILE 181.A O no hydrogen 2.899 N/A LEU 186.A N GLN 182.A O no hydrogen 2.910 N/A ALA 187.A N GLN 183.A O no hydrogen 3.402 N/A ILE 188.A N TYR 184.A O no hydrogen 2.949 N/A ALA 189.A N ALA 185.A O no hydrogen 2.864 N/A ARG 190.A N LEU 186.A O no hydrogen 3.039 N/A ILE 191.A N ALA 187.A O no hydrogen 3.098 N/A PHE 192.A N ILE 188.A O no hydrogen 2.911 N/A LYS 193.A N ALA 189.A O no hydrogen 2.908 N/A GLU 194.A N ARG 190.A O no hydrogen 3.077 N/A LYS 195.A N ILE 191.A O no hydrogen 3.019 N/A CYS 196.A N PHE 192.A O no hydrogen 2.838 N/A TRP 198.A N ASP 21.A OD2 no hydrogen 2.898 N/A THR 199.A N ASP 21.A OD1 no hydrogen 2.892 N/A THR 199.A OG1 ASP 21.A OD1 no hydrogen 2.704 N/A PHE 200.A N CYS 196.A O no hydrogen 2.889 N/A GLU 201.A N PRO 197.A O no hydrogen 2.985 N/A ALA 202.A N TRP 198.A O no hydrogen 3.006 N/A PHE 203.A N THR 199.A O no hydrogen 2.823 N/A LEU 204.A N PHE 200.A O no hydrogen 2.917 N/A LYS 205.A N GLU 201.A O no hydrogen 3.029 N/A TYR 206.A N ALA 202.A O no hydrogen 2.895 N/A ALA 207.A N PHE 203.A O no hydrogen 2.938 N/A TYR 208.A N PHE 203.A O no hydrogen 2.777 N/A TYR 208.A OH ALA 173.A O no hydrogen 2.525 N/A LYS 209.A N ASN 170.A OD1 no hydrogen 2.825 N/A ILE 212.A N TYR 208.A OH no hydrogen 3.018 N/A LEU 213.A N TYR 208.A OH no hydrogen 2.957 N/A