Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3lkk_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): MET 1.A N ASP 37.A OD2 no hydrogen 3.260 N/A MET 1.A N ASP 157.A OD1 no hydrogen 2.918 N/A MET 2.A N ASP 37.A O no hydrogen 2.903 N/A ILE 3.A N VAL 158.A O no hydrogen 3.069 N/A LEU 4.A N CYS 40.A O no hydrogen 3.128 N/A LYS 5.A N VAL 160.A O no hydrogen 2.790 N/A LYS 5.A NZ ASP 144.A OD1 no hydrogen 2.968 N/A ILE 6.A N VAL 42.A O no hydrogen 2.763 N/A GLY 7.A N LEU 162.A O no hydrogen 2.894 N/A VAL 10.A N GLY 7.A O no hydrogen 3.130 N/A ILE 11.A N GLY 7.A O no hydrogen 3.371 N/A THR 12.A N GLY 8.A O no hydrogen 3.058 N/A THR 12.A OG1 GLY 8.A O no hydrogen 2.800 N/A ASP 13.A N THR 19.A O no hydrogen 2.828 N/A SER 15.A N ASP 13.A OD1 no hydrogen 3.038 N/A SER 15.A OG ASP 13.A OD1 no hydrogen 2.733 N/A ALA 16.A N ASP 13.A O no hydrogen 3.110 N/A TYR 17.A OH ASP 76.A OD1 no hydrogen 3.365 N/A TYR 17.A OH ASP 76.A OD2 no hydrogen 2.545 N/A ARG 18.A N SER 47.A O no hydrogen 2.934 N/A THR 19.A N SER 47.A OG no hydrogen 3.345 N/A THR 19.A OG1 ALA 16.A O no hydrogen 2.888 N/A THR 19.A OG1 TYR 17.A O no hydrogen 3.231 N/A ARG 21.A N ILE 11.A O no hydrogen 2.811 N/A ARG 21.A NH1 SER 9.A O no hydrogen 3.186 N/A ILE 25.A N ARG 21.A O no hydrogen 3.041 N/A ARG 26.A N THR 22.A O no hydrogen 2.975 N/A SER 27.A N TYR 23.A O no hydrogen 2.933 N/A ILE 28.A N ALA 24.A O no hydrogen 2.980 N/A VAL 29.A N ILE 25.A O no hydrogen 3.045 N/A LYS 30.A N ARG 26.A O no hydrogen 2.972 N/A VAL 31.A N SER 27.A O no hydrogen 3.319 N/A LEU 32.A N ILE 28.A O no hydrogen 2.799 N/A SER 33.A N VAL 29.A O no hydrogen 2.931 N/A SER 33.A OG VAL 29.A O no hydrogen 3.556 N/A SER 33.A OG LYS 30.A O no hydrogen 2.651 N/A GLY 34.A N VAL 31.A O no hydrogen 3.084 N/A ILE 35.A N LEU 32.A O no hydrogen 3.034 N/A LEU 38.A N ILE 35.A O no hydrogen 3.407 N/A VAL 39.A N MET 2.A O no hydrogen 2.903 N/A CYS 40.A SG PRO 124.A O no hydrogen 3.762 N/A VAL 41.A N PRO 124.A O no hydrogen 3.076 N/A VAL 42.A N LEU 4.A O no hydrogen 2.847 N/A HIS 43.A N SER 126.A O no hydrogen 2.995 N/A HIS 43.A ND1 GLY 44.A O no hydrogen 2.890 N/A HIS 43.A NE2 ASP 81.A OD1 no hydrogen 2.740 N/A GLY 44.A N ILE 6.A O no hydrogen 3.021 N/A SER 47.A N THR 12.A OG1 no hydrogen 3.249 N/A SER 47.A OG ASP 13.A O no hydrogen 2.869 N/A SER 47.A OG ALA 16.A O no hydrogen 2.960 N/A PHE 48.A N GLY 45.A O no hydrogen 2.818 N/A HIS 50.A N GLY 46.A O no hydrogen 2.831 N/A LYS 52.A NZ GLU 55.A OE1 no hydrogen 2.743 N/A ALA 53.A N GLY 49.A O no hydrogen 3.219 N/A MET 54.A N HIS 50.A O no hydrogen 3.175 N/A GLU 55.A N ILE 51.A O no hydrogen 3.045 N/A PHE 56.A N LYS 52.A O no hydrogen 2.836 N/A PHE 56.A N ALA 53.A O no hydrogen 3.248 N/A LEU 58.A N ALA 53.A O no hydrogen 2.966 N/A GLY 60.A N TYR 138.A O no hydrogen 3.003 N/A LYS 62.A N HIS 136.A O no hydrogen 2.955 N/A LYS 62.A NZ TYR 138.A OH no hydrogen 3.431 N/A ASN 63.A N SER 66.A OG no hydrogen 2.959 N/A SER 66.A N ASN 63.A OD1 no hydrogen 2.936 N/A SER 66.A OG PRO 61.A O no hydrogen 2.825 N/A SER 66.A OG ASN 63.A O no hydrogen 3.345 N/A SER 67.A N ASN 63.A O no hydrogen 2.897 N/A SER 67.A OG ASN 63.A O no hydrogen 2.902 N/A SER 67.A OG TYR 138.A OH no hydrogen 2.744 N/A ILE 68.A N PRO 64.A O no hydrogen 3.343 N/A GLY 69.A N ARG 65.A O no hydrogen 2.948 N/A TYR 70.A N SER 66.A O no hydrogen 2.843 N/A ILE 72.A N ILE 68.A O no hydrogen 3.156 N/A VAL 73.A N GLY 69.A O no hydrogen 2.753 N/A HIS 74.A N TYR 70.A O no hydrogen 3.041 N/A HIS 74.A ND1 ASP 129.A OD1 no hydrogen 2.629 N/A ARG 75.A N SER 71.A O no hydrogen 2.988 N/A ARG 75.A NE ASP 76.A OD1 no hydrogen 2.905 N/A ARG 75.A NH1 ASP 76.A OD1 no hydrogen 3.161 N/A ASP 76.A N ILE 72.A O no hydrogen 2.832 N/A MET 77.A N VAL 73.A O no hydrogen 2.941 N/A GLU 78.A N HIS 74.A O no hydrogen 2.935 N/A ASN 79.A N ARG 75.A O no hydrogen 3.040 N/A LEU 80.A N ASP 76.A O no hydrogen 3.050 N/A ASP 81.A N MET 77.A O no hydrogen 2.831 N/A LEU 82.A N GLU 78.A O no hydrogen 2.794 N/A MET 83.A N LEU 80.A O no hydrogen 2.934 N/A VAL 84.A N LEU 80.A O no hydrogen 3.356 N/A ILE 85.A N ASP 81.A O no hydrogen 2.963 N/A ASP 86.A N LEU 82.A O no hydrogen 2.809 N/A ALA 87.A N MET 83.A O no hydrogen 3.387 N/A MET 88.A N VAL 84.A O no hydrogen 2.924 N/A ILE 89.A N ILE 85.A O no hydrogen 2.860 N/A GLU 90.A N ASP 86.A O no hydrogen 2.958 N/A MET 91.A N ALA 87.A O no hydrogen 3.122 N/A MET 91.A N MET 88.A O no hydrogen 3.218 N/A GLY 92.A N ILE 89.A O no hydrogen 2.990 N/A MET 93.A N MET 88.A O no hydrogen 2.953 N/A ARG 94.A NH1 ALA 120.A O no hydrogen 2.887 N/A ILE 96.A N VAL 123.A O no hydrogen 3.204 N/A VAL 98.A N VAL 125.A O no hydrogen 2.848 N/A SER 101.A N ASP 129.A OD2 no hydrogen 3.286 N/A SER 101.A OG ASP 129.A OD2 no hydrogen 2.860 N/A ALA 102.A N PRO 99.A O no hydrogen 3.067 N/A LEU 103.A N ILE 100.A O no hydrogen 3.212 N/A ARG 104.A NE ASP 110.A OD2 no hydrogen 3.242 N/A ARG 104.A NH2 ASP 110.A OD2 no hydrogen 2.892 N/A ASP 106.A N ARG 108.A O no hydrogen 3.178 N/A ARG 108.A N ASP 106.A OD1 no hydrogen 3.061 N/A ARG 108.A NH1 GLU 152.A OE1 no hydrogen 3.490 N/A ASP 110.A N ARG 104.A O no hydrogen 2.896 N/A TYR 111.A OH ASP 149.A OD2 no hydrogen 2.599 N/A THR 112.A N ASP 110.A OD1 no hydrogen 3.010 N/A THR 112.A OG1 ASP 110.A OD1 no hydrogen 2.572 N/A ILE 115.A N TYR 111.A O no hydrogen 3.250 N/A ARG 116.A N THR 112.A O no hydrogen 2.942 N/A TYR 117.A N PRO 113.A O no hydrogen 3.132 N/A ILE 118.A N LEU 114.A O no hydrogen 3.059 N/A ASP 119.A N ILE 115.A O no hydrogen 2.941 N/A ALA 120.A N ARG 116.A O no hydrogen 2.985 N/A ALA 120.A N TYR 117.A O no hydrogen 3.116 N/A GLY 121.A N ILE 118.A O no hydrogen 2.907 N/A PHE 122.A N TYR 117.A O no hydrogen 2.878 N/A VAL 123.A N ARG 94.A O no hydrogen 3.049 N/A VAL 125.A N ILE 96.A O no hydrogen 2.966 N/A SER 126.A N VAL 41.A O no hydrogen 2.967 N/A SER 126.A OG VAL 98.A O no hydrogen 2.868 N/A GLY 128.A N HIS 43.A O no hydrogen 3.143 N/A ASP 129.A N TYR 141.A O no hydrogen 2.902 N/A TYR 131.A N GLY 139.A O no hydrogen 3.089 N/A LYS 133.A N SER 137.A O no hydrogen 2.987 N/A ASP 134.A N SER 137.A O no hydrogen 3.345 N/A HIS 136.A N ASP 134.A OD2 no hydrogen 2.862 N/A SER 137.A N ASP 134.A O no hydrogen 3.159 N/A SER 137.A OG ASP 134.A OD1 no hydrogen 3.099 N/A SER 137.A OG ASP 134.A OD2 no hydrogen 2.869 N/A TYR 138.A N GLY 60.A O no hydrogen 2.994 N/A TYR 138.A OH SER 67.A OG no hydrogen 2.744 N/A GLY 139.A N TYR 131.A O no hydrogen 2.841 N/A TYR 141.A N ASP 129.A O no hydrogen 2.813 N/A TYR 141.A OH ASP 149.A OD1 no hydrogen 3.334 N/A TYR 141.A OH ASP 149.A OD2 no hydrogen 2.621 N/A SER 142.A N ASP 145.A OD2 no hydrogen 3.086 N/A ASP 145.A N SER 142.A OG no hydrogen 3.341 N/A ILE 146.A N SER 142.A O no hydrogen 3.106 N/A MET 147.A N GLY 143.A O no hydrogen 2.926 N/A ALA 148.A N ASP 144.A O no hydrogen 2.950 N/A ASP 149.A N ASP 145.A O no hydrogen 2.970 N/A MET 150.A N ILE 146.A O no hydrogen 2.844 N/A ALA 151.A N MET 147.A O no hydrogen 2.911 N/A GLU 152.A N ALA 148.A O no hydrogen 3.123 N/A LEU 153.A N ASP 149.A O no hydrogen 2.934 N/A LEU 154.A N MET 150.A O no hydrogen 2.881 N/A LYS 155.A N ALA 151.A O no hydrogen 2.860 N/A LYS 155.A NZ SER 202.A OG no hydrogen 2.992 N/A ASP 157.A N MET 1.A O no hydrogen 2.885 N/A VAL 158.A N MET 1.A O no hydrogen 3.194 N/A ALA 159.A N GLY 206.A O no hydrogen 3.139 N/A VAL 160.A N ILE 3.A O no hydrogen 2.973 N/A PHE 161.A N TYR 208.A O no hydrogen 2.788 N/A LEU 162.A N LYS 5.A O no hydrogen 2.902 N/A THR 163.A N ILE 210.A O no hydrogen 3.070 N/A THR 163.A OG1 VAL 165.A O no hydrogen 3.426 N/A ILE 168.A N THR 229.A OG1 no hydrogen 2.875 N/A SER 170.A N VAL 180.A O no hydrogen 2.941 N/A LYS 171.A NZ ASP 178.A OD2 no hydrogen 2.982 N/A LYS 174.A N ASP 172.A OD1 no hydrogen 3.049 N/A LYS 174.A NZ ASP 164.A OD2 no hydrogen 2.933 N/A ARG 175.A N ASP 172.A O no hydrogen 3.180 N/A ASN 176.A N ASP 172.A O no hydrogen 3.036 N/A ASN 176.A ND2 ASP 172.A O no hydrogen 3.496 N/A ALA 179.A N ASN 176.A O no hydrogen 2.794 N/A VAL 180.A N SER 170.A OG no hydrogen 3.099 N/A LEU 182.A N ILE 168.A O no hydrogen 2.753 N/A ARG 183.A NH1 PHE 226.A O no hydrogen 2.810 N/A ARG 183.A NH2 PHE 226.A O no hydrogen 3.024 N/A ILE 185.A N VAL 230.A O no hydrogen 2.834 N/A ASN 188.A N ASP 186.A OD1 no hydrogen 3.075 N/A LYS 192.A NZ ASP 144.A OD2 no hydrogen 2.742 N/A PHE 193.A N ILE 189.A O no hydrogen 2.644 N/A GLU 194.A N GLY 190.A O no hydrogen 3.159 N/A SER 195.A N LYS 191.A O no hydrogen 3.277 N/A SER 195.A OG LYS 191.A O no hydrogen 3.307 N/A SER 195.A OG LYS 192.A O no hydrogen 3.147 N/A MET 196.A N LYS 192.A O no hydrogen 3.046 N/A VAL 197.A N PHE 193.A O no hydrogen 2.856 N/A LYS 198.A N GLU 194.A O no hydrogen 2.921 N/A MET 199.A N SER 195.A O no hydrogen 2.961 N/A LYS 200.A N VAL 197.A O no hydrogen 3.143 N/A LYS 200.A NZ LYS 200.A O no hydrogen 3.164 N/A LYS 200.A NZ VAL 203.A O no hydrogen 2.815 N/A LYS 200.A NZ LYS 204.A O no hydrogen 3.233 N/A SER 201.A N LYS 198.A O no hydrogen 3.401 N/A SER 201.A OG LYS 198.A O no hydrogen 3.125 N/A SER 202.A N MET 199.A O no hydrogen 2.794 N/A VAL 203.A N LYS 200.A O no hydrogen 3.212 N/A ASN 205.A N ASP 157.A O no hydrogen 2.881 N/A VAL 207.A N ILE 231.A O no hydrogen 3.136 N/A TYR 208.A N ALA 159.A O no hydrogen 2.869 N/A TYR 208.A OH ASN 205.A O no hydrogen 3.304 N/A LEU 209.A N THR 229.A O no hydrogen 2.888 N/A ILE 210.A N PHE 161.A O no hydrogen 2.908 N/A ASN 211.A ND2 ASP 166.A OD1 no hydrogen 2.838 N/A GLY 212.A N THR 163.A O no hydrogen 2.725 N/A ASN 213.A N ASN 211.A OD1 no hydrogen 2.964 N/A HIS 214.A N ASN 211.A O no hydrogen 2.698 N/A HIS 214.A ND1 GLU 216.A OE2 no hydrogen 2.944 N/A GLU 216.A N GLU 216.A OE1 no hydrogen 2.762 N/A ARG 217.A N HIS 214.A O no hydrogen 2.883 N/A ARG 217.A NH1 ASP 166.A OD1 no hydrogen 2.796 N/A ILE 218.A N PRO 215.A O no hydrogen 2.994 N/A GLY 219.A N GLU 216.A O no hydrogen 3.110 N/A ASP 220.A N ARG 217.A O no hydrogen 2.785 N/A ILE 221.A N ILE 218.A O no hydrogen 3.424 N/A LYS 223.A N ASP 220.A O no hydrogen 2.878 N/A LYS 223.A NZ GLY 219.A O no hydrogen 3.121 N/A PHE 226.A N LYS 223.A O no hydrogen 2.920 N/A THR 229.A N LEU 209.A O no hydrogen 2.901 N/A THR 229.A OG1 ILE 168.A O no hydrogen 3.490 N/A THR 229.A OG1 LEU 182.A O no hydrogen 2.644 N/A VAL 230.A N ARG 183.A O no hydrogen 2.994 N/A ILE 231.A N VAL 207.A O no hydrogen 2.814 N/A ARG 232.A N ILE 185.A O no hydrogen 3.115 N/A ARG 232.A NE ASP 184.A OD1 no hydrogen 2.774 N/A ARG 232.A NH2 ASP 184.A OD1 no hydrogen 3.225 N/A ARG 232.A NH2 ASP 184.A OD2 no hydrogen 2.975 N/A