Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3mg9_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): MET 6.A N ASP 186.A OD2 no hydrogen 3.453 N/A GLY 8.A N GLU 65.A O no hydrogen 3.335 N/A ILE 9.A N ALA 86.A O no hydrogen 2.826 N/A ARG 10.A N VAL 67.A O no hydrogen 2.724 N/A ARG 10.A NE LEU 185.A O no hydrogen 2.951 N/A ARG 10.A NH1 MET 6.A O no hydrogen 2.822 N/A ARG 10.A NH1 GLY 8.A O no hydrogen 2.964 N/A ARG 10.A NH2 MET 6.A O no hydrogen 2.706 N/A ARG 10.A NH2 LEU 185.A O no hydrogen 3.262 N/A ARG 10.A NH2 ASP 186.A O no hydrogen 2.894 N/A TRP 11.A N LYS 89.A O no hydrogen 3.031 N/A TRP 11.A NE1 THR 87.A OG1 no hydrogen 2.909 N/A ILE 12.A N VAL 69.A O no hydrogen 2.818 N/A ALA 13.A N LEU 91.A O no hydrogen 2.978 N/A SER 14.A N THR 71.A O no hydrogen 3.304 N/A SER 14.A OG TYR 15.A O no hydrogen 2.854 N/A TYR 15.A OH GLY 140.A O no hydrogen 2.672 N/A ALA 18.A N TYR 15.A O no hydrogen 3.061 N/A ASN 20.A N SER 14.A OG no hydrogen 3.088 N/A ASN 20.A ND2 ILE 12.A O no hydrogen 3.397 N/A TRP 22.A NE1 SER 203.A OG no hydrogen 3.214 N/A VAL 23.A N GLY 19.A O no hydrogen 3.054 N/A ARG 24.A N ASN 20.A O no hydrogen 2.997 N/A ARG 24.A NH1 ARG 24.A O no hydrogen 2.975 N/A CYS 25.A N THR 21.A O no hydrogen 2.986 N/A CYS 25.A SG THR 21.A O no hydrogen 3.495 N/A CYS 25.A SG TRP 39.A O no hydrogen 3.991 N/A MET 26.A N TRP 22.A O no hydrogen 3.083 N/A LEU 27.A N VAL 23.A O no hydrogen 2.836 N/A ALA 28.A N ARG 24.A O no hydrogen 3.030 N/A ALA 29.A N CYS 25.A O no hydrogen 3.023 N/A TYR 30.A N MET 26.A O no hydrogen 2.882 N/A ILE 31.A N LEU 27.A O no hydrogen 2.823 N/A THR 32.A N ALA 28.A O no hydrogen 2.882 N/A THR 32.A OG1 ALA 28.A O no hydrogen 2.630 N/A GLY 33.A N ALA 29.A O no hydrogen 2.822 N/A LYS 34.A N THR 32.A OG1 no hydrogen 3.313 N/A ASP 41.A N VAL 38.A O no hydrogen 2.956 N/A ILE 42.A N TRP 39.A O no hydrogen 3.073 N/A ALA 44.A N ASP 41.A O no hydrogen 2.939 N/A GLU 45.A N ILE 42.A O no hydrogen 3.092 N/A SER 46.A OG ILE 42.A O no hydrogen 2.650 N/A THR 48.A OG1 ASP 43.A OD1 no hydrogen 2.807 N/A LEU 49.A N LYS 70.A O no hydrogen 2.988 N/A GLU 50.A N GLU 50.A OE1 no hydrogen 2.752 N/A MET 52.A N THR 48.A O no hydrogen 2.838 N/A LEU 53.A N LEU 49.A O no hydrogen 2.792 N/A ARG 54.A N GLU 50.A O no hydrogen 3.262 N/A PHE 55.A N MET 52.A O no hydrogen 2.965 N/A GLY 56.A N LEU 53.A O no hydrogen 2.916 N/A ASP 57.A N MET 52.A O no hydrogen 2.937 N/A LEU 58.A N ASP 57.A OD1 no hydrogen 2.745 N/A VAL 67.A N GLY 8.A O no hydrogen 3.086 N/A VAL 69.A N ARG 10.A O no hydrogen 2.879 N/A LYS 70.A N LEU 47.A O no hydrogen 2.915 N/A LYS 70.A NZ THR 21.A OG1 no hydrogen 2.889 N/A THR 71.A N ILE 12.A O no hydrogen 3.163 N/A THR 71.A OG1 GLU 50.A OE1 no hydrogen 2.889 N/A THR 71.A OG1 GLU 50.A OE2 no hydrogen 3.546 N/A HIS 72.A N GLU 50.A OE2 no hydrogen 2.879 N/A HIS 72.A ND1 SER 14.A O no hydrogen 2.794 N/A LEU 73.A N THR 71.A OG1 no hydrogen 3.221 N/A LYS 74.A N GLY 138.A O no hydrogen 2.915 N/A ALA 75.A N SER 148.A OG no hydrogen 2.961 N/A VAL 77.A N LYS 74.A O no hydrogen 3.422 N/A LEU 80.A N VAL 77.A O no hydrogen 2.901 N/A GLY 81.A N PRO 78.A O no hydrogen 3.071 N/A LEU 82.A N VAL 79.A O no hydrogen 3.189 N/A TYR 83.A N LEU 80.A O no hydrogen 3.066 N/A TYR 83.A OH PRO 59.A O no hydrogen 2.562 N/A THR 87.A N TYR 83.A O no hydrogen 3.086 N/A THR 87.A OG1 TYR 83.A O no hydrogen 2.670 N/A ALA 88.A N ILE 9.A O no hydrogen 2.840 N/A LYS 89.A N ILE 9.A O no hydrogen 3.044 N/A LYS 89.A NZ ASP 161.A OD2 no hydrogen 2.872 N/A LYS 89.A NZ PHE 184.A O no hydrogen 3.370 N/A VAL 90.A N ASP 161.A O no hydrogen 2.754 N/A LEU 91.A N TRP 11.A O no hydrogen 2.960 N/A TYR 92.A N LEU 163.A O no hydrogen 2.808 N/A TYR 92.A OH ASN 145.A OD1 no hydrogen 2.664 N/A LEU 93.A N ALA 13.A O no hydrogen 2.932 N/A VAL 94.A N MET 165.A O no hydrogen 2.960 N/A ARG 95.A NH1 LYS 17.A O no hydrogen 2.913 N/A ASN 96.A N GLU 168.A OE2 no hydrogen 2.922 N/A ASN 96.A ND2 ASP 220.A OD2 no hydrogen 3.072 N/A ARG 98.A N ASN 96.A OD1 no hydrogen 3.004 N/A ARG 98.A NH1 GLU 231.A OE2 no hydrogen 2.950 N/A ARG 98.A NH2 GLN 221.A O no hydrogen 3.156 N/A ARG 98.A NH2 GLU 231.A OE1 no hydrogen 3.003 N/A ARG 98.A NH2 GLU 231.A OE2 no hydrogen 3.294 N/A ASP 99.A N ASN 96.A O no hydrogen 2.967 N/A MET 100.A N ASN 96.A O no hydrogen 2.975 N/A LEU 101.A N PRO 97.A O no hydrogen 2.791 N/A LEU 102.A N ARG 98.A O no hydrogen 3.141 N/A SER 103.A N ASP 99.A O no hydrogen 2.979 N/A SER 103.A OG ASP 99.A O no hydrogen 2.770 N/A SER 103.A OG MET 100.A O no hydrogen 3.209 N/A SER 104.A N MET 100.A O no hydrogen 2.785 N/A SER 104.A OG MET 100.A O no hydrogen 3.036 N/A SER 104.A OG LEU 101.A O no hydrogen 3.329 N/A MET 105.A N LEU 101.A O no hydrogen 3.192 N/A ARG 106.A N SER 103.A O no hydrogen 3.336 N/A MET 107.A N SER 104.A O no hydrogen 2.995 N/A ALA 108.A N MET 105.A O no hydrogen 2.950 N/A SER 109.A N ARG 106.A O no hydrogen 3.039 N/A SER 111.A OG ASP 113.A OD1 no hydrogen 3.218 N/A ARG 112.A NH1 GLN 221.A OE1 no hydrogen 3.443 N/A ARG 112.A NH2 GLN 221.A OE1 no hydrogen 2.603 N/A ASP 114.A N SER 111.A O no hydrogen 2.943 N/A LYS 117.A N ASP 114.A OD2 no hydrogen 3.389 N/A SER 118.A N ASP 114.A O no hydrogen 2.888 N/A SER 118.A OG ASP 114.A O no hydrogen 2.874 N/A ARG 119.A N VAL 115.A O no hydrogen 2.755 N/A ARG 119.A NH1 LEU 226.A O no hydrogen 2.930 N/A ARG 119.A NH1 ASP 229.A OD1 no hydrogen 2.902 N/A ARG 119.A NH1 ASP 229.A OD2 no hydrogen 3.553 N/A ARG 119.A NH2 ASP 229.A OD2 no hydrogen 2.933 N/A ASP 120.A N GLU 116.A O no hydrogen 3.301 N/A PHE 121.A N LYS 117.A O no hydrogen 3.083 N/A ALA 122.A N SER 118.A O no hydrogen 2.919 N/A ARG 123.A N ARG 119.A O no hydrogen 3.008 N/A LYS 124.A N ASP 120.A O no hydrogen 3.113 N/A PHE 125.A N PHE 121.A O no hydrogen 3.038 N/A ILE 126.A N ALA 122.A O no hydrogen 2.847 N/A ALA 127.A N ARG 123.A O no hydrogen 2.979 N/A ASN 128.A N LYS 124.A O no hydrogen 3.025 N/A ASN 128.A ND2 LYS 124.A O no hydrogen 2.582 N/A GLY 130.A N PHE 125.A O no hydrogen 2.890 N/A LEU 131.A N TYR 15.A OH no hydrogen 2.831 N/A TRP 133.A NE1 GLY 130.A O no hydrogen 2.751 N/A LEU 139.A N GLY 136.A O no hydrogen 3.102 N/A SER 141.A N GLU 144.A OE2 no hydrogen 2.930 N/A TRP 142.A N GLU 129.A O no hydrogen 2.903 N/A GLU 144.A N SER 141.A OG no hydrogen 3.307 N/A ASN 145.A N SER 141.A O no hydrogen 2.839 N/A ASN 145.A ND2 HIS 72.A O no hydrogen 2.878 N/A ASN 145.A ND2 LEU 139.A O no hydrogen 2.972 N/A VAL 146.A N TRP 142.A O no hydrogen 2.871 N/A ARG 147.A N PRO 143.A O no hydrogen 2.963 N/A ARG 147.A NE TYR 247.A OH no hydrogen 3.115 N/A SER 148.A N GLU 144.A O no hydrogen 2.944 N/A SER 148.A OG GLU 144.A O no hydrogen 3.470 N/A SER 148.A OG ASN 145.A O no hydrogen 2.832 N/A TRP 149.A N ASN 145.A O no hydrogen 3.285 N/A TRP 149.A NE1 LEU 73.A O no hydrogen 2.768 N/A THR 150.A N VAL 146.A O no hydrogen 3.002 N/A THR 150.A OG1 VAL 146.A O no hydrogen 2.856 N/A GLU 151.A N ARG 147.A O no hydrogen 2.898 N/A SER 153.A OG TRP 149.A O no hydrogen 3.259 N/A ASP 155.A N SER 152.A O no hydrogen 3.163 N/A ARG 156.A N SER 152.A O no hydrogen 2.942 N/A ARG 156.A NH1 GLU 151.A O no hydrogen 3.023 N/A PHE 157.A N SER 153.A O no hydrogen 2.748 N/A ASN 159.A ND2 GLU 85.A O no hydrogen 3.050 N/A ALA 160.A N PHE 157.A O no hydrogen 2.960 N/A ASP 161.A N ALA 88.A O no hydrogen 3.048 N/A LEU 163.A N VAL 90.A O no hydrogen 2.782 N/A MET 165.A N TYR 92.A O no hydrogen 2.868 N/A ARG 166.A NE TYR 251.A O no hydrogen 2.911 N/A ARG 166.A NH1 ASP 169.A OD2 no hydrogen 3.402 N/A ARG 166.A NH2 TYR 251.A O no hydrogen 3.210 N/A TYR 167.A N VAL 94.A O no hydrogen 2.777 N/A GLU 168.A N GLU 168.A OE1 no hydrogen 2.760 N/A ASP 169.A N ARG 166.A O no hydrogen 3.092 N/A LEU 170.A N ARG 166.A O no hydrogen 3.195 N/A LYS 171.A N TYR 167.A O no hydrogen 2.849 N/A LYS 171.A NZ TYR 167.A OH no hydrogen 2.971 N/A GLY 172.A N GLU 168.A O no hydrogen 3.016 N/A ASP 173.A N ASP 169.A O no hydrogen 3.117 N/A ARG 177.A N ASP 173.A O no hydrogen 2.880 N/A PHE 178.A N PRO 174.A O no hydrogen 2.815 N/A SER 179.A N VAL 175.A O no hydrogen 3.389 N/A SER 179.A OG VAL 175.A O no hydrogen 2.961 N/A SER 179.A OG ALA 176.A O no hydrogen 3.075 N/A GLU 180.A N ALA 176.A O no hydrogen 3.340 N/A ILE 181.A N ARG 177.A O no hydrogen 2.988 N/A VAL 182.A N PHE 178.A O no hydrogen 2.969 N/A GLU 183.A N SER 179.A O no hydrogen 2.983 N/A PHE 184.A N GLU 180.A O no hydrogen 2.865 N/A LEU 185.A N ILE 181.A O no hydrogen 2.966 N/A ASP 186.A N VAL 182.A O no hydrogen 3.161 N/A ASP 195.A N ASP 192.A O no hydrogen 3.042 N/A ILE 196.A N ASP 192.A O no hydrogen 3.202 N/A ARG 197.A N ILE 193.A O no hydrogen 2.900 N/A ARG 198.A N GLU 194.A O no hydrogen 3.157 N/A ALA 199.A N ASP 195.A O no hydrogen 3.130 N/A VAL 200.A N ILE 196.A O no hydrogen 3.120 N/A ALA 201.A N ARG 197.A O no hydrogen 2.799 N/A ALA 202.A N ARG 198.A O no hydrogen 3.022 N/A SER 203.A N ALA 199.A O no hydrogen 3.244 N/A THR 204.A N VAL 200.A O no hydrogen 2.995 N/A THR 204.A OG1 VAL 200.A O no hydrogen 3.270 N/A LEU 205.A N ALA 201.A O no hydrogen 2.944 N/A GLU 206.A N ALA 202.A O no hydrogen 3.047 N/A ARG 207.A N SER 203.A O no hydrogen 3.015 N/A MET 208.A N THR 204.A O no hydrogen 2.922 N/A ARG 209.A N LEU 205.A O no hydrogen 3.022 N/A ARG 209.A NE GLU 206.A OE1 no hydrogen 2.814 N/A ARG 209.A NH2 GLU 206.A OE1 no hydrogen 2.982 N/A GLU 210.A N GLU 206.A O no hydrogen 3.108 N/A LEU 211.A N ARG 207.A O no hydrogen 2.964 N/A GLU 212.A N MET 208.A O no hydrogen 3.144 N/A LYS 213.A N ARG 209.A O no hydrogen 3.187 N/A ARG 214.A N GLU 210.A O no hydrogen 2.833 N/A SER 215.A N LEU 211.A O no hydrogen 2.971 N/A SER 215.A N GLU 212.A O no hydrogen 3.136 N/A SER 215.A OG LEU 211.A O no hydrogen 2.905 N/A GLU 216.A N LYS 213.A O no hydrogen 3.428 N/A ASP 220.A N ASP 99.A OD2 no hydrogen 2.841 N/A GLN 221.A N ASP 99.A OD1 no hydrogen 3.080 N/A GLN 221.A NE2 ASP 99.A OD1 no hydrogen 2.683 N/A SER 222.A OG SER 224.A OG no hydrogen 2.897 N/A LEU 223.A N GLU 231.A OE1 no hydrogen 2.835 N/A SER 224.A N SER 222.A OG no hydrogen 3.158 N/A SER 224.A OG SER 222.A OG no hydrogen 2.897 N/A LEU 226.A N LEU 223.A O no hydrogen 3.051 N/A GLY 227.A N SER 224.A O no hydrogen 2.924 N/A ILE 230.A N GLY 227.A O no hydrogen 3.139 N/A GLU 231.A N GLY 227.A O no hydrogen 3.461 N/A SER 232.A N GLU 228.A O no hydrogen 2.950 N/A ASP 233.A N ASP 229.A O no hydrogen 2.875 N/A TYR 234.A N ILE 230.A O no hydrogen 2.942 N/A GLN 235.A N GLU 231.A O no hydrogen 3.030 N/A GLU 236.A N SER 232.A O no hydrogen 3.040 N/A LEU 237.A N ASP 233.A O no hydrogen 3.169 N/A LEU 238.A N TYR 234.A O no hydrogen 3.004 N/A HIS 239.A N GLN 235.A O no hydrogen 3.037 N/A HIS 239.A N GLU 236.A O no hydrogen 3.291 N/A ALA 245.A N SER 242.A OG no hydrogen 3.109 N/A LEU 246.A N SER 242.A O no hydrogen 3.012 N/A TYR 247.A N GLY 243.A O no hydrogen 2.921 N/A ALA 248.A N PHE 244.A O no hydrogen 3.035 N/A LYS 249.A N ALA 245.A O no hydrogen 3.023 N/A GLN 250.A N LEU 246.A O no hydrogen 2.904 N/A TYR 251.A N TYR 247.A O no hydrogen 2.941 N/A GLY 252.A N LYS 249.A O no hydrogen 3.126 N/A TYR 253.A N ALA 248.A O no hydrogen 2.663 N/A TYR 253.A OH GLU 168.A OE1 no hydrogen 2.592 N/A