Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3ge3_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ARG 5.A NH1 GLU 56.A OE1 no hydrogen 2.924 N/A LYS 6.A NZ ASP 7.A OD1 no hydrogen 3.024 N/A ASP 7.A N PRO 4.A O no hydrogen 2.919 N/A TRP 8.A N ARG 5.A O no hydrogen 3.126 N/A TRP 8.A NE1 HIS 3.A O no hydrogen 2.979 N/A TYR 9.A N ARG 5.A O no hydrogen 2.820 N/A TYR 9.A OH GLU 48.A OE2 no hydrogen 2.535 N/A LEU 11.A N TRP 8.A O no hydrogen 3.130 N/A THR 12.A N TYR 9.A O no hydrogen 2.921 N/A THR 12.A OG1 TYR 9.A O no hydrogen 2.680 N/A ARG 13.A N GLU 10.A O no hydrogen 3.166 N/A ARG 13.A NE GLU 10.A OE1 no hydrogen 3.040 N/A ARG 13.A NH1 ASP 47.A OD1 no hydrogen 2.926 N/A ARG 13.A NH1 GLU 48.A OE1 no hydrogen 2.818 N/A ARG 13.A NH2 GLU 10.A OE1 no hydrogen 3.497 N/A ARG 13.A NH2 GLU 10.A OE2 no hydrogen 2.829 N/A ARG 13.A NH2 ASP 47.A OD1 no hydrogen 3.020 N/A ALA 14.A N LEU 11.A O no hydrogen 3.340 N/A ASN 16.A ND2 GLU 44.A OE2 no hydrogen 3.201 N/A ASN 16.A ND2 LYS 118.A O no hydrogen 2.978 N/A THR 23.A N GLN 26.A OE1 no hydrogen 2.806 N/A THR 23.A OG1 GLN 26.A OE1 no hydrogen 3.365 N/A GLN 26.A N THR 23.A OG1 no hydrogen 2.960 N/A LEU 27.A N THR 23.A O no hydrogen 2.979 N/A PHE 28.A N GLU 24.A O no hydrogen 2.877 N/A GLU 30.A N GLU 25.A OE2 no hydrogen 2.881 N/A MET 32.A N PRO 29.A O no hydrogen 2.900 N/A SER 33.A N PRO 29.A O no hydrogen 2.776 N/A SER 33.A OG.A PHE 116.A O no hydrogen 2.667 N/A GLY 34.A N GLU 30.A O no hydrogen 2.839 N/A HIS 35.A NE2 PHE 28.A O no hydrogen 2.990 N/A MET 36.A N GLU 30.A OE1 no hydrogen 2.793 N/A MET 36.A N GLU 30.A OE2 no hydrogen 3.135 N/A GLY 37.A N HIS 35.A ND1 no hydrogen 3.023 N/A ILE 38.A N HIS 35.A O no hydrogen 2.995 N/A LEU 40.A N GLU 24.A OE2 no hydrogen 3.047 N/A LYS 42.A N PRO 39.A O no hydrogen 3.004 N/A TRP 43.A N LEU 40.A O no hydrogen 2.981 N/A TRP 43.A NE1 ILE 38.A O no hydrogen 2.941 N/A GLU 44.A N GLU 41.A O no hydrogen 3.146 N/A SER 45.A N LYS 42.A O no hydrogen 3.501 N/A SER 45.A OG.A LYS 42.A O no hydrogen 3.298 N/A TYR 46.A N TRP 43.A O no hydrogen 3.182 N/A TYR 46.A OH GLN 236.A O no hydrogen 2.772 N/A GLU 48.A N GLU 48.A OE1 no hydrogen 2.665 N/A LYS 51.A NZ ASP 47.A OD1 no hydrogen 2.901 N/A LYS 51.A NZ GLU 48.A O no hydrogen 2.788 N/A THR 52.A OG1 SER 53.A O no hydrogen 3.563 N/A SER 53.A OG GLU 56.A OE1 no hydrogen 2.735 N/A TYR 57.A N SER 53.A O no hydrogen 2.800 N/A TYR 57.A OH ASP 132.A OD1 no hydrogen 2.607 N/A VAL 58.A N TYR 54.A O no hydrogen 3.050 N/A SER 59.A N PRO 55.A O no hydrogen 3.279 N/A ILE 60.A N.A GLU 56.A O no hydrogen 2.862 N/A ILE 60.A N.B GLU 56.A O no hydrogen 2.890 N/A GLN 61.A N TYR 57.A O no hydrogen 2.853 N/A GLN 61.A NE2 ASP 229.A OD1 no hydrogen 2.900 N/A ARG 62.A N VAL 58.A O no hydrogen 3.029 N/A GLU 63.A N SER 59.A O no hydrogen 3.194 N/A LYS 64.A N ILE 60.A O.A no hydrogen 2.992 N/A LYS 64.A N ILE 60.A O.B no hydrogen 2.846 N/A LYS 64.A NZ GLN 61.A OE1 no hydrogen 3.201 N/A LYS 64.A NZ THR 228.A OG1 no hydrogen 2.844 N/A LYS 64.A NZ ASP 229.A OD1 no hydrogen 2.674 N/A ASP 65.A N GLN 61.A O no hydrogen 3.062 N/A ALA 66.A N ARG 62.A O no hydrogen 2.946 N/A GLY 67.A N GLU 63.A O no hydrogen 3.134 N/A ALA 68.A N LYS 64.A O no hydrogen 3.116 N/A TYR 69.A N ASP 65.A O no hydrogen 2.908 N/A SER 70.A N.A ALA 66.A O no hydrogen 2.935 N/A SER 70.A N.B ALA 66.A O no hydrogen 2.944 N/A SER 70.A OG.A ALA 66.A O no hydrogen 2.876 N/A SER 70.A OG.B ALA 66.A O no hydrogen 2.886 N/A SER 70.A OG.B GLY 67.A O no hydrogen 3.244 N/A VAL 71.A N GLY 67.A O no hydrogen 3.042 N/A LYS 72.A N ALA 68.A O no hydrogen 3.152 N/A LYS 72.A NZ GLU 76.A OE2.A no hydrogen 2.812 N/A LYS 72.A NZ GLU 146.A OE1 no hydrogen 2.938 N/A ALA 73.A N TYR 69.A O no hydrogen 2.911 N/A ALA 74.A N SER 70.A O.A no hydrogen 2.895 N/A ALA 74.A N SER 70.A O.B no hydrogen 2.949 N/A LEU 75.A N VAL 71.A O no hydrogen 3.093 N/A LEU 75.A N LYS 72.A O no hydrogen 3.237 N/A GLU 76.A N.A ALA 73.A O no hydrogen 3.484 N/A GLU 76.A N.B ALA 73.A O no hydrogen 3.412 N/A ALA 78.A N LEU 75.A O no hydrogen 2.860 N/A ASN 83.A N LYS 79.A O no hydrogen 2.251 N/A SER 84.A N ILE 80.A O no hydrogen 2.713 N/A SER 84.A OG ILE 80.A O no hydrogen 2.491 N/A GLY 87.A N ASP 85.A OD1 no hydrogen 2.757 N/A TRP 88.A N ASP 85.A O no hydrogen 2.989 N/A TRP 88.A NE1 ASP 216.A OD2 no hydrogen 2.865 N/A ILE 89.A N ASP 85.A O no hydrogen 3.167 N/A SER 90.A N PRO 86.A O no hydrogen 2.860 N/A SER 90.A OG PRO 86.A O no hydrogen 3.254 N/A SER 90.A OG ASN 344.A O no hydrogen 2.680 N/A THR 91.A N GLY 87.A O no hydrogen 3.072 N/A THR 91.A OG1 GLY 87.A O no hydrogen 3.042 N/A LEU 92.A N TRP 88.A O no hydrogen 3.103 N/A LYS 93.A N ILE 89.A O no hydrogen 3.001 N/A LYS 93.A NZ ASP 151.A OD2 no hydrogen 2.791 N/A LYS 93.A NZ GLN 153.A OE1 no hydrogen 2.640 N/A SER 94.A N.A SER 90.A O no hydrogen 2.893 N/A SER 94.A N.B SER 90.A O no hydrogen 2.860 N/A SER 94.A OG.A SER 90.A O no hydrogen 3.548 N/A SER 94.A OG.A THR 91.A O no hydrogen 3.398 N/A HIS 95.A N THR 91.A O no hydrogen 2.926 N/A HIS 95.A ND1 GLN 203.A OE1 no hydrogen 2.896 N/A TYR 96.A N LEU 92.A O no hydrogen 2.914 N/A GLY 97.A N LYS 93.A O no hydrogen 3.101 N/A ALA 98.A N SER 94.A O.A no hydrogen 2.968 N/A ALA 98.A N SER 94.A O.B no hydrogen 2.807 N/A ALA 100.A N TYR 96.A O no hydrogen 3.005 N/A GLU 103.A N ILE 99.A O no hydrogen 2.856 N/A TYR 104.A N ALA 100.A O no hydrogen 3.351 N/A ALA 105.A N VAL 101.A O no hydrogen 2.940 N/A ALA 106.A N GLY 102.A O no hydrogen 2.907 N/A VAL 107.A N TYR 104.A O no hydrogen 3.079 N/A THR 108.A N ALA 105.A O no hydrogen 2.810 N/A GLU 110.A N ALA 106.A O no hydrogen 3.065 N/A GLY 111.A N VAL 107.A O no hydrogen 2.768 N/A ARG 112.A N THR 108.A O no hydrogen 2.802 N/A ARG 112.A NH2 THR 180.A O no hydrogen 2.815 N/A MET 113.A N GLY 109.A O no hydrogen 3.274 N/A ALA 114.A N GLU 110.A O no hydrogen 2.850 N/A ARG 115.A N GLY 111.A O no hydrogen 3.036 N/A ARG 115.A NH1 LEU 27.A O no hydrogen 2.945 N/A ARG 115.A NH1 ARG 115.A O no hydrogen 2.872 N/A ARG 115.A NH2 LEU 27.A O no hydrogen 2.887 N/A PHE 116.A N ARG 112.A O no hydrogen 2.894 N/A SER 117.A N MET 113.A O no hydrogen 2.993 N/A LYS 118.A NZ GLU 24.A OE2 no hydrogen 2.741 N/A LYS 118.A NZ ILE 38.A O no hydrogen 3.339 N/A ALA 119.A N SER 117.A OG no hydrogen 3.158 N/A ASN 122.A ND2 SER 117.A OG no hydrogen 2.682 N/A ARG 123.A N ALA 119.A O no hydrogen 3.054 N/A ARG 123.A NH1 ASN 16.A OD1 no hydrogen 2.986 N/A ARG 123.A NH1 SER 117.A O no hydrogen 2.890 N/A ARG 123.A NH2 THR 15.A OG1 no hydrogen 3.034 N/A ARG 123.A NH2 ASN 16.A OD1 no hydrogen 2.789 N/A ASN 124.A N PRO 120.A O no hydrogen 3.153 N/A ASN 124.A ND2 THR 12.A O no hydrogen 2.867 N/A MET 125.A N GLY 121.A O no hydrogen 2.984 N/A ALA 126.A N ASN 122.A O no hydrogen 2.853 N/A THR 127.A N ARG 123.A O no hydrogen 3.236 N/A THR 127.A N ASN 124.A O no hydrogen 2.996 N/A THR 127.A OG1 ARG 123.A O no hydrogen 2.915 N/A PHE 128.A N ASN 124.A O no hydrogen 3.273 N/A GLY 129.A N MET 125.A O no hydrogen 2.792 N/A MET 130.A N ALA 126.A O no hydrogen 2.752 N/A MET 131.A N THR 127.A O no hydrogen 3.166 N/A ASP 132.A N PHE 128.A O no hydrogen 2.796 N/A GLU 133.A N GLY 129.A O no hydrogen 2.910 N/A LEU 134.A N MET 130.A O no hydrogen 3.032 N/A ARG 135.A N MET 131.A O no hydrogen 2.933 N/A ARG 135.A NE ASP 65.A OD1 no hydrogen 2.692 N/A ARG 135.A NH1 SER 225.A O no hydrogen 3.402 N/A ARG 135.A NH1 SER 225.A OG no hydrogen 3.287 N/A ARG 135.A NH1 ASP 229.A OD2 no hydrogen 2.805 N/A ARG 135.A NH2 ASP 65.A OD1 no hydrogen 2.962 N/A ARG 135.A NH2 SER 225.A OG no hydrogen 2.951 N/A HIS 136.A N ASP 132.A O no hydrogen 2.935 N/A HIS 136.A ND1 GLU 103.A OE2 no hydrogen 3.157 N/A HIS 136.A NE2 ASP 229.A OD2 no hydrogen 2.763 N/A GLY 137.A N GLU 133.A O no hydrogen 2.886 N/A GLN 138.A N LEU 134.A O no hydrogen 2.954 N/A LEU 139.A N ARG 135.A O no hydrogen 2.806 N/A GLN 140.A N HIS 136.A O no hydrogen 3.106 N/A LEU 141.A N GLY 137.A O no hydrogen 3.075 N/A LEU 141.A N GLN 138.A O no hydrogen 3.311 N/A PHE 142.A N GLN 138.A O no hydrogen 2.868 N/A PHE 143.A N LEU 139.A O no hydrogen 2.914 N/A HIS 145.A N LEU 141.A O no hydrogen 3.174 N/A TYR 147.A N PRO 144.A O no hydrogen 2.801 N/A CYS 148.A N HIS 145.A O no hydrogen 3.145 N/A CYS 148.A SG HIS 145.A O no hydrogen 3.476 N/A LYS 149.A NZ GLU 146.A O no hydrogen 3.108 N/A LYS 150.A N TYR 147.A O no hydrogen 2.858 N/A ASP 151.A N TYR 147.A O no hydrogen 3.225 N/A ASP 151.A N CYS 148.A O no hydrogen 3.343 N/A ARG 152.A NE GLU 477.A OE2 no hydrogen 2.943 N/A ARG 152.A NH2 GLU 477.A OE2 no hydrogen 3.030 N/A GLN 153.A N ASP 151.A OD1 no hydrogen 2.886 N/A GLN 153.A NE2 ASN 344.A OD1 no hydrogen 3.034 N/A GLN 153.A NE2 GLU 477.A O no hydrogen 3.036 N/A PHE 154.A N ASP 151.A O no hydrogen 2.965 N/A ASP 155.A N ARG 152.A O no hydrogen 2.926 N/A TRP 156.A N GLN 153.A O no hydrogen 3.084 N/A ALA 157.A N PHE 154.A O no hydrogen 3.050 N/A TRP 158.A N ASP 155.A O no hydrogen 3.112 N/A ARG 159.A N ASP 155.A O no hydrogen 2.920 N/A ARG 159.A NE ASP 155.A OD2 no hydrogen 2.950 N/A ARG 159.A NH1 GLY 471.A O no hydrogen 2.951 N/A ARG 159.A NH1 GLU 477.A OE1 no hydrogen 2.705 N/A ARG 159.A NH2 ASP 155.A OD2 no hydrogen 2.899 N/A ARG 159.A NH2 GLU 477.A OE2 no hydrogen 2.903 N/A ALA 160.A N TRP 156.A O no hydrogen 3.023 N/A TYR 161.A OH ALA 98.A O no hydrogen 2.714 N/A HIS 162.A N ARG 159.A O no hydrogen 2.798 N/A SER 163.A N ALA 160.A O no hydrogen 2.958 N/A SER 163.A OG ALA 160.A O no hydrogen 2.734 N/A GLU 165.A N SER 163.A OG no hydrogen 2.984 N/A TRP 166.A NE1 THR 340.A OG1 no hydrogen 2.825 N/A ALA 168.A N GLU 165.A OE1 no hydrogen 2.982 N/A ILE 169.A N GLU 165.A O no hydrogen 2.953 N/A ALA 170.A N TRP 166.A O no hydrogen 2.985 N/A ALA 171.A N ALA 167.A O no hydrogen 2.911 N/A LYS 172.A N ALA 168.A O no hydrogen 2.882 N/A LYS 172.A NZ TYR 161.A O no hydrogen 2.790 N/A LYS 172.A NZ SER 163.A O no hydrogen 2.899 N/A HIS 173.A N ILE 169.A O no hydrogen 2.820 N/A PHE 174.A N ALA 170.A O no hydrogen 3.162 N/A PHE 175.A N.A ALA 171.A O no hydrogen 2.848 N/A PHE 175.A N.B ALA 171.A O no hydrogen 2.897 N/A ASP 176.A N LYS 172.A O no hydrogen 2.725 N/A ASP 177.A N HIS 173.A O no hydrogen 3.032 N/A ILE 178.A N PHE 174.A O no hydrogen 2.918 N/A ILE 179.A N PHE 175.A O.A no hydrogen 2.737 N/A ILE 179.A N PHE 175.A O.B no hydrogen 3.007 N/A THR 180.A N PHE 175.A O.A no hydrogen 3.283 N/A THR 180.A N PHE 175.A O.B no hydrogen 3.078 N/A THR 180.A OG1 ASP 176.A OD1 no hydrogen 3.154 N/A ARG 182.A NE ASP 177.A O no hydrogen 3.005 N/A ARG 182.A NE ASP 177.A OD1 no hydrogen 3.179 N/A ARG 182.A NH1 ASP 439.A OD2 no hydrogen 3.147 N/A ARG 182.A NH2 ASP 177.A OD1 no hydrogen 2.900 N/A ARG 182.A NH2 ASP 439.A OD2 no hydrogen 3.335 N/A ALA 184.A N MET 32.A O no hydrogen 2.801 N/A ILE 185.A N SER 33.A O no hydrogen 3.071 N/A SER 186.A N ASP 183.A OD1 no hydrogen 2.870 N/A SER 186.A OG ASP 183.A OD1 no hydrogen 2.769 N/A VAL 187.A N ASP 183.A O no hydrogen 2.980 N/A ALA 188.A N ALA 184.A O no hydrogen 2.925 N/A ILE 189.A N ILE 185.A O no hydrogen 3.178 N/A ILE 189.A N SER 186.A O no hydrogen 3.267 N/A MET 190.A N.A SER 186.A O no hydrogen 2.709 N/A MET 190.A N.B SER 186.A O no hydrogen 2.715 N/A LEU 191.A N VAL 187.A O no hydrogen 2.897 N/A THR 192.A OG1 ALA 188.A O no hydrogen 2.624 N/A PHE 193.A N ILE 189.A O no hydrogen 3.312 N/A SER 194.A OG MET 190.A O.A no hydrogen 2.684 N/A SER 194.A OG MET 190.A O.B no hydrogen 2.576 N/A GLU 196.A N LEU 191.A O no hydrogen 3.057 N/A THR 197.A N THR 192.A O no hydrogen 2.974 N/A THR 197.A OG1 THR 192.A O no hydrogen 2.899 N/A GLY 198.A N PHE 195.A O no hydrogen 3.154 N/A PHE 199.A N SER 194.A O no hydrogen 2.966 N/A ALA 200.A N PHE 195.A O no hydrogen 2.720 N/A ASN 201.A N GLY 198.A O no hydrogen 3.071 N/A ASN 201.A ND2 GLY 198.A O no hydrogen 3.692 N/A MET 202.A N PHE 199.A O no hydrogen 2.921 N/A GLN 203.A N PHE 199.A O no hydrogen 3.236 N/A PHE 204.A N ALA 200.A O no hydrogen 2.843 N/A LEU 205.A N ASN 201.A O no hydrogen 3.029 N/A GLY 206.A N ASN 201.A O no hydrogen 2.896 N/A LEU 207.A N MET 202.A O no hydrogen 2.991 N/A ALA 209.A N LEU 205.A O no hydrogen 2.983 N/A ASP 210.A N GLY 206.A O no hydrogen 3.391 N/A ALA 211.A N LEU 207.A O no hydrogen 2.836 N/A ALA 212.A N ALA 208.A O no hydrogen 2.854 N/A GLU 213.A N ALA 209.A O no hydrogen 3.023 N/A ALA 214.A N ASP 210.A O no hydrogen 2.889 N/A GLY 215.A N ALA 212.A O no hydrogen 2.975 N/A ASP 216.A N ALA 211.A O no hydrogen 2.819 N/A PHE 219.A N ASP 216.A OD1 no hydrogen 3.241 N/A ALA 220.A N ASP 216.A O no hydrogen 3.026 N/A ASN 221.A N TYR 217.A O no hydrogen 2.852 N/A LEU 222.A N THR 218.A O no hydrogen 3.055 N/A ILE 223.A N PHE 219.A O no hydrogen 2.978 N/A SER 224.A N ALA 220.A O no hydrogen 3.082 N/A SER 224.A OG ALA 220.A O no hydrogen 3.031 N/A SER 224.A OG ASN 221.A O no hydrogen 3.403 N/A SER 225.A N ASN 221.A O no hydrogen 3.094 N/A ILE 226.A N LEU 222.A O no hydrogen 2.988 N/A GLN 227.A N ILE 223.A O no hydrogen 3.094 N/A GLN 227.A NE2 GLU 196.A O no hydrogen 3.285 N/A GLN 227.A NE2 ASN 201.A OD1 no hydrogen 2.883 N/A THR 228.A N SER 224.A O no hydrogen 3.288 N/A THR 228.A N SER 225.A O no hydrogen 3.130 N/A THR 228.A OG1 SER 225.A O no hydrogen 2.655 N/A ASP 229.A N ILE 226.A O no hydrogen 3.015 N/A GLU 230.A N ILE 226.A O no hydrogen 3.316 N/A SER 231.A N GLN 227.A O no hydrogen 2.923 N/A SER 231.A OG GLN 227.A O no hydrogen 3.201 N/A ARG 232.A N ASP 229.A O no hydrogen 3.030 N/A ARG 232.A NH1 ASP 132.A OD2 no hydrogen 2.836 N/A ARG 232.A NH2 GLN 61.A OE1 no hydrogen 3.414 N/A ARG 232.A NH2 ASP 132.A OD1 no hydrogen 3.053 N/A ARG 232.A NH2 ASP 132.A OD2 no hydrogen 3.284 N/A HIS 233.A N ASP 229.A O no hydrogen 2.936 N/A HIS 233.A ND1 ASP 132.A OD2 no hydrogen 2.758 N/A HIS 233.A NE2 GLU 230.A OE2 no hydrogen 2.767 N/A ALA 234.A N GLU 230.A O no hydrogen 2.786 N/A GLN 235.A N ARG 232.A O no hydrogen 3.093 N/A GLN 236.A N HIS 233.A O no hydrogen 3.165 N/A GLN 236.A NE2 ASN 122.A O no hydrogen 3.284 N/A GLN 236.A NE2 ASN 122.A OD1 no hydrogen 2.794 N/A GLY 237.A N ALA 234.A O no hydrogen 3.059 N/A LEU 241.A N GLY 237.A O no hydrogen 2.885 N/A GLN 242.A N.A GLY 238.A O no hydrogen 2.875 N/A GLN 242.A N.B GLY 238.A O no hydrogen 2.865 N/A GLN 242.A NE2.B GLY 238.A O no hydrogen 2.554 N/A LEU 243.A N PRO 239.A O no hydrogen 3.041 N/A LEU 244.A N ALA 240.A O no hydrogen 2.996 N/A ILE 245.A N LEU 241.A O no hydrogen 2.973 N/A GLU 246.A N GLN 242.A O.A no hydrogen 2.861 N/A GLU 246.A N GLN 242.A O.B no hydrogen 2.910 N/A ASN 247.A N LEU 243.A O no hydrogen 3.110 N/A ASN 247.A N LEU 244.A O no hydrogen 3.157 N/A GLY 248.A N ILE 245.A O no hydrogen 3.312 N/A LYS 249.A N LEU 244.A O no hydrogen 2.843 N/A LYS 249.A NZ MET 36.A O no hydrogen 3.334 N/A ARG 250.A NH1 GLY 309.A O no hydrogen 2.648 N/A ARG 250.A NH2 GLY 309.A O no hydrogen 3.005 N/A GLU 252.A N GLU 252.A OE1 no hydrogen 2.893 N/A ALA 253.A N LYS 249.A O no hydrogen 2.974 N/A GLN 254.A N ARG 250.A O no hydrogen 2.867 N/A GLN 254.A NE2 ASP 258.A OD1 no hydrogen 2.869 N/A GLN 254.A NE2 ASP 311.A O no hydrogen 3.010 N/A LYS 255.A N GLU 251.A O.A no hydrogen 3.005 N/A LYS 255.A N GLU 251.A O.B no hydrogen 3.063 N/A LYS 256.A N GLU 252.A O no hydrogen 3.017 N/A LYS 256.A NZ SER 186.A OG no hydrogen 3.260 N/A VAL 257.A N ALA 253.A O no hydrogen 2.966 N/A ASP 258.A N GLN 254.A O no hydrogen 2.827 N/A MET 259.A N.A LYS 255.A O no hydrogen 2.934 N/A MET 259.A N.B LYS 255.A O no hydrogen 2.938 N/A ALA 260.A N LYS 256.A O no hydrogen 2.958 N/A ILE 261.A N VAL 257.A O no hydrogen 2.952 N/A TRP 262.A N ASP 258.A O no hydrogen 3.350 N/A TRP 262.A NE1 ASP 432.A OD2 no hydrogen 2.984 N/A ARG 263.A N MET 259.A O.A no hydrogen 3.044 N/A ARG 263.A N MET 259.A O.B no hydrogen 2.975 N/A ARG 263.A NH1 HIS 173.A ND1 no hydrogen 3.068 N/A ARG 263.A NH1 HIS 173.A O no hydrogen 3.387 N/A ARG 263.A NH1 ASP 177.A OD2 no hydrogen 2.817 N/A ARG 263.A NH2 HIS 173.A ND1 no hydrogen 2.952 N/A ALA 264.A N ALA 260.A O no hydrogen 2.889 N/A TRP 265.A N ILE 261.A O no hydrogen 2.867 N/A TRP 265.A NE1 ASP 322.A OD2 no hydrogen 2.885 N/A ARG 266.A N TRP 262.A O no hydrogen 3.084 N/A ARG 266.A NH1 GLY 428.A O no hydrogen 3.323 N/A ARG 266.A NH2 ASP 322.A OD2 no hydrogen 2.813 N/A LEU 267.A N ARG 263.A O no hydrogen 3.396 N/A PHE 268.A N ALA 264.A O no hydrogen 2.923 N/A ALA 269.A N TRP 265.A O no hydrogen 2.828 N/A VAL 270.A N ARG 266.A O no hydrogen 3.370 N/A VAL 270.A N LEU 267.A O no hydrogen 3.114 N/A LEU 271.A N.A LEU 267.A O no hydrogen 3.035 N/A LEU 271.A N.B LEU 267.A O no hydrogen 3.046 N/A THR 272.A N PHE 268.A O no hydrogen 2.802 N/A THR 272.A OG1 PHE 268.A O no hydrogen 3.434 N/A GLY 273.A N PHE 268.A O no hydrogen 3.336 N/A MET 276.A N THR 272.A O no hydrogen 2.927 N/A ASP 277.A N GLY 273.A O no hydrogen 3.205 N/A TYR 278.A N PRO 274.A O no hydrogen 2.951 N/A TYR 278.A OH HIS 328.A ND1 no hydrogen 2.681 N/A TYR 279.A N PRO 274.A O no hydrogen 2.897 N/A THR 280.A N VAL 275.A O no hydrogen 2.976 N/A THR 280.A OG1 VAL 275.A O no hydrogen 2.875 N/A ASP 284.A N PRO 281.A O no hydrogen 2.779 N/A ARG 285.A N LEU 282.A O no hydrogen 3.136 N/A ARG 285.A NE THR 280.A O no hydrogen 2.815 N/A ARG 285.A NH2 THR 280.A O no hydrogen 2.950 N/A ARG 285.A NH2 GLU 353.A OE2 no hydrogen 3.009 N/A SER 286.A N ASP 210.A OD1 no hydrogen 2.986 N/A GLN 287.A NE2 GLU 295.A OE1 no hydrogen 2.750 N/A SER 288.A N GLU 291.A OE1 no hydrogen 2.850 N/A PHE 289.A N ASP 277.A OD1 no hydrogen 2.811 N/A LYS 290.A N TYR 361.A OH no hydrogen 3.067 N/A LYS 290.A NZ ASP 324.A OD1 no hydrogen 2.774 N/A GLU 291.A N SER 288.A OG no hydrogen 3.002 N/A PHE 292.A N SER 288.A O no hydrogen 2.849 N/A MET 293.A N PHE 289.A O no hydrogen 2.804 N/A TYR 294.A N LYS 290.A O no hydrogen 2.875 N/A GLU 295.A N GLU 291.A O no hydrogen 2.984 N/A TRP 296.A N PHE 292.A O no hydrogen 2.788 N/A ILE 297.A N MET 293.A O no hydrogen 2.824 N/A ILE 298.A N MET 293.A O no hydrogen 3.030 N/A GLY 299.A N TYR 294.A O no hydrogen 2.858 N/A GLN 300.A N GLU 295.A O no hydrogen 3.152 N/A PHE 301.A N TRP 296.A O no hydrogen 2.953 N/A GLU 302.A N ILE 297.A O no hydrogen 2.855 N/A ARG 303.A NH1 ASP 307.A OD2 no hydrogen 3.529 N/A ARG 303.A NH2 ARG 303.A O no hydrogen 3.131 N/A ARG 303.A NH2 ASP 307.A OD2 no hydrogen 2.951 N/A SER 304.A N.A GLN 300.A O no hydrogen 3.027 N/A SER 304.A N.B GLN 300.A O no hydrogen 3.045 N/A SER 304.A N.B PHE 301.A O no hydrogen 3.050 N/A SER 304.A OG.A PHE 301.A O no hydrogen 2.615 N/A SER 304.A OG.B GLN 300.A O no hydrogen 3.332 N/A LEU 305.A N PHE 301.A O no hydrogen 3.041 N/A ILE 306.A N GLU 302.A O no hydrogen 3.066 N/A ASP 307.A N ARG 303.A O no hydrogen 2.993 N/A LEU 308.A N SER 304.A O.A no hydrogen 3.022 N/A LEU 308.A N SER 304.A O.B no hydrogen 3.100 N/A LEU 308.A N LEU 305.A O no hydrogen 3.235 N/A GLY 309.A N ILE 306.A O no hydrogen 2.979 N/A LEU 310.A N LEU 305.A O no hydrogen 3.045 N/A ASP 311.A N GLN 254.A OE1 no hydrogen 2.839 N/A TYR 315.A OH ASP 258.A O no hydrogen 2.627 N/A TRP 316.A N PRO 313.A O no hydrogen 3.069 N/A PHE 319.A N TYR 315.A O no hydrogen 2.875 N/A LEU 320.A N TRP 316.A O no hydrogen 2.984 N/A LYS 321.A N ASP 317.A O no hydrogen 3.154 N/A LYS 321.A NZ GLU 325.A OE1 no hydrogen 2.983 N/A LYS 321.A NZ GLU 325.A OE2 no hydrogen 3.090 N/A ASP 322.A N LEU 318.A O no hydrogen 2.948 N/A ILE 323.A N PHE 319.A O no hydrogen 2.960 N/A ASP 324.A N LYS 321.A O no hydrogen 3.031 N/A GLU 325.A N ASP 322.A O no hydrogen 3.093 N/A LEU 326.A N ASP 322.A O no hydrogen 2.826 N/A HIS 327.A NE2 ASP 277.A OD2 no hydrogen 2.702 N/A HIS 328.A ND1 TYR 278.A OH no hydrogen 2.681 N/A SER 329.A OG GLY 405.A O no hydrogen 2.667 N/A TYR 330.A N LEU 326.A O no hydrogen 2.914 N/A HIS 331.A N HIS 327.A O no hydrogen 2.810 N/A HIS 331.A NE2 ALA 347.A O no hydrogen 2.825 N/A MET 332.A N HIS 328.A O no hydrogen 3.217 N/A GLY 333.A N SER 329.A O no hydrogen 2.901 N/A VAL 334.A N TYR 330.A O no hydrogen 2.864 N/A TRP 335.A N HIS 331.A O no hydrogen 2.855 N/A TRP 335.A NE1 ASP 481.A OD1 no hydrogen 2.890 N/A TYR 336.A N MET 332.A O no hydrogen 2.790 N/A TYR 336.A OH LEU 386.A O no hydrogen 2.668 N/A TRP 337.A N GLY 333.A O no hydrogen 2.959 N/A TRP 337.A NE1 THR 391.A O no hydrogen 2.854 N/A ARG 338.A N TRP 335.A O no hydrogen 2.979 N/A ARG 338.A NH1 VAL 387.A O.A no hydrogen 2.940 N/A ARG 338.A NH1 VAL 387.A O.B no hydrogen 2.903 N/A ARG 338.A NH2 TRP 335.A O no hydrogen 3.021 N/A ARG 338.A NH2 VAL 387.A O.A no hydrogen 2.990 N/A ARG 338.A NH2 VAL 387.A O.B no hydrogen 2.959 N/A THR 340.A N TRP 337.A O no hydrogen 2.892 N/A THR 340.A OG1 TRP 337.A O no hydrogen 2.679 N/A ALA 341.A N ARG 338.A O no hydrogen 2.931 N/A TRP 342.A NE1 LYS 93.A O no hydrogen 2.919 N/A TRP 343.A NE1 TYR 279.A OH no hydrogen 3.017 N/A ASN 344.A N SER 90.A OG no hydrogen 3.104 N/A THR 350.A N GLU 353.A OE1 no hydrogen 3.095 N/A THR 350.A OG1 GLU 353.A OE1 no hydrogen 2.672 N/A ARG 354.A N THR 350.A O no hydrogen 2.875 N/A ARG 354.A NE ASN 365.A OD1 no hydrogen 2.993 N/A ARG 354.A NH1 ASP 373.A OD1 no hydrogen 2.882 N/A ARG 354.A NH2 ASN 365.A OD1 no hydrogen 2.906 N/A ARG 354.A NH2 GLY 369.A O no hydrogen 3.391 N/A ARG 354.A NH2 ASP 373.A OD1 no hydrogen 2.926 N/A ASP 355.A N PRO 351.A O no hydrogen 2.970 N/A TRP 356.A N GLU 352.A O no hydrogen 3.210 N/A LEU 357.A N GLU 353.A O no hydrogen 2.803 N/A GLU 358.A N ARG 354.A O no hydrogen 2.901 N/A GLU 359.A N ASP 355.A O no hydrogen 3.001 N/A LYS 360.A N TRP 356.A O no hydrogen 2.900 N/A LYS 360.A NZ GLU 291.A OE1 no hydrogen 3.559 N/A LYS 360.A NZ GLU 291.A OE2 no hydrogen 2.862 N/A TYR 361.A N LEU 357.A O no hydrogen 2.777 N/A TYR 361.A OH ASP 277.A OD2 no hydrogen 2.558 N/A GLY 363.A N GLU 358.A OE2 no hydrogen 2.784 N/A TRP 364.A N TYR 361.A O no hydrogen 2.960 N/A TRP 364.A NE1 TYR 278.A OH no hydrogen 3.098 N/A ASN 365.A N GLU 358.A OE1 no hydrogen 2.832 N/A ASN 365.A ND2 ARG 354.A O no hydrogen 3.477 N/A ASN 365.A ND2 GLU 358.A OE1 no hydrogen 2.799 N/A LYS 366.A N GLY 363.A O no hydrogen 3.209 N/A LYS 366.A NZ ASP 409.A OD2 no hydrogen 2.868 N/A ARG 367.A N TRP 364.A O no hydrogen 3.035 N/A ARG 367.A NE ASP 410.A OD1 no hydrogen 3.116 N/A ARG 367.A NH2 ASP 410.A OD2 no hydrogen 3.507 N/A TRP 368.A NE1 SER 329.A OG no hydrogen 2.862 N/A GLY 369.A N TRP 364.A O no hydrogen 3.065 N/A ARG 370.A N ARG 367.A O no hydrogen 2.940 N/A ARG 370.A NE ASP 409.A OD1 no hydrogen 2.888 N/A ARG 370.A NH2 ASP 409.A OD1 no hydrogen 3.535 N/A ARG 370.A NH2 ASP 409.A OD2 no hydrogen 2.857 N/A TRP 372.A N TRP 368.A O no hydrogen 3.090 N/A ASP 373.A N GLY 369.A O no hydrogen 2.806 N/A VAL 374.A N ARG 370.A O no hydrogen 3.419 N/A ILE 375.A N CYS 371.A O no hydrogen 3.120 N/A THR 376.A N TRP 372.A O no hydrogen 2.788 N/A THR 376.A OG1 TRP 372.A O no hydrogen 2.703 N/A GLU 377.A N ASP 373.A O no hydrogen 3.036 N/A ASN 378.A N VAL 374.A O no hydrogen 2.996 N/A VAL 379.A N ILE 375.A O no hydrogen 3.038 N/A LEU 380.A N THR 376.A O no hydrogen 2.963 N/A ASN 381.A N GLU 377.A O no hydrogen 3.047 N/A ASP 382.A N VAL 379.A O no hydrogen 2.972 N/A ARG 383.A N ASN 378.A O no hydrogen 2.886 N/A LEU 386.A N ARG 383.A O no hydrogen 3.136 N/A VAL 387.A N.A MET 384.A O no hydrogen 3.129 N/A VAL 387.A N.B MET 384.A O no hydrogen 3.171 N/A CYS 396.A N ILE 401.A O no hydrogen 2.852 N/A ASN 397.A N HIS 426.A O no hydrogen 2.822 N/A ASN 397.A ND2 HIS 426.A O no hydrogen 3.486 N/A GLN 400.A N CYS 396.A O no hydrogen 3.170 N/A GLN 400.A NE2 ASN 397.A O no hydrogen 3.214 N/A GLN 400.A NE2 MET 398.A O no hydrogen 3.018 N/A ILE 401.A N SER 399.A OG no hydrogen 3.324 N/A LEU 403.A N SER 394.A O no hydrogen 2.755 N/A VAL 406.A N ASN 412.A O no hydrogen 2.866 N/A ASP 409.A N LYS 366.A O no hydrogen 2.859 N/A TRP 411.A N GLY 408.A O no hydrogen 3.318 N/A ASN 412.A N VAL 406.A O no hydrogen 2.980 N/A PHE 416.A N PHE 427.A O no hydrogen 2.888 N/A SER 417.A OG HIS 426.A ND1 no hydrogen 2.701 N/A LEU 418.A N TYR 425.A O no hydrogen 2.944 N/A HIS 420.A N ARG 423.A O no hydrogen 2.962 N/A HIS 420.A NE2 GLN 444.A OE1 no hydrogen 2.805 N/A ARG 423.A N HIS 420.A O no hydrogen 3.095 N/A ARG 423.A NH1 HIS 446.A O no hydrogen 3.023 N/A ARG 423.A NH2 HIS 446.A O no hydrogen 2.964 N/A TYR 425.A N LEU 418.A O no hydrogen 2.805 N/A TYR 425.A OH GLN 444.A O no hydrogen 2.548 N/A HIS 426.A ND1 SER 417.A OG no hydrogen 2.701 N/A PHE 427.A N PHE 416.A O no hydrogen 2.876 N/A SER 429.A OG ASP 432.A OD2 no hydrogen 2.709 N/A ASP 432.A N SER 429.A OG no hydrogen 2.899 N/A ARG 433.A N SER 429.A O no hydrogen 3.242 N/A ARG 433.A NH1 SER 417.A O no hydrogen 2.903 N/A ARG 433.A NH2 GLU 430.A OE2 no hydrogen 2.855 N/A TRP 434.A N GLU 430.A O no hydrogen 2.908 N/A VAL 435.A N VAL 431.A O no hydrogen 2.794 N/A PHE 436.A N ASP 432.A O no hydrogen 3.147 N/A GLN 437.A N ARG 433.A O no hydrogen 3.071 N/A GLN 438.A N TRP 434.A O no hydrogen 3.066 N/A GLN 438.A N VAL 435.A O no hydrogen 3.170 N/A GLN 438.A NE2 TRP 434.A O no hydrogen 3.054 N/A ASP 439.A N PHE 436.A O no hydrogen 3.169 N/A GLN 442.A N ASP 439.A O no hydrogen 2.910 N/A GLN 442.A NE2 ASP 177.A OD1 no hydrogen 2.919 N/A GLN 442.A NE2 GLY 181.A O no hydrogen 3.461 N/A TYR 443.A N PRO 440.A O no hydrogen 2.950 N/A TYR 443.A OH ASP 177.A OD1 no hydrogen 3.250 N/A TYR 443.A OH ASP 177.A OD2 no hydrogen 2.588 N/A GLN 444.A N PRO 440.A O no hydrogen 2.661 N/A HIS 446.A N TYR 443.A O no hydrogen 2.983 N/A ASN 448.A N ASP 451.A OD2 no hydrogen 2.904 N/A ASN 448.A ND2 CYS 396.A O no hydrogen 3.553 N/A ASP 451.A N ASN 448.A OD1 no hydrogen 2.804 N/A ARG 452.A N ASN 448.A O no hydrogen 2.902 N/A ARG 452.A NE MET 447.A O.A no hydrogen 2.805 N/A ARG 452.A NE MET 447.A O.B no hydrogen 2.796 N/A ARG 452.A NH1 TYR 469.A OH no hydrogen 3.008 N/A ARG 452.A NH2 MET 447.A O.A no hydrogen 3.019 N/A ARG 452.A NH2 MET 447.A O.B no hydrogen 2.992 N/A PHE 453.A N ILE 449.A O no hydrogen 2.939 N/A LEU 454.A N VAL 450.A O no hydrogen 2.874 N/A ALA 455.A N ASP 451.A O no hydrogen 2.994 N/A ALA 455.A N ARG 452.A O no hydrogen 3.219 N/A GLY 456.A N PHE 453.A O no hydrogen 3.505 N/A GLN 457.A N ARG 452.A O no hydrogen 3.054 N/A GLN 459.A NE2 GLY 456.A O no hydrogen 3.066 N/A THR 462.A N PRO 460.A O no hydrogen 2.797 N/A GLY 465.A N THR 462.A OG1 no hydrogen 2.966 N/A ALA 466.A N THR 462.A O no hydrogen 2.893 N/A LEU 467.A N LEU 463.A O no hydrogen 2.821 N/A LYS 468.A N GLU 464.A O no hydrogen 3.029 N/A TYR 469.A N GLY 465.A O no hydrogen 2.963 N/A MET 470.A N ALA 466.A O no hydrogen 2.910 N/A GLY 471.A N LYS 468.A O no hydrogen 3.043 N/A GLN 473.A N GLU 477.A OE1 no hydrogen 2.814 N/A SER 474.A OG GLU 476.A OE1 no hydrogen 2.668 N/A GLU 476.A N GLU 476.A OE1 no hydrogen 2.910 N/A GLU 477.A N SER 474.A O no hydrogen 3.128 N/A MET 478.A N ILE 475.A O no hydrogen 3.381 N/A LYS 480.A N.A ASN 344.A OD1 no hydrogen 2.987 N/A LYS 480.A N.B ASN 344.A OD1 no hydrogen 2.980 N/A LYS 480.A NZ.B ASP 481.A O no hydrogen 3.038 N/A LYS 480.A NZ.B ASP 484.A OD1.A no hydrogen 3.445 N/A ALA 482.A N PRO 345.A O no hydrogen 2.912 N/A HIS 483.A N ASP 481.A OD2 no hydrogen 2.966 N/A HIS 483.A NE2 ASP 85.A OD1 no hydrogen 3.065 N/A HIS 483.A NE2 ASP 85.A OD2 no hydrogen 3.070 N/A ASP 484.A N ASP 481.A O no hydrogen 3.080 N/A PHE 485.A N ASP 481.A OD2 no hydrogen 2.916 N/A ALA 486.A N HIS 483.A O no hydrogen 2.902 N/A TRP 487.A NE1 ASP 481.A OD1 no hydrogen 2.872 N/A ALA 488.A N PHE 485.A O no hydrogen 3.058 N/A ASP 489.A N ALA 486.A O no hydrogen 3.222 N/A LYS 490.A N TRP 487.A O no hydrogen 2.991 N/A CYS 491.A N ALA 488.A O no hydrogen 2.831 N/A CYS 491.A SG TRP 487.A O no hydrogen 3.731 N/A