Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4m56_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): TRP 2.A NE1 ASP 244.A OD1 no hydrogen 2.817 N/A LYS 4.A N GLU 1.A O no hydrogen 3.102 N/A LYS 4.A NZ GLU 1.A OE1 no hydrogen 3.279 N/A LYS 4.A NZ GLU 1.A OE2 no hydrogen 2.997 N/A GLU 5.A N TRP 2.A O no hydrogen 3.221 N/A VAL 7.A N ASP 43.A OD1 no hydrogen 3.276 N/A VAL 8.A N PRO 360.A O no hydrogen 2.986 N/A TYR 9.A N VAL 44.A O no hydrogen 2.820 N/A TYR 9.A OH GLU 367.A OE2 no hydrogen 2.619 N/A GLN 10.A N ILE 362.A O no hydrogen 2.721 N/A GLN 10.A NE2 HIS 326.A ND1 no hydrogen 2.941 N/A ILE 11.A N TRP 46.A O no hydrogen 2.872 N/A TYR 12.A N GLN 364.A OE1 no hydrogen 2.810 N/A ARG 14.A NH1 GLN 55.A OE1 no hydrogen 2.849 N/A SER 15.A N TYR 12.A O no hydrogen 2.913 N/A SER 15.A OG ARG 417.A O no hydrogen 2.663 N/A PHE 16.A N PRO 13.A O no hydrogen 3.445 N/A ASP 18.A N PHE 430.A O no hydrogen 3.112 N/A ALA 19.A N ASP 26.A OD1 no hydrogen 2.935 N/A ASN 20.A N ASP 26.A OD2 no hydrogen 3.173 N/A GLY 21.A N ASP 18.A OD1 no hydrogen 2.888 N/A GLY 23.A N ASP 18.A OD2 no hydrogen 2.771 N/A PHE 24.A N ASP 22.A OD1 no hydrogen 3.066 N/A GLY 25.A N ARG 14.A O no hydrogen 3.099 N/A ASP 26.A N TYR 17.A O no hydrogen 3.219 N/A LEU 27.A N PHE 72.A O no hydrogen 3.020 N/A GLN 28.A NE2 ASP 77.A OD1 no hydrogen 2.858 N/A GLN 28.A NE2 GLN 80.A OE1 no hydrogen 3.076 N/A GLY 29.A N ASP 26.A OD1 no hydrogen 2.900 N/A VAL 30.A N ASP 26.A O no hydrogen 3.174 N/A ILE 31.A N LEU 27.A O no hydrogen 2.989 N/A GLN 32.A N GLN 28.A O no hydrogen 3.071 N/A LYS 33.A N VAL 30.A O no hydrogen 2.908 N/A LEU 34.A N ILE 31.A O no hydrogen 3.312 N/A TYR 36.A OH GLU 367.A OE2 no hydrogen 2.838 N/A ILE 37.A N LYS 33.A O no hydrogen 3.200 N/A LYS 38.A N LEU 34.A O no hydrogen 2.958 N/A LYS 38.A NZ ARG 88.A O no hydrogen 3.100 N/A ASN 39.A N ASP 35.A O no hydrogen 2.930 N/A LEU 40.A N TYR 36.A O no hydrogen 3.043 N/A GLY 41.A N ILE 37.A O no hydrogen 3.012 N/A ASP 43.A N VAL 7.A O no hydrogen 3.103 N/A VAL 44.A N VAL 7.A O no hydrogen 3.351 N/A ILE 45.A N LYS 91.A O no hydrogen 2.811 N/A TRP 46.A N TYR 9.A O no hydrogen 2.988 N/A TRP 46.A NE1 ASP 95.A OD2 no hydrogen 2.957 N/A LEU 47.A N VAL 93.A O no hydrogen 2.953 N/A SER 48.A N ILE 11.A O no hydrogen 2.871 N/A SER 48.A OG TYR 60.A OH no hydrogen 3.034 N/A ASP 52.A N ASN 67.A O no hydrogen 3.003 N/A SER 53.A N ASP 52.A OD2 no hydrogen 2.996 N/A SER 53.A OG ASP 61.A O no hydrogen 2.744 N/A SER 53.A OG ASP 61.A OD1 no hydrogen 2.893 N/A GLN 55.A N SER 53.A OG no hydrogen 2.922 N/A GLN 55.A NE2 SER 53.A O no hydrogen 3.217 N/A ASP 56.A N ASP 61.A OD2 no hydrogen 2.833 N/A ASP 57.A N ASP 61.A OD1 no hydrogen 3.124 N/A ASN 58.A ND2 TYR 12.A OH no hydrogen 3.454 N/A ASN 58.A ND2 ASP 381.A OD2 no hydrogen 3.184 N/A TYR 60.A N ASP 57.A O no hydrogen 3.128 N/A TYR 60.A OH SER 48.A OG no hydrogen 3.034 N/A TYR 60.A OH ASP 95.A OD2 no hydrogen 2.667 N/A SER 63.A N ASP 52.A O no hydrogen 2.788 N/A ASP 64.A N ASP 52.A O no hydrogen 3.466 N/A TYR 65.A OH VAL 97.A O no hydrogen 2.689 N/A LYS 66.A N ASP 64.A OD1 no hydrogen 2.833 N/A ASN 67.A ND2 ASP 64.A OD2 no hydrogen 2.771 N/A TYR 69.A N VAL 50.A O no hydrogen 2.963 N/A PHE 72.A N TYR 69.A O no hydrogen 3.067 N/A GLY 73.A N GLU 70.A O no hydrogen 3.087 N/A THR 74.A N ASP 77.A OD2 no hydrogen 2.895 N/A THR 74.A OG1 ASP 77.A OD2 no hydrogen 3.230 N/A ASN 75.A ND2 LYS 66.A O no hydrogen 3.096 N/A ASP 77.A N THR 74.A O no hydrogen 3.140 N/A ASP 77.A N THR 74.A OG1 no hydrogen 3.306 N/A MET 78.A N THR 74.A O no hydrogen 3.315 N/A PHE 79.A N ASN 75.A O no hydrogen 2.901 N/A GLN 80.A N GLU 76.A O no hydrogen 3.244 N/A LEU 81.A N ASP 77.A O no hydrogen 2.850 N/A ILE 82.A N MET 78.A O no hydrogen 2.938 N/A ASP 83.A N PHE 79.A O no hydrogen 3.007 N/A GLU 84.A N GLN 80.A O no hydrogen 2.815 N/A VAL 85.A N LEU 81.A O no hydrogen 2.904 N/A HIS 86.A N ILE 82.A O no hydrogen 3.059 N/A HIS 86.A NE2 ASP 192.A OD2 no hydrogen 2.830 N/A LYS 87.A N ASP 83.A O no hydrogen 2.836 N/A LYS 87.A NZ GLU 84.A OE2 no hydrogen 3.313 N/A ARG 88.A N VAL 85.A O no hydrogen 3.241 N/A ARG 88.A NE ASP 35.A OD1 no hydrogen 2.776 N/A ARG 88.A NH1 GLU 84.A O no hydrogen 2.880 N/A ARG 88.A NH1 GLU 84.A OE2 no hydrogen 2.835 N/A ARG 88.A NH2 ASP 35.A OD1 no hydrogen 3.193 N/A GLY 89.A N HIS 86.A O no hydrogen 3.003 N/A MET 90.A N VAL 85.A O no hydrogen 2.888 N/A LYS 91.A N ASP 43.A O no hydrogen 2.873 N/A ILE 92.A N ASP 192.A OD2 no hydrogen 2.872 N/A VAL 93.A N ILE 45.A O no hydrogen 2.683 N/A MET 94.A N GLY 193.A O no hydrogen 3.107 N/A LEU 96.A N ARG 195.A O no hydrogen 2.737 N/A ASN 99.A ND2 HIS 100.A ND1 no hydrogen 3.242 N/A ASN 99.A ND2 ASP 167.A OD2 no hydrogen 3.061 N/A THR 101.A N PRO 166.A O no hydrogen 3.146 N/A THR 101.A OG1 SER 102.A O no hydrogen 3.066 N/A THR 101.A OG1 TYR 123.A OH no hydrogen 2.647 N/A SER 102.A N ILE 62.A O no hydrogen 2.879 N/A SER 102.A OG ASP 103.A OD1 no hydrogen 3.509 N/A ASP 103.A N LYS 164.A O no hydrogen 3.049 N/A GLU 104.A N SER 102.A OG no hydrogen 2.828 N/A HIS 105.A N SER 102.A O no hydrogen 2.910 N/A TRP 107.A N HIS 105.A ND1 no hydrogen 3.208 N/A ALA 109.A N HIS 105.A O no hydrogen 3.021 N/A GLU 110.A N ALA 106.A O no hydrogen 3.228 N/A SER 111.A N TRP 107.A O no hydrogen 2.949 N/A SER 111.A OG TYR 119.A O no hydrogen 3.158 N/A SER 111.A OG ARG 120.A O no hydrogen 2.991 N/A ARG 112.A N PHE 108.A O no hydrogen 2.950 N/A ARG 112.A NH2 ASP 150.A OD1 no hydrogen 3.204 N/A LYS 113.A N GLU 110.A O no hydrogen 2.817 N/A LYS 113.A NZ GLU 110.A OE1 no hydrogen 3.299 N/A LYS 113.A NZ GLU 110.A OE2 no hydrogen 2.759 N/A SER 114.A OG ASP 116.A OD1 no hydrogen 2.811 N/A ASN 117.A N SER 114.A O no hydrogen 3.223 N/A ASN 117.A ND2 GLU 110.A OE1 no hydrogen 2.786 N/A TYR 119.A N ASN 117.A OD1 no hydrogen 2.816 N/A ARG 120.A N ASN 117.A O no hydrogen 2.845 N/A ARG 120.A NH1 SER 111.A O no hydrogen 2.965 N/A ARG 120.A NH2 THR 153.A OG1 no hydrogen 2.892 N/A ARG 120.A NH2 GLN 155.A OE1 no hydrogen 2.709 N/A TYR 122.A N TYR 119.A O no hydrogen 3.045 N/A TYR 122.A OH GLU 178.A OE1 no hydrogen 2.783 N/A TYR 123.A OH THR 101.A OG1 no hydrogen 2.647 N/A TRP 125.A NE1 SER 111.A OG no hydrogen 2.961 N/A LYS 126.A N TYR 156.A O no hydrogen 3.016 N/A LYS 129.A N SER 133.A O no hydrogen 2.891 N/A GLY 132.A N LYS 129.A O no hydrogen 2.686 N/A SER 133.A N ASP 131.A OD1 no hydrogen 3.247 N/A SER 133.A OG ASP 131.A OD1 no hydrogen 2.617 N/A SER 133.A OG ASP 131.A OD2 no hydrogen 3.358 N/A GLU 134.A N GLU 134.A OE1 no hydrogen 2.838 N/A ASN 136.A ND2 PHE 208.A O no hydrogen 3.126 N/A ASN 137.A N ASP 210.A OD1 no hydrogen 2.925 N/A ASN 137.A ND2 TYR 211.A O no hydrogen 3.209 N/A TRP 138.A N ASN 136.A OD1 no hydrogen 3.061 N/A TRP 138.A NE1 PRO 209.A O no hydrogen 2.940 N/A GLY 139.A N ILE 217.A O no hydrogen 2.789 N/A SER 140.A N GLY 144.A O no hydrogen 2.911 N/A SER 140.A OG TYR 160.A O no hydrogen 3.089 N/A SER 140.A OG PHE 161.A O no hydrogen 2.632 N/A ILE 141.A N TYR 160.A O no hydrogen 2.671 N/A PHE 142.A N SER 140.A OG no hydrogen 2.881 N/A SER 143.A N SER 140.A O no hydrogen 3.000 N/A GLY 144.A N GLU 391.A OE2 no hydrogen 2.839 N/A SER 145.A OG TRP 147.A O no hydrogen 3.192 N/A ALA 146.A N TRP 138.A O no hydrogen 2.892 N/A TRP 147.A N SER 145.A OG no hydrogen 2.827 N/A TRP 147.A NE1 ASN 136.A OD1 no hydrogen 2.714 N/A THR 148.A N TYR 157.A O no hydrogen 3.058 N/A THR 148.A OG1 HIS 159.A NE2 no hydrogen 2.688 N/A ASP 150.A N GLN 155.A O no hydrogen 2.831 N/A THR 153.A N ASP 150.A O no hydrogen 3.120 N/A THR 153.A N ASP 150.A OD2 no hydrogen 2.886 N/A THR 153.A OG1 ASP 150.A OD2 no hydrogen 3.161 N/A GLY 154.A N ASP 150.A O no hydrogen 2.871 N/A GLN 155.A NE2 ASP 127.A OD1 no hydrogen 2.838 N/A TYR 156.A N LYS 126.A O no hydrogen 2.856 N/A TYR 156.A OH GLY 132.A O no hydrogen 2.890 N/A TYR 157.A N THR 148.A O no hydrogen 2.852 N/A TYR 157.A OH LYS 163.A O no hydrogen 2.552 N/A LEU 158.A N LEU 124.A O no hydrogen 3.102 N/A HIS 159.A N ALA 146.A O no hydrogen 2.595 N/A HIS 159.A ND1 PHE 161.A O no hydrogen 2.677 N/A HIS 159.A NE2 THR 148.A OG1 no hydrogen 2.688 N/A TYR 160.A N ASP 167.A OD1 no hydrogen 2.849 N/A SER 162.A N GLN 165.A OE1 no hydrogen 2.846 N/A SER 162.A OG ASP 56.A OD2 no hydrogen 2.744 N/A SER 162.A OG GLN 165.A OE1 no hydrogen 3.122 N/A LYS 164.A N SER 162.A OG no hydrogen 2.906 N/A LYS 164.A NZ ASP 103.A OD1 no hydrogen 2.857 N/A LYS 164.A NZ ASP 103.A OD2 no hydrogen 3.483 N/A LYS 164.A NZ GLU 104.A OE2 no hydrogen 2.959 N/A GLN 165.A N SER 162.A O no hydrogen 2.875 N/A GLN 165.A NE2 ASP 57.A OD2 no hydrogen 3.075 N/A GLN 165.A NE2 TYR 60.A O no hydrogen 3.089 N/A ASP 167.A N LEU 158.A O no hydrogen 3.033 N/A LEU 168.A N ASN 99.A O no hydrogen 2.844 N/A ASN 169.A N TYR 122.A O no hydrogen 2.891 N/A ASN 169.A ND2 ASP 121.A O no hydrogen 2.869 N/A TRP 170.A NE1 VAL 98.A O no hydrogen 2.897 N/A GLU 171.A N ASN 169.A OD1 no hydrogen 3.220 N/A ASN 172.A N ASN 169.A O no hydrogen 2.903 N/A ASN 172.A ND2 ASP 121.A O no hydrogen 3.110 N/A ALA 174.A N ASN 172.A OD1 no hydrogen 2.944 N/A ARG 176.A N ASN 172.A O no hydrogen 3.329 N/A ARG 176.A NE GLU 234.A OE1 no hydrogen 2.717 N/A ARG 176.A NH1 TRP 170.A O no hydrogen 2.716 N/A ARG 177.A N GLU 173.A O no hydrogen 3.053 N/A GLU 178.A N ALA 174.A O no hydrogen 2.926 N/A VAL 179.A N VAL 175.A O no hydrogen 3.016 N/A TYR 180.A N ARG 176.A O no hydrogen 2.880 N/A TYR 180.A OH GLU 234.A OE1 no hydrogen 2.763 N/A ASP 181.A N ARG 177.A O no hydrogen 2.875 N/A VAL 182.A N GLU 178.A O no hydrogen 3.060 N/A MET 183.A N VAL 179.A O no hydrogen 2.950 N/A ARG 184.A N TYR 180.A O no hydrogen 2.795 N/A PHE 185.A N ASP 181.A O no hydrogen 2.958 N/A TRP 186.A N VAL 182.A O no hydrogen 3.408 N/A TRP 186.A NE1 TYR 65.A O no hydrogen 2.820 N/A MET 187.A N MET 183.A O no hydrogen 3.000 N/A ASP 188.A N ARG 184.A O no hydrogen 2.926 N/A ARG 189.A N TRP 186.A O no hydrogen 3.149 N/A ARG 189.A NH1 PHE 185.A O no hydrogen 2.851 N/A GLY 190.A N MET 187.A O no hydrogen 3.262 N/A VAL 191.A N TRP 186.A O no hydrogen 2.993 N/A ASP 192.A N ILE 92.A O no hydrogen 2.846 N/A TRP 194.A N MET 246.A O no hydrogen 3.010 N/A ARG 195.A N MET 94.A O no hydrogen 2.874 N/A ARG 195.A NH1 ASP 95.A OD1 no hydrogen 3.050 N/A ARG 195.A NH1 ASP 197.A OD1 no hydrogen 2.984 N/A MET 196.A N VAL 248.A O no hydrogen 2.884 N/A ASP 197.A N LEU 96.A O no hydrogen 2.834 N/A VAL 198.A N GLU 250.A OE1 no hydrogen 3.016 N/A ILE 199.A N GLU 250.A O no hydrogen 3.070 N/A GLY 200.A N ASN 252.A OD1 no hydrogen 3.232 N/A SER 201.A N VAL 198.A O no hydrogen 3.046 N/A SER 201.A OG HIS 222.A O no hydrogen 2.846 N/A ILE 202.A N ILE 199.A O no hydrogen 3.432 N/A LYS 204.A NZ ASP 167.A OD2 no hydrogen 2.831 N/A LYS 204.A NZ SER 201.A O no hydrogen 2.706 N/A TYR 205.A OH ASN 224.A O no hydrogen 3.216 N/A PHE 208.A N TYR 205.A O no hydrogen 2.789 N/A TYR 211.A N ASN 137.A OD1 no hydrogen 3.027 N/A TYR 211.A OH HIS 222.A ND1 no hydrogen 2.942 N/A THR 213.A OG1 ARG 214.A O no hydrogen 3.492 N/A TYR 216.A OH GLU 134.A OE2 no hydrogen 2.966 N/A ILE 217.A N ASN 137.A O no hydrogen 2.816 N/A GLY 219.A N HIS 222.A ND1 no hydrogen 3.484 N/A TYR 221.A N TYR 211.A OH no hydrogen 2.974 N/A HIS 222.A N GLY 219.A O no hydrogen 3.112 N/A HIS 222.A ND1 TYR 211.A OH no hydrogen 2.942 N/A HIS 222.A NE2 GLY 139.A O no hydrogen 2.979 N/A ASN 224.A N GLY 200.A O no hydrogen 2.843 N/A ASN 224.A ND2 GLY 253.A O no hydrogen 2.964 N/A ARG 227.A N SER 203.A OG no hydrogen 2.953 N/A ARG 227.A NE GLU 230.A OE1 no hydrogen 2.996 N/A ARG 227.A NH1 GLU 171.A OE2 no hydrogen 2.684 N/A ARG 227.A NH2 GLU 230.A OE2 no hydrogen 3.036 N/A LEU 228.A N GLY 225.A O no hydrogen 3.211 N/A HIS 229.A ND1 GLU 269.A OE1 no hydrogen 2.610 N/A HIS 229.A NE2 GLU 258.A OE2 no hydrogen 3.029 N/A PHE 231.A N ARG 227.A O no hydrogen 2.972 N/A ILE 232.A N LEU 228.A O no hydrogen 3.173 N/A GLN 233.A N HIS 229.A O no hydrogen 2.873 N/A GLN 233.A NE2 GLU 269.A OE2 no hydrogen 2.817 N/A GLU 234.A N GLU 230.A O no hydrogen 2.995 N/A MET 235.A N PHE 231.A O no hydrogen 2.831 N/A ASN 236.A N ILE 232.A O no hydrogen 2.837 N/A ASN 236.A ND2 GLU 269.A O no hydrogen 2.817 N/A ARG 237.A N GLN 233.A O no hydrogen 3.070 N/A GLU 238.A N GLU 234.A O no hydrogen 2.798 N/A VAL 239.A N MET 235.A O no hydrogen 2.887 N/A LEU 240.A N MET 235.A O no hydrogen 3.328 N/A SER 241.A N ASN 236.A O no hydrogen 2.863 N/A SER 241.A OG ASN 236.A O no hydrogen 3.137 N/A SER 241.A OG ARG 237.A O no hydrogen 3.083 N/A HIS 242.A N VAL 239.A O no hydrogen 2.662 N/A TYR 243.A N LEU 240.A O no hydrogen 3.245 N/A TYR 243.A OH ASP 188.A OD1 no hydrogen 2.749 N/A CYS 245.A SG LEU 240.A O no hydrogen 3.638 N/A CYS 245.A SG TYR 243.A O no hydrogen 3.646 N/A MET 246.A N ASP 192.A O no hydrogen 3.047 N/A THR 247.A N ASN 271.A OD1 no hydrogen 2.951 N/A THR 247.A OG1 ASN 271.A OD1 no hydrogen 3.434 N/A VAL 248.A N TRP 194.A O no hydrogen 2.969 N/A GLY 249.A N MET 272.A O no hydrogen 2.994 N/A GLU 250.A N MET 196.A O no hydrogen 2.783 N/A ALA 251.A N PHE 274.A O no hydrogen 3.121 N/A ASN 252.A N GLU 250.A O no hydrogen 3.188 N/A ASN 252.A ND2 SER 201.A OG no hydrogen 2.795 N/A SER 254.A N ALA 251.A O no hydrogen 3.214 N/A SER 254.A OG ALA 251.A O no hydrogen 2.560 N/A SER 254.A OG THR 275.A OG1 no hydrogen 3.229 N/A GLU 258.A N ASP 255.A OD1 no hydrogen 2.967 N/A ALA 259.A N ASP 255.A O no hydrogen 2.825 N/A LYS 260.A N ILE 256.A O no hydrogen 3.149 N/A LYS 260.A N GLU 257.A O no hydrogen 3.199 N/A LYS 260.A NZ GLU 257.A OE2 no hydrogen 3.314 N/A LYS 261.A N GLU 257.A O no hydrogen 3.384 N/A LYS 261.A NZ GLU 258.A OE1 no hydrogen 3.522 N/A TYR 262.A N GLU 258.A O no hydrogen 3.034 N/A THR 263.A N ALA 259.A O no hydrogen 2.938 N/A THR 263.A OG1 ALA 259.A O no hydrogen 2.710 N/A ASP 264.A N LYS 260.A O no hydrogen 2.978 N/A SER 266.A N ASP 264.A OD1 no hydrogen 2.867 N/A SER 266.A OG ASP 264.A OD1 no hydrogen 2.667 N/A ARG 267.A N ASP 264.A O no hydrogen 2.901 N/A ARG 267.A NE LYS 261.A O no hydrogen 2.674 N/A ARG 267.A NE GLU 269.A OE2 no hydrogen 3.221 N/A ARG 267.A NH2 GLU 269.A OE2 no hydrogen 2.881 N/A GLN 268.A N ALA 265.A O no hydrogen 3.163 N/A LEU 270.A N TYR 262.A O no hydrogen 2.915 N/A ASN 271.A N THR 247.A OG1 no hydrogen 3.109 N/A MET 272.A N THR 247.A O no hydrogen 3.322 N/A PHE 274.A N GLY 249.A O no hydrogen 2.709 N/A THR 275.A OG1 SER 254.A O no hydrogen 3.115 N/A THR 275.A OG1 SER 254.A OG no hydrogen 3.229 N/A GLU 277.A N THR 275.A OG1 no hydrogen 3.392 N/A HIS 278.A NE2 TYR 322.A O no hydrogen 2.853 N/A ASP 280.A N GLU 277.A O no hydrogen 3.307 N/A LYS 283.A N ASP 280.A O no hydrogen 3.217 N/A GLU 284.A N GLN 293.A O no hydrogen 3.166 N/A ASN 289.A N SER 287.A OG no hydrogen 3.379 N/A ASN 289.A ND2 GLN 293.A OE1 no hydrogen 2.847 N/A ASN 289.A ND2 THR 398.A O no hydrogen 2.796 N/A GLY 290.A N SER 287.A O no hydrogen 2.998 N/A LYS 291.A NZ GLU 384.A OE1 no hydrogen 2.865 N/A LYS 291.A NZ GLU 384.A OE2 no hydrogen 3.111 N/A TRP 292.A N ASN 289.A O no hydrogen 2.978 N/A GLN 293.A N GLY 290.A O no hydrogen 2.976 N/A LYS 295.A N ASP 282.A O no hydrogen 2.882 N/A ALA 301.A N ASP 298.A OD2 no hydrogen 3.442 N/A LEU 302.A N ASP 298.A O no hydrogen 3.049 N/A LYS 303.A N LEU 299.A O no hydrogen 2.879 N/A LYS 303.A NZ GLN 484.A O no hydrogen 3.250 N/A LYS 303.A NZ GLU 485.A O no hydrogen 2.941 N/A LYS 303.A NZ ASP 487.A O no hydrogen 2.908 N/A LYS 303.A NZ VAL 490.A O no hydrogen 2.993 N/A LYS 304.A N ILE 300.A O no hydrogen 2.856 N/A THR 305.A N ALA 301.A O no hydrogen 2.947 N/A THR 305.A OG1 ALA 301.A O no hydrogen 2.826 N/A MET 306.A N LEU 302.A O no hydrogen 2.964 N/A THR 307.A N LYS 303.A O no hydrogen 2.936 N/A THR 307.A OG1 LYS 303.A O no hydrogen 2.711 N/A THR 307.A OG1 TYR 480.A OH no hydrogen 2.714 N/A ARG 308.A N LYS 304.A O no hydrogen 3.030 N/A ARG 308.A NH1 GLU 277.A OE1 no hydrogen 2.610 N/A TRP 309.A N THR 305.A O no hydrogen 3.242 N/A TRP 309.A NE1 GLU 277.A OE1 no hydrogen 2.941 N/A GLN 310.A N MET 306.A O no hydrogen 2.818 N/A GLN 310.A NE2 LYS 357.A O no hydrogen 2.827 N/A THR 311.A N THR 307.A O no hydrogen 2.904 N/A THR 311.A OG1 THR 307.A O no hydrogen 2.992 N/A THR 311.A OG1 ARG 308.A O no hydrogen 3.418 N/A GLY 312.A N ARG 308.A O no hydrogen 2.887 N/A LEU 313.A N TRP 309.A O no hydrogen 3.204 N/A MET 314.A N THR 311.A O no hydrogen 3.159 N/A TRP 318.A NE1 THR 359.A OG1 no hydrogen 2.892 N/A ASN 319.A ND2 TRP 309.A O no hydrogen 2.948 N/A THR 320.A OG1 ILE 273.A O no hydrogen 2.623 N/A LEU 321.A N THR 359.A O no hydrogen 2.897 N/A TYR 322.A OH THR 275.A O no hydrogen 2.616 N/A ASP 327.A N ASN 325.A OD1 no hydrogen 2.655 N/A GLN 328.A N ASN 325.A O no hydrogen 3.264 N/A ARG 330.A N ASN 372.A OD1 no hydrogen 2.979 N/A ARG 330.A NE HIS 415.A O no hydrogen 3.481 N/A ARG 330.A NH1 GLN 364.A O no hydrogen 3.296 N/A ARG 330.A NH2 GLU 324.A OE2 no hydrogen 3.029 N/A ARG 330.A NH2 GLN 364.A O no hydrogen 2.830 N/A VAL 331.A N GLU 324.A OE1 no hydrogen 3.001 N/A SER 333.A OG ASP 338.A OD2 no hydrogen 2.654 N/A ARG 334.A N ARG 330.A O no hydrogen 2.931 N/A ARG 334.A NE ASP 282.A OD2 no hydrogen 2.747 N/A ARG 334.A NH1 ASP 282.A OD1 no hydrogen 2.781 N/A ARG 334.A NH1 ASP 282.A OD2 no hydrogen 3.334 N/A ARG 334.A NH2 GLN 328.A OE1 no hydrogen 2.918 N/A TRP 335.A N VAL 331.A O no hydrogen 2.890 N/A TRP 335.A NE1 ASP 282.A OD2 no hydrogen 2.967 N/A GLY 336.A N ILE 332.A O no hydrogen 3.025 N/A ASN 337.A ND2 GLU 510.A OE1 no hydrogen 2.945 N/A ARG 339.A N ASN 337.A OD1 no hydrogen 3.063 N/A LEU 341.A N ASN 337.A OD1 no hydrogen 2.819 N/A ARG 342.A N ARG 339.A O no hydrogen 3.137 N/A ARG 342.A NH1 ILE 368.A O no hydrogen 2.910 N/A ARG 342.A NH1 GLY 369.A O no hydrogen 2.935 N/A LYS 343.A NZ ASP 454.A OD2 no hydrogen 2.966 N/A CYS 345.A N LEU 341.A O no hydrogen 2.943 N/A CYS 345.A SG ASN 337.A O no hydrogen 3.667 N/A ALA 346.A N ARG 342.A O no hydrogen 2.912 N/A LYS 347.A N LYS 343.A O no hydrogen 2.955 N/A LYS 347.A NZ ASP 456.A O no hydrogen 2.730 N/A ALA 348.A N GLU 344.A O no hydrogen 2.703 N/A PHE 349.A N CYS 345.A O no hydrogen 2.989 N/A ALA 350.A N ALA 346.A O no hydrogen 3.041 N/A THR 351.A N LYS 347.A O no hydrogen 2.955 N/A THR 351.A OG1 LYS 347.A O no hydrogen 2.893 N/A THR 351.A OG1 TYR 461.A OH no hydrogen 2.746 N/A VAL 352.A N ALA 348.A O no hydrogen 3.033 N/A LEU 353.A N PHE 349.A O no hydrogen 3.138 N/A HIS 354.A N ALA 350.A O no hydrogen 2.828 N/A GLY 355.A N THR 351.A O no hydrogen 3.005 N/A MET 356.A N LEU 353.A O no hydrogen 3.243 N/A LYS 357.A N GLN 310.A OE1 no hydrogen 2.979 N/A LYS 357.A NZ MET 314.A O no hydrogen 2.881 N/A THR 359.A N ASN 319.A O no hydrogen 2.982 N/A THR 359.A OG1 TRP 3.A O no hydrogen 2.762 N/A PHE 361.A N LEU 321.A O no hydrogen 2.833 N/A ILE 362.A N VAL 8.A O no hydrogen 2.691 N/A TYR 363.A N GLU 366.A OE1 no hydrogen 3.076 N/A TYR 363.A OH ALA 416.A O no hydrogen 2.645 N/A GLN 364.A N GLN 10.A O no hydrogen 3.006 N/A GLN 364.A NE2 SER 15.A O no hydrogen 3.452 N/A GLY 365.A N GLU 367.A OE1 no hydrogen 2.888 N/A GLU 366.A N TYR 363.A O no hydrogen 2.740 N/A GLU 367.A N GLU 367.A OE1 no hydrogen 2.685 N/A ILE 368.A N GLY 365.A O no hydrogen 3.339 N/A GLY 369.A N GLU 366.A O no hydrogen 3.128 N/A MET 370.A N GLY 365.A O no hydrogen 3.029 N/A ASN 372.A N SER 333.A OG no hydrogen 2.884 N/A ASN 372.A ND2 MET 409.A O no hydrogen 3.059 N/A ASN 372.A ND2 ILE 410.A O no hydrogen 3.073 N/A SER 373.A N HIS 415.A ND1 no hydrogen 3.201 N/A MET 375.A N SER 373.A OG no hydrogen 2.965 N/A GLU 378.A N GLU 378.A OE1 no hydrogen 2.796 N/A MET 379.A N PRO 376.A O no hydrogen 2.864 N/A TYR 380.A N LEU 377.A O no hydrogen 3.259 N/A ASP 381.A N ASP 414.A OD2 no hydrogen 2.793 N/A ASP 382.A N ASP 414.A OD2 no hydrogen 3.018 N/A GLU 384.A N ASP 382.A OD1 no hydrogen 3.103 N/A ILE 385.A N ASP 382.A O no hydrogen 2.976 N/A LYS 386.A NZ TYR 380.A O no hydrogen 3.552 N/A ASN 387.A N LEU 383.A O no hydrogen 2.917 N/A ASN 387.A ND2 PHE 142.A O no hydrogen 3.035 N/A ALA 388.A N GLU 384.A O no hydrogen 3.124 N/A TYR 389.A N ILE 385.A O no hydrogen 2.797 N/A TYR 389.A OH GLU 401.A OE1 no hydrogen 2.530 N/A ARG 390.A N LYS 386.A O no hydrogen 3.082 N/A ARG 390.A NH1 ASN 387.A OD1 no hydrogen 3.545 N/A ARG 390.A NH2 ASN 387.A OD1 no hydrogen 3.311 N/A GLU 391.A N ASN 387.A O no hydrogen 2.991 N/A LEU 392.A N ALA 388.A O no hydrogen 2.738 N/A VAL 393.A N TYR 389.A O no hydrogen 2.963 N/A VAL 394.A N TYR 389.A O no hydrogen 3.250 N/A GLU 395.A N ARG 390.A O no hydrogen 2.962 N/A ASN 396.A N GLU 391.A O no hydrogen 2.811 N/A LYS 397.A NZ VAL 394.A O no hydrogen 3.133 N/A THR 398.A N LEU 392.A O no hydrogen 2.936 N/A THR 398.A OG1 ASN 289.A OD1 no hydrogen 2.472 N/A MET 399.A N LEU 392.A O no hydrogen 3.362 N/A GLU 403.A N SER 400.A OG no hydrogen 3.213 N/A PHE 404.A N SER 400.A O no hydrogen 2.955 N/A VAL 405.A N GLU 401.A O no hydrogen 2.942 N/A LYS 406.A N LYS 402.A O no hydrogen 3.140 N/A ALA 407.A N GLU 403.A O no hydrogen 3.115 N/A VAL 408.A N PHE 404.A O no hydrogen 3.041 N/A MET 409.A N VAL 405.A O no hydrogen 2.969 N/A ILE 410.A N ALA 407.A O no hydrogen 3.155 N/A LYS 411.A N ALA 407.A O no hydrogen 2.962 N/A LYS 411.A NZ ASP 282.A O no hydrogen 2.955 N/A LYS 411.A NZ ASP 282.A OD1 no hydrogen 2.900 N/A LYS 411.A NZ LYS 291.A O no hydrogen 3.017 N/A GLY 412.A N VAL 408.A O no hydrogen 2.806 N/A ARG 413.A NE ASP 382.A OD2 no hydrogen 2.816 N/A ARG 413.A NH1 ASP 57.A OD1 no hydrogen 3.040 N/A ARG 413.A NH1 ASP 382.A OD1 no hydrogen 2.907 N/A ARG 413.A NH2 ASP 327.A OD1 no hydrogen 2.953 N/A HIS 415.A N GLY 412.A O no hydrogen 3.132 N/A HIS 415.A NE2 VAL 408.A O no hydrogen 2.756 N/A ALA 416.A N ARG 413.A O no hydrogen 2.967 N/A ARG 417.A N ASP 414.A O no hydrogen 2.876 N/A ARG 417.A NE HIS 326.A O no hydrogen 3.001 N/A ARG 417.A NH2 HIS 326.A O no hydrogen 2.973 N/A MET 420.A N SER 15.A O no hydrogen 2.721 N/A GLN 421.A NE2 ILE 446.A O no hydrogen 2.757 N/A TRP 422.A N ALA 428.A O no hydrogen 2.778 N/A TRP 422.A NE1 PHE 16.A O no hydrogen 2.875 N/A ASP 423.A N ALA 428.A O no hydrogen 2.980 N/A GLY 425.A N ASP 423.A OD1 no hydrogen 2.728 N/A GLY 429.A N LYS 426.A O no hydrogen 3.020 N/A PHE 430.A N HIS 427.A O no hydrogen 2.853 N/A THR 431.A OG1 ASP 18.A OD2 no hydrogen 2.546 N/A GLY 433.A N THR 431.A OG1 no hydrogen 2.974 N/A TRP 436.A N GLY 23.A O no hydrogen 2.906 N/A TRP 436.A NE1 SER 15.A OG no hydrogen 2.852 N/A SER 441.A OG ASP 374.A OD1 no hydrogen 3.015 N/A ARG 442.A N ASN 440.A OD1 no hydrogen 3.010 N/A ARG 442.A NH1 ASP 338.A O no hydrogen 3.107 N/A ARG 442.A NH2 ASP 338.A O no hydrogen 2.769 N/A TYR 443.A N ASN 440.A O no hydrogen 3.195 N/A ASP 445.A N ARG 442.A O no hydrogen 3.167 N/A ILE 446.A N TYR 443.A O no hydrogen 3.255 N/A ASN 447.A N GLU 450.A OE1 no hydrogen 2.896 N/A ASN 447.A ND2 TYR 443.A O no hydrogen 2.937 N/A ASN 447.A ND2 GLN 444.A O no hydrogen 3.375 N/A VAL 448.A N GLN 421.A O no hydrogen 3.010 N/A LYS 449.A N TRP 422.A O no hydrogen 2.907 N/A GLU 450.A N ASN 447.A OD1 no hydrogen 2.958 N/A SER 451.A N ASN 447.A O no hydrogen 3.002 N/A SER 451.A OG ASN 447.A O no hydrogen 2.894 N/A SER 451.A OG GLU 450.A OE1 no hydrogen 3.218 N/A LEU 452.A N VAL 448.A O no hydrogen 2.793 N/A GLU 453.A N LYS 449.A O no hydrogen 3.247 N/A ASP 454.A N GLU 450.A O no hydrogen 3.098 N/A ASP 454.A N SER 451.A O no hydrogen 3.243 N/A ASP 456.A N ASP 454.A OD1 no hydrogen 3.050 N/A SER 457.A N ASP 454.A O no hydrogen 2.961 N/A SER 457.A OG SER 451.A O no hydrogen 2.913 N/A SER 457.A OG ASP 454.A O no hydrogen 3.017 N/A PHE 460.A N SER 457.A OG no hydrogen 3.191 N/A TYR 461.A N SER 457.A O no hydrogen 3.231 N/A TYR 461.A OH THR 351.A OG1 no hydrogen 2.746 N/A TYR 462.A N ILE 458.A O no hydrogen 2.923 N/A TYR 462.A OH GLU 366.A OE2 no hydrogen 2.495 N/A GLN 463.A N PHE 459.A O no hydrogen 2.936 N/A GLN 463.A NE2 ASN 39.A O no hydrogen 2.807 N/A LYS 464.A N PHE 460.A O no hydrogen 2.858 N/A LEU 465.A N TYR 461.A O no hydrogen 3.006 N/A ILE 466.A N TYR 462.A O no hydrogen 2.943 N/A GLN 467.A N GLN 463.A O no hydrogen 2.980 N/A LEU 468.A N LYS 464.A O no hydrogen 2.909 N/A ARG 469.A N LEU 465.A O no hydrogen 3.249 N/A ARG 469.A NH1 HIS 354.A O no hydrogen 2.673 N/A ARG 469.A NH2 MET 356.A O no hydrogen 2.984 N/A ARG 469.A NH2 GLY 358.A O no hydrogen 2.906 N/A LYS 470.A N ILE 466.A O no hydrogen 3.271 N/A LYS 470.A NZ GLY 41.A O no hydrogen 2.926 N/A GLN 471.A N LEU 468.A O no hydrogen 3.123 N/A TYR 472.A N LEU 468.A O no hydrogen 2.822 N/A MET 475.A N TYR 472.A O no hydrogen 2.898 N/A ILE 476.A N LYS 473.A O no hydrogen 3.043 N/A TYR 477.A N LYS 473.A O no hydrogen 2.919 N/A TYR 477.A OH GLU 5.A OE2 no hydrogen 2.624 N/A GLY 478.A N ILE 474.A O no hydrogen 2.920 N/A ASP 479.A N GLU 496.A O no hydrogen 2.990 N/A TYR 480.A OH THR 307.A OG1 no hydrogen 2.714 N/A GLN 481.A N LEU 494.A O no hydrogen 2.924 N/A LEU 483.A N SER 492.A O no hydrogen 3.015 N/A ASP 487.A N GLN 484.A O no hydrogen 3.126 N/A GLN 489.A N ASP 487.A OD2 no hydrogen 2.942 N/A GLN 489.A NE2 SER 509.A OG no hydrogen 2.992 N/A GLN 489.A NE2 LYS 512.A O no hydrogen 2.959 N/A VAL 490.A N ASP 487.A OD2 no hydrogen 2.636 N/A PHE 491.A N VAL 506.A O no hydrogen 2.784 N/A SER 492.A OG LEU 483.A O no hydrogen 3.427 N/A TYR 493.A N VAL 504.A O no hydrogen 2.962 N/A TYR 493.A OH VAL 352.A O no hydrogen 2.715 N/A LEU 494.A N GLN 481.A O no hydrogen 2.845 N/A ARG 495.A N LEU 502.A O no hydrogen 2.705 N/A ARG 495.A NE ASP 479.A O no hydrogen 2.885 N/A ARG 495.A NH1 GLY 355.A O no hydrogen 2.769 N/A ARG 495.A NH1 MET 475.A O no hydrogen 2.772 N/A ARG 495.A NH2 MET 475.A O no hydrogen 2.892 N/A ARG 495.A NH2 GLY 478.A O no hydrogen 2.993 N/A GLU 496.A N ASP 479.A OD1 no hydrogen 2.795 N/A TYR 497.A N GLU 500.A O no hydrogen 2.971 N/A GLU 500.A N TYR 497.A O no hydrogen 2.961 N/A LYS 501.A N SER 554.A OG no hydrogen 2.920 N/A LYS 501.A NZ GLU 524.A OE1 no hydrogen 3.312 N/A LEU 502.A N ARG 495.A O no hydrogen 2.717 N/A LEU 503.A N GLY 552.A O no hydrogen 2.760 N/A VAL 504.A N TYR 493.A O no hydrogen 2.888 N/A VAL 505.A N VAL 550.A O no hydrogen 2.845 N/A VAL 506.A N PHE 491.A O no hydrogen 2.909 N/A ASN 507.A N GLU 548.A O no hydrogen 2.906 N/A ASN 507.A ND2 GLU 511.A O no hydrogen 2.831 N/A ASN 507.A ND2 LYS 545.A O no hydrogen 3.028 N/A LEU 508.A N GLN 489.A O no hydrogen 2.857 N/A SER 509.A OG ASN 507.A OD1 no hydrogen 2.828 N/A SER 509.A OG GLU 511.A O no hydrogen 3.365 N/A GLU 511.A N SER 509.A OG no hydrogen 3.424 N/A ALA 513.A N LEU 544.A O no hydrogen 2.874 N/A PHE 515.A N ILE 542.A O no hydrogen 2.899 N/A ALA 517.A N LYS 540.A O no hydrogen 3.085 N/A GLU 520.A N GLU 520.A OE1 no hydrogen 2.970 N/A LEU 521.A N PRO 518.A O no hydrogen 2.849 N/A ILE 522.A N PRO 519.A O no hydrogen 3.420 N/A GLU 524.A N LEU 521.A O no hydrogen 3.117 N/A LYS 527.A N ILE 553.A O no hydrogen 2.856 N/A LEU 529.A N MET 551.A O no hydrogen 2.878 N/A SER 531.A OG TYR 533.A O no hydrogen 3.187 N/A SER 531.A OG ALA 549.A O no hydrogen 2.792 N/A ASN 532.A N ALA 549.A O no hydrogen 3.430 N/A ASN 532.A ND2 GLU 344.A O no hydrogen 2.903 N/A ASN 532.A ND2 TYR 547.A O no hydrogen 2.672 N/A TYR 533.A N SER 531.A OG no hydrogen 3.221 N/A TYR 533.A OH PRO 546.A O no hydrogen 2.900 N/A LYS 540.A NZ ASP 538.A OD1 no hydrogen 3.171 N/A ILE 542.A N PHE 515.A O no hydrogen 2.867 N/A LEU 544.A N ALA 513.A O no hydrogen 2.653 N/A LYS 545.A N GLU 548.A OE1 no hydrogen 2.659 N/A TYR 547.A N SER 509.A O no hydrogen 3.042 N/A GLU 548.A N LYS 545.A O no hydrogen 2.962 N/A ALA 549.A N ASN 532.A OD1 no hydrogen 2.799 N/A VAL 550.A N VAL 505.A O no hydrogen 2.855 N/A MET 551.A N ILE 530.A O no hydrogen 3.170 N/A GLY 552.A N LEU 503.A O no hydrogen 2.842 N/A ILE 553.A N LYS 527.A O no hydrogen 3.055 N/A SER 554.A N LYS 501.A O no hydrogen 2.884 N/A SER 554.A OG LYS 501.A O no hydrogen 3.550 N/A ILE 555.A N ARG 525.A O no hydrogen 2.880 N/A