Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1yve_I.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ALA 1.A N THR 3.A O no hydrogen 3.504 N/A PHE 6.A N ASP 5.A OD1 no hydrogen 2.718 N/A SER 8.A OG ASP 207.A OD1 no hydrogen 2.705 N/A SER 9.A OG ASP 207.A OD2 no hydrogen 2.606 N/A VAL 10.A N SER 8.A OG no hydrogen 3.347 N/A PHE 11.A N SER 8.A OG no hydrogen 2.939 N/A LYS 13.A NZ ASP 5.A OD1 no hydrogen 2.950 N/A LYS 13.A NZ PHE 6.A O no hydrogen 2.854 N/A GLU 14.A N ILE 25.A O no hydrogen 2.863 N/A VAL 16.A N GLU 23.A O no hydrogen 2.792 N/A THR 17.A OG1 ASP 22.A OD1 no hydrogen 2.829 N/A LEU 18.A N HIS 21.A O no hydrogen 2.773 N/A SER 19.A OG SER 19.A O no hydrogen 2.533 N/A HIS 21.A N LEU 18.A O no hydrogen 2.825 N/A HIS 21.A ND1 LEU 18.A O no hydrogen 3.122 N/A HIS 21.A ND1 SER 19.A O no hydrogen 2.730 N/A GLU 23.A N VAL 16.A O no hydrogen 2.700 N/A ILE 25.A N GLU 14.A O no hydrogen 2.713 N/A VAL 26.A N THR 221.A O no hydrogen 3.042 N/A GLY 28.A N PRO 219.A O no hydrogen 2.854 N/A ARG 30.A N ASN 187.A O no hydrogen 2.879 N/A ARG 30.A NE VAL 186.A O no hydrogen 3.152 N/A ARG 30.A NH1 GLU 68.A OE1 no hydrogen 2.952 N/A ARG 30.A NH1 GLU 68.A OE2 no hydrogen 3.483 N/A ARG 30.A NH2 VAL 186.A O no hydrogen 2.946 N/A ASN 31.A N ASN 187.A OD1 no hydrogen 3.088 N/A LEU 32.A N GLY 29.A O no hydrogen 3.053 N/A PHE 33.A N ARG 30.A O no hydrogen 3.078 N/A LEU 35.A N LEU 32.A O no hydrogen 2.911 N/A LEU 36.A N PHE 33.A O no hydrogen 3.035 N/A ALA 39.A N LEU 35.A O no hydrogen 3.133 N/A PHE 40.A N LEU 36.A O no hydrogen 2.884 N/A LYS 41.A N ASP 38.A O no hydrogen 3.436 N/A ILE 43.A N PHE 40.A O no hydrogen 3.001 N/A LYS 44.A N ASP 112.A OD2 no hydrogen 2.768 N/A LYS 44.A NZ LYS 44.A O no hydrogen 3.180 N/A LYS 44.A NZ ASP 72.A O no hydrogen 3.106 N/A GLN 45.A N ASP 112.A OD2 no hydrogen 3.127 N/A GLN 45.A NE2 SER 111.A OG no hydrogen 2.838 N/A ILE 46.A N VAL 74.A O no hydrogen 2.834 N/A GLY 47.A N LEU 113.A O no hydrogen 2.848 N/A VAL 48.A N LYS 76.A O no hydrogen 2.839 N/A ILE 49.A N LEU 115.A O no hydrogen 2.937 N/A GLY 50.A N GLY 78.A O no hydrogen 3.109 N/A SER 53.A OG ASN 434.A O no hydrogen 2.735 N/A ALA 57.A N GLN 54.A O no hydrogen 3.091 N/A GLN 58.A N GLN 54.A O no hydrogen 2.773 N/A GLN 58.A NE2 GLN 54.A OE1 no hydrogen 2.945 N/A GLN 58.A NE2 SER 143.A OG no hydrogen 3.103 N/A ALA 59.A N ALA 55.A O no hydrogen 2.877 N/A GLN 60.A N PRO 56.A O no hydrogen 3.327 N/A GLN 60.A NE2 PRO 56.A O no hydrogen 2.998 N/A ASN 61.A N ALA 57.A O no hydrogen 3.074 N/A ASN 61.A ND2 VAL 176.A O no hydrogen 3.127 N/A ASN 61.A ND2 LEU 216.A O no hydrogen 2.848 N/A LEU 62.A N GLN 58.A O no hydrogen 2.885 N/A LYS 63.A N ALA 59.A O no hydrogen 2.981 N/A LYS 63.A NZ GLY 93.A O no hydrogen 3.392 N/A ASP 64.A N GLN 60.A O no hydrogen 2.871 N/A SER 65.A N ASN 61.A O no hydrogen 2.889 N/A SER 65.A OG ASN 61.A O no hydrogen 3.003 N/A SER 65.A OG TYR 180.A OH no hydrogen 2.713 N/A SER 65.A OG ALA 215.A O no hydrogen 2.812 N/A LEU 66.A N LEU 62.A O no hydrogen 2.943 N/A THR 67.A N LYS 63.A O no hydrogen 2.942 N/A THR 67.A OG1 LYS 63.A O no hydrogen 2.921 N/A GLU 68.A N ASP 64.A O no hydrogen 2.967 N/A ALA 69.A N SER 65.A O no hydrogen 2.888 N/A LYS 70.A N THR 67.A O no hydrogen 2.977 N/A SER 71.A N LEU 66.A O no hydrogen 2.990 N/A VAL 73.A N SER 71.A OG no hydrogen 3.042 N/A VAL 74.A N LYS 44.A O no hydrogen 2.954 N/A LYS 76.A N ILE 46.A O no hydrogen 2.995 N/A ILE 77.A N THR 100.A O no hydrogen 2.910 N/A GLY 78.A N VAL 48.A O no hydrogen 2.949 N/A LEU 79.A N GLY 102.A O no hydrogen 3.008 N/A ARG 80.A NH1 TYR 341.A OH no hydrogen 3.569 N/A LYS 81.A NZ ASP 103.A OD1 no hydrogen 3.280 N/A SER 83.A N ARG 80.A O no hydrogen 3.055 N/A SER 85.A N SER 83.A OG no hydrogen 2.981 N/A ALA 89.A N SER 85.A O no hydrogen 2.983 N/A ARG 90.A N PHE 86.A O no hydrogen 3.031 N/A ARG 90.A NE GLU 96.A OE1 no hydrogen 2.990 N/A ARG 90.A NH2 GLU 96.A OE2 no hydrogen 2.844 N/A ALA 91.A N ALA 87.A O no hydrogen 2.993 N/A ALA 92.A N GLU 88.A O no hydrogen 3.150 N/A ALA 92.A N ALA 89.A O no hydrogen 3.176 N/A GLY 93.A N ARG 90.A O no hydrogen 2.910 N/A PHE 94.A N ALA 89.A O no hydrogen 3.044 N/A SER 95.A N THR 100.A OG1 no hydrogen 3.020 N/A SER 95.A OG ASN 98.A OD1 no hydrogen 3.504 N/A GLU 96.A N GLU 96.A OE1 no hydrogen 2.706 N/A ASN 98.A N SER 95.A O no hydrogen 3.307 N/A GLY 99.A N GLU 96.A O no hydrogen 2.985 N/A THR 100.A N SER 95.A O no hydrogen 2.871 N/A THR 100.A OG1 SER 95.A O no hydrogen 3.312 N/A THR 100.A OG1 ASN 98.A OD1 no hydrogen 2.619 N/A GLY 102.A N ILE 77.A O no hydrogen 2.852 N/A MET 104.A N LEU 79.A O no hydrogen 2.776 N/A GLU 106.A N ASP 103.A OD2 no hydrogen 3.138 N/A THR 107.A N ASP 103.A O no hydrogen 2.875 N/A THR 107.A OG1 ASP 103.A O no hydrogen 2.771 N/A ILE 108.A N MET 104.A O no hydrogen 3.020 N/A SER 109.A N TRP 105.A O no hydrogen 3.030 N/A SER 109.A OG TRP 105.A O no hydrogen 3.308 N/A SER 109.A OG HIS 133.A O no hydrogen 3.493 N/A GLY 110.A N GLU 106.A O no hydrogen 3.295 N/A GLY 110.A N THR 107.A O no hydrogen 3.290 N/A SER 111.A N ILE 108.A O no hydrogen 3.026 N/A SER 111.A OG THR 107.A O no hydrogen 2.691 N/A ASP 112.A N GLN 45.A O no hydrogen 2.940 N/A LEU 113.A N GLN 45.A O no hydrogen 3.473 N/A VAL 114.A N ILE 139.A O no hydrogen 2.848 N/A LEU 115.A N GLY 47.A O no hydrogen 2.888 N/A LEU 116.A N GLY 141.A O no hydrogen 3.054 N/A LEU 117.A N ILE 49.A O no hydrogen 2.955 N/A SER 119.A OG SER 121.A OG no hydrogen 3.340 N/A SER 121.A OG SER 119.A OG no hydrogen 3.340 N/A ALA 122.A N SER 119.A OG no hydrogen 3.202 N/A GLN 123.A N SER 119.A O no hydrogen 3.047 N/A GLN 123.A NE2 ILE 118.A O no hydrogen 3.142 N/A ALA 124.A N ASP 120.A O no hydrogen 3.008 N/A ASP 125.A N SER 121.A O no hydrogen 3.007 N/A ASN 126.A N GLN 123.A O no hydrogen 3.331 N/A ASN 126.A ND2 ALA 122.A O no hydrogen 2.864 N/A VAL 130.A N ASN 126.A O no hydrogen 3.238 N/A PHE 131.A N TYR 127.A O no hydrogen 2.819 N/A SER 132.A N GLU 128.A O no hydrogen 2.924 N/A SER 132.A OG GLU 128.A O no hydrogen 3.567 N/A SER 132.A OG LYS 129.A O no hydrogen 3.013 N/A SER 132.A OG HIS 133.A ND1 no hydrogen 3.162 N/A HIS 133.A N VAL 130.A O no hydrogen 3.205 N/A HIS 133.A ND1 LYS 129.A O no hydrogen 2.840 N/A HIS 133.A ND1 SER 132.A OG no hydrogen 3.162 N/A MET 134.A N PHE 131.A O no hydrogen 3.222 N/A LYS 135.A NZ ASP 112.A OD1 no hydrogen 2.930 N/A ASN 137.A N ASN 161.A O no hydrogen 2.759 N/A SER 138.A N LYS 135.A O no hydrogen 3.108 N/A SER 138.A OG LYS 135.A O no hydrogen 2.712 N/A ILE 139.A N ASP 112.A O no hydrogen 2.975 N/A LEU 140.A N SER 163.A O no hydrogen 2.980 N/A GLY 141.A N VAL 114.A O no hydrogen 2.735 N/A LEU 142.A N ILE 165.A O no hydrogen 2.859 N/A SER 143.A OG VAL 167.A O no hydrogen 2.811 N/A HIS 144.A ND1 GLU 229.A OE1 no hydrogen 2.811 N/A GLY 145.A N GLU 229.A OE1 no hydrogen 2.949 N/A LEU 148.A N GLY 145.A O no hydrogen 2.903 N/A GLY 149.A N GLY 145.A O no hydrogen 3.443 N/A HIS 150.A N PHE 146.A O no hydrogen 3.031 N/A LEU 151.A N LEU 147.A O no hydrogen 2.957 N/A GLN 152.A N LEU 148.A O no hydrogen 2.887 N/A GLN 152.A NE2 GLU 227.A OE1 no hydrogen 3.013 N/A SER 153.A N GLY 149.A O no hydrogen 3.124 N/A SER 153.A OG HIS 150.A O no hydrogen 2.689 N/A LEU 154.A N HIS 150.A O no hydrogen 3.307 N/A LEU 154.A N LEU 151.A O no hydrogen 2.934 N/A GLY 155.A N GLN 152.A O no hydrogen 3.078 N/A GLN 156.A N LEU 151.A O no hydrogen 2.879 N/A PHE 158.A N ASP 157.A OD1 no hydrogen 2.905 N/A LYS 160.A NZ PHE 158.A O no hydrogen 2.849 N/A LYS 160.A NZ GLN 199.A OE1 no hydrogen 2.892 N/A SER 163.A N SER 138.A O no hydrogen 3.138 N/A VAL 164.A N GLN 199.A O no hydrogen 2.902 N/A ILE 165.A N LEU 140.A O no hydrogen 3.006 N/A ALA 166.A N ALA 196.A O no hydrogen 3.010 N/A VAL 167.A N LEU 142.A O no hydrogen 3.048 N/A CYS 168.A N SER 194.A O no hydrogen 2.788 N/A LYS 170.A N ASN 192.A O no hydrogen 2.855 N/A LYS 170.A NZ GLU 229.A OE2 no hydrogen 2.885 N/A LYS 170.A NZ ASP 233.A OD2 no hydrogen 3.090 N/A MET 172.A N SER 418.A OG no hydrogen 3.003 N/A SER 175.A N MET 172.A O no hydrogen 2.956 N/A SER 175.A OG MET 172.A O no hydrogen 2.682 N/A SER 175.A OG SER 418.A OG no hydrogen 2.761 N/A VAL 176.A N MET 172.A O no hydrogen 3.126 N/A ARG 177.A N GLY 173.A O no hydrogen 3.167 N/A ARG 177.A NH1 ASN 61.A OD1 no hydrogen 2.875 N/A ARG 177.A NH1 ASP 64.A OD2 no hydrogen 2.920 N/A ARG 177.A NH2 ASP 64.A OD2 no hydrogen 3.033 N/A ARG 178.A N PRO 174.A O no hydrogen 2.931 N/A ARG 178.A NE SER 498.A O no hydrogen 2.981 N/A LEU 179.A N SER 175.A O no hydrogen 3.060 N/A TYR 180.A N VAL 176.A O no hydrogen 3.436 N/A TYR 180.A OH SER 65.A OG no hydrogen 2.713 N/A VAL 181.A N ARG 177.A O no hydrogen 3.017 N/A GLN 182.A N ARG 178.A O no hydrogen 2.952 N/A GLN 182.A NE2 ASP 496.A O no hydrogen 2.956 N/A GLY 183.A N LEU 179.A O no hydrogen 2.813 N/A LYS 184.A N VAL 181.A O no hydrogen 3.049 N/A LYS 184.A NZ ASP 64.A OD2 no hydrogen 2.766 N/A GLU 185.A N GLN 182.A O no hydrogen 3.338 N/A VAL 186.A N GLY 183.A O no hydrogen 3.012 N/A ASN 187.A ND2 ASN 31.A OD1 no hydrogen 3.059 N/A GLY 188.A N GLY 183.A O no hydrogen 2.983 N/A ASN 192.A ND2 ASN 409.A OD1 no hydrogen 3.019 N/A SER 193.A N PHE 220.A O no hydrogen 3.223 N/A SER 193.A OG ILE 191.A O no hydrogen 3.500 N/A SER 193.A OG SER 218.A OG no hydrogen 2.817 N/A SER 194.A N CYS 168.A O no hydrogen 3.104 N/A PHE 195.A N PHE 222.A O no hydrogen 2.884 N/A ALA 196.A N ALA 166.A O no hydrogen 2.956 N/A HIS 198.A N VAL 164.A O no hydrogen 2.847 N/A GLN 199.A N VAL 164.A O no hydrogen 3.121 N/A GLN 199.A NE2 PRO 159.A O no hydrogen 3.096 N/A GLN 199.A NE2 ILE 162.A O no hydrogen 3.003 N/A VAL 201.A N SER 163.A OG no hydrogen 2.859 N/A ASP 202.A N ASP 200.A OD1 no hydrogen 3.124 N/A GLY 203.A N ASP 200.A OD1 no hydrogen 2.756 N/A ARG 204.A N ASP 202.A OD1 no hydrogen 3.040 N/A ARG 204.A NE ASP 202.A OD1 no hydrogen 3.372 N/A ARG 204.A NE ASP 202.A OD2 no hydrogen 3.165 N/A ARG 204.A NH1 LYS 41.A O no hydrogen 3.172 N/A ARG 204.A NH2 ASP 202.A OD2 no hydrogen 2.953 N/A VAL 208.A N ARG 204.A O no hydrogen 3.068 N/A ALA 209.A N ALA 205.A O no hydrogen 2.941 N/A LEU 210.A N THR 206.A O no hydrogen 2.898 N/A GLY 211.A N ASP 207.A O no hydrogen 2.813 N/A TRP 212.A N VAL 208.A O no hydrogen 2.978 N/A TRP 212.A NE1 GLN 58.A OE1 no hydrogen 2.915 N/A SER 213.A N ALA 209.A O no hydrogen 3.056 N/A SER 213.A OG SER 218.A OG no hydrogen 2.834 N/A SER 213.A OG THR 221.A OG1 no hydrogen 2.747 N/A ILE 214.A N LEU 210.A O no hydrogen 2.957 N/A ALA 215.A N GLY 211.A O no hydrogen 2.906 N/A LEU 216.A N TRP 212.A O no hydrogen 3.099 N/A LEU 216.A N SER 213.A O no hydrogen 3.037 N/A GLY 217.A N ILE 214.A O no hydrogen 2.995 N/A SER 218.A N SER 213.A O no hydrogen 3.348 N/A SER 218.A OG ILE 191.A O no hydrogen 3.280 N/A SER 218.A OG SER 193.A OG no hydrogen 2.817 N/A SER 218.A OG SER 213.A O no hydrogen 3.154 N/A SER 218.A OG SER 213.A OG no hydrogen 2.834 N/A PHE 220.A N ASN 192.A OD1 no hydrogen 3.288 N/A THR 221.A N VAL 26.A O no hydrogen 2.948 N/A THR 221.A OG1 SER 213.A OG no hydrogen 2.747 N/A PHE 222.A N SER 193.A O no hydrogen 3.121 N/A THR 224.A N PHE 195.A O no hydrogen 2.929 N/A THR 224.A OG1 GLU 406.A OE2 no hydrogen 2.661 N/A GLN 228.A N THR 225.A OG1 no hydrogen 3.022 N/A GLU 229.A N THR 225.A O no hydrogen 2.932 N/A TYR 230.A N LEU 226.A O no hydrogen 3.004 N/A TYR 230.A OH GLN 152.A OE1 no hydrogen 2.934 N/A LYS 231.A N GLU 227.A O no hydrogen 3.106 N/A SER 232.A N GLN 228.A O no hydrogen 3.061 N/A SER 232.A OG GLN 228.A O no hydrogen 3.038 N/A SER 232.A OG GLU 229.A O no hydrogen 3.369 N/A ASP 233.A N GLU 229.A O no hydrogen 2.849 N/A ILE 234.A N TYR 230.A O no hydrogen 3.059 N/A GLY 236.A N SER 232.A O no hydrogen 2.774 N/A GLU 237.A N ASP 233.A O no hydrogen 3.203 N/A ARG 238.A NE GLU 329.A OE2 no hydrogen 2.822 N/A ARG 238.A NH1 ILE 234.A O no hydrogen 2.986 N/A ARG 238.A NH1 GLU 237.A OE2 no hydrogen 2.872 N/A ARG 238.A NH2 THR 438.A O no hydrogen 2.993 N/A GLY 239.A N PHE 235.A O no hydrogen 2.871 N/A ILE 240.A N GLN 393.A OE1 no hydrogen 2.847 N/A LEU 241.A N GLY 236.A O no hydrogen 3.368 N/A LEU 242.A N GLU 237.A O no hydrogen 3.238 N/A GLY 243.A N GLU 237.A O no hydrogen 3.084 N/A ALA 244.A N GLY 239.A O no hydrogen 2.859 N/A HIS 246.A N LEU 242.A O no hydrogen 3.037 N/A HIS 246.A NE2 GLU 250.A OE2 no hydrogen 2.942 N/A GLY 247.A N GLY 243.A O no hydrogen 2.992 N/A ILE 248.A N ALA 244.A O no hydrogen 2.858 N/A VAL 249.A N VAL 245.A O no hydrogen 3.095 N/A GLU 250.A N HIS 246.A O no hydrogen 3.072 N/A CYS 251.A N GLY 247.A O no hydrogen 3.012 N/A CYS 251.A SG ASP 451.A O no hydrogen 3.989 N/A CYS 251.A SG SER 455.A OG no hydrogen 3.305 N/A LEU 252.A N ILE 248.A O no hydrogen 2.845 N/A PHE 253.A N VAL 249.A O no hydrogen 3.032 N/A ARG 254.A N GLU 250.A O no hydrogen 3.113 N/A ARG 254.A NH1 ASP 451.A OD1 no hydrogen 2.958 N/A ARG 254.A NH2 ASP 451.A OD2 no hydrogen 2.849 N/A ARG 255.A N CYS 251.A O no hydrogen 3.058 N/A ARG 255.A NH1 ASP 463.A OD1 no hydrogen 3.457 N/A ARG 255.A NH1 ASP 463.A OD2 no hydrogen 3.022 N/A ARG 255.A NH2 ASP 463.A OD1 no hydrogen 2.954 N/A TYR 256.A N LEU 252.A O no hydrogen 2.898 N/A TYR 256.A OH THR 382.A OG1 no hydrogen 2.784 N/A THR 257.A N PHE 253.A O no hydrogen 3.075 N/A THR 257.A OG1 PHE 253.A O no hydrogen 2.937 N/A THR 257.A OG1 ARG 254.A O no hydrogen 3.235 N/A GLU 258.A N ARG 254.A O no hydrogen 2.999 N/A SER 259.A N ARG 255.A O no hydrogen 2.952 N/A SER 259.A OG ARG 255.A O no hydrogen 3.114 N/A GLY 260.A N THR 257.A O no hydrogen 3.195 N/A MET 261.A N TYR 256.A O no hydrogen 3.029 N/A LEU 265.A N SER 262.A OG no hydrogen 3.112 N/A ALA 266.A N SER 262.A O no hydrogen 2.874 N/A TYR 267.A N GLU 263.A O no hydrogen 2.939 N/A LYS 268.A N ASP 264.A O no hydrogen 3.017 N/A LYS 268.A NZ ASP 264.A OD2 no hydrogen 2.826 N/A ASN 269.A N LEU 265.A O no hydrogen 2.822 N/A THR 270.A N TYR 267.A O no hydrogen 3.263 N/A THR 270.A OG1 ALA 266.A O no hydrogen 2.820 N/A THR 270.A OG1 TYR 267.A O no hydrogen 3.246 N/A VAL 271.A N THR 270.A OG1 no hydrogen 2.745 N/A GLU 272.A N TYR 267.A O no hydrogen 3.433 N/A CYS 273.A N LYS 268.A O no hydrogen 2.959 N/A ILE 274.A N THR 270.A O no hydrogen 3.054 N/A THR 275.A N VAL 271.A O no hydrogen 2.913 N/A THR 275.A OG1 VAL 271.A O no hydrogen 2.895 N/A GLY 276.A N GLU 272.A O no hydrogen 2.875 N/A VAL 277.A N LEU 375.A O no hydrogen 2.703 N/A ILE 278.A N CYS 273.A O no hydrogen 3.124 N/A SER 279.A N ILE 274.A O no hydrogen 3.269 N/A SER 279.A OG ILE 274.A O no hydrogen 2.808 N/A LYS 280.A N GLY 276.A O no hydrogen 2.955 N/A THR 281.A N VAL 277.A O no hydrogen 2.964 N/A THR 281.A OG1 VAL 277.A O no hydrogen 2.868 N/A ILE 282.A N ILE 278.A O no hydrogen 3.017 N/A SER 283.A N SER 279.A O no hydrogen 2.859 N/A SER 283.A OG ASP 417.A OD1 no hydrogen 2.667 N/A THR 284.A N LYS 280.A O no hydrogen 3.312 N/A THR 284.A OG1 LYS 280.A O no hydrogen 3.261 N/A LYS 285.A N THR 281.A O no hydrogen 2.736 N/A GLY 286.A N THR 281.A O no hydrogen 3.026 N/A LEU 290.A N GLY 286.A O no hydrogen 3.281 N/A TYR 291.A N MET 287.A O no hydrogen 3.052 N/A ASN 292.A N LEU 288.A O no hydrogen 2.890 N/A SER 293.A N LEU 290.A O no hydrogen 3.044 N/A SER 293.A OG ALA 289.A O no hydrogen 3.562 N/A SER 293.A OG LEU 290.A O no hydrogen 2.755 N/A LEU 294.A N TYR 291.A O no hydrogen 3.131 N/A GLY 298.A N SER 295.A OG no hydrogen 2.947 N/A LYS 299.A N SER 295.A O no hydrogen 2.848 N/A LYS 299.A NZ GLU 296.A OE2 no hydrogen 2.996 N/A LYS 300.A N GLU 296.A O no hydrogen 3.420 N/A ASP 301.A N GLU 297.A O no hydrogen 3.234 N/A PHE 302.A N GLY 298.A O no hydrogen 2.924 N/A GLN 303.A N LYS 299.A O no hydrogen 2.884 N/A GLN 303.A NE2 TYR 291.A OH no hydrogen 2.943 N/A ALA 304.A N LYS 300.A O no hydrogen 2.957 N/A ALA 305.A N ASP 301.A O no hydrogen 3.033 N/A TYR 306.A N PHE 302.A O no hydrogen 2.856 N/A SER 307.A N GLN 303.A O no hydrogen 2.861 N/A ALA 308.A N ALA 304.A O no hydrogen 3.148 N/A SER 309.A N ALA 305.A O no hydrogen 2.965 N/A SER 309.A N TYR 306.A O no hydrogen 3.241 N/A SER 309.A OG ALA 305.A O no hydrogen 2.873 N/A TYR 310.A N TYR 306.A O no hydrogen 3.025 N/A SER 313.A N SER 309.A O no hydrogen 3.059 N/A SER 313.A OG SER 309.A O no hydrogen 2.786 N/A MET 314.A N TYR 310.A O no hydrogen 3.016 N/A ASP 315.A N TYR 311.A O no hydrogen 2.920 N/A LEU 317.A N SER 313.A O no hydrogen 3.108 N/A TYR 318.A N MET 314.A O no hydrogen 2.769 N/A GLU 319.A N ASP 315.A O no hydrogen 3.101 N/A CYS 320.A N ILE 316.A O no hydrogen 2.828 N/A TYR 321.A N LEU 317.A O no hydrogen 2.897 N/A TYR 321.A OH HIS 402.A NE2 no hydrogen 2.714 N/A GLU 322.A N TYR 318.A O no hydrogen 3.139 N/A ASP 323.A N GLU 319.A O no hydrogen 3.022 N/A VAL 324.A N CYS 320.A O no hydrogen 2.995 N/A ALA 325.A N TYR 321.A O no hydrogen 2.917 N/A SER 326.A N GLU 322.A O no hydrogen 3.004 N/A SER 326.A OG GLU 322.A O no hydrogen 3.235 N/A SER 326.A OG ASP 323.A O no hydrogen 3.289 N/A SER 326.A OG SER 328.A OG no hydrogen 3.367 N/A SER 328.A N SER 326.A OG no hydrogen 3.210 N/A SER 328.A OG SER 326.A OG no hydrogen 3.367 N/A GLU 329.A N ASP 323.A O no hydrogen 3.008 N/A ARG 331.A N GLY 327.A O no hydrogen 3.148 N/A ARG 331.A NH2 SER 153.A OG no hydrogen 2.862 N/A SER 332.A N SER 328.A O no hydrogen 3.006 N/A SER 332.A OG SER 328.A O no hydrogen 3.197 N/A VAL 333.A N GLU 329.A O no hydrogen 3.035 N/A VAL 334.A N ILE 330.A O no hydrogen 3.057 N/A LEU 335.A N ARG 331.A O no hydrogen 2.928 N/A ALA 336.A N SER 332.A O no hydrogen 2.942 N/A GLY 337.A N VAL 333.A O no hydrogen 3.130 N/A ARG 338.A N LEU 335.A O no hydrogen 3.107 N/A ARG 338.A NE ASP 125.A OD2 no hydrogen 2.981 N/A ARG 338.A NH2 ASP 125.A OD1 no hydrogen 2.817 N/A ARG 339.A N LEU 335.A O no hydrogen 3.283 N/A PHE 340.A N GLY 337.A O no hydrogen 3.233 N/A TYR 341.A N ARG 338.A O no hydrogen 3.211 N/A LYS 343.A NZ GLU 344.A OE2 no hydrogen 2.836 N/A LEU 346.A N LYS 343.A O no hydrogen 2.836 N/A PHE 349.A N ARG 339.A O no hydrogen 2.785 N/A GLN 356.A NE2 ASP 355.A OD1 no hydrogen 2.921 N/A ARG 358.A NE GLU 263.A OE2 no hydrogen 2.953 N/A ARG 358.A NH2 GLU 263.A OE2 no hydrogen 3.146 N/A TRP 360.A N THR 357.A O no hydrogen 3.074 N/A TRP 360.A NE1 GLU 250.A OE2 no hydrogen 2.880 N/A LYS 361.A N THR 357.A O no hydrogen 3.141 N/A LYS 361.A NZ GLN 356.A O no hydrogen 3.193 N/A VAL 362.A N ARG 358.A O no hydrogen 3.020 N/A GLY 363.A N MET 359.A O no hydrogen 2.907 N/A GLU 364.A N TRP 360.A O no hydrogen 3.032 N/A LYS 365.A N LYS 361.A O no hydrogen 3.307 N/A VAL 366.A N VAL 362.A O no hydrogen 3.018 N/A ARG 367.A N GLY 363.A O no hydrogen 2.894 N/A SER 368.A N GLU 364.A O no hydrogen 2.787 N/A SER 368.A OG LYS 365.A O no hydrogen 2.553 N/A VAL 369.A N VAL 366.A O no hydrogen 3.350 N/A ARG 370.A N ARG 367.A O no hydrogen 3.051 N/A ARG 370.A NH1 GLU 272.A OE1 no hydrogen 2.882 N/A ARG 370.A NH1 HIS 424.A O no hydrogen 2.938 N/A ARG 370.A NH2 HIS 424.A O no hydrogen 3.098 N/A GLY 376.A N ASP 374.A OD1 no hydrogen 3.029 N/A THR 382.A OG1 TYR 256.A OH no hydrogen 2.784 N/A THR 382.A OG1 ASN 269.A O no hydrogen 2.672 N/A ALA 383.A N TYR 379.A O no hydrogen 3.112 N/A GLY 384.A N PRO 380.A O no hydrogen 2.973 N/A VAL 385.A N PHE 381.A O no hydrogen 3.187 N/A TYR 386.A N THR 382.A O no hydrogen 3.071 N/A VAL 387.A N ALA 383.A O no hydrogen 2.970 N/A ALA 388.A N GLY 384.A O no hydrogen 3.066 N/A LEU 389.A N VAL 385.A O no hydrogen 3.051 N/A MET 390.A N TYR 386.A O no hydrogen 3.024 N/A MET 391.A N VAL 387.A O no hydrogen 2.906 N/A ALA 392.A N ALA 388.A O no hydrogen 2.930 N/A GLN 393.A N LEU 389.A O no hydrogen 2.952 N/A GLN 393.A NE2 GLU 410.A O no hydrogen 3.145 N/A GLN 393.A NE2 SER 411.A OG no hydrogen 3.117 N/A ILE 394.A N MET 390.A O no hydrogen 3.108 N/A GLU 395.A N MET 391.A O no hydrogen 3.010 N/A ILE 396.A N ALA 392.A O no hydrogen 3.033 N/A LEU 397.A N GLN 393.A O no hydrogen 3.077 N/A ARG 398.A N ILE 394.A O no hydrogen 2.897 N/A ARG 398.A NE GLU 395.A OE1 no hydrogen 3.111 N/A ARG 398.A NH1 TYR 404.A OH no hydrogen 3.093 N/A ARG 398.A NH1 ASP 479.A OD1 no hydrogen 2.785 N/A ARG 398.A NH2 GLU 395.A OE1 no hydrogen 2.987 N/A ARG 398.A NH2 ASP 479.A OD1 no hydrogen 3.533 N/A ARG 398.A NH2 ASP 479.A OD2 no hydrogen 2.846 N/A LYS 399.A N GLU 395.A O no hydrogen 2.896 N/A LYS 399.A NZ GLU 395.A OE2 no hydrogen 2.802 N/A LYS 400.A N ILE 396.A O no hydrogen 2.965 N/A LYS 400.A N LEU 397.A O no hydrogen 3.299 N/A LYS 400.A NZ GLU 322.A OE2 no hydrogen 2.950 N/A GLY 401.A N ARG 398.A O no hydrogen 3.115 N/A HIS 402.A N LEU 397.A O no hydrogen 3.151 N/A HIS 402.A ND1 GLU 406.A OE1 no hydrogen 2.771 N/A HIS 402.A NE2 TYR 321.A OH no hydrogen 2.714 N/A SER 405.A N GLU 23.A OE1 no hydrogen 2.993 N/A SER 405.A OG GLU 23.A OE1 no hydrogen 3.052 N/A GLU 406.A N SER 403.A OG no hydrogen 3.293 N/A ILE 407.A N SER 403.A O no hydrogen 2.908 N/A ILE 408.A N TYR 404.A O no hydrogen 2.852 N/A ASN 409.A N SER 405.A O no hydrogen 3.203 N/A ASN 409.A ND2 SER 405.A O no hydrogen 2.924 N/A GLU 410.A N GLU 406.A O no hydrogen 3.021 N/A SER 411.A N ILE 407.A O no hydrogen 2.925 N/A SER 411.A OG ILE 407.A O no hydrogen 2.906 N/A VAL 412.A N ILE 408.A O no hydrogen 2.949 N/A ILE 413.A N ILE 408.A O no hydrogen 3.048 N/A GLU 414.A N ASN 409.A O no hydrogen 3.115 N/A VAL 416.A N VAL 412.A O no hydrogen 3.257 N/A ASP 417.A N ILE 413.A O no hydrogen 2.852 N/A SER 418.A N GLU 414.A O no hydrogen 3.094 N/A SER 418.A OG SER 175.A OG no hydrogen 2.761 N/A LEU 419.A N GLU 414.A O no hydrogen 3.036 N/A ASN 420.A N ALA 415.A O no hydrogen 2.837 N/A ASN 420.A ND2 SER 279.A OG no hydrogen 2.864 N/A ASN 420.A ND2 TYR 386.A OH no hydrogen 3.391 N/A PHE 422.A N LEU 419.A O no hydrogen 2.925 N/A HIS 424.A N ASN 420.A O no hydrogen 2.913 N/A ALA 425.A N PRO 421.A O no hydrogen 2.924 N/A ARG 426.A N PHE 422.A O no hydrogen 2.945 N/A ARG 426.A NH1 ALA 501.A O no hydrogen 2.959 N/A ARG 426.A NH1 LEU 510.A O no hydrogen 2.990 N/A ARG 426.A NH2 LEU 510.A O no hydrogen 2.927 N/A GLY 427.A N MET 423.A O no hydrogen 2.997 N/A SER 429.A OG ASP 433.A OD2 no hydrogen 2.724 N/A MET 431.A N VAL 428.A O no hydrogen 3.244 N/A VAL 432.A N VAL 428.A O no hydrogen 2.873 N/A ASP 433.A N SER 429.A O no hydrogen 2.818 N/A ASN 434.A N MET 431.A O no hydrogen 3.391 N/A ASN 434.A ND2 PHE 430.A O no hydrogen 2.818 N/A CYS 435.A N VAL 432.A O no hydrogen 3.027 N/A CYS 435.A SG MET 431.A O no hydrogen 3.422 N/A THR 438.A OG1 ASP 120.A OD2 no hydrogen 2.640 N/A ALA 439.A N SER 436.A OG no hydrogen 2.972 N/A ARG 440.A N SER 436.A O no hydrogen 2.767 N/A ARG 440.A NE ASP 433.A OD1 no hydrogen 2.862 N/A ARG 440.A NH2 ASP 433.A OD1 no hydrogen 3.400 N/A LEU 441.A N THR 437.A O no hydrogen 2.956 N/A GLY 442.A N THR 438.A O no hydrogen 3.005 N/A SER 443.A N ALA 439.A O no hydrogen 2.883 N/A ARG 444.A N ARG 440.A O no hydrogen 3.280 N/A ARG 444.A NH1 ASP 433.A OD1 no hydrogen 3.186 N/A ARG 444.A NH1 ARG 440.A O no hydrogen 3.129 N/A ARG 444.A NH2 GLY 352.A O no hydrogen 2.854 N/A ARG 444.A NH2 ASP 433.A OD1 no hydrogen 3.045 N/A LYS 445.A N LEU 441.A O no hydrogen 2.997 N/A LYS 445.A NZ GLU 329.A OE1 no hydrogen 2.859 N/A TRP 446.A N GLY 442.A O no hydrogen 2.942 N/A TRP 446.A NE1 GLU 329.A OE2 no hydrogen 2.968 N/A ALA 447.A N SER 443.A O no hydrogen 2.930 N/A ARG 449.A NH1 GLU 319.A OE2 no hydrogen 2.894 N/A ARG 449.A NH2 GLU 319.A OE1 no hydrogen 2.881 N/A ARG 449.A NH2 GLU 319.A OE2 no hydrogen 3.535 N/A PHE 450.A N TRP 446.A O no hydrogen 3.235 N/A ASP 451.A N ALA 447.A O no hydrogen 3.059 N/A TYR 452.A N PRO 448.A O no hydrogen 2.995 N/A ILE 453.A N ARG 449.A O no hydrogen 3.066 N/A LEU 454.A N PHE 450.A O no hydrogen 3.027 N/A SER 455.A N ASP 451.A O no hydrogen 3.054 N/A SER 455.A OG ASP 451.A O no hydrogen 3.146 N/A SER 455.A OG ASP 451.A OD1 no hydrogen 3.540 N/A GLN 456.A N TYR 452.A O no hydrogen 2.845 N/A GLN 457.A N ILE 453.A O no hydrogen 2.899 N/A LEU 459.A N LEU 454.A O no hydrogen 2.867 N/A ALA 461.A N GLN 457.A O no hydrogen 2.892 N/A VAL 462.A N ALA 458.A O no hydrogen 3.155 N/A ASP 463.A N LEU 459.A O no hydrogen 3.033 N/A ASN 464.A N ALA 461.A O no hydrogen 3.154 N/A GLY 465.A N VAL 462.A O no hydrogen 3.373 N/A ALA 466.A N ALA 461.A O no hydrogen 3.051 N/A ASN 469.A N SER 307.A OG no hydrogen 2.697 N/A ASN 469.A ND2 SER 307.A O no hydrogen 3.410 N/A GLN 470.A NE2 GLN 303.A OE1 no hydrogen 3.079 N/A LEU 472.A N ASN 469.A O no hydrogen 3.075 N/A SER 474.A N GLN 470.A O no hydrogen 2.920 N/A ASN 475.A N ASP 471.A O no hydrogen 2.818 N/A PHE 476.A N LEU 472.A O no hydrogen 2.984 N/A LEU 477.A N ILE 473.A O no hydrogen 3.021 N/A SER 478.A N SER 474.A O no hydrogen 2.956 N/A SER 478.A OG SER 474.A O no hydrogen 3.071 N/A SER 478.A OG ASN 475.A O no hydrogen 3.534 N/A ASP 479.A N PHE 476.A O no hydrogen 3.371 N/A VAL 481.A N ASP 479.A OD1 no hydrogen 2.917 N/A HIS 482.A N ASP 479.A O no hydrogen 3.354 N/A HIS 482.A NE2 PHE 476.A O no hydrogen 2.813 N/A ILE 485.A N VAL 481.A O no hydrogen 2.899 N/A GLY 486.A N HIS 482.A O no hydrogen 3.092 N/A VAL 487.A N GLU 483.A O no hydrogen 3.063 N/A CYS 488.A N ALA 484.A O no hydrogen 2.953 N/A CYS 488.A SG ALA 484.A O no hydrogen 3.495 N/A ALA 489.A N ILE 485.A O no hydrogen 2.904 N/A GLN 490.A N GLY 486.A O no hydrogen 3.362 N/A GLN 490.A N VAL 487.A O no hydrogen 3.257 N/A LEU 491.A N CYS 488.A O no hydrogen 2.905 N/A ARG 492.A N ALA 489.A O no hydrogen 3.176 N/A ARG 492.A NE ASP 417.A OD1 no hydrogen 3.429 N/A ARG 492.A NE ASP 417.A OD2 no hydrogen 2.955 N/A ARG 492.A NH1 ASP 496.A OD1 no hydrogen 2.753 N/A ARG 492.A NH2 ASP 417.A OD1 no hydrogen 3.286 N/A ARG 492.A NH2 ASP 496.A OD1 no hydrogen 2.576 N/A SER 498.A N GLN 182.A OE1 no hydrogen 2.846 N/A THR 500.A OG1 ASP 502.A OD1 no hydrogen 2.672 N/A ALA 503.A N THR 500.A O no hydrogen 3.094 N/A ARG 507.A N ASN 434.A OD1 no hydrogen 3.010 N/A ARG 507.A NE ASP 433.A O no hydrogen 2.883 N/A ARG 507.A NH2 CYS 435.A O no hydrogen 2.654 N/A GLU 509.A N GLU 509.A OE1 no hydrogen 2.926 N/A LEU 510.A N ARG 507.A O no hydrogen 2.807 N/A ARG 511.A N PRO 508.A O no hydrogen 3.127 N/A ARG 511.A NE ASP 504.A O no hydrogen 2.780 N/A ARG 511.A NH1 GLU 88.A OE2 no hydrogen 2.977 N/A ARG 511.A NH2 GLU 88.A OE1 no hydrogen 2.973 N/A ARG 511.A NH2 ASP 504.A O no hydrogen 3.429 N/A