Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3g4d_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ALA 1.A N PRO 240.A O no hydrogen 3.082 N/A ASP 2.A N PRO 240.A O no hydrogen 2.924 N/A GLN 4.A N ALA 242.A O no hydrogen 2.716 N/A GLN 4.A NE2 PHE 235.A O no hydrogen 3.634 N/A TRP 8.A N SER 6.A OG no hydrogen 3.233 N/A TRP 8.A NE1 GLU 248.A OE2 no hydrogen 3.043 N/A GLY 9.A N SER 6.A O no hydrogen 3.334 N/A LEU 11.A N TRP 8.A O no hydrogen 3.045 N/A LEU 13.A N ASP 10.A O no hydrogen 3.138 N/A GLU 20.A N ASP 18.A OD1 no hydrogen 2.741 N/A LYS 23.A N ALA 19.A O no hydrogen 3.169 N/A ARG 24.A N GLU 20.A O no hydrogen 2.914 N/A HIS 25.A N THR 21.A O no hydrogen 2.954 N/A HIS 25.A NE2 ASP 211.A OD1 no hydrogen 2.806 N/A GLN 26.A N GLU 22.A O no hydrogen 2.994 N/A GLN 27.A N LYS 23.A O no hydrogen 2.926 N/A LEU 28.A N ARG 24.A O no hydrogen 2.709 N/A LYS 29.A N HIS 25.A O no hydrogen 2.943 N/A LYS 29.A NZ HIS 61.A ND1 no hydrogen 3.495 N/A GLU 31.A N GLN 27.A O no hydrogen 3.217 N/A VAL 32.A N LEU 28.A O no hydrogen 2.890 N/A ARG 33.A N LYS 29.A O no hydrogen 2.953 N/A ARG 33.A NE GLU 30.A OE1 no hydrogen 3.286 N/A ARG 33.A NE GLU 30.A OE2 no hydrogen 2.893 N/A ARG 33.A NH1 HIS 61.A O no hydrogen 3.543 N/A ARG 33.A NH1 GLU 65.A OE1 no hydrogen 2.807 N/A ARG 33.A NH2 GLU 30.A OE1 no hydrogen 3.120 N/A LYS 34.A N GLU 30.A O no hydrogen 2.907 N/A MET 35.A N GLU 31.A O no hydrogen 2.995 N/A ILE 36.A N VAL 32.A O no hydrogen 3.092 N/A ILE 36.A N ARG 33.A O no hydrogen 3.037 N/A VAL 37.A N ARG 33.A O no hydrogen 3.273 N/A ALA 38.A N LYS 34.A O no hydrogen 2.795 N/A ALA 41.A N GLN 45.A OE1 no hydrogen 3.137 N/A THR 44.A OG1 THR 86.A OG1 no hydrogen 2.549 N/A GLN 45.A N ASN 42.A O no hydrogen 3.258 N/A LYS 46.A N ASN 42.A O no hydrogen 3.216 N/A LYS 46.A NZ ILE 36.A O no hydrogen 3.059 N/A LYS 46.A NZ ALA 38.A O no hydrogen 2.888 N/A LYS 46.A NZ GLU 69.A OE1 no hydrogen 2.576 N/A LEU 47.A N SER 43.A O no hydrogen 2.855 N/A ALA 48.A N THR 44.A O no hydrogen 2.913 N/A PHE 49.A N GLN 45.A O no hydrogen 2.850 N/A ILE 50.A N LYS 46.A O no hydrogen 2.985 N/A ASP 51.A N LEU 47.A O no hydrogen 2.943 N/A SER 52.A N ALA 48.A O no hydrogen 3.075 N/A SER 52.A OG ALA 48.A O no hydrogen 3.248 N/A SER 52.A OG TYR 190.A OH no hydrogen 3.302 N/A VAL 53.A N PHE 49.A O no hydrogen 2.923 N/A GLN 54.A N ILE 50.A O no hydrogen 2.905 N/A GLN 54.A NE2 HIS 97.A NE2 no hydrogen 2.695 N/A ARG 55.A N ASP 51.A O no hydrogen 2.749 N/A ARG 55.A NE ASP 51.A OD2 no hydrogen 3.166 N/A ARG 55.A NH1 GLU 169.A OE2 no hydrogen 3.325 N/A ARG 55.A NH2 ASP 51.A OD2 no hydrogen 3.012 N/A ARG 55.A NH2 GLU 169.A OE2 no hydrogen 3.125 N/A LEU 56.A N SER 52.A O no hydrogen 2.870 N/A GLY 57.A N GLN 54.A O no hydrogen 3.054 N/A VAL 58.A N VAL 53.A O no hydrogen 3.331 N/A TYR 60.A OH ASP 211.A OD2 no hydrogen 2.783 N/A HIS 61.A N VAL 58.A O no hydrogen 3.166 N/A HIS 61.A NE2 ASP 211.A OD1 no hydrogen 2.892 N/A PHE 62.A N SER 59.A O no hydrogen 2.821 N/A LYS 64.A NZ ASP 68.A OD1 no hydrogen 2.782 N/A GLU 65.A N GLU 65.A OE2 no hydrogen 2.855 N/A ILE 66.A N PHE 62.A O no hydrogen 2.960 N/A GLU 67.A N THR 63.A O no hydrogen 2.997 N/A ASP 68.A N LYS 64.A O no hydrogen 2.819 N/A GLU 69.A N GLU 65.A O no hydrogen 3.216 N/A LEU 70.A N ILE 66.A O no hydrogen 2.986 N/A GLU 71.A N GLU 67.A O no hydrogen 2.913 N/A ASN 72.A N ASP 68.A O no hydrogen 3.244 N/A ILE 73.A N GLU 69.A O no hydrogen 3.166 N/A TYR 74.A N LEU 70.A O no hydrogen 3.062 N/A TYR 74.A N GLU 71.A O no hydrogen 3.170 N/A HIS 75.A N GLU 71.A O no hydrogen 3.245 N/A ASN 76.A N ASN 72.A O no hydrogen 2.948 N/A ASN 82.A ND2 ASN 77.A OD1 no hydrogen 3.341 N/A THR 86.A OG1 THR 44.A OG1 no hydrogen 2.549 N/A THR 87.A N ASP 83.A O no hydrogen 3.202 N/A THR 87.A OG1 ASP 83.A O no hydrogen 2.651 N/A SER 88.A N LEU 84.A O no hydrogen 2.939 N/A SER 88.A OG LEU 84.A O no hydrogen 2.664 N/A ILE 89.A N TYR 85.A O no hydrogen 3.009 N/A ARG 90.A N THR 86.A O no hydrogen 3.095 N/A ARG 90.A NE ILE 73.A O no hydrogen 3.347 N/A ARG 90.A NH2 ILE 73.A O no hydrogen 3.520 N/A ARG 90.A NH2 TYR 74.A O no hydrogen 3.483 N/A PHE 91.A N THR 87.A O no hydrogen 2.988 N/A ARG 92.A N SER 88.A O no hydrogen 2.844 N/A ARG 92.A NH1 ASP 51.A OD1 no hydrogen 2.955 N/A ARG 92.A NH2 ASP 51.A OD1 no hydrogen 3.481 N/A ARG 92.A NH2 ASP 51.A OD2 no hydrogen 3.134 N/A ARG 92.A NH2 GLU 129.A OE2 no hydrogen 3.002 N/A LEU 93.A N ILE 89.A O no hydrogen 3.038 N/A LEU 94.A N ARG 90.A O no hydrogen 3.038 N/A ARG 95.A N PHE 91.A O no hydrogen 2.968 N/A ARG 95.A NH1 VAL 101.A O no hydrogen 2.853 N/A ARG 95.A NH1 GLU 141.A OE2 no hydrogen 2.861 N/A ARG 95.A NH2 LEU 136.A O no hydrogen 3.027 N/A ARG 95.A NH2 GLU 141.A OE1 no hydrogen 2.867 N/A ARG 95.A NH2 GLU 141.A OE2 no hydrogen 3.472 N/A GLU 96.A N ARG 92.A O no hydrogen 2.933 N/A HIS 97.A N LEU 93.A O no hydrogen 3.101 N/A HIS 97.A ND1 GLU 67.A OE2 no hydrogen 2.995 N/A GLY 98.A N ARG 95.A O no hydrogen 3.059 N/A TYR 99.A N LEU 94.A O no hydrogen 2.899 N/A TYR 99.A OH GLU 67.A OE1 no hydrogen 3.059 N/A VAL 101.A N TYR 99.A O no hydrogen 2.905 N/A ASP 104.A N SER 102.A OG no hydrogen 2.898 N/A VAL 105.A N SER 102.A O no hydrogen 3.388 N/A PHE 106.A N CYS 103.A O no hydrogen 3.101 N/A ASN 107.A N ASP 104.A O no hydrogen 2.761 N/A LYS 108.A NZ GLU 81.A OE2 no hydrogen 2.971 N/A PHE 109.A N PHE 106.A O no hydrogen 3.234 N/A LYS 110.A N ASN 107.A O no hydrogen 2.878 N/A LYS 110.A NZ GLU 146.A OE1 no hydrogen 2.799 N/A LYS 110.A NZ GLU 146.A OE2 no hydrogen 3.109 N/A ASP 111.A N ASN 115.A O no hydrogen 2.694 N/A GLY 114.A N ASP 111.A O no hydrogen 2.687 N/A ASN 115.A N ASP 111.A OD2 no hydrogen 2.712 N/A LYS 117.A N PHE 109.A O no hydrogen 3.124 N/A LYS 117.A NZ LYS 108.A O no hydrogen 3.453 N/A THR 121.A N SER 118.A O no hydrogen 3.157 N/A THR 121.A OG1 SER 118.A O no hydrogen 2.766 N/A SER 122.A N SER 119.A O no hydrogen 3.062 N/A SER 122.A OG SER 118.A O no hydrogen 3.471 N/A SER 122.A OG SER 119.A O no hydrogen 3.350 N/A ASP 123.A N VAL 120.A O no hydrogen 3.032 N/A GLY 126.A N ASP 123.A OD1 no hydrogen 2.808 N/A LEU 127.A N ASP 123.A O no hydrogen 2.736 N/A LEU 128.A N VAL 124.A O no hydrogen 2.800 N/A GLU 129.A N ARG 125.A O no hydrogen 3.159 N/A LEU 130.A N GLY 126.A O no hydrogen 2.968 N/A TYR 131.A N LEU 127.A O no hydrogen 2.916 N/A TYR 131.A OH ALA 173.A O no hydrogen 2.755 N/A GLN 132.A N LEU 128.A O no hydrogen 2.948 N/A ALA 133.A N GLU 129.A O no hydrogen 2.852 N/A SER 134.A N LEU 130.A O no hydrogen 3.019 N/A SER 134.A OG TYR 131.A O no hydrogen 2.851 N/A TYR 135.A N GLN 132.A O no hydrogen 3.177 N/A TYR 135.A OH TYR 131.A OH no hydrogen 3.027 N/A LEU 136.A N ALA 133.A O no hydrogen 2.937 N/A ARG 137.A N SER 134.A O no hydrogen 3.206 N/A ARG 137.A NE SER 134.A O no hydrogen 2.793 N/A ARG 137.A NH1 ASP 145.A OD1 no hydrogen 3.514 N/A VAL 138.A N GLU 141.A OE1 no hydrogen 2.966 N/A HIS 139.A NE2 ASP 464.A OD1 no hydrogen 2.761 N/A ASP 142.A N ASP 142.A OD1 no hydrogen 2.379 N/A LEU 144.A N GLU 141.A O no hydrogen 2.946 N/A ASP 145.A N GLU 141.A O no hydrogen 3.229 N/A GLU 146.A N ASP 142.A O no hydrogen 2.840 N/A ALA 147.A N ILE 143.A O no hydrogen 2.936 N/A ILE 148.A N LEU 144.A O no hydrogen 3.070 N/A SER 149.A OG ASP 145.A O no hydrogen 3.529 N/A PHE 150.A N GLU 146.A O no hydrogen 2.777 N/A THR 151.A N ALA 147.A O no hydrogen 2.801 N/A THR 151.A OG1 ALA 147.A O no hydrogen 2.623 N/A THR 151.A OG1 ILE 148.A O no hydrogen 3.553 N/A THR 152.A N ILE 148.A O no hydrogen 3.223 N/A THR 152.A OG1 ILE 148.A O no hydrogen 2.565 N/A HIS 153.A N SER 149.A O no hydrogen 3.220 N/A HIS 153.A N PHE 150.A O no hydrogen 3.154 N/A HIS 154.A N PHE 150.A O no hydrogen 3.268 N/A LEU 155.A N THR 151.A O no hydrogen 2.908 N/A SER 156.A N THR 152.A O no hydrogen 3.319 N/A SER 156.A OG THR 152.A O no hydrogen 2.576 N/A LEU 157.A N HIS 153.A O no hydrogen 3.327 N/A ALA 158.A N HIS 154.A O no hydrogen 3.137 N/A VAL 159.A N SER 156.A O no hydrogen 3.461 N/A SER 161.A OG ALA 158.A O no hydrogen 3.312 N/A LEU 162.A N VAL 159.A O no hydrogen 2.941 N/A HIS 164.A NE2 ASP 196.A OD1 no hydrogen 2.469 N/A SER 167.A N ASP 163.A O no hydrogen 3.187 N/A GLU 169.A N PRO 165.A O no hydrogen 2.946 N/A VAL 170.A N LEU 166.A O no hydrogen 3.010 N/A SER 171.A N SER 167.A O no hydrogen 3.033 N/A SER 171.A OG GLU 168.A O no hydrogen 3.173 N/A HIS 172.A N GLU 168.A O no hydrogen 2.996 N/A HIS 172.A NE2 GLU 186.A OE1 no hydrogen 2.678 N/A ALA 173.A N GLU 169.A O no hydrogen 2.934 N/A LEU 174.A N VAL 170.A O no hydrogen 3.005 N/A LYS 175.A N SER 171.A O no hydrogen 3.293 N/A LYS 175.A N HIS 172.A O no hydrogen 2.918 N/A GLN 176.A N HIS 172.A O no hydrogen 2.724 N/A GLN 176.A NE2 SER 177.A O no hydrogen 3.211 N/A GLN 176.A NE2 ASP 491.A OD1 no hydrogen 3.085 N/A ILE 178.A N GLN 132.A OE1 no hydrogen 2.962 N/A ARG 179.A NH1 ASN 466.A OD1 no hydrogen 2.888 N/A ARG 180.A N SER 177.A OG no hydrogen 3.227 N/A ARG 180.A NH1 GLU 459.A OE1 no hydrogen 3.144 N/A ARG 180.A NH2 GLU 459.A OE2 no hydrogen 2.954 N/A GLY 181.A N ILE 178.A O no hydrogen 3.301 N/A GLU 186.A N LEU 182.A O no hydrogen 2.907 N/A ALA 187.A N PRO 183.A O no hydrogen 2.845 N/A ARG 188.A N ARG 184.A O no hydrogen 3.142 N/A ARG 188.A NH1 ARG 188.A O no hydrogen 3.098 N/A HIS 189.A N VAL 185.A O no hydrogen 3.392 N/A HIS 189.A NE2 GLU 168.A OE2 no hydrogen 2.857 N/A TYR 190.A N GLU 186.A O no hydrogen 2.784 N/A TYR 190.A OH SER 52.A OG no hydrogen 3.302 N/A LEU 191.A N ALA 187.A O no hydrogen 2.869 N/A SER 192.A N HIS 189.A O no hydrogen 2.969 N/A VAL 193.A N HIS 189.A O no hydrogen 3.506 N/A TYR 194.A N TYR 190.A O no hydrogen 2.908 N/A GLN 195.A N SER 192.A O no hydrogen 3.328 N/A SER 199.A OG GLU 198.A O no hydrogen 2.371 N/A HIS 200.A N ILE 197.A O no hydrogen 2.995 N/A HIS 200.A ND1 ILE 197.A O no hydrogen 2.932 N/A ASN 201.A N TYR 194.A OH no hydrogen 2.955 N/A LEU 204.A N ASN 201.A OD1 no hydrogen 2.755 N/A LEU 205.A N ASN 201.A O no hydrogen 3.109 N/A GLU 206.A N LYS 202.A O no hydrogen 3.062 N/A PHE 207.A N ALA 203.A O no hydrogen 2.883 N/A ALA 208.A N LEU 204.A O no hydrogen 2.910 N/A LYS 209.A N LEU 205.A O no hydrogen 3.084 N/A ILE 210.A N GLU 206.A O no hydrogen 3.069 N/A ASP 211.A N PHE 207.A O no hydrogen 2.815 N/A PHE 212.A N ALA 208.A O no hydrogen 2.820 N/A ASN 213.A N LYS 209.A O no hydrogen 3.136 N/A ASN 213.A ND2 ILE 514.A O no hydrogen 3.046 N/A MET 214.A N ILE 210.A O no hydrogen 3.041 N/A LEU 215.A N ASP 211.A O no hydrogen 2.955 N/A GLN 216.A N PHE 212.A O no hydrogen 2.916 N/A GLN 216.A NE2 LEU 509.A O no hydrogen 2.920 N/A GLN 216.A NE2 GLU 512.A O no hydrogen 2.946 N/A PHE 217.A N ASN 213.A O no hydrogen 3.004 N/A LEU 218.A N MET 214.A O no hydrogen 3.110 N/A HIS 219.A N LEU 215.A O no hydrogen 2.844 N/A HIS 219.A NE2 PHE 258.A O no hydrogen 2.862 N/A ARG 220.A N GLN 216.A O no hydrogen 2.823 N/A ARG 220.A NH1 LEU 510.A O no hydrogen 3.044 N/A LYS 221.A N PHE 217.A O no hydrogen 3.060 N/A GLU 222.A N LEU 218.A O no hydrogen 3.035 N/A LEU 223.A N HIS 219.A O no hydrogen 2.863 N/A SER 224.A N ARG 220.A O no hydrogen 2.983 N/A SER 224.A OG LEU 13.A O no hydrogen 2.907 N/A GLU 225.A N LYS 221.A O no hydrogen 3.213 N/A ILE 226.A N GLU 222.A O no hydrogen 3.170 N/A CYS 227.A N LEU 223.A O no hydrogen 2.846 N/A CYS 227.A SG LEU 223.A O no hydrogen 3.132 N/A ARG 228.A N SER 224.A O no hydrogen 2.980 N/A TRP 229.A N GLU 225.A O no hydrogen 2.961 N/A TRP 230.A N ILE 226.A O no hydrogen 2.779 N/A TRP 230.A NE1 ASP 244.A OD2 no hydrogen 2.707 N/A LYS 231.A N CYS 227.A O no hydrogen 2.704 N/A ASP 232.A N ARG 228.A O no hydrogen 3.090 N/A LEU 233.A N TRP 229.A O no hydrogen 3.382 N/A LEU 233.A N TRP 230.A O no hydrogen 3.138 N/A ASP 234.A N LYS 231.A O no hydrogen 3.209 N/A ARG 237.A N ASP 234.A O no hydrogen 3.269 N/A LYS 238.A N ASP 234.A O no hydrogen 3.152 N/A LEU 239.A N PHE 235.A O no hydrogen 2.627 N/A TYR 241.A OH THR 282.A OG1 no hydrogen 3.034 N/A ALA 242.A N LEU 239.A O no hydrogen 3.446 N/A ARG 243.A N ASP 281.A OD2 no hydrogen 3.147 N/A ARG 243.A NE ASP 281.A OD2 no hydrogen 3.310 N/A VAL 246.A N ASP 244.A OD1 no hydrogen 3.298 N/A GLU 248.A N GLU 248.A OE1 no hydrogen 2.703 N/A GLY 249.A N ARG 245.A O no hydrogen 2.705 N/A TYR 250.A N VAL 246.A O no hydrogen 2.694 N/A TYR 250.A OH GLU 222.A OE1 no hydrogen 2.726 N/A PHE 251.A N VAL 247.A O no hydrogen 2.833 N/A TRP 252.A N GLU 248.A O no hydrogen 3.009 N/A ILE 253.A N GLY 249.A O no hydrogen 2.935 N/A SER 254.A N TYR 250.A O no hydrogen 2.831 N/A SER 254.A OG PHE 251.A O no hydrogen 2.910 N/A GLY 255.A N PHE 251.A O no hydrogen 3.212 N/A VAL 256.A N TRP 252.A O no hydrogen 3.133 N/A TYR 257.A N ILE 253.A O no hydrogen 3.088 N/A TYR 257.A OH SER 390.A O no hydrogen 2.719 N/A PHE 258.A N GLU 259.A OE1 no hydrogen 3.123 N/A GLU 259.A N GLU 259.A OE1 no hydrogen 2.643 N/A TYR 262.A N GLU 259.A O no hydrogen 3.023 N/A TYR 262.A OH GLU 478.A OE1 no hydrogen 2.574 N/A SER 263.A N PRO 260.A O no hydrogen 3.211 N/A SER 263.A OG GLU 222.A OE2 no hydrogen 2.499 N/A ARG 266.A N TYR 262.A O no hydrogen 2.932 N/A ARG 266.A NE GLU 222.A OE1 no hydrogen 2.785 N/A ARG 266.A NH1 TYR 257.A O no hydrogen 2.869 N/A ARG 266.A NH1 GLU 259.A O no hydrogen 2.873 N/A ARG 266.A NH2 GLU 222.A OE2 no hydrogen 2.903 N/A ARG 266.A NH2 GLU 259.A O no hydrogen 3.073 N/A LYS 267.A N SER 263.A O no hydrogen 3.148 N/A LYS 267.A NZ GLU 225.A OE1 no hydrogen 2.721 N/A MET 268.A N LEU 264.A O no hydrogen 3.040 N/A LEU 269.A N GLY 265.A O no hydrogen 2.934 N/A THR 270.A N ARG 266.A O no hydrogen 2.895 N/A THR 270.A OG1 ARG 266.A O no hydrogen 2.585 N/A LYS 271.A N LYS 267.A O no hydrogen 3.290 N/A LYS 271.A NZ GLU 327.A OE2 no hydrogen 2.723 N/A VAL 272.A N MET 268.A O no hydrogen 2.930 N/A ILE 273.A N LEU 269.A O no hydrogen 2.833 N/A ALA 274.A N THR 270.A O no hydrogen 2.886 N/A MET 275.A N LYS 271.A O no hydrogen 2.953 N/A ALA 276.A N VAL 272.A O no hydrogen 2.853 N/A SER 277.A N ILE 273.A O no hydrogen 3.005 N/A SER 277.A OG ILE 273.A O no hydrogen 2.869 N/A ILE 278.A N ALA 274.A O no hydrogen 3.077 N/A VAL 279.A N MET 275.A O no hydrogen 2.897 N/A ASP 280.A N ALA 276.A O no hydrogen 2.898 N/A ASP 281.A N SER 277.A O no hydrogen 2.857 N/A THR 282.A N ILE 278.A O no hydrogen 3.009 N/A THR 282.A OG1 TYR 241.A OH no hydrogen 3.034 N/A THR 282.A OG1 ILE 278.A O no hydrogen 2.731 N/A TYR 283.A N VAL 279.A O no hydrogen 3.170 N/A TYR 283.A OH THR 296.A OG1 no hydrogen 2.611 N/A ASP 284.A N ASP 280.A O no hydrogen 3.063 N/A SER 285.A N THR 282.A O no hydrogen 3.479 N/A SER 285.A OG THR 282.A O no hydrogen 2.895 N/A ALA 287.A N SER 285.A OG no hydrogen 3.095 N/A THR 288.A N GLU 291.A OE1 no hydrogen 3.096 N/A THR 288.A OG1 GLU 291.A OE1 no hydrogen 3.299 N/A GLU 291.A N THR 288.A O no hydrogen 2.840 N/A LEU 292.A N THR 288.A O no hydrogen 2.933 N/A ILE 293.A N TYR 289.A O no hydrogen 2.985 N/A TYR 295.A N GLU 291.A O no hydrogen 3.356 N/A TYR 295.A OH SER 317.A OG no hydrogen 2.802 N/A THR 296.A N LEU 292.A O no hydrogen 2.813 N/A THR 296.A OG1 TYR 283.A OH no hydrogen 2.611 N/A THR 296.A OG1 LEU 292.A O no hydrogen 2.845 N/A ASN 297.A N ILE 293.A O no hydrogen 2.758 N/A ALA 298.A N PRO 294.A O no hydrogen 2.926 N/A ILE 299.A N TYR 295.A O no hydrogen 3.048 N/A GLU 300.A N THR 296.A O no hydrogen 2.869 N/A ARG 301.A N ASN 297.A O no hydrogen 2.991 N/A ARG 301.A NH1 ASN 297.A OD1 no hydrogen 3.024 N/A TRP 302.A N ALA 298.A O no hydrogen 2.774 N/A ASP 303.A N TYR 318.A OH no hydrogen 3.113 N/A LYS 305.A N ASP 303.A OD1 no hydrogen 2.726 N/A CYS 306.A N ASP 303.A O no hydrogen 2.819 N/A ILE 307.A N ILE 304.A O no hydrogen 3.122 N/A GLU 309.A N CYS 306.A O no hydrogen 2.766 N/A MET 314.A N PRO 311.A O no hydrogen 2.872 N/A LYS 315.A N GLU 312.A O no hydrogen 3.183 N/A LYS 315.A NZ GLU 312.A OE1 no hydrogen 3.231 N/A SER 317.A N MET 314.A O no hydrogen 3.170 N/A SER 317.A OG TYR 295.A OH no hydrogen 2.802 N/A SER 317.A OG MET 314.A O no hydrogen 2.950 N/A TYR 318.A N MET 314.A O no hydrogen 3.173 N/A TYR 318.A OH ALA 298.A O no hydrogen 2.737 N/A TYR 318.A OH ASP 303.A O no hydrogen 3.143 N/A LYS 319.A N LYS 315.A O no hydrogen 2.900 N/A LYS 319.A NZ ASP 323.A OD1 no hydrogen 3.180 N/A ALA 320.A N PRO 316.A O no hydrogen 3.136 N/A LEU 321.A N SER 317.A O no hydrogen 2.778 N/A LEU 322.A N TYR 318.A O no hydrogen 2.952 N/A ASP 323.A N LYS 319.A O no hydrogen 2.986 N/A VAL 324.A N ALA 320.A O no hydrogen 3.151 N/A TYR 325.A N LEU 321.A O no hydrogen 3.492 N/A GLU 326.A N LEU 322.A O no hydrogen 3.000 N/A GLU 327.A N ASP 323.A O no hydrogen 2.837 N/A MET 328.A N VAL 324.A O no hydrogen 3.026 N/A VAL 329.A N TYR 325.A O no hydrogen 3.134 N/A GLN 330.A N GLU 326.A O no hydrogen 3.248 N/A GLN 330.A NE2 GLU 326.A OE1 no hydrogen 2.666 N/A LEU 331.A N GLU 327.A O no hydrogen 2.887 N/A ALA 333.A N GLN 330.A O no hydrogen 3.381 N/A HIS 335.A N VAL 332.A O no hydrogen 3.369 N/A GLY 336.A N ALA 333.A O no hydrogen 3.003 N/A ARG 337.A N VAL 332.A O no hydrogen 3.112 N/A GLN 338.A N GLN 338.A OE1 no hydrogen 2.802 N/A ARG 340.A N ARG 337.A O no hydrogen 3.104 N/A ARG 340.A NE TYR 339.A OH no hydrogen 3.129 N/A ARG 340.A NH1 VAL 392.A O no hydrogen 3.101 N/A ARG 340.A NH1 MET 394.A O no hydrogen 2.680 N/A ARG 340.A NH2 GLY 395.A O no hydrogen 2.815 N/A VAL 341.A N GLN 338.A O no hydrogen 3.012 N/A LYS 345.A N VAL 341.A O no hydrogen 2.856 N/A LYS 345.A NZ GLU 342.A OE1 no hydrogen 3.013 N/A ASN 346.A N GLU 342.A O no hydrogen 2.958 N/A ALA 347.A N TYR 343.A O no hydrogen 3.124 N/A MET 348.A N ALA 344.A O no hydrogen 3.065 N/A ILE 349.A N LYS 345.A O no hydrogen 2.995 N/A ARG 350.A N ASN 346.A O no hydrogen 3.074 N/A ARG 350.A NH1 ARG 350.A O no hydrogen 2.936 N/A LEU 351.A N ALA 347.A O no hydrogen 3.076 N/A ALA 352.A N MET 348.A O no hydrogen 2.954 N/A GLN 353.A N ILE 349.A O no hydrogen 2.936 N/A GLN 353.A NE2 GLU 300.A OE2 no hydrogen 2.763 N/A SER 354.A N ARG 350.A O no hydrogen 3.099 N/A SER 354.A OG LEU 351.A O no hydrogen 2.790 N/A SER 354.A OG PRO 379.A O no hydrogen 3.053 N/A TYR 355.A N LEU 351.A O no hydrogen 3.004 N/A LEU 356.A N ALA 352.A O no hydrogen 3.161 N/A VAL 357.A N GLN 353.A O no hydrogen 3.468 N/A GLU 358.A N SER 354.A O no hydrogen 3.100 N/A ALA 359.A N TYR 355.A O no hydrogen 2.860 N/A LYS 360.A N LEU 356.A O no hydrogen 3.022 N/A TRP 361.A N VAL 357.A O no hydrogen 3.135 N/A THR 362.A N GLU 358.A O no hydrogen 3.232 N/A THR 362.A OG1 ALA 359.A O no hydrogen 2.998 N/A LEU 363.A N ALA 359.A O no hydrogen 2.913 N/A GLN 364.A N LYS 360.A O no hydrogen 2.862 N/A ASN 365.A N THR 362.A O no hydrogen 3.256 N/A TYR 366.A N TRP 361.A O no hydrogen 2.935 N/A TYR 366.A OH GLU 372.A OE1 no hydrogen 2.678 N/A TYR 366.A OH GLU 372.A OE2 no hydrogen 2.772 N/A SER 369.A N GLU 372.A OE1 no hydrogen 2.994 N/A GLU 372.A N SER 369.A OG no hydrogen 3.275 N/A PHE 373.A N SER 369.A O no hydrogen 3.308 N/A LYS 374.A N PHE 370.A O no hydrogen 2.766 N/A ALA 375.A N GLU 371.A O no hydrogen 2.902 N/A ASN 376.A N PHE 373.A O no hydrogen 3.239 N/A THR 380.A N ALA 377.A O no hydrogen 3.307 N/A THR 380.A OG1 ALA 377.A O no hydrogen 3.265 N/A CYS 381.A N LEU 378.A O no hydrogen 3.216 N/A TYR 383.A OH LEU 486.A O no hydrogen 3.100 N/A LEU 386.A N GLY 382.A O no hydrogen 3.010 N/A ALA 387.A N TYR 383.A O no hydrogen 3.135 N/A ILE 388.A N ALA 384.A O no hydrogen 2.996 N/A THR 389.A N MET 385.A O no hydrogen 2.948 N/A THR 389.A OG1 MET 385.A O no hydrogen 2.597 N/A SER 390.A N LEU 386.A O no hydrogen 2.810 N/A SER 390.A OG ALA 387.A O no hydrogen 2.784 N/A PHE 391.A N ALA 387.A O no hydrogen 3.227 N/A PHE 391.A N ILE 388.A O no hydrogen 3.243 N/A VAL 392.A N THR 389.A O no hydrogen 2.971 N/A MET 394.A N PHE 391.A O no hydrogen 3.173 N/A VAL 398.A N GLY 395.A O no hydrogen 3.168 N/A THR 399.A N THR 402.A OG1 no hydrogen 3.016 N/A THR 399.A OG1 GLU 401.A OE1 no hydrogen 3.333 N/A THR 402.A N THR 399.A O no hydrogen 2.880 N/A THR 402.A OG1 THR 399.A O no hydrogen 3.320 N/A LYS 404.A N PRO 400.A O no hydrogen 3.317 N/A TRP 405.A N GLU 401.A O no hydrogen 2.952 N/A TRP 405.A NE1 GLU 474.A OE1 no hydrogen 2.811 N/A ALA 406.A N THR 402.A O no hydrogen 2.924 N/A ALA 407.A N PHE 403.A O no hydrogen 3.040 N/A SER 408.A N LYS 404.A O no hydrogen 3.228 N/A SER 408.A N TRP 405.A O no hydrogen 3.170 N/A SER 408.A OG TRP 405.A O no hydrogen 2.705 N/A ASP 409.A N ALA 406.A O no hydrogen 3.176 N/A LYS 411.A NZ GLU 474.A OE1 no hydrogen 2.738 N/A LYS 411.A NZ GLU 474.A OE2 no hydrogen 2.811 N/A GLN 414.A N PRO 410.A O no hydrogen 2.898 N/A ALA 415.A N LYS 411.A O no hydrogen 2.807 N/A SER 416.A N ILE 412.A O no hydrogen 3.223 N/A SER 416.A OG ILE 413.A O no hydrogen 2.836 N/A THR 417.A N ILE 413.A O no hydrogen 2.982 N/A THR 417.A OG1 ILE 413.A O no hydrogen 2.999 N/A ILE 418.A N GLN 414.A O no hydrogen 2.897 N/A ILE 419.A N ALA 415.A O no hydrogen 2.995 N/A CYS 420.A N SER 416.A O no hydrogen 2.903 N/A CYS 420.A SG CYS 381.A O no hydrogen 3.984 N/A ARG 421.A N THR 417.A O no hydrogen 2.799 N/A PHE 422.A N ILE 418.A O no hydrogen 2.837 N/A MET 423.A N ILE 419.A O no hydrogen 3.097 N/A ASP 424.A N CYS 420.A O no hydrogen 3.095 N/A ASP 425.A N ARG 421.A O no hydrogen 2.980 N/A VAL 426.A N PHE 422.A O no hydrogen 3.065 N/A ALA 427.A N MET 423.A O no hydrogen 3.064 N/A GLU 428.A N ASP 424.A O no hydrogen 3.010 N/A HIS 429.A N ASP 425.A O no hydrogen 3.128 N/A HIS 429.A ND1 TYR 451.A OH no hydrogen 2.681 N/A HIS 429.A NE2 GLU 437.A OE1 no hydrogen 3.069 N/A LYS 430.A N VAL 426.A O no hydrogen 2.959 N/A GLU 437.A N SER 434.A OG no hydrogen 2.826 N/A CYS 438.A N SER 434.A O no hydrogen 2.861 N/A TYR 439.A N ALA 435.A O no hydrogen 2.869 N/A MET 440.A N ILE 436.A O no hydrogen 2.862 N/A GLU 441.A N GLU 437.A O no hydrogen 3.102 N/A GLU 442.A N CYS 438.A O no hydrogen 2.925 N/A TYR 443.A N TYR 439.A O no hydrogen 2.932 N/A GLY 444.A N GLU 441.A O no hydrogen 3.303 N/A VAL 445.A N MET 440.A O no hydrogen 3.089 N/A THR 446.A N GLU 449.A OE1 no hydrogen 2.953 N/A THR 446.A OG1 GLU 449.A OE1 no hydrogen 2.570 N/A GLN 448.A NE2 ASP 452.A OD1 no hydrogen 3.378 N/A GLU 449.A N THR 446.A OG1 no hydrogen 3.352 N/A ALA 450.A N THR 446.A O no hydrogen 2.995 N/A TYR 451.A N ALA 447.A O no hydrogen 2.772 N/A TYR 451.A OH HIS 429.A ND1 no hydrogen 2.681 N/A ASP 452.A N GLN 448.A O no hydrogen 3.004 N/A VAL 453.A N GLU 449.A O no hydrogen 3.191 N/A PHE 454.A N ALA 450.A O no hydrogen 2.931 N/A ASN 455.A N TYR 451.A O no hydrogen 2.809 N/A LYS 456.A N ASP 452.A O no hydrogen 3.097 N/A HIS 457.A N VAL 453.A O no hydrogen 3.141 N/A VAL 458.A N PHE 454.A O no hydrogen 2.989 N/A GLU 459.A N ASN 455.A O no hydrogen 2.903 N/A SER 460.A N LYS 456.A O no hydrogen 3.033 N/A ALA 461.A N HIS 457.A O no hydrogen 2.846 N/A TRP 462.A N VAL 458.A O no hydrogen 2.913 N/A LYS 463.A N GLU 459.A O no hydrogen 3.136 N/A LYS 463.A NZ ASP 145.A OD1 no hydrogen 3.042 N/A ASP 464.A N SER 460.A O no hydrogen 3.110 N/A LEU 465.A N ALA 461.A O no hydrogen 2.944 N/A ASN 466.A N TRP 462.A O no hydrogen 3.008 N/A ASN 466.A ND2 TYR 135.A O no hydrogen 3.064 N/A ASN 466.A ND2 ARG 137.A O no hydrogen 3.136 N/A GLN 467.A N LYS 463.A O no hydrogen 2.915 N/A GLU 468.A N ASP 464.A O no hydrogen 2.980 N/A PHE 469.A N ASN 466.A O no hydrogen 3.033 N/A LEU 470.A N GLN 467.A O no hydrogen 3.179 N/A LYS 471.A N GLY 98.A O no hydrogen 2.971 N/A THR 473.A OG1 MET 475.A O no hydrogen 2.830 N/A VAL 479.A N PRO 476.A O no hydrogen 3.031 N/A LEU 480.A N PRO 476.A O no hydrogen 3.123 N/A ASN 481.A N THR 477.A O no hydrogen 2.810 N/A ASN 481.A ND2 GLU 478.A OE2 no hydrogen 2.991 N/A ARG 482.A N VAL 479.A O no hydrogen 3.237 N/A ARG 482.A NE VAL 256.A O no hydrogen 3.110 N/A ARG 482.A NH1 GLU 478.A O no hydrogen 2.818 N/A ARG 482.A NH1 GLU 478.A OE1 no hydrogen 2.761 N/A ARG 482.A NH2 VAL 256.A O no hydrogen 2.773 N/A SER 483.A N LEU 480.A O no hydrogen 2.976 N/A LEU 484.A N LEU 480.A O no hydrogen 3.144 N/A ASN 485.A N ASN 481.A O no hydrogen 2.820 N/A ASN 485.A ND2 VAL 256.A O no hydrogen 3.051 N/A LEU 486.A N ARG 482.A O no hydrogen 3.198 N/A ALA 487.A N SER 483.A O no hydrogen 3.120 N/A ARG 488.A N LEU 484.A O no hydrogen 2.942 N/A ARG 488.A NE ARG 179.A O no hydrogen 2.869 N/A ARG 488.A NH1 ASN 485.A OD1 no hydrogen 2.930 N/A ARG 488.A NH2 ARG 179.A O no hydrogen 3.274 N/A VAL 489.A N ASN 485.A O no hydrogen 2.810 N/A MET 490.A N LEU 486.A O no hydrogen 3.207 N/A ASP 491.A N ALA 487.A O no hydrogen 3.062 N/A VAL 492.A N ARG 488.A O no hydrogen 3.092 N/A LEU 493.A N VAL 489.A O no hydrogen 2.946 N/A TYR 494.A N MET 490.A O no hydrogen 2.891 N/A ARG 495.A NE ASP 491.A O no hydrogen 2.642 N/A ARG 495.A NH2 GLN 176.A OE1 no hydrogen 3.009 N/A LYS 503.A N GLY 499.A O no hydrogen 2.992 N/A GLY 504.A N LYS 500.A O no hydrogen 2.825 N/A GLY 505.A N ALA 501.A O no hydrogen 2.840 N/A ILE 506.A N ALA 502.A O no hydrogen 2.685 N/A THR 507.A N LYS 503.A O no hydrogen 3.009 N/A THR 507.A OG1 LYS 503.A O no hydrogen 2.809 N/A SER 508.A N GLY 504.A O no hydrogen 2.957 N/A SER 508.A OG GLY 504.A O no hydrogen 3.003 N/A SER 508.A OG GLY 505.A O no hydrogen 3.332 N/A LEU 509.A N GLY 505.A O no hydrogen 2.982 N/A LEU 510.A N ILE 506.A O no hydrogen 2.894 N/A ILE 511.A N THR 507.A O no hydrogen 3.041 N/A GLU 512.A N THR 507.A O no hydrogen 3.023 N/A ILE 514.A N ASN 213.A OD1 no hydrogen 2.831 N/A