Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4p71_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): MET 1.A N VAL 159.A O no hydrogen 3.042 N/A LYS 2.A NZ ASP 241.A OD1 no hydrogen 2.935 N/A LYS 2.A NZ ASP 241.A OD2 no hydrogen 3.392 N/A PHE 3.A N ILE 157.A O no hydrogen 2.901 N/A SER 4.A OG ASP 154.A OD2 no hydrogen 2.784 N/A GLU 5.A N TYR 155.A O no hydrogen 3.020 N/A LYS 6.A N ASP 154.A OD1 no hydrogen 2.813 N/A TRP 7.A N SER 4.A OG no hydrogen 2.993 N/A LEU 8.A N SER 4.A O no hydrogen 3.141 N/A ARG 9.A N GLU 5.A O no hydrogen 2.842 N/A ARG 9.A NH1 VAL 16.A O no hydrogen 2.604 N/A SER 10.A N LYS 6.A O no hydrogen 3.025 N/A SER 10.A N TRP 7.A O no hydrogen 3.158 N/A SER 10.A OG TRP 7.A O no hydrogen 2.693 N/A TRP 11.A N LEU 8.A O no hydrogen 2.985 N/A ALA 12.A N LEU 8.A O no hydrogen 2.901 N/A GLN 15.A N ASN 13.A OD1 no hydrogen 2.983 N/A SER 17.A N GLU 20.A OE1 no hydrogen 3.187 N/A HIS 18.A ND1 GLU 5.A OE1 no hydrogen 2.663 N/A HIS 18.A NE2 ASP 35.A OD2 no hydrogen 2.866 N/A GLU 20.A N SER 17.A OG no hydrogen 3.243 N/A LEU 21.A N SER 17.A O no hydrogen 3.064 N/A VAL 22.A N HIS 18.A O no hydrogen 2.837 N/A ALA 23.A N ASP 19.A O no hydrogen 3.074 N/A ARG 24.A N GLU 20.A O no hydrogen 3.028 N/A LEU 25.A N LEU 21.A O no hydrogen 3.135 N/A MET 27.A N ALA 23.A O no hydrogen 3.337 N/A VAL 28.A N LEU 25.A O no hydrogen 3.132 N/A GLY 29.A N SER 26.A O no hydrogen 3.392 N/A LEU 30.A N LEU 25.A O no hydrogen 2.861 N/A VAL 32.A N SER 26.A OG no hydrogen 3.141 N/A ASP 33.A N GLU 158.A O no hydrogen 2.758 N/A LEU 36.A N THR 156.A O no hydrogen 3.105 N/A VAL 38.A N ASP 154.A O no hydrogen 3.079 N/A SER 43.A N GLU 97.A O no hydrogen 2.904 N/A VAL 46.A N PHE 91.A O no hydrogen 3.128 N/A VAL 47.A N GLN 144.A O no hydrogen 2.833 N/A GLY 48.A N ILE 89.A O no hydrogen 2.946 N/A GLU 49.A N SER 68.A O no hydrogen 2.895 N/A VAL 50.A N LEU 87.A O no hydrogen 2.815 N/A LEU 51.A N GLN 66.A O no hydrogen 2.750 N/A GLU 54.A N VAL 64.A O no hydrogen 2.879 N/A GLN 55.A NE2 ASP 60.A O no hydrogen 2.900 N/A HIS 56.A N LEU 62.A O no hydrogen 3.289 N/A HIS 56.A NE2 LEU 109.A O no hydrogen 2.874 N/A ASP 58.A N HIS 56.A ND1 no hydrogen 3.071 N/A LEU 62.A N ALA 59.A O no hydrogen 3.143 N/A ARG 63.A N CYS 78.A O no hydrogen 2.980 N/A VAL 64.A N GLU 54.A O no hydrogen 2.780 N/A CYS 65.A N VAL 76.A O no hydrogen 2.947 N/A GLN 66.A N SER 52.A O no hydrogen 3.053 N/A VAL 67.A N PHE 74.A O no hydrogen 2.971 N/A SER 68.A N GLU 49.A O no hydrogen 2.903 N/A ASN 69.A N GLU 72.A O no hydrogen 3.086 N/A GLY 70.A N SER 68.A OG no hydrogen 3.148 N/A SER 71.A N ASN 69.A OD1 no hydrogen 3.327 N/A GLU 72.A N ASN 69.A OD1 no hydrogen 2.879 N/A PHE 74.A N VAL 67.A O no hydrogen 2.821 N/A VAL 76.A N CYS 65.A O no hydrogen 2.931 N/A VAL 77.A N SER 114.A OG no hydrogen 2.966 N/A CYS 78.A N ARG 63.A O no hydrogen 2.791 N/A ASN 82.A ND2 LEU 133.A O no hydrogen 3.018 N/A ASN 82.A ND2 GLU 135.A OE2 no hydrogen 3.221 N/A VAL 83.A N ALA 80.A O no hydrogen 3.308 N/A ARG 84.A NH1 ASN 82.A O no hydrogen 2.984 N/A ARG 84.A NH1 GLU 135.A OE2 no hydrogen 3.005 N/A ARG 84.A NH2 GLU 135.A OE1 no hydrogen 2.909 N/A GLY 86.A N VAL 50.A O no hydrogen 2.701 N/A LYS 88.A NZ ALA 138.A O no hydrogen 2.766 N/A LYS 88.A NZ ALA 140.A O no hydrogen 2.805 N/A ILE 89.A N GLY 48.A O no hydrogen 2.925 N/A PHE 91.A N VAL 46.A O no hydrogen 2.778 N/A ALA 92.A N MET 117.A O no hydrogen 2.712 N/A GLY 95.A N ILE 104.A O no hydrogen 2.981 N/A ALA 96.A N MET 93.A O no hydrogen 3.148 N/A LEU 98.A N PHE 102.A O no hydrogen 2.770 N/A PHE 102.A N LEU 98.A O no hydrogen 3.180 N/A ILE 104.A N ALA 96.A O no hydrogen 3.026 N/A ALA 107.A N SER 114.A O no hydrogen 3.237 N/A LYS 108.A NZ GLU 113.A OE2 no hydrogen 3.474 N/A VAL 112.A N LEU 109.A O no hydrogen 3.097 N/A SER 114.A N ALA 107.A O no hydrogen 2.790 N/A SER 114.A OG GLY 116.A O no hydrogen 3.254 N/A PHE 115.A N GLN 75.A O no hydrogen 2.704 N/A MET 117.A N ALA 92.A O no hydrogen 2.811 N/A CYS 119.A N PRO 90.A O no hydrogen 2.891 N/A CYS 119.A SG PRO 90.A O no hydrogen 3.537 N/A SER 120.A N GLU 123.A OE1 no hydrogen 3.261 N/A SER 120.A OG GLU 123.A OE1 no hydrogen 3.407 N/A SER 120.A OG ASN 130.A OD1 no hydrogen 3.089 N/A LYS 122.A N GLU 129.A O no hydrogen 3.226 N/A GLU 123.A N SER 120.A OG no hydrogen 3.310 N/A LEU 124.A N ALA 121.A O no hydrogen 3.238 N/A GLN 125.A N LYS 122.A O no hydrogen 2.924 N/A GLN 125.A NE2 ASP 100.A OD1 no hydrogen 3.512 N/A ILE 126.A N ALA 121.A O no hydrogen 2.810 N/A GLU 129.A N SER 127.A OG no hydrogen 3.196 N/A LEU 133.A N ASN 82.A OD1 no hydrogen 2.948 N/A LEU 134.A N CYS 119.A O no hydrogen 2.937 N/A LEU 136.A N LYS 88.A O no hydrogen 2.749 N/A ALA 140.A N PRO 137.A O no hydrogen 3.188 N/A GLY 143.A N VAL 47.A O no hydrogen 2.847 N/A GLN 144.A N PRO 141.A O no hydrogen 3.166 N/A VAL 146.A N VAL 45.A O no hydrogen 3.091 N/A ARG 147.A N ASP 145.A OD1 no hydrogen 3.434 N/A ARG 147.A NH2 GLY 40.A O no hydrogen 2.783 N/A THR 148.A OG1 ASP 145.A OD2 no hydrogen 3.530 N/A TYR 149.A N ASP 145.A O no hydrogen 2.899 N/A LEU 150.A N VAL 146.A O no hydrogen 2.789 N/A GLU 151.A N THR 148.A O no hydrogen 3.352 N/A LEU 152.A N ARG 147.A O no hydrogen 2.926 N/A THR 156.A N LEU 36.A O no hydrogen 2.787 N/A THR 156.A OG1 PHE 3.A O no hydrogen 3.360 N/A THR 156.A OG1 ARG 239.A O no hydrogen 2.724 N/A ILE 157.A N PHE 3.A O no hydrogen 2.812 N/A GLU 158.A N ALA 34.A O no hydrogen 2.840 N/A VAL 159.A N MET 1.A O no hydrogen 2.807 N/A GLY 160.A N GLU 31.A O no hydrogen 2.848 N/A ARG 165.A N THR 162.A O no hydrogen 3.082 N/A ARG 165.A NE ASP 167.A OD1 no hydrogen 3.005 N/A ARG 165.A NH2 ASP 167.A OD2 no hydrogen 3.073 N/A ARG 165.A NH2 GLU 177.A OE1 no hydrogen 2.747 N/A CYS 168.A N ARG 165.A O no hydrogen 3.078 N/A CYS 168.A SG ASP 167.A OD2 no hydrogen 3.781 N/A LEU 169.A N GLY 166.A O no hydrogen 3.389 N/A SER 170.A OG ASP 167.A O no hydrogen 3.443 N/A LEU 171.A N ILE 257.A O no hydrogen 2.938 N/A ALA 172.A N GLU 258.A O no hydrogen 2.938 N/A GLY 173.A N SER 170.A OG no hydrogen 3.133 N/A LEU 174.A N SER 170.A O no hydrogen 3.148 N/A ALA 175.A N LEU 171.A O no hydrogen 2.840 N/A ARG 176.A N ALA 172.A O no hydrogen 3.212 N/A ARG 176.A NH1 GLU 433.A OE1 no hydrogen 3.122 N/A ARG 176.A NH1 GLU 433.A OE2 no hydrogen 3.097 N/A GLU 177.A N GLY 173.A O no hydrogen 3.281 N/A VAL 178.A N LEU 174.A O no hydrogen 3.156 N/A SER 179.A N ALA 175.A O no hydrogen 2.997 N/A SER 179.A OG ARG 176.A O no hydrogen 2.726 N/A ALA 180.A N ARG 176.A O no hydrogen 3.149 N/A ILE 181.A N GLU 177.A O no hydrogen 2.798 N/A TYR 182.A N VAL 178.A O no hydrogen 2.946 N/A VAL 184.A N SER 179.A O no hydrogen 3.116 N/A ALA 187.A N TRP 11.A O no hydrogen 2.808 N/A VAL 194.A N GLU 373.A OE1 no hydrogen 2.972 N/A GLN 197.A N PRO 387.A O no hydrogen 2.772 N/A ARG 202.A NE GLU 200.A OE2 no hydrogen 3.222 N/A ARG 202.A NH2 GLU 200.A OE2 no hydrogen 2.735 N/A GLU 205.A N VAL 275.A O no hydrogen 2.814 N/A ALA 207.A N VAL 277.A O no hydrogen 2.816 N/A ALA 208.A N VAL 277.A O no hydrogen 3.230 N/A CYS 212.A N ALA 208.A O no hydrogen 3.095 N/A CYS 212.A SG ARG 214.A O no hydrogen 3.329 N/A CYS 212.A SG PHE 336.A O no hydrogen 3.342 N/A ARG 214.A NE SER 365.A O no hydrogen 2.926 N/A ARG 214.A NH1 GLU 392.A OE2 no hydrogen 3.300 N/A ARG 214.A NH2 SER 365.A O no hydrogen 3.094 N/A TYR 215.A N GLN 393.A O no hydrogen 2.936 N/A TYR 215.A OH GLU 333.A OE1 no hydrogen 2.749 N/A LEU 216.A N ALA 334.A O no hydrogen 2.733 N/A GLY 217.A N VAL 391.A O no hydrogen 2.877 N/A ARG 218.A N LEU 332.A O no hydrogen 3.090 N/A ARG 218.A NE GLY 388.A O no hydrogen 2.817 N/A ARG 218.A NH1 GLU 373.A OE1 no hydrogen 2.819 N/A ARG 218.A NH1 THR 376.A OG1 no hydrogen 3.148 N/A ARG 218.A NH2 VAL 194.A O no hydrogen 2.756 N/A ARG 218.A NH2 GLY 388.A O no hydrogen 3.241 N/A ILE 220.A N LEU 330.A O no hydrogen 2.952 N/A ARG 221.A N GLU 386.A O no hydrogen 2.944 N/A ARG 221.A NH2 GLU 200.A OE1 no hydrogen 3.091 N/A ASN 222.A N ASP 329.A OD1 no hydrogen 3.100 N/A VAL 223.A N ARG 328.A O no hydrogen 2.825 N/A ASP 224.A N VAL 383.A O no hydrogen 2.805 N/A SER 226.A N ASP 224.A OD1 no hydrogen 3.447 N/A SER 226.A OG ASP 224.A OD1 no hydrogen 2.652 N/A SER 226.A OG ASP 224.A OD2 no hydrogen 3.532 N/A ARG 227.A N ASP 224.A O no hydrogen 3.328 N/A THR 229.A OG1 ASP 250.A OD2 no hydrogen 2.788 N/A VAL 234.A N PRO 230.A O no hydrogen 3.066 N/A GLU 235.A N LEU 231.A O no hydrogen 2.865 N/A ARG 236.A N TRP 232.A O no hydrogen 3.015 N/A ARG 236.A NH1 TYR 254.A OH no hydrogen 2.776 N/A LEU 237.A N MET 233.A O no hydrogen 2.902 N/A ARG 238.A N VAL 234.A O no hydrogen 2.847 N/A ARG 238.A NE GLU 235.A OE1 no hydrogen 2.770 N/A ARG 238.A NE GLU 235.A OE2 no hydrogen 3.278 N/A ARG 238.A NH2 VAL 38.A O no hydrogen 2.850 N/A ARG 238.A NH2 GLU 235.A OE2 no hydrogen 3.109 N/A ARG 239.A N GLU 235.A O no hydrogen 2.857 N/A ARG 239.A NE GLU 235.A OE2 no hydrogen 2.956 N/A ARG 239.A NH1 GLU 151.A O no hydrogen 2.912 N/A ARG 239.A NH1 ASP 154.A OD2 no hydrogen 2.869 N/A ARG 239.A NH2 LEU 150.A O no hydrogen 2.969 N/A ARG 239.A NH2 GLU 151.A O no hydrogen 3.064 N/A ARG 239.A NH2 GLU 235.A OE2 no hydrogen 3.227 N/A SER 240.A N LEU 237.A O no hydrogen 2.892 N/A SER 240.A OG LYS 2.A O no hydrogen 3.118 N/A SER 240.A OG ARG 236.A O no hydrogen 3.434 N/A ASP 241.A N ARG 238.A O no hydrogen 3.111 N/A ILE 242.A N LEU 237.A O no hydrogen 2.778 N/A SER 244.A OG ASP 250.A OD2 no hydrogen 2.737 N/A ILE 245.A N ASP 250.A OD1 no hydrogen 2.843 N/A VAL 249.A N ASP 246.A OD2 no hydrogen 3.006 N/A ASP 250.A N ASP 246.A O no hydrogen 2.953 N/A VAL 251.A N PRO 247.A O no hydrogen 2.896 N/A THR 252.A N VAL 248.A O no hydrogen 3.253 N/A THR 252.A OG1 VAL 248.A O no hydrogen 3.239 N/A THR 252.A OG1 VAL 249.A O no hydrogen 3.125 N/A ASN 253.A N VAL 249.A O no hydrogen 2.869 N/A TYR 254.A N ASP 250.A O no hydrogen 2.793 N/A TYR 254.A OH GLU 258.A OE2 no hydrogen 2.711 N/A VAL 255.A N VAL 251.A O no hydrogen 2.829 N/A MET 256.A N THR 252.A O no hydrogen 3.249 N/A ILE 257.A N ASN 253.A O no hydrogen 2.910 N/A GLU 258.A N TYR 254.A O no hydrogen 2.729 N/A LEU 259.A N VAL 255.A O no hydrogen 2.769 N/A HIS 264.A N GLU 333.A O no hydrogen 3.080 N/A PHE 266.A N PHE 331.A O no hydrogen 3.031 N/A ASP 267.A N SER 321.A O no hydrogen 3.057 N/A LEU 268.A N ASP 329.A O no hydrogen 2.966 N/A ALA 269.A N ASP 267.A OD1 no hydrogen 3.422 N/A GLU 270.A N ASP 267.A O no hydrogen 2.774 N/A ILE 271.A N LEU 268.A O no hydrogen 3.048 N/A ASN 272.A N ASP 305.A OD2 no hydrogen 2.877 N/A VAL 275.A N PRO 203.A O no hydrogen 2.846 N/A ARG 276.A N ALA 304.A O no hydrogen 2.794 N/A VAL 277.A N GLU 205.A O no hydrogen 2.786 N/A ARG 278.A N VAL 302.A O no hydrogen 3.176 N/A ARG 278.A NH1 MET 279.A O no hydrogen 3.031 N/A ARG 278.A NH1 GLU 284.A OE1 no hydrogen 3.010 N/A ARG 278.A NH2 GLU 284.A OE1 no hydrogen 3.286 N/A ARG 278.A NH2 GLU 284.A OE2 no hydrogen 2.791 N/A ALA 280.A N THR 300.A O no hydrogen 2.844 N/A GLU 281.A N GLU 284.A OE1 no hydrogen 3.061 N/A GLY 283.A N LEU 296.A O no hydrogen 2.853 N/A GLU 284.A N GLU 281.A O no hydrogen 3.030 N/A LYS 285.A NZ GLU 293.A OE1 no hydrogen 2.805 N/A LEU 286.A N ILE 294.A O no hydrogen 2.924 N/A LEU 288.A N GLN 292.A O no hydrogen 2.846 N/A LEU 289.A N GLY 317.A O no hydrogen 2.894 N/A GLY 291.A N LEU 288.A O no hydrogen 2.980 N/A GLN 292.A N ASP 290.A OD1 no hydrogen 2.918 N/A GLN 292.A NE2 ASP 290.A OD2 no hydrogen 2.922 N/A ILE 294.A N LEU 286.A O no hydrogen 2.815 N/A LEU 296.A N GLU 284.A O no hydrogen 2.803 N/A ARG 297.A N TYR 349.A OH no hydrogen 2.934 N/A ARG 297.A NH1 SER 348.A OG no hydrogen 2.739 N/A ARG 297.A NH2 ASP 299.A OD2 no hydrogen 3.343 N/A ALA 298.A N ASP 282.A OD1 no hydrogen 3.408 N/A THR 300.A N ARG 297.A O no hydrogen 3.186 N/A THR 300.A OG1 ASP 299.A OD1 no hydrogen 3.360 N/A THR 300.A OG1 TYR 349.A OH no hydrogen 2.714 N/A VAL 302.A N ARG 278.A O no hydrogen 2.901 N/A ILE 303.A N ALA 311.A O no hydrogen 2.950 N/A ALA 304.A N ARG 276.A O no hydrogen 2.930 N/A ASP 305.A N ARG 308.A O no hydrogen 2.901 N/A HIS 306.A N ASN 272.A O no hydrogen 2.880 N/A GLN 307.A N ASP 305.A OD1 no hydrogen 2.767 N/A GLN 307.A NE2 GLN 307.A O no hydrogen 3.132 N/A ARG 308.A N ASP 305.A OD1 no hydrogen 2.799 N/A LEU 310.A N ILE 303.A O no hydrogen 2.721 N/A ALA 311.A N ILE 303.A O no hydrogen 2.984 N/A ILE 312.A N MET 316.A O no hydrogen 2.805 N/A ALA 313.A N LEU 301.A O no hydrogen 2.993 N/A VAL 315.A N ILE 312.A O no hydrogen 3.007 N/A MET 316.A N ILE 312.A O no hydrogen 3.100 N/A GLY 318.A N LEU 310.A O no hydrogen 2.936 N/A GLU 319.A N VAL 287.A O no hydrogen 3.086 N/A SER 321.A OG LEU 310.A O no hydrogen 2.752 N/A SER 321.A OG GLY 318.A O no hydrogen 3.362 N/A SER 324.A N THR 327.A OG1 no hydrogen 2.776 N/A SER 324.A OG SER 326.A OG no hydrogen 2.739 N/A SER 324.A OG THR 327.A OG1 no hydrogen 3.341 N/A SER 326.A OG SER 324.A OG no hydrogen 2.739 N/A THR 327.A OG1 ASP 267.A OD2 no hydrogen 2.826 N/A THR 327.A OG1 SER 324.A O no hydrogen 3.389 N/A THR 327.A OG1 SER 324.A OG no hydrogen 3.341 N/A LEU 330.A N ILE 220.A O no hydrogen 2.801 N/A PHE 331.A N PHE 266.A O no hydrogen 3.020 N/A LEU 332.A N ARG 218.A O no hydrogen 2.750 N/A GLU 333.A N HIS 264.A O no hydrogen 2.760 N/A ALA 334.A N LEU 216.A O no hydrogen 3.120 N/A PHE 336.A N ARG 214.A O no hydrogen 2.771 N/A ASP 338.A N ALA 211.A O no hydrogen 2.827 N/A ALA 341.A N ASP 338.A OD2 no hydrogen 3.080 N/A LEU 342.A N ASP 338.A O no hydrogen 3.252 N/A ALA 343.A N THR 339.A O no hydrogen 2.980 N/A GLY 344.A N GLU 360.A OE1 no hydrogen 2.891 N/A LYS 345.A N LEU 342.A O no hydrogen 2.943 N/A LYS 345.A NZ ASP 299.A O no hydrogen 2.818 N/A LYS 345.A NZ ASP 299.A OD1 no hydrogen 3.540 N/A LYS 345.A NZ ALA 341.A O no hydrogen 3.236 N/A SER 348.A N GLY 344.A O no hydrogen 3.029 N/A SER 348.A OG GLY 344.A O no hydrogen 3.521 N/A SER 348.A OG LYS 345.A O no hydrogen 2.602 N/A TYR 349.A N ALA 346.A O no hydrogen 3.136 N/A TYR 349.A OH THR 300.A OG1 no hydrogen 2.714 N/A GLY 350.A N ARG 347.A O no hydrogen 2.863 N/A LEU 351.A N ALA 346.A O no hydrogen 2.834 N/A THR 353.A N SER 356.A OG no hydrogen 2.826 N/A THR 353.A OG1 VAL 315.A O no hydrogen 2.802 N/A SER 356.A N THR 353.A OG1 no hydrogen 2.839 N/A SER 356.A OG THR 353.A O no hydrogen 2.977 N/A SER 356.A OG THR 353.A OG1 no hydrogen 3.312 N/A HIS 357.A N THR 353.A O no hydrogen 2.980 N/A ARG 358.A N ASP 354.A O no hydrogen 3.334 N/A ARG 358.A NE LEU 169.A O no hydrogen 2.795 N/A ARG 358.A NH1 ASP 354.A O no hydrogen 3.200 N/A ARG 358.A NH2 LEU 169.A O no hydrogen 2.761 N/A PHE 359.A N SER 355.A O no hydrogen 3.047 N/A GLU 360.A N SER 356.A O no hydrogen 3.023 N/A ARG 361.A N HIS 357.A O no hydrogen 3.007 N/A ARG 361.A NH2 PRO 163.A O no hydrogen 3.010 N/A GLY 362.A N PHE 359.A O no hydrogen 3.348 N/A GLN 366.A N ASP 364.A OD1 no hydrogen 3.014 N/A LEU 367.A N ASP 364.A O no hydrogen 3.278 N/A ARG 369.A NH2 GLU 392.A OE1 no hydrogen 3.114 N/A LYS 370.A NZ VAL 189.A O no hydrogen 3.533 N/A ALA 371.A N LEU 367.A O no hydrogen 3.162 N/A MET 372.A N ALA 368.A O no hydrogen 2.964 N/A GLU 373.A N ARG 369.A O no hydrogen 3.027 N/A ARG 374.A N LYS 370.A O no hydrogen 2.966 N/A ARG 374.A NE GLU 258.A OE1 no hydrogen 2.803 N/A ARG 374.A NH2 GLU 258.A OE1 no hydrogen 3.405 N/A ARG 374.A NH2 GLU 258.A OE2 no hydrogen 3.102 N/A ALA 375.A N ALA 371.A O no hydrogen 2.809 N/A THR 376.A N MET 372.A O no hydrogen 3.047 N/A THR 376.A OG1 MET 372.A O no hydrogen 2.644 N/A ARG 377.A N GLU 373.A O no hydrogen 3.130 N/A LEU 378.A N ARG 374.A O no hydrogen 3.242 N/A ILE 379.A N ALA 375.A O no hydrogen 2.809 N/A LEU 380.A N THR 376.A O no hydrogen 2.964 N/A ASP 381.A N ARG 377.A O no hydrogen 2.903 N/A ILE 382.A N LEU 378.A O no hydrogen 2.834 N/A ILE 382.A N ILE 379.A O no hydrogen 3.130 N/A VAL 383.A N ILE 379.A O no hydrogen 2.739 N/A GLU 386.A N ARG 221.A O no hydrogen 2.778 N/A GLY 388.A N VAL 219.A O no hydrogen 2.812 N/A VAL 391.A N GLY 217.A O no hydrogen 2.803 N/A GLN 393.A N TYR 215.A O no hydrogen 2.946 N/A SER 395.A N PRO 213.A O no hydrogen 2.771 N/A SER 395.A OG HIS 398.A ND1 no hydrogen 2.863 N/A HIS 398.A N SER 395.A O no hydrogen 3.188 N/A HIS 398.A ND1 SER 395.A OG no hydrogen 2.863 N/A LEU 399.A N GLU 396.A O no hydrogen 3.206 N/A LYS 401.A NZ GLU 396.A O no hydrogen 2.788 N/A LYS 401.A NZ LEU 399.A O no hydrogen 2.797 N/A ILE 405.A N VAL 446.A O no hydrogen 2.783 N/A LEU 407.A N TRP 444.A O no hydrogen 2.983 N/A ARG 408.A N GLU 458.A OE2 no hydrogen 3.148 N/A ARG 408.A NE GLU 458.A OE2 no hydrogen 2.908 N/A ARG 408.A NH2 GLU 458.A OE1 no hydrogen 3.172 N/A ALA 409.A N GLY 442.A O no hydrogen 3.128 N/A ARG 411.A N ARG 408.A O no hydrogen 3.182 N/A VAL 412.A N ARG 408.A O no hydrogen 3.376 N/A THR 413.A N ALA 409.A O no hydrogen 3.061 N/A THR 413.A OG1 ALA 409.A O no hydrogen 3.089 N/A GLN 414.A N GLU 410.A O no hydrogen 2.917 N/A MET 415.A N ARG 411.A O no hydrogen 3.061 N/A LEU 416.A N VAL 412.A O no hydrogen 2.953 N/A GLY 417.A N THR 413.A O no hydrogen 2.782 N/A ILE 425.A N ASP 421.A O no hydrogen 2.888 N/A VAL 426.A N ALA 422.A O no hydrogen 2.886 N/A ARG 427.A N ALA 423.A O no hydrogen 2.800 N/A ARG 427.A NH1 GLU 424.A OE2 no hydrogen 2.748 N/A ARG 427.A NH2 GLU 424.A OE2 no hydrogen 3.284 N/A LEU 428.A N GLU 424.A O no hydrogen 2.934 N/A LEU 429.A N ILE 425.A O no hydrogen 3.029 N/A GLN 430.A N VAL 426.A O no hydrogen 2.890 N/A ALA 431.A N ARG 427.A O no hydrogen 3.263 N/A ALA 431.A N LEU 428.A O no hydrogen 3.253 N/A LEU 432.A N LEU 429.A O no hydrogen 3.124 N/A GLU 433.A N GLN 430.A O no hydrogen 2.900 N/A LEU 434.A N LEU 429.A O no hydrogen 3.124 N/A THR 435.A N GLY 447.A O no hydrogen 2.941 N/A VAL 437.A N SER 445.A O no hydrogen 3.054 N/A ASP 439.A N GLN 443.A O no hydrogen 2.973 N/A GLN 443.A NE2 ASP 439.A O no hydrogen 3.126 N/A TRP 444.A N LEU 407.A O no hydrogen 2.855 N/A SER 445.A N VAL 437.A O no hydrogen 2.761 N/A VAL 446.A N ILE 405.A O no hydrogen 2.741 N/A GLY 447.A N THR 435.A O no hydrogen 2.934 N/A SER 450.A OG ASP 364.A OD1 no hydrogen 2.688 N/A SER 450.A OG ASP 364.A OD2 no hydrogen 3.490 N/A SER 450.A OG GLN 366.A OE1 no hydrogen 3.226 N/A ARG 452.A N PRO 449.A O no hydrogen 3.130 N/A ARG 452.A NE ASP 454.A OD1 no hydrogen 2.898 N/A ARG 452.A NH1 GLU 464.A OE1 no hydrogen 3.466 N/A ARG 452.A NH2 ASP 454.A OD2 no hydrogen 3.193 N/A ARG 452.A NH2 GLU 464.A OE1 no hydrogen 3.026 N/A SER 456.A N ASP 460.A OD2 no hydrogen 3.098 N/A LEU 457.A N ASP 460.A OD2 no hydrogen 2.853 N/A ASP 460.A N LEU 457.A O no hydrogen 3.156 N/A ILE 462.A N GLU 458.A O no hydrogen 3.025 N/A GLU 463.A N VAL 459.A O no hydrogen 2.811 N/A GLU 464.A N ASP 460.A O no hydrogen 3.148 N/A LEU 465.A N LEU 461.A O no hydrogen 2.991 N/A ALA 466.A N ILE 462.A O no hydrogen 2.877 N/A ARG 467.A N GLU 463.A O no hydrogen 2.873 N/A ARG 467.A NE VAL 28.A O no hydrogen 2.751 N/A ARG 467.A NH1 GLU 177.A OE2 no hydrogen 2.506 N/A LEU 468.A N GLU 464.A O no hydrogen 2.974 N/A TYR 469.A N LEU 465.A O no hydrogen 2.901 N/A GLY 470.A N ALA 466.A O no hydrogen 2.914 N/A TYR 471.A OH GLU 463.A OE1 no hydrogen 2.952 N/A ARG 473.A N GLY 470.A O no hydrogen 3.080 N/A ARG 473.A NH1 TYR 469.A O no hydrogen 3.441 N/A LEU 474.A N GLY 470.A O no hydrogen 3.261 N/A LEU 474.A N TYR 471.A O no hydrogen 3.371 N/A ASN 486.A ND2 ALA 484.A O no hydrogen 3.175 N/A LYS 488.A N ASN 487.A OD1 no hydrogen 3.146 N/A ARG 492.A N GLU 490.A O no hydrogen 3.055 N/A ALA 493.A N VAL 687.A O no hydrogen 2.767 N/A LEU 498.A N ALA 494.A O no hydrogen 3.202 N/A ARG 499.A N LEU 495.A O no hydrogen 2.999 N/A ARG 500.A N PRO 496.A O no hydrogen 3.342 N/A LEU 501.A N LEU 497.A O no hydrogen 3.073 N/A LEU 502.A N LEU 498.A O no hydrogen 3.210 N/A VAL 503.A N ARG 499.A O no hydrogen 2.945 N/A ALA 504.A N ARG 500.A O no hydrogen 2.969 N/A ARG 505.A N LEU 501.A O no hydrogen 2.868 N/A ARG 505.A NE ASP 617.A OD1 no hydrogen 2.800 N/A ARG 505.A NH2 ASP 617.A OD1 no hydrogen 2.772 N/A GLY 506.A N VAL 503.A O no hydrogen 2.965 N/A TYR 507.A N LEU 502.A O no hydrogen 2.875 N/A TYR 507.A OH ASP 617.A OD2 no hydrogen 2.786 N/A GLN 508.A N ARG 568.A O no hydrogen 2.966 N/A ALA 510.A N PHE 570.A O no hydrogen 2.746 N/A THR 512.A N GLU 571.A OE1 no hydrogen 2.894 N/A THR 512.A OG1 GLU 571.A OE1 no hydrogen 3.198 N/A THR 512.A OG1 GLU 571.A OE2 no hydrogen 2.735 N/A ILE 516.A N ALA 543.A O no hydrogen 2.730 N/A LEU 520.A N ASP 517.A OD2 no hydrogen 3.332 N/A PHE 521.A N ASP 517.A O no hydrogen 2.997 N/A GLU 522.A N PRO 518.A O no hydrogen 3.067 N/A LEU 523.A N ALA 519.A O no hydrogen 3.264 N/A LEU 523.A N LEU 520.A O no hydrogen 3.106 N/A ASP 525.A N PHE 521.A O no hydrogen 2.762 N/A THR 528.A OG1 ASP 525.A OD1 no hydrogen 2.816 N/A LEU 533.A N ALA 542.A O no hydrogen 3.004 N/A SER 538.A OG ASP 540.A OD1 no hydrogen 2.924 N/A ALA 543.A N ILE 516.A O no hydrogen 2.917 N/A MET 544.A N LEU 531.A O no hydrogen 2.936 N/A ARG 545.A N SER 514.A O no hydrogen 2.876 N/A ARG 545.A NE LEU 574.A O no hydrogen 2.908 N/A ARG 545.A NH1 GLU 571.A OE1 no hydrogen 2.976 N/A ARG 545.A NH2 LEU 574.A O no hydrogen 3.460 N/A SER 546.A OG ASP 525.A OD2 no hydrogen 2.740 N/A SER 547.A OG GLU 680.A OE1 no hydrogen 3.478 N/A SER 547.A OG GLU 680.A OE2 no hydrogen 3.110 N/A LEU 548.A N GLU 680.A OE1 no hydrogen 2.784 N/A TRP 549.A N SER 547.A OG no hydrogen 3.102 N/A TRP 549.A NE1 PHE 679.A O no hydrogen 2.957 N/A LEU 552.A N LEU 548.A O no hydrogen 2.978 N/A VAL 553.A N TRP 549.A O no hydrogen 2.758 N/A LYS 554.A N PRO 550.A O no hydrogen 2.942 N/A ALA 555.A N GLY 551.A O no hydrogen 3.089 N/A LEU 556.A N LEU 552.A O no hydrogen 2.833 N/A GLN 557.A N VAL 553.A O no hydrogen 2.858 N/A GLN 557.A NE2 LEU 670.A O no hydrogen 3.547 N/A HIS 558.A N LYS 554.A O no hydrogen 2.810 N/A ASN 559.A N ALA 555.A O no hydrogen 3.237 N/A ASN 559.A ND2 ALA 555.A O no hydrogen 2.745 N/A LEU 560.A N LEU 556.A O no hydrogen 3.025 N/A ASN 561.A N GLN 557.A O no hydrogen 2.893 N/A ARG 562.A N ASN 559.A O no hydrogen 2.765 N/A ARG 562.A NH1 HIS 558.A O no hydrogen 2.824 N/A GLN 564.A N ASN 559.A O no hydrogen 3.200 N/A ARG 566.A NH2 LYS 596.A O no hydrogen 3.499 N/A VAL 567.A N CYS 594.A O no hydrogen 3.192 N/A ARG 568.A NE GLY 506.A O no hydrogen 3.058 N/A ARG 568.A NH1 ARG 505.A O no hydrogen 2.804 N/A LEU 569.A N ALA 592.A O no hydrogen 2.863 N/A PHE 570.A N GLN 508.A O no hydrogen 2.986 N/A GLU 571.A N ALA 590.A O no hydrogen 2.875 N/A GLY 573.A N MET 588.A O no hydrogen 2.928 N/A ARG 575.A N GLU 586.A O no hydrogen 2.813 N/A ARG 575.A NE GLU 586.A OE2 no hydrogen 2.827 N/A ARG 575.A NH2 GLU 586.A OE2 no hydrogen 3.148 N/A PHE 576.A N ARG 545.A O no hydrogen 2.745 N/A VAL 577.A N LYS 584.A O no hydrogen 2.864 N/A GLN 579.A NE2 PRO 530.A O no hydrogen 3.275 N/A LEU 583.A N LEU 580.A O no hydrogen 3.259 N/A LYS 584.A N VAL 577.A O no hydrogen 2.852 N/A LYS 584.A NZ GLU 586.A OE1 no hydrogen 3.343 N/A LYS 584.A NZ GLU 586.A OE2 no hydrogen 3.223 N/A GLU 586.A N ARG 575.A O no hydrogen 3.194 N/A MET 588.A N GLY 573.A O no hydrogen 2.689 N/A LEU 589.A N LEU 681.A O no hydrogen 3.004 N/A ALA 590.A N GLU 571.A O no hydrogen 2.797 N/A GLY 591.A N PHE 679.A O no hydrogen 2.898 N/A ALA 592.A N LEU 569.A O no hydrogen 2.814 N/A ILE 593.A N PHE 677.A O no hydrogen 2.892 N/A CYS 594.A N VAL 567.A O no hydrogen 2.970 N/A CYS 594.A SG VAL 567.A O no hydrogen 3.934 N/A LYS 596.A NZ ARG 606.A O no hydrogen 2.924 N/A ARG 597.A N ASP 607.A O no hydrogen 2.860 N/A ARG 597.A NH1 ASP 613.A OD2 no hydrogen 2.807 N/A ASN 604.A ND2 PRO 599.A O no hydrogen 2.973 N/A VAL 609.A N GLY 595.A O no hydrogen 2.860 N/A ASP 610.A N ASP 613.A OD2 no hydrogen 2.866 N/A ASP 613.A N ASP 610.A O no hydrogen 3.071 N/A LYS 615.A N PHE 611.A O no hydrogen 2.964 N/A ALA 616.A N PHE 612.A O no hydrogen 3.266 N/A VAL 618.A N ALA 614.A O no hydrogen 2.988 N/A GLU 619.A N LYS 615.A O no hydrogen 2.772 N/A ALA 620.A N ALA 616.A O no hydrogen 2.931 N/A VAL 621.A N ASP 617.A O no hydrogen 3.221 N/A LEU 622.A N VAL 618.A O no hydrogen 2.850 N/A SER 624.A N VAL 621.A O no hydrogen 3.303 N/A SER 624.A OG ALA 620.A O no hydrogen 3.272 N/A SER 624.A OG VAL 621.A O no hydrogen 3.195 N/A GLY 626.A N ALA 623.A O no hydrogen 3.101 N/A ASP 630.A N ALA 627.A O no hydrogen 3.064 N/A PHE 631.A N LEU 628.A O no hydrogen 3.245 N/A SER 632.A N GLU 650.A O no hydrogen 3.017 N/A VAL 634.A N ARG 648.A O no hydrogen 2.897 N/A GLY 636.A N THR 646.A O no hydrogen 2.999 N/A ALA 640.A N HIS 638.A ND1 no hydrogen 3.034 N/A LEU 641.A N HIS 638.A O no hydrogen 3.042 N/A HIS 642.A N ALA 661.A O no hydrogen 2.843 N/A GLY 644.A N HIS 642.A ND1 no hydrogen 3.037 N/A GLN 645.A N HIS 642.A O no hydrogen 2.985 N/A THR 646.A OG1 HIS 642.A O no hydrogen 2.558 N/A ALA 647.A N LEU 659.A O no hydrogen 2.768 N/A ARG 648.A N VAL 634.A O no hydrogen 2.831 N/A ARG 648.A NE GLU 650.A OE2 no hydrogen 2.796 N/A ARG 648.A NH1 TYR 658.A OH no hydrogen 2.898 N/A ILE 649.A N GLY 657.A O no hydrogen 2.881 N/A GLU 650.A N SER 632.A O no hydrogen 2.925 N/A ARG 651.A N ARG 654.A O no hydrogen 2.959 N/A ARG 651.A NH1 GLU 685.A O no hydrogen 2.874 N/A ARG 651.A NH1 ASP 688.A O no hydrogen 2.925 N/A ARG 651.A NH2 ASP 630.A OD2 no hydrogen 3.149 N/A ARG 651.A NH2 ASP 688.A O no hydrogen 2.789 N/A ARG 654.A N ARG 651.A O no hydrogen 2.930 N/A ARG 654.A NH1 GLU 685.A OE2 no hydrogen 2.985 N/A VAL 656.A N ILE 649.A O no hydrogen 2.878 N/A GLY 657.A N ILE 649.A O no hydrogen 3.432 N/A TYR 658.A N GLU 680.A O no hydrogen 3.221 N/A LEU 659.A N ALA 647.A O no hydrogen 2.973 N/A GLY 660.A N LEU 678.A O no hydrogen 3.013 N/A ALA 661.A N GLN 645.A O no hydrogen 3.235 N/A LEU 662.A N VAL 676.A O no hydrogen 2.710 N/A HIS 663.A N ALA 640.A O no hydrogen 2.954 N/A GLU 665.A N HIS 663.A ND1 no hydrogen 2.985 N/A ALA 667.A N HIS 663.A O no hydrogen 3.098 N/A LYS 668.A N PRO 664.A O no hydrogen 2.977 N/A LYS 669.A N GLU 665.A O no hydrogen 3.204 N/A LEU 670.A N LEU 666.A O no hydrogen 2.983 N/A LEU 670.A N ALA 667.A O no hydrogen 3.118 N/A ASP 671.A N LYS 668.A O no hydrogen 2.943 N/A LEU 672.A N ALA 667.A O no hydrogen 2.855 N/A GLN 674.A NE2 SER 565.A O no hydrogen 3.501 N/A PHE 677.A N ILE 593.A O no hydrogen 2.801 N/A LEU 678.A N GLY 660.A O no hydrogen 2.825 N/A PHE 679.A N GLY 591.A O no hydrogen 3.066 N/A GLU 680.A N TYR 658.A O no hydrogen 3.042 N/A LEU 681.A N LEU 589.A O no hydrogen 2.785 N/A LEU 682.A N VAL 656.A O no hydrogen 2.806 N/A LEU 683.A N ALA 587.A O no hydrogen 3.136 N/A GLU 685.A N LEU 682.A O no hydrogen 3.052 N/A VAL 686.A N LEU 683.A O no hydrogen 3.048 N/A VAL 687.A N LEU 683.A O no hydrogen 3.056 N/A GLY 689.A N ALA 491.A O no hydrogen 3.049 N/A HIS 690.A N ALA 625.A O no hydrogen 2.975 N/A HIS 690.A ND1 GLY 626.A O no hydrogen 3.213 N/A HIS 690.A NE2 ASP 630.A OD2 no hydrogen 2.781 N/A SER 698.A OG HIS 761.A O no hydrogen 2.626 N/A PHE 700.A N SER 698.A OG no hydrogen 3.098 N/A VAL 703.A N TRP 759.A O no hydrogen 2.770 N/A ARG 704.A NE ASP 706.A OD1 no hydrogen 2.955 N/A ARG 704.A NH2 ASP 706.A OD1 no hydrogen 2.818 N/A ARG 705.A N LEU 757.A O no hydrogen 2.901 N/A ARG 705.A NE ASN 772.A OD1 no hydrogen 3.355 N/A ARG 705.A NH1 ASN 772.A OD1 no hydrogen 3.110 N/A LEU 707.A N VAL 755.A O no hydrogen 2.811 N/A LEU 709.A N LEU 753.A O no hydrogen 2.907 N/A LEU 710.A N THR 789.A O no hydrogen 2.797 N/A VAL 711.A N LYS 751.A O no hydrogen 2.988 N/A GLN 713.A N HIS 749.A O no hydrogen 3.001 N/A ASP 714.A N ASP 712.A OD1 no hydrogen 3.246 N/A VAL 715.A N ASP 712.A O no hydrogen 3.111 N/A ASP 719.A N PRO 716.A O no hydrogen 2.881 N/A LEU 721.A N ALA 717.A O no hydrogen 3.123 N/A THR 722.A N GLN 718.A O no hydrogen 2.934 N/A THR 722.A OG1 GLN 718.A O no hydrogen 2.682 N/A GLN 723.A N ASP 719.A O no hydrogen 3.075 N/A ILE 724.A N ILE 720.A O no hydrogen 2.935 N/A ARG 725.A N LEU 721.A O no hydrogen 3.036 N/A ALA 726.A N THR 722.A O no hydrogen 3.176 N/A ALA 727.A N GLN 723.A O no hydrogen 3.294 N/A ALA 727.A N ILE 724.A O no hydrogen 2.981 N/A ALA 728.A N ILE 724.A O no hydrogen 2.767 N/A GLU 730.A N GLU 730.A OE2 no hydrogen 2.730 N/A THR 733.A N THR 758.A O no hydrogen 2.842 N/A ASP 734.A N THR 758.A O no hydrogen 3.341 N/A ARG 736.A N GLY 756.A O no hydrogen 3.029 N/A PHE 738.A N ALA 754.A O no hydrogen 2.959 N/A TYR 741.A N SER 752.A O no hydrogen 2.824 N/A HIS 742.A NE2 PRO 748.A O no hydrogen 2.925 N/A GLY 745.A N TYR 741.A OH no hydrogen 2.868 N/A HIS 749.A N ASP 747.A OD2 no hydrogen 3.091 N/A ARG 750.A N ASP 747.A O no hydrogen 3.039 N/A ARG 750.A NH1 ASN 787.A O no hydrogen 3.265 N/A ARG 750.A NH2 ASN 787.A O no hydrogen 2.836 N/A LYS 751.A N VAL 711.A O no hydrogen 2.895 N/A LYS 751.A NZ GLN 713.A O no hydrogen 3.364 N/A LYS 751.A NZ VAL 715.A O no hydrogen 2.883 N/A SER 752.A N TYR 741.A O no hydrogen 2.810 N/A LEU 753.A N LEU 709.A O no hydrogen 2.790 N/A ALA 754.A N ASP 739.A O no hydrogen 2.825 N/A VAL 755.A N LEU 707.A O no hydrogen 2.964 N/A GLY 756.A N ARG 736.A O no hydrogen 2.785 N/A LEU 757.A N ARG 705.A O no hydrogen 2.777 N/A THR 758.A N ASP 734.A O no hydrogen 2.798 N/A TRP 759.A N VAL 703.A O no hydrogen 2.781 N/A TRP 759.A NE1 ALA 728.A O no hydrogen 3.035 N/A GLN 760.A N TRP 731.A O no hydrogen 2.988 N/A ARG 764.A NH1 THR 765.A O no hydrogen 3.064 N/A ARG 764.A NH1 GLU 770.A OE1 no hydrogen 2.763 N/A ARG 764.A NH1 GLU 770.A OE2 no hydrogen 3.478 N/A ARG 764.A NH2 GLU 770.A OE2 no hydrogen 3.212 N/A ASN 767.A N GLU 770.A OE1 no hydrogen 2.799 N/A GLU 770.A N ASN 767.A OD1 no hydrogen 2.868 N/A VAL 771.A N ASN 767.A O no hydrogen 3.402 N/A ASN 772.A N ASP 768.A O no hydrogen 2.797 N/A SER 773.A N ASP 769.A O no hydrogen 2.903 N/A THR 774.A N GLU 770.A O no hydrogen 2.878 N/A THR 774.A OG1 GLU 770.A O no hydrogen 3.184 N/A THR 775.A N VAL 771.A O no hydrogen 3.001 N/A THR 775.A OG1 VAL 771.A O no hydrogen 2.928 N/A GLN 776.A N ASN 772.A O no hydrogen 3.036 N/A GLN 776.A NE2 THR 780.A OG1 no hydrogen 2.980 N/A ASN 777.A N SER 773.A O no hydrogen 3.123 N/A ASN 777.A ND2 ALA 727.A O no hydrogen 2.973 N/A ASN 777.A ND2 THR 774.A O no hydrogen 3.579 N/A ILE 778.A N THR 774.A O no hydrogen 2.986 N/A VAL 779.A N THR 775.A O no hydrogen 3.025 N/A THR 780.A N GLN 776.A O no hydrogen 2.874 N/A THR 780.A OG1 GLN 776.A O no hydrogen 2.810 N/A SER 781.A N ASN 777.A O no hydrogen 3.019 N/A LEU 782.A N ILE 778.A O no hydrogen 3.106 N/A GLU 783.A N VAL 779.A O no hydrogen 2.868 N/A GLU 784.A N THR 780.A O no hydrogen 3.093 N/A ARG 785.A N SER 781.A O no hydrogen 3.005 N/A PHE 786.A N LEU 782.A O no hydrogen 3.078 N/A ALA 788.A N LEU 782.A O no hydrogen 3.228 N/A THR 789.A N LEU 710.A O no hydrogen 3.152 N/A ARG 791.A N ALA 708.A O no hydrogen 3.400 N/A