Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 8cro_B.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): THR 3.A N ASP 6.A OD2 no hydrogen 3.072 N/A THR 3.A OG1 ASP 6.A OD2 no hydrogen 3.332 N/A ASP 6.A N THR 3.A O no hydrogen 2.857 N/A LEU 7.A N THR 3.A O no hydrogen 3.228 N/A TRP 8.A N PRO 4.A O no hydrogen 2.948 N/A MET 11.A N LEU 7.A O no hydrogen 2.999 N/A GLU 12.A N TRP 8.A O no hydrogen 2.855 N/A SER 13.A N ILE 9.A O no hydrogen 2.903 N/A SER 13.A OG VAL 10.A O no hydrogen 2.712 N/A TYR 14.A N VAL 10.A O no hydrogen 2.920 N/A TYR 14.A OH ALA 477.A O no hydrogen 3.361 N/A TRP 15.A N MET 11.A O no hydrogen 2.995 N/A TRP 15.A NE1 LEU 475.A O no hydrogen 2.873 N/A GLN 16.A N GLU 12.A O no hydrogen 2.844 N/A GLU 17.A N SER 13.A O no hydrogen 2.923 N/A LYS 18.A N TYR 14.A O no hydrogen 3.192 N/A GLN 23.A N GLN 23.A OE1 no hydrogen 3.006 N/A LEU 25.A N VAL 21.A O no hydrogen 3.302 N/A ASP 26.A N ARG 22.A O no hydrogen 2.869 N/A SER 27.A N GLN 23.A O no hydrogen 2.956 N/A SER 27.A OG HIS 24.A O no hydrogen 3.214 N/A TYR 28.A N HIS 24.A O no hydrogen 2.920 N/A ASN 29.A N LEU 25.A O no hydrogen 2.867 N/A ALA 30.A N ASP 26.A O no hydrogen 2.935 N/A PHE 31.A N SER 27.A O no hydrogen 2.899 N/A ILE 32.A N TYR 28.A O no hydrogen 2.904 N/A GLU 33.A N ASN 29.A O no hydrogen 2.896 N/A ARG 34.A N ALA 30.A O no hydrogen 3.032 N/A GLY 35.A N ALA 30.A O no hydrogen 3.240 N/A LEU 36.A N PHE 31.A O no hydrogen 2.954 N/A GLN 37.A NE2 ASN 41.A OD1 no hydrogen 3.610 N/A GLN 37.A NE2 GLY 58.A O no hydrogen 3.165 N/A GLU 38.A N ARG 34.A O no hydrogen 2.834 N/A VAL 39.A N GLY 35.A O no hydrogen 2.920 N/A VAL 40.A N LEU 36.A O no hydrogen 2.954 N/A ASN 41.A N GLN 37.A O no hydrogen 2.862 N/A GLU 42.A N GLU 38.A O no hydrogen 2.942 N/A PHE 43.A N VAL 39.A O no hydrogen 2.950 N/A ASP 49.A N THR 365.A OG1 no hydrogen 3.187 N/A GLU 54.A N VAL 100.A O no hydrogen 3.213 N/A VAL 55.A N ILE 46.A O no hydrogen 3.061 N/A LYS 56.A N ILE 98.A O no hydrogen 2.547 N/A LYS 56.A NZ GLU 54.A OE2 no hydrogen 3.238 N/A GLY 58.A N GLU 96.A O no hydrogen 2.464 N/A LYS 59.A N GLU 96.A OE1 no hydrogen 3.399 N/A ILE 60.A N GLN 37.A OE1 no hydrogen 2.886 N/A ARG 61.A N TYR 94.A O no hydrogen 2.830 N/A ARG 61.A NH2 GLU 110.A OE2 no hydrogen 2.351 N/A GLY 63.A N PRO 92.A O no hydrogen 2.983 N/A PHE 67.A N LYS 75.A O no hydrogen 3.133 N/A GLN 68.A NE2 GLY 72.A O no hydrogen 3.664 N/A GLU 69.A N GLN 73.A O no hydrogen 3.332 N/A ARG 74.A NH2 GLU 115.A OE1 no hydrogen 3.073 N/A LYS 75.A N PHE 67.A O no hydrogen 3.225 N/A LEU 77.A N PRO 65.A O no hydrogen 3.033 N/A ALA 82.A N TYR 78.A O no hydrogen 2.933 N/A ARG 83.A N PRO 79.A O no hydrogen 2.904 N/A ARG 83.A NH1 GLU 140.A OE2 no hydrogen 3.396 N/A ARG 85.A N ASP 81.A O no hydrogen 3.041 N/A ARG 85.A NH2 GLU 69.A OE2 no hydrogen 3.146 N/A ASN 86.A ND2 GLU 749.A OE1 no hydrogen 3.016 N/A LEU 87.A N ALA 82.A O no hydrogen 2.889 N/A THR 88.A OG1 ASN 152.A OD1 no hydrogen 3.290 N/A TYR 89.A N ILE 150.A O no hydrogen 2.993 N/A ALA 91.A N LEU 116.A O no hydrogen 3.001 N/A LEU 93.A N GLY 114.A O no hydrogen 2.794 N/A TYR 94.A N ARG 61.A O no hydrogen 2.707 N/A LEU 95.A N VAL 111.A O no hydrogen 3.057 N/A MET 97.A N VAL 109.A O no hydrogen 2.965 N/A ILE 98.A N LYS 56.A O no hydrogen 2.644 N/A VAL 100.A N GLU 54.A O no hydrogen 2.427 N/A ILE 101.A N VAL 104.A O no hydrogen 2.785 N/A LYS 102.A N ASP 52.A O no hydrogen 3.154 N/A LYS 102.A NZ LYS 102.A O no hydrogen 2.810 N/A VAL 104.A N ILE 101.A O no hydrogen 3.146 N/A GLN 106.A N PRO 99.A O no hydrogen 3.163 N/A VAL 109.A N MET 97.A O no hydrogen 3.271 N/A VAL 111.A N LEU 95.A O no hydrogen 3.311 N/A ILE 113.A N LEU 93.A O no hydrogen 2.961 N/A LEU 116.A N ALA 91.A O no hydrogen 2.959 N/A ILE 118.A N TYR 89.A O no hydrogen 2.844 N/A LEU 120.A N TYR 148.A O no hydrogen 2.797 N/A LYS 121.A NZ ASP 144.A O no hydrogen 2.869 N/A SER 122.A N MET 119.A O no hydrogen 3.347 N/A SER 122.A OG MET 119.A O no hydrogen 2.665 N/A LYS 123.A N ASN 29.A OD1 no hydrogen 3.123 N/A LYS 123.A NZ GLU 33.A OE2 no hydrogen 2.382 N/A CYS 125.A N SER 122.A O no hydrogen 3.182 N/A CYS 125.A SG TYR 89.A OH no hydrogen 3.522 N/A ARG 126.A N TYR 89.A OH no hydrogen 3.224 N/A ARG 126.A NE PRO 65.A O no hydrogen 3.307 N/A ARG 126.A NH2 PRO 65.A O no hydrogen 3.205 N/A LEU 135.A N SER 131.A O no hydrogen 3.047 N/A ILE 136.A N ASP 132.A O no hydrogen 2.903 N/A LYS 137.A N GLU 133.A O no hydrogen 2.888 N/A LEU 138.A N GLU 134.A O no hydrogen 3.194 N/A GLY 139.A N ILE 136.A O no hydrogen 2.870 N/A GLU 140.A N LEU 135.A O no hydrogen 3.011 N/A LYS 143.A N ASP 141.A OD1 no hydrogen 3.340 N/A LYS 143.A NZ ASP 705.A OD2 no hydrogen 3.316 N/A ASP 144.A N ASP 141.A O no hydrogen 3.055 N/A GLY 146.A N ASP 144.A OD2 no hydrogen 3.103 N/A GLY 147.A N LEU 120.A O no hydrogen 2.929 N/A TYR 148.A OH ASP 144.A OD1 no hydrogen 3.032 N/A TYR 148.A OH ASP 144.A OD2 no hydrogen 2.828 N/A PHE 149.A N ARG 156.A O no hydrogen 2.869 N/A ILE 151.A N SER 154.A O no hydrogen 2.854 N/A ASN 152.A N THR 88.A OG1 no hydrogen 2.732 N/A ASN 152.A ND2 GLU 398.A OE2 no hydrogen 3.195 N/A GLY 153.A N LEU 87.A O no hydrogen 2.675 N/A SER 154.A N ILE 151.A O no hydrogen 3.120 N/A SER 154.A OG ILE 151.A O no hydrogen 2.923 N/A ARG 156.A N PHE 149.A O no hydrogen 2.811 N/A ARG 156.A NE SER 414.A OG no hydrogen 3.092 N/A ARG 156.A NH2 SER 414.A O no hydrogen 2.746 N/A VAL 157.A N GLN 415.A O no hydrogen 2.859 N/A VAL 159.A N VAL 413.A O no hydrogen 3.042 N/A ILE 161.A N ARG 339.A O no hydrogen 3.144 N/A GLU 162.A N THR 433.A O no hydrogen 2.628 N/A ALA 165.A N ASN 335.A O no hydrogen 2.661 N/A ASN 167.A N PHE 185.A O no hydrogen 2.905 N/A ARG 168.A NH1 GLU 609.A OE2 no hydrogen 2.333 N/A LEU 170.A N LYS 183.A O no hydrogen 3.041 N/A VAL 171.A N ASP 328.A OD2 no hydrogen 3.165 N/A GLU 172.A N ILE 181.A O no hydrogen 2.966 N/A LYS 173.A N GLU 327.A OE2 no hydrogen 2.707 N/A ASP 174.A N LYS 179.A O no hydrogen 3.257 N/A LYS 179.A NZ GLU 198.A OE2 no hydrogen 3.307 N/A TYR 180.A N ARG 199.A O no hydrogen 3.064 N/A ILE 181.A N GLU 172.A O no hydrogen 3.006 N/A ALA 182.A N VAL 197.A O no hydrogen 3.237 N/A LYS 183.A N LEU 170.A O no hydrogen 3.171 N/A LYS 183.A NZ GLU 172.A OE2 no hydrogen 3.193 N/A VAL 184.A N VAL 195.A O no hydrogen 2.905 N/A SER 186.A N ALA 193.A O no hydrogen 2.922 N/A SER 186.A OG HIS 295.A ND1 no hydrogen 2.663 N/A TYR 187.A N ASN 167.A OD1 no hydrogen 3.080 N/A ARG 188.A N TYR 191.A O no hydrogen 3.031 N/A TYR 191.A N ARG 188.A O no hydrogen 3.207 N/A ARG 192.A NE TYR 187.A OH no hydrogen 3.315 N/A ALA 193.A N SER 186.A O no hydrogen 2.812 N/A VAL 195.A N VAL 184.A O no hydrogen 3.179 N/A ALA 196.A N ASP 208.A O no hydrogen 3.297 N/A VAL 197.A N ALA 182.A O no hydrogen 2.998 N/A ARG 199.A N TYR 180.A O no hydrogen 3.161 N/A ARG 200.A N ILE 204.A O no hydrogen 3.144 N/A GLY 203.A N ARG 200.A O no hydrogen 3.044 N/A ILE 204.A N ASP 202.A OD1 no hydrogen 3.144 N/A TYR 206.A N GLU 198.A O no hydrogen 2.565 N/A VAL 207.A N VAL 216.A O no hydrogen 2.669 N/A ASP 208.A N ALA 196.A O no hydrogen 2.670 N/A VAL 212.A N ILE 209.A O no hydrogen 3.147 N/A VAL 216.A N VAL 207.A O no hydrogen 2.978 N/A PHE 218.A N LEU 205.A O no hydrogen 2.751 N/A VAL 221.A N LYS 217.A O no hydrogen 3.428 N/A MET 222.A N PHE 218.A O no hydrogen 2.910 N/A ARG 223.A N VAL 219.A O no hydrogen 2.906 N/A ARG 223.A NH1 ASP 230.A OD2 no hydrogen 2.399 N/A ARG 223.A NH2 GLU 228.A O no hydrogen 2.759 N/A ARG 223.A NH2 ASP 230.A OD1 no hydrogen 2.595 N/A ALA 224.A N TYR 220.A O no hydrogen 2.885 N/A LEU 225.A N VAL 221.A O no hydrogen 2.923 N/A GLY 226.A N ARG 223.A O no hydrogen 3.234 N/A LEU 227.A N MET 222.A O no hydrogen 3.412 N/A ILE 233.A N ARG 229.A O no hydrogen 3.220 N/A VAL 234.A N ASP 230.A O no hydrogen 2.955 N/A GLU 235.A N LYS 231.A O no hydrogen 2.896 N/A ALA 236.A N ASP 232.A O no hydrogen 2.862 N/A VAL 237.A N ILE 233.A O no hydrogen 2.956 N/A GLY 238.A N VAL 234.A O no hydrogen 3.367 N/A ASN 239.A ND2 GLU 235.A OE2 no hydrogen 3.181 N/A VAL 243.A N ASP 240.A OD2 no hydrogen 2.948 N/A GLN 244.A N ASP 240.A O no hydrogen 2.648 N/A GLN 245.A N PRO 241.A O no hydrogen 2.891 N/A ILE 246.A N GLU 242.A O no hydrogen 2.951 N/A MET 247.A N VAL 243.A O no hydrogen 2.909 N/A PHE 248.A N GLN 244.A O no hydrogen 2.901 N/A ASP 249.A N GLN 245.A O no hydrogen 2.936 N/A ASN 250.A N ILE 246.A O no hydrogen 2.890 N/A ASN 250.A ND2 GLY 203.A O no hydrogen 2.958 N/A ASN 250.A ND2 ILE 246.A O no hydrogen 2.710 N/A LEU 251.A N MET 247.A O no hydrogen 2.860 N/A LEU 251.A N PHE 248.A O no hydrogen 3.273 N/A GLU 252.A N PHE 248.A O no hydrogen 2.933 N/A ALA 254.A N LEU 251.A O no hydrogen 3.260 N/A SER 255.A N LEU 251.A O no hydrogen 2.862 N/A SER 255.A OG ASP 230.A OD2 no hydrogen 3.326 N/A ASP 256.A N GLU 252.A O no hydrogen 2.943 N/A ILE 257.A N ALA 254.A O no hydrogen 3.087 N/A THR 258.A N ALA 254.A O no hydrogen 2.674 N/A GLN 260.A N THR 259.A OG1 no hydrogen 2.665 N/A GLN 260.A NE2 ARG 223.A O no hydrogen 2.731 N/A ALA 263.A N THR 259.A O no hydrogen 3.250 N/A ALA 263.A N GLN 260.A O no hydrogen 3.431 N/A PHE 266.A N GLU 262.A O no hydrogen 2.896 N/A ILE 267.A N ALA 263.A O no hydrogen 2.933 N/A GLY 268.A N LEU 264.A O no hydrogen 2.888 N/A LYS 269.A N GLU 265.A O no hydrogen 2.937 N/A LYS 269.A N PHE 266.A O no hydrogen 3.244 N/A VAL 271.A N ILE 267.A O no hydrogen 2.911 N/A ALA 272.A N GLY 268.A O no hydrogen 2.780 N/A ARG 277.A NH2 GLU 265.A O no hydrogen 2.783 N/A ARG 280.A N ALA 276.A O no hydrogen 2.781 N/A ARG 280.A NH2 GLN 275.A O no hydrogen 2.744 N/A LEU 281.A N ARG 277.A O no hydrogen 2.911 N/A LYS 282.A N GLU 278.A O no hydrogen 2.909 N/A LYS 282.A NZ GLU 285.A OE2 no hydrogen 3.477 N/A ARG 283.A N TYR 279.A O no hydrogen 2.897 N/A ALA 284.A N ARG 280.A O no hydrogen 2.903 N/A GLU 285.A N LEU 281.A O no hydrogen 2.937 N/A TYR 286.A N LYS 282.A O no hydrogen 2.889 N/A VAL 287.A N ARG 283.A O no hydrogen 2.931 N/A ILE 288.A N ALA 284.A O no hydrogen 2.915 N/A ASP 289.A N GLU 285.A O no hydrogen 2.899 N/A ASN 290.A N TYR 286.A O no hydrogen 2.890 N/A ASN 291.A N VAL 287.A O no hydrogen 3.097 N/A HIS 295.A ND1 SER 186.A OG no hydrogen 2.663 N/A MET 296.A N LEU 293.A O no hydrogen 3.188 N/A GLY 297.A N PRO 294.A O no hydrogen 3.002 N/A SER 299.A N ASP 302.A OD2 no hydrogen 2.937 N/A SER 299.A OG ASP 302.A OD2 no hydrogen 2.485 N/A ASP 302.A N SER 299.A O no hydrogen 2.981 N/A ARG 303.A N PRO 300.A O no hydrogen 3.195 N/A LYS 306.A N ASP 302.A O no hydrogen 3.104 N/A LYS 306.A NZ ILE 288.A O no hydrogen 3.165 N/A LYS 306.A NZ ASP 289.A O no hydrogen 2.684 N/A LYS 306.A NZ LEU 292.A O no hydrogen 2.908 N/A LYS 306.A NZ LEU 293.A O no hydrogen 3.450 N/A LYS 306.A NZ GLY 297.A O no hydrogen 2.812 N/A ALA 307.A N ARG 303.A O no hydrogen 3.062 N/A TYR 308.A N ILE 304.A O no hydrogen 2.971 N/A TYR 309.A N LYS 305.A O no hydrogen 2.937 N/A TYR 309.A OH ASN 167.A O no hydrogen 2.638 N/A LEU 310.A N LYS 306.A O no hydrogen 2.884 N/A GLY 311.A N ALA 307.A O no hydrogen 2.877 N/A MET 312.A N TYR 308.A O no hydrogen 2.934 N/A MET 313.A N TYR 309.A O no hydrogen 2.941 N/A ALA 314.A N LEU 310.A O no hydrogen 2.887 N/A LEU 315.A N GLY 311.A O no hydrogen 2.863 N/A LYS 316.A N MET 312.A O no hydrogen 2.940 N/A LYS 316.A NZ THR 169.A O no hydrogen 2.944 N/A LYS 316.A NZ ASP 328.A OD2 no hydrogen 3.464 N/A VAL 317.A N MET 313.A O no hydrogen 2.957 N/A ILE 318.A N ALA 314.A O no hydrogen 2.873 N/A GLU 319.A N LEU 315.A O no hydrogen 2.902 N/A LEU 320.A N LYS 316.A O no hydrogen 2.947 N/A SER 321.A N VAL 317.A O no hydrogen 2.913 N/A SER 321.A OG VAL 317.A O no hydrogen 2.654 N/A LEU 322.A N ILE 318.A O no hydrogen 2.887 N/A GLY 323.A N LEU 320.A O no hydrogen 3.123 N/A ARG 324.A N GLU 319.A O no hydrogen 3.076 N/A ARG 324.A NE GLU 319.A OE2 no hydrogen 2.796 N/A ARG 325.A NH2 GLU 555.A OE2 no hydrogen 3.239 N/A ASP 328.A N VAL 171.A O no hydrogen 2.870 N/A ASP 331.A N ASP 329.A OD1 no hydrogen 3.035 N/A ALA 334.A N HIS 332.A ND1 no hydrogen 2.921 N/A ASN 335.A N HIS 332.A O no hydrogen 2.950 N/A ASN 335.A ND2 ASP 329.A O no hydrogen 2.394 N/A LYS 336.A NZ GLU 162.A OE1 no hydrogen 2.984 N/A ARG 337.A N ASP 163.A O no hydrogen 3.159 N/A ARG 337.A NE ASP 561.A OD2 no hydrogen 3.319 N/A ARG 337.A NH1 ALA 334.A O no hydrogen 3.417 N/A ARG 337.A NH1 LYS 336.A O no hydrogen 3.000 N/A ARG 337.A NH2 ALA 334.A O no hydrogen 2.985 N/A LEU 338.A N GLY 563.A O no hydrogen 2.707 N/A ARG 339.A N ILE 161.A O no hydrogen 2.897 N/A LEU 340.A N ASP 343.A OD2 no hydrogen 2.520 N/A GLY 342.A N SER 27.A OG no hydrogen 2.572 N/A LEU 344.A N LEU 340.A O no hydrogen 3.110 N/A LEU 345.A N ALA 341.A O no hydrogen 2.890 N/A LYS 346.A N GLY 342.A O no hydrogen 2.870 N/A LYS 346.A NZ GLU 38.A OE1 no hydrogen 3.396 N/A ASP 347.A N ASP 343.A O no hydrogen 2.942 N/A LEU 348.A N LEU 344.A O no hydrogen 2.954 N/A PHE 349.A N LEU 345.A O no hydrogen 2.824 N/A ARG 350.A N LYS 346.A O no hydrogen 2.883 N/A ARG 350.A NE GLU 42.A OE1 no hydrogen 2.582 N/A ARG 350.A NH1 ASP 347.A OD1 no hydrogen 3.537 N/A ARG 350.A NH2 GLU 42.A OE1 no hydrogen 3.106 N/A ARG 350.A NH2 GLU 42.A OE2 no hydrogen 2.429 N/A VAL 351.A N ASP 347.A O no hydrogen 3.004 N/A ALA 352.A N LEU 348.A O no hydrogen 2.951 N/A PHE 353.A N PHE 349.A O no hydrogen 2.825 N/A SER 354.A N ARG 350.A O no hydrogen 2.926 N/A GLN 355.A N VAL 351.A O no hydrogen 3.018 N/A LEU 356.A N ALA 352.A O no hydrogen 2.925 N/A VAL 357.A N PHE 353.A O no hydrogen 2.852 N/A LYS 358.A N SER 354.A O no hydrogen 2.997 N/A ASP 359.A N GLN 355.A O no hydrogen 2.944 N/A ILE 360.A N LEU 356.A O no hydrogen 2.876 N/A GLN 361.A N VAL 357.A O no hydrogen 2.947 N/A TYR 362.A N LYS 358.A O no hydrogen 2.988 N/A GLN 363.A N ASP 359.A O no hydrogen 2.904 N/A MET 364.A N ILE 360.A O no hydrogen 2.878 N/A THR 365.A N GLN 361.A O no hydrogen 3.010 N/A THR 365.A OG1 GLN 361.A O no hydrogen 3.396 N/A LYS 366.A N TYR 362.A O no hydrogen 2.932 N/A LYS 366.A NZ GLN 363.A OE1 no hydrogen 3.503 N/A THR 367.A N GLN 363.A O no hydrogen 2.913 N/A THR 367.A OG1 GLN 363.A O no hydrogen 3.250 N/A TYR 368.A N MET 364.A O no hydrogen 2.938 N/A GLN 369.A N THR 365.A O no hydrogen 2.952 N/A ARG 370.A N LYS 366.A O no hydrogen 2.910 N/A LYS 371.A N THR 367.A O no hydrogen 2.924 N/A ASN 379.A N TYR 375.A O no hydrogen 2.897 N/A ILE 384.A N ILE 380.A O no hydrogen 2.924 N/A ARG 385.A N HIS 381.A O no hydrogen 2.901 N/A ASN 386.A N ARG 382.A O no hydrogen 2.903 N/A SER 387.A N ILE 384.A O no hydrogen 3.239 N/A ILE 388.A N ARG 385.A O no hydrogen 3.338 N/A ARG 389.A NH2 GLN 363.A OE1 no hydrogen 2.691 N/A GLU 395.A N ASP 391.A O no hydrogen 2.912 N/A ARG 396.A N VAL 392.A O no hydrogen 2.949 N/A ILE 397.A N LEU 393.A O no hydrogen 2.947 N/A GLU 398.A N THR 394.A O no hydrogen 2.888 N/A HIS 399.A N GLU 395.A O no hydrogen 2.886 N/A ALA 400.A N ARG 396.A O no hydrogen 2.956 N/A LEU 401.A N ILE 397.A O no hydrogen 2.939 N/A ALA 402.A N GLU 398.A O no hydrogen 2.874 N/A THR 403.A N HIS 399.A O no hydrogen 2.923 N/A THR 403.A OG1 HIS 399.A O no hydrogen 2.848 N/A GLY 404.A N ALA 400.A O no hydrogen 2.867 N/A TRP 406.A NE1 LEU 344.A O no hydrogen 3.037 N/A THR 411.A OG1 GLY 409.A O no hydrogen 3.049 N/A VAL 413.A N GLY 404.A O no hydrogen 3.168 N/A SER 414.A OG LEU 401.A O no hydrogen 2.754 N/A GLN 415.A N VAL 157.A O no hydrogen 2.879 N/A GLN 415.A NE2 GLY 412.A O no hydrogen 3.254 N/A LEU 417.A N GLU 155.A O no hydrogen 2.987 N/A ASP 418.A N HIS 428.A ND1 no hydrogen 3.356 N/A ARG 419.A NE GLU 155.A OE1 no hydrogen 2.878 N/A ARG 419.A NH2 GLU 155.A OE1 no hydrogen 2.826 N/A ASN 421.A N SER 424.A OG no hydrogen 3.428 N/A ASN 421.A ND2 SER 666.A O no hydrogen 2.491 N/A SER 424.A N ASN 421.A OD1 no hydrogen 2.968 N/A SER 424.A OG ASP 418.A O no hydrogen 3.359 N/A SER 424.A OG ASP 418.A OD2 no hydrogen 3.549 N/A SER 424.A OG ASN 421.A O no hydrogen 3.188 N/A THR 425.A N ASN 421.A O no hydrogen 3.258 N/A THR 425.A OG1 ASP 418.A O no hydrogen 2.515 N/A THR 425.A OG1 ASN 421.A O no hydrogen 3.098 N/A LEU 426.A N TYR 422.A O no hydrogen 2.999 N/A SER 427.A N MET 423.A O no hydrogen 2.880 N/A SER 427.A OG MET 423.A O no hydrogen 2.472 N/A SER 427.A OG SER 424.A O no hydrogen 2.859 N/A HIS 428.A N SER 424.A O no hydrogen 2.901 N/A HIS 428.A NE2 GLN 415.A OE1 no hydrogen 3.147 N/A LEU 429.A N THR 425.A O no hydrogen 2.947 N/A ARG 430.A N SER 427.A O no hydrogen 3.050 N/A ARG 430.A NH1 LEU 20.A O no hydrogen 2.961 N/A VAL 432.A N LYS 471.A O no hydrogen 2.518 N/A THR 433.A N SER 160.A O no hydrogen 3.005 N/A THR 433.A OG1 SER 160.A O no hydrogen 2.936 N/A SER 434.A N LEU 469.A O no hydrogen 2.977 N/A ARG 438.A NE LEU 436.A O no hydrogen 3.144 N/A ARG 438.A NH1 ASN 466.A OD1 no hydrogen 2.611 N/A HIS 442.A N GLN 440.A O no hydrogen 3.080 N/A HIS 442.A NE2 ASP 437.A O no hydrogen 2.731 N/A ALA 445.A N HIS 442.A O no hydrogen 3.136 N/A ARG 446.A N HIS 442.A O no hydrogen 2.818 N/A ARG 446.A NH1 PRO 465.A O no hydrogen 2.803 N/A ARG 446.A NH2 GLN 440.A O no hydrogen 3.555 N/A ARG 446.A NH2 PRO 465.A O no hydrogen 2.646 N/A HIS 449.A NE2 ASP 329.A OD2 no hydrogen 2.655 N/A THR 451.A OG1 HIS 449.A ND1 no hydrogen 2.923 N/A HIS 452.A N HIS 449.A O no hydrogen 3.167 N/A TRP 453.A NE1 GLU 631.A OE2 no hydrogen 2.643 N/A ARG 455.A N HIS 452.A O no hydrogen 2.930 N/A ARG 455.A NE VAL 565.A O no hydrogen 3.253 N/A ARG 455.A NH1 THR 451.A O no hydrogen 2.961 N/A ARG 455.A NH2 LEU 606.A O no hydrogen 3.206 N/A ARG 455.A NH2 GLU 611.A OE1 no hydrogen 2.308 N/A ILE 456.A N HIS 452.A O no hydrogen 2.954 N/A CYS 457.A N ASN 472.A O no hydrogen 2.789 N/A CYS 457.A SG THR 459.A OG1 no hydrogen 3.759 N/A THR 461.A OG1 VAL 470.A O no hydrogen 3.359 N/A CYS 467.A N GLY 464.A O no hydrogen 3.214 N/A GLY 468.A N THR 461.A OG1 no hydrogen 3.003 N/A LEU 469.A N ASN 466.A O no hydrogen 3.074 N/A VAL 470.A N ASN 466.A O no hydrogen 3.106 N/A LYS 471.A N VAL 432.A O no hydrogen 2.650 N/A LYS 471.A NZ GLU 162.A OE2 no hydrogen 3.386 N/A LYS 471.A NZ GLY 468.A O no hydrogen 2.976 N/A LEU 473.A N ARG 430.A O no hydrogen 3.031 N/A ALA 474.A N ARG 455.A O no hydrogen 3.369 N/A LEU 475.A N LEU 638.A O no hydrogen 3.054 N/A MET 476.A N ALA 636.A O no hydrogen 3.355 N/A ALA 477.A N ALA 474.A O no hydrogen 3.038 N/A GLN 478.A N ARG 566.A O no hydrogen 2.730 N/A THR 480.A N ARG 564.A O no hydrogen 3.099 N/A THR 480.A OG1 ASP 561.A O no hydrogen 3.180 N/A GLU 486.A N GLU 486.A OE1 no hydrogen 2.792 N/A ARG 489.A N GLU 485.A O no hydrogen 2.792 N/A GLU 490.A N GLU 486.A O no hydrogen 2.903 N/A TYR 491.A N GLU 487.A O no hydrogen 2.924 N/A TYR 491.A OH ASP 535.A OD2 no hydrogen 2.318 N/A LEU 492.A N ILE 488.A O no hydrogen 2.908 N/A MET 493.A N ARG 489.A O no hydrogen 2.907 N/A SER 494.A N GLU 490.A O no hydrogen 2.897 N/A SER 494.A OG TYR 491.A O no hydrogen 2.783 N/A LEU 495.A N TYR 491.A O no hydrogen 2.948 N/A LEU 495.A N LEU 492.A O no hydrogen 3.072 N/A GLY 496.A N MET 493.A O no hydrogen 3.307 N/A VAL 498.A N THR 521.A O no hydrogen 3.292 N/A GLU 501.A N GLU 501.A OE2 no hydrogen 2.310 N/A VAL 502.A N PRO 499.A O no hydrogen 3.146 N/A ARG 503.A N PRO 499.A O no hydrogen 3.314 N/A ARG 503.A NH1 GLU 523.A OE1 no hydrogen 3.051 N/A ARG 503.A NH2 THR 521.A O no hydrogen 3.179 N/A ARG 503.A NH2 GLU 523.A OE2 no hydrogen 2.391 N/A THR 508.A OG1 THR 508.A O no hydrogen 2.494 N/A LEU 509.A N ASP 506.A O no hydrogen 3.066 N/A TRP 510.A N ILE 522.A O no hydrogen 2.815 N/A ARG 511.A N LYS 554.A O no hydrogen 3.199 N/A ARG 511.A NE TYR 513.A OH no hydrogen 2.690 N/A ARG 511.A NH2 GLU 555.A OE2 no hydrogen 2.456 N/A VAL 512.A N GLY 520.A O no hydrogen 3.376 N/A TYR 513.A N VAL 556.A O no hydrogen 2.723 N/A TYR 513.A OH GLU 555.A OE2 no hydrogen 3.079 N/A LEU 514.A N VAL 517.A O no hydrogen 2.732 N/A ASN 515.A N VAL 558.A O no hydrogen 2.574 N/A VAL 517.A N LEU 514.A O no hydrogen 3.024 N/A ILE 519.A N VAL 512.A O no hydrogen 3.046 N/A THR 521.A N VAL 498.A O no hydrogen 3.023 N/A ILE 522.A N TRP 510.A O no hydrogen 3.172 N/A LYS 526.A NZ TYR 549.A OH no hydrogen 3.498 N/A ALA 527.A N ASP 524.A OD1 no hydrogen 3.307 N/A LEU 528.A N ASP 524.A O no hydrogen 3.399 N/A VAL 529.A N GLY 525.A O no hydrogen 2.923 N/A GLN 530.A N LYS 526.A O no hydrogen 2.899 N/A ARG 531.A N ALA 527.A O no hydrogen 2.893 N/A ILE 532.A N LEU 528.A O no hydrogen 2.902 N/A ARG 533.A N VAL 529.A O no hydrogen 2.974 N/A ARG 533.A NH2 VAL 547.A O no hydrogen 2.662 N/A GLN 534.A N GLN 530.A O no hydrogen 2.905 N/A ASP 535.A N ARG 531.A O no hydrogen 2.886 N/A ARG 536.A N ILE 532.A O no hydrogen 2.907 N/A ARG 536.A NH1 ILE 545.A O no hydrogen 2.835 N/A ARG 536.A NH1 GLU 610.A OE1 no hydrogen 3.190 N/A ARG 536.A NH2 GLU 604.A OE2 no hydrogen 2.426 N/A ARG 536.A NH2 GLU 610.A OE2 no hydrogen 3.133 N/A ARG 537.A N ARG 533.A O no hydrogen 2.909 N/A ARG 537.A NE GLU 604.A OE2 no hydrogen 3.284 N/A ARG 537.A NH2 GLU 604.A OE2 no hydrogen 3.479 N/A SER 538.A N GLN 534.A O no hydrogen 2.907 N/A SER 538.A OG GLN 534.A O no hydrogen 2.360 N/A GLY 539.A N ASP 535.A O no hydrogen 3.183 N/A GLY 539.A N ARG 536.A O no hydrogen 3.181 N/A ILE 545.A N SER 542.A O no hydrogen 3.482 N/A ASN 546.A N ASN 559.A O no hydrogen 3.009 N/A ASN 546.A ND2 TYR 605.A O no hydrogen 2.888 N/A ASN 546.A ND2 GLU 610.A OE1 no hydrogen 2.404 N/A VAL 547.A N GLU 610.A OE1 no hydrogen 3.046 N/A ALA 548.A N TYR 557.A O no hydrogen 2.911 N/A TYR 549.A N ASN 613.A OD1 no hydrogen 2.723 N/A TYR 550.A N GLU 555.A O no hydrogen 2.887 N/A GLU 555.A N TYR 550.A O no hydrogen 3.362 N/A VAL 556.A N ARG 511.A O no hydrogen 2.949 N/A TYR 557.A N ALA 548.A O no hydrogen 2.715 N/A TYR 557.A OH GLU 555.A OE1 no hydrogen 2.217 N/A VAL 558.A N TYR 513.A O no hydrogen 2.659 N/A ASN 559.A N ASN 546.A O no hydrogen 2.742 N/A ASN 559.A ND2 GLU 609.A OE1 no hydrogen 2.293 N/A SER 560.A N ASN 515.A OD1 no hydrogen 3.335 N/A GLY 563.A N THR 480.A O no hydrogen 3.397 N/A ARG 564.A N THR 480.A OG1 no hydrogen 3.264 N/A ARG 564.A NH1 ASN 546.A OD1 no hydrogen 3.309 N/A ARG 564.A NH2 VAL 544.A O no hydrogen 2.708 N/A ARG 566.A N GLN 478.A O no hydrogen 2.691 N/A ARG 566.A NE GLN 478.A OE1 no hydrogen 3.164 N/A ARG 566.A NH1 ASP 543.A O no hydrogen 2.951 N/A ARG 566.A NH1 ASN 546.A OD1 no hydrogen 2.710 N/A ARG 566.A NH2 GLN 478.A OE1 no hydrogen 3.129 N/A ARG 566.A NH2 ASP 543.A OD1 no hydrogen 2.315 N/A ARG 567.A N LEU 606.A O no hydrogen 3.118 N/A ARG 567.A NE GLU 611.A OE1 no hydrogen 2.776 N/A ARG 567.A NE GLU 611.A OE2 no hydrogen 2.712 N/A ARG 567.A NH1 GLU 631.A OE1 no hydrogen 3.230 N/A ARG 567.A NH1 GLU 631.A OE2 no hydrogen 2.540 N/A ARG 567.A NH2 GLU 611.A OE2 no hydrogen 2.544 N/A ARG 567.A NH2 GLU 631.A OE2 no hydrogen 2.767 N/A LEU 569.A N GLU 604.A O no hydrogen 2.740 N/A ILE 570.A N LEU 630.A O no hydrogen 2.992 N/A ILE 571.A N ILE 602.A O no hydrogen 3.238 N/A VAL 572.A N THR 628.A O no hydrogen 2.977 N/A GLU 573.A N VAL 576.A O no hydrogen 3.110 N/A ASN 574.A ND2 GLU 573.A OE1 no hydrogen 2.275 N/A VAL 576.A N GLU 573.A O no hydrogen 2.952 N/A LYS 578.A N ILE 571.A O no hydrogen 2.749 N/A THR 580.A OG1 GLU 582.A OE2 no hydrogen 2.795 N/A VAL 584.A N THR 580.A O no hydrogen 3.232 N/A GLN 585.A N LYS 581.A O no hydrogen 2.906 N/A GLN 585.A NE2 GLU 589.A OE2 no hydrogen 2.997 N/A ALA 586.A N GLU 582.A O no hydrogen 2.899 N/A VAL 587.A N HIS 583.A O no hydrogen 2.926 N/A LYS 588.A N VAL 584.A O no hydrogen 2.881 N/A GLU 589.A N GLN 585.A O no hydrogen 2.919 N/A GLY 590.A N VAL 587.A O no hydrogen 3.238 N/A ARG 591.A NH1 GLU 589.A OE1 no hydrogen 2.527 N/A LEU 592.A N ALA 586.A O no hydrogen 3.220 N/A LYS 593.A N ASP 596.A OD2 no hydrogen 2.935 N/A TRP 594.A NE1 TYR 605.A OH no hydrogen 2.612 N/A SER 595.A N GLU 17.A OE2 no hydrogen 2.903 N/A SER 595.A OG GLU 17.A OE1 no hydrogen 3.333 N/A SER 595.A OG GLU 17.A OE2 no hydrogen 2.917 N/A LEU 597.A N LYS 593.A O no hydrogen 3.105 N/A ILE 598.A N TRP 594.A O no hydrogen 2.948 N/A LYS 599.A N SER 595.A O no hydrogen 2.890 N/A MET 600.A N ASP 596.A O no hydrogen 2.916 N/A GLY 601.A N ILE 598.A O no hydrogen 3.335 N/A ILE 602.A N LEU 597.A O no hydrogen 3.148 N/A ILE 603.A N LEU 597.A O no hydrogen 3.462 N/A GLU 604.A N LEU 569.A O no hydrogen 2.725 N/A LEU 606.A N ARG 567.A O no hydrogen 3.073 N/A GLU 611.A N ASP 607.A O no hydrogen 2.827 N/A GLU 612.A N ALA 608.A O no hydrogen 2.926 N/A GLU 612.A N GLU 609.A O no hydrogen 3.218 N/A ASN 613.A N GLU 610.A O no hydrogen 3.035 N/A ASN 613.A ND2 TYR 549.A O no hydrogen 2.814 N/A ALA 614.A N GLU 611.A O no hydrogen 2.904 N/A TYR 615.A N THR 628.A OG1 no hydrogen 2.901 N/A ALA 617.A N HIS 629.A O no hydrogen 2.839 N/A GLU 622.A N TRP 619.A O no hydrogen 2.954 N/A VAL 623.A N PRO 620.A O no hydrogen 3.415 N/A THR 624.A N HIS 627.A ND1 no hydrogen 3.206 N/A GLU 625.A N GLU 625.A OE1 no hydrogen 2.715 N/A HIS 627.A N THR 624.A O no hydrogen 3.159 N/A THR 628.A N TYR 615.A O no hydrogen 3.068 N/A THR 628.A OG1 HIS 629.A ND1 no hydrogen 2.838 N/A HIS 629.A ND1 THR 628.A OG1 no hydrogen 2.838 N/A HIS 629.A NE2 GLU 604.A OE1 no hydrogen 2.516 N/A LEU 630.A N ILE 570.A O no hydrogen 2.872 N/A GLU 631.A N ALA 617.A O no hydrogen 2.855 N/A ALA 636.A N MET 633.A O no hydrogen 3.059 N/A ILE 637.A N PRO 634.A O no hydrogen 3.501 N/A SER 643.A N GLY 639.A O no hydrogen 2.772 N/A SER 643.A OG GLY 639.A O no hydrogen 2.769 N/A LEU 644.A N LEU 640.A O no hydrogen 2.993 N/A LEU 644.A N PRO 641.A O no hydrogen 3.229 N/A VAL 645.A N ALA 642.A O no hydrogen 3.317 N/A TYR 647.A N GLY 922.A O no hydrogen 3.278 N/A TYR 647.A OH GLU 928.A O no hydrogen 2.959 N/A GLU 649.A N GLU 649.A OE1 no hydrogen 2.526 N/A HIS 650.A N TYR 647.A O no hydrogen 3.291 N/A ASN 651.A ND2 ASN 656.A OD1 no hydrogen 3.249 N/A ASN 651.A ND2 HIS 862.A ND1 no hydrogen 2.985 N/A ARG 655.A NH2 GLY 863.A O no hydrogen 2.599 N/A ASN 656.A N ALA 652.A O no hydrogen 3.031 N/A ASN 656.A ND2 PRO 648.A O no hydrogen 2.590 N/A THR 657.A N ALA 653.A O no hydrogen 2.932 N/A THR 657.A OG1 THR 459.A O no hydrogen 2.847 N/A THR 657.A OG1 ALA 653.A O no hydrogen 3.089 N/A TYR 658.A N PRO 654.A O no hydrogen 2.903 N/A GLY 659.A N ARG 655.A O no hydrogen 2.890 N/A ALA 660.A N ASN 656.A O no hydrogen 2.907 N/A GLY 661.A N THR 657.A O no hydrogen 2.930 N/A MET 662.A N TYR 658.A O no hydrogen 2.872 N/A ALA 663.A N GLY 659.A O no hydrogen 2.923 N/A LYS 664.A NZ GLU 460.A OE2 no hydrogen 3.559 N/A GLN 665.A N MET 662.A O no hydrogen 3.187 N/A SER 666.A OG ALA 663.A O no hydrogen 2.893 N/A SER 666.A OG GLN 971.A OE1 no hydrogen 3.503 N/A LEU 667.A N ARG 972.A O no hydrogen 2.828 N/A ALA 672.A N ASP 141.A OD2 no hydrogen 2.826 N/A ASN 673.A ND2 GLY 139.A O no hydrogen 2.770 N/A PHE 674.A N TRP 671.A O no hydrogen 3.345 N/A ARG 675.A NE ASP 828.A OD2 no hydrogen 2.995 N/A ARG 675.A NH2 ASP 828.A OD1 no hydrogen 3.210 N/A ARG 677.A N PHE 674.A O no hydrogen 3.325 N/A ARG 677.A NH1 GLU 155.A OE2 no hydrogen 2.640 N/A ARG 677.A NH2 GLU 155.A OE2 no hydrogen 2.538 N/A THR 680.A N ASP 679.A OD1 no hydrogen 2.957 N/A GLY 682.A N PHE 745.A O no hydrogen 2.995 N/A HIS 686.A N ARG 741.A O no hydrogen 3.132 N/A HIS 686.A NE2 THR 743.A OG1 no hydrogen 2.306 N/A GLN 689.A N GLY 709.A O no hydrogen 2.957 N/A LEU 692.A N ASN 711.A OD1 no hydrogen 3.023 N/A ASN 694.A N VAL 920.A O no hydrogen 3.264 N/A ARG 696.A NE ASP 921.A OD2 no hydrogen 3.050 N/A ARG 696.A NE THR 923.A OG1 no hydrogen 3.342 N/A ARG 696.A NH1 ASP 5.A OD1 no hydrogen 2.864 N/A ARG 696.A NH2 ASP 5.A OD1 no hydrogen 3.274 N/A ARG 696.A NH2 ASP 921.A OD2 no hydrogen 2.541 N/A ILE 697.A N SER 695.A OG no hydrogen 3.352 N/A MET 698.A N SER 695.A O no hydrogen 3.204 N/A ALA 700.A N ARG 696.A O no hydrogen 2.964 N/A VAL 701.A N ILE 697.A O no hydrogen 2.868 N/A GLY 702.A N MET 698.A O no hydrogen 3.334 N/A TYR 703.A N MET 698.A O no hydrogen 2.963 N/A TYR 703.A OH ALA 708.A O no hydrogen 3.369 N/A TYR 703.A OH TYR 969.A OH no hydrogen 3.275 N/A ASP 705.A N GLY 702.A O no hydrogen 3.265 N/A ARG 706.A N TYR 703.A O no hydrogen 3.100 N/A ARG 706.A NE ASP 141.A OD2 no hydrogen 3.418 N/A ARG 706.A NH1 ASP 705.A O no hydrogen 2.795 N/A ARG 706.A NH2 ASP 141.A OD1 no hydrogen 2.712 N/A ARG 706.A NH2 ASP 141.A OD2 no hydrogen 3.272 N/A ALA 708.A N TYR 703.A OH no hydrogen 3.347 N/A GLN 710.A N TYR 970.A O no hydrogen 2.999 N/A GLN 710.A NE2 TYR 687.A O no hydrogen 2.874 N/A ASN 711.A N GLN 689.A OE1 no hydrogen 2.934 N/A ASN 711.A ND2 GLN 689.A OE1 no hydrogen 3.027 N/A ASN 711.A ND2 ILE 690.A O no hydrogen 2.840 N/A PHE 712.A N ILE 968.A O no hydrogen 2.861 N/A VAL 714.A N GLY 966.A O no hydrogen 2.799 N/A ALA 715.A N LEU 888.A O no hydrogen 3.097 N/A VAL 716.A N PHE 964.A O no hydrogen 2.946 N/A TYR 719.A N ASN 723.A OD1 no hydrogen 3.326 N/A TYR 719.A OH ASP 876.A O no hydrogen 3.364 N/A TYR 722.A N TYR 719.A O no hydrogen 3.236 N/A ASN 723.A ND2 LEU 717.A O no hydrogen 2.843 N/A ALA 727.A N MET 724.A O no hydrogen 3.317 N/A ILE 728.A N VAL 867.A O no hydrogen 2.840 N/A ILE 729.A N ILE 889.A O no hydrogen 3.207 N/A ILE 730.A N LEU 870.A O no hydrogen 3.162 N/A ASN 731.A ND2 PRO 886.A O no hydrogen 3.245 N/A LYS 732.A N VAL 872.A O no hydrogen 2.785 N/A ALA 733.A N ASN 731.A OD1 no hydrogen 3.389 N/A SER 734.A OG ASP 887.A OD1 no hydrogen 2.706 N/A ILE 735.A N ASN 731.A O no hydrogen 3.212 N/A GLU 736.A N LYS 732.A O no hydrogen 2.915 N/A ARG 737.A N SER 734.A O no hydrogen 3.177 N/A ARG 737.A NH2 GLN 874.A OE1 no hydrogen 2.901 N/A GLY 738.A N ILE 735.A O no hydrogen 3.045 N/A LEU 739.A N SER 734.A O no hydrogen 2.975 N/A ALA 740.A N GLN 710.A OE1 no hydrogen 2.799 N/A ARG 741.A N GLY 738.A O no hydrogen 3.471 N/A ARG 741.A NH2 ILE 735.A O no hydrogen 2.986 N/A THR 743.A N LEU 684.A O no hydrogen 3.077 N/A THR 743.A OG1 HIS 686.A NE2 no hydrogen 2.306 N/A PHE 744.A N ASP 848.A O no hydrogen 2.741 N/A PHE 745.A N GLY 682.A O no hydrogen 2.764 N/A ARG 746.A N VAL 846.A O no hydrogen 2.869 N/A ARG 746.A NE GLU 823.A OE1 no hydrogen 2.914 N/A ARG 746.A NE GLU 823.A OE2 no hydrogen 2.959 N/A THR 747.A N THR 680.A O no hydrogen 3.461 N/A THR 747.A OG1 ASP 679.A O no hydrogen 2.711 N/A THR 747.A OG1 THR 845.A OG1 no hydrogen 2.989 N/A TYR 748.A N VAL 844.A O no hydrogen 2.685 N/A ALA 750.A N VAL 842.A O no hydrogen 3.073 N/A GLU 752.A N LYS 840.A O no hydrogen 2.969 N/A TYR 755.A N GLN 759.A O no hydrogen 3.249 N/A TYR 755.A OH SER 805.A OG no hydrogen 3.136 N/A LYS 762.A N THR 804.A O no hydrogen 3.083 N/A GLU 764.A N GLY 802.A O no hydrogen 2.923 N/A VAL 770.A N ASP 767.A O no hydrogen 3.176 N/A ARG 771.A N ARG 812.A O no hydrogen 2.986 N/A ARG 774.A N TYR 779.A OH no hydrogen 3.400 N/A ARG 774.A NE GLU 814.A OE2 no hydrogen 2.962 N/A TYR 778.A N GLY 775.A O no hydrogen 3.142 N/A TYR 779.A OH GLU 814.A OE1 no hydrogen 2.792 N/A TYR 779.A OH GLU 814.A OE2 no hydrogen 2.299 N/A ARG 780.A N LYS 777.A O no hydrogen 3.166 N/A ARG 780.A NH2 ASP 798.A OD2 no hydrogen 2.826 N/A LEU 782.A N TYR 779.A O no hydrogen 3.430 N/A ASP 783.A N LEU 787.A O no hydrogen 2.999 N/A GLU 784.A N ASP 783.A OD1 no hydrogen 2.627 N/A GLY 786.A N ASP 783.A O no hydrogen 2.673 N/A ILE 788.A N LEU 800.A O no hydrogen 3.028 N/A GLU 791.A N VAL 827.A O no hydrogen 2.522 N/A SER 792.A OG PHE 789.A O no hydrogen 2.748 N/A VAL 794.A N GLY 825.A O no hydrogen 2.913 N/A GLU 795.A N ASP 798.A OD2 no hydrogen 3.385 N/A ASP 798.A N GLU 795.A O no hydrogen 3.256 N/A VAL 799.A N TYR 778.A O no hydrogen 3.268 N/A LEU 800.A N VAL 817.A O no hydrogen 2.741 N/A VAL 801.A N VAL 817.A O no hydrogen 3.364 N/A GLY 802.A N GLY 786.A O no hydrogen 3.058 N/A ARG 803.A NE THR 815.A O no hydrogen 3.128 N/A ARG 803.A NE THR 815.A OG1 no hydrogen 3.203 N/A ARG 803.A NH2 THR 815.A O no hydrogen 3.177 N/A THR 804.A N LYS 762.A O no hydrogen 3.233 N/A THR 804.A OG1 GLU 764.A OE2 no hydrogen 3.064 N/A SER 805.A N ARG 813.A O no hydrogen 2.707 N/A SER 805.A OG TYR 755.A OH no hydrogen 3.136 N/A SER 805.A OG THR 815.A OG1 no hydrogen 2.883 N/A ARG 812.A NE THR 804.A OG1 no hydrogen 3.121 N/A ARG 812.A NH2 THR 760.A O no hydrogen 2.704 N/A ARG 812.A NH2 THR 804.A O no hydrogen 3.238 N/A THR 815.A N ARG 803.A O no hydrogen 3.091 N/A THR 815.A OG1 SER 805.A OG no hydrogen 2.883 N/A SER 816.A OG GLU 814.A OE2 no hydrogen 2.480 N/A VAL 817.A N VAL 801.A O no hydrogen 3.171 N/A VAL 819.A N ASP 798.A O no hydrogen 3.046 N/A ARG 820.A N TYR 748.A OH no hydrogen 3.444 N/A GLU 823.A N ARG 820.A O no hydrogen 3.027 N/A GLY 825.A N VAL 794.A O no hydrogen 2.945 N/A VAL 826.A N ARG 847.A O no hydrogen 2.832 N/A VAL 827.A N SER 792.A O no hydrogen 3.362 N/A ASP 828.A N THR 845.A O no hydrogen 2.743 N/A LYS 829.A N THR 845.A O no hydrogen 3.385 N/A ILE 831.A N LYS 843.A O no hydrogen 2.965 N/A THR 833.A N LEU 841.A O no hydrogen 2.651 N/A THR 833.A OG1 GLU 834.A O no hydrogen 3.344 N/A THR 835.A N THR 839.A O no hydrogen 2.666 N/A THR 835.A OG1 ASP 837.A OD1 no hydrogen 2.968 N/A THR 835.A OG1 THR 839.A O no hydrogen 2.583 N/A THR 835.A OG1 THR 839.A OG1 no hydrogen 2.376 N/A THR 839.A N ASP 837.A OD1 no hydrogen 3.039 N/A THR 839.A OG1 GLU 751.A OE1 no hydrogen 3.445 N/A THR 839.A OG1 THR 835.A OG1 no hydrogen 2.376 N/A THR 839.A OG1 ASP 837.A OD1 no hydrogen 2.715 N/A LEU 841.A N THR 833.A O no hydrogen 2.647 N/A VAL 842.A N ALA 750.A O no hydrogen 3.068 N/A LYS 843.A N ILE 831.A O no hydrogen 3.109 N/A LYS 843.A NZ ASN 86.A OD1 no hydrogen 2.560 N/A LYS 843.A NZ GLU 749.A OE1 no hydrogen 3.385 N/A VAL 844.A N TYR 748.A O no hydrogen 2.849 N/A THR 845.A N LYS 829.A O no hydrogen 2.833 N/A THR 845.A OG1 THR 747.A OG1 no hydrogen 2.989 N/A VAL 846.A N ARG 746.A O no hydrogen 2.730 N/A ARG 847.A N VAL 826.A O no hydrogen 2.888 N/A ARG 847.A NE ASP 828.A OD1 no hydrogen 2.687 N/A ARG 847.A NH2 GLU 791.A OE2 no hydrogen 3.093 N/A ASP 848.A N PHE 744.A O no hydrogen 2.744 N/A ARG 850.A N SER 742.A O no hydrogen 2.843 N/A ARG 850.A NE ASP 848.A OD2 no hydrogen 2.784 N/A ARG 850.A NH1 ASP 979.A OD2 no hydrogen 3.099 N/A ARG 850.A NH2 ASP 979.A OD2 no hydrogen 3.104 N/A GLU 853.A N ASP 856.A OD2 no hydrogen 2.526 N/A GLY 855.A N ILE 868.A O no hydrogen 3.124 N/A ASP 856.A N GLU 853.A O no hydrogen 3.413 N/A PHE 858.A N GLY 866.A O no hydrogen 2.529 N/A ALA 859.A N GLN 971.A O no hydrogen 3.032 N/A SER 860.A OG GLN 903.A OE1 no hydrogen 2.754 N/A ARG 861.A NH1 LEU 644.A O no hydrogen 3.322 N/A ARG 861.A NH1 VAL 693.A O no hydrogen 2.833 N/A ARG 861.A NH2 VAL 693.A O no hydrogen 2.821 N/A ARG 861.A NH2 GLU 906.A OE2 no hydrogen 2.518 N/A HIS 862.A N SER 860.A OG no hydrogen 3.380 N/A HIS 862.A NE2 GLU 906.A OE1 no hydrogen 2.406 N/A GLY 863.A N SER 860.A O no hydrogen 3.343 N/A GLN 864.A NE2 GLY 894.A O no hydrogen 3.290 N/A GLY 866.A N PHE 858.A O no hydrogen 2.814 N/A ILE 868.A N ASP 856.A O no hydrogen 3.089 N/A GLY 869.A N ILE 728.A O no hydrogen 2.625 N/A VAL 872.A N ILE 730.A O no hydrogen 2.907 N/A GLU 875.A N GLU 875.A OE1 no hydrogen 3.157 N/A ASP 876.A N PRO 873.A O no hydrogen 2.967 N/A MET 877.A N GLN 874.A O no hydrogen 3.054 N/A TRP 879.A N TYR 951.A O no hydrogen 3.230 N/A THR 880.A N ILE 884.A O no hydrogen 2.982 N/A THR 880.A OG1 ILE 884.A O no hydrogen 2.920 N/A GLU 881.A N ILE 949.A O no hydrogen 3.156 N/A SER 882.A OG GLU 948.A OE1 no hydrogen 3.548 N/A GLY 883.A N THR 880.A O no hydrogen 2.884 N/A ASP 887.A N VAL 713.A O no hydrogen 2.684 N/A ILE 889.A N ILE 729.A O no hydrogen 2.776 N/A VAL 890.A N ALA 715.A O no hydrogen 3.112 N/A HIS 893.A ND1 ASN 891.A OD1 no hydrogen 2.934 N/A GLY 894.A N ASN 891.A O no hydrogen 3.363 N/A ILE 895.A N PRO 892.A O no hydrogen 3.108 N/A ARG 898.A NH1 ASP 726.A OD1 no hydrogen 2.695 N/A ARG 898.A NH1 GLY 894.A O no hydrogen 3.494 N/A ARG 898.A NH2 ASP 726.A OD1 no hydrogen 2.701 N/A ARG 898.A NH2 ASP 726.A OD2 no hydrogen 3.154 N/A MET 899.A N ILE 895.A O no hydrogen 2.890 N/A GLY 902.A N HIS 650.A O no hydrogen 3.236 N/A GLY 902.A N ASN 651.A OD1 no hydrogen 2.896 N/A ILE 905.A N VAL 901.A O no hydrogen 2.975 N/A GLU 906.A N GLY 902.A O no hydrogen 2.836 N/A ALA 907.A N GLN 903.A O no hydrogen 2.906 N/A ILE 908.A N LEU 904.A O no hydrogen 2.995 N/A GLY 909.A N ILE 905.A O no hydrogen 2.874 N/A GLY 910.A N GLU 906.A O no hydrogen 2.818 N/A LYS 911.A N ALA 907.A O no hydrogen 3.000 N/A LYS 911.A NZ GLY 946.A O no hydrogen 3.446 N/A LYS 911.A NZ GLU 948.A OE2 no hydrogen 2.894 N/A LYS 911.A NZ ILE 965.A O no hydrogen 3.121 N/A VAL 912.A N ILE 908.A O no hydrogen 2.954 N/A ALA 913.A N GLY 909.A O no hydrogen 2.812 N/A SER 914.A N GLY 910.A O no hydrogen 2.924 N/A SER 914.A OG GLY 910.A O no hydrogen 2.529 N/A LEU 915.A N LYS 911.A O no hydrogen 2.953 N/A LYS 916.A N VAL 912.A O no hydrogen 2.862 N/A LYS 916.A NZ GLU 936.A OE1 no hydrogen 3.556 N/A LYS 916.A NZ GLU 936.A OE2 no hydrogen 3.503 N/A GLY 917.A N ALA 913.A O no hydrogen 2.929 N/A VAL 920.A N LEU 692.A O no hydrogen 3.038 N/A GLY 922.A N ASN 694.A O no hydrogen 3.041 N/A THR 923.A N ASP 921.A OD1 no hydrogen 3.123 N/A THR 923.A OG1 ASP 921.A OD1 no hydrogen 2.247 N/A GLU 928.A N ASP 921.A O no hydrogen 3.067 N/A GLU 931.A N GLU 931.A OE1 no hydrogen 2.740 N/A LEU 933.A N PRO 929.A O no hydrogen 3.151 N/A ARG 934.A N GLU 930.A O no hydrogen 2.892 N/A ARG 934.A NE HIS 944.A O no hydrogen 2.852 N/A ARG 934.A NH2 HIS 944.A ND1 no hydrogen 3.372 N/A LYS 935.A N GLU 931.A O no hydrogen 2.928 N/A GLU 936.A N LYS 932.A O no hydrogen 2.888 N/A LEU 937.A N LEU 933.A O no hydrogen 2.878 N/A GLU 938.A N ARG 934.A O no hydrogen 2.909 N/A GLU 939.A N LYS 935.A O no hydrogen 2.917 N/A LEU 940.A N GLU 936.A O no hydrogen 2.924 N/A GLY 941.A N GLU 938.A O no hydrogen 3.340 N/A PHE 942.A N LEU 937.A O no hydrogen 3.219 N/A GLY 946.A N LYS 943.A O no hydrogen 3.072 N/A ARG 947.A N THR 945.A OG1 no hydrogen 3.154 N/A GLU 948.A N ILE 963.A O no hydrogen 2.741 N/A TYR 951.A N TRP 879.A O no hydrogen 2.810 N/A TYR 951.A OH GLU 881.A OE2 no hydrogen 3.426 N/A ASP 952.A N LYS 957.A O no hydrogen 2.973 N/A GLY 956.A N ASP 952.A O no hydrogen 2.814 N/A LYS 957.A NZ THR 955.A OG1 no hydrogen 3.139 N/A ARG 958.A NH2 TYR 951.A OH no hydrogen 2.513 N/A LEU 959.A N MET 950.A O no hydrogen 2.878 N/A ILE 963.A N GLU 948.A O no hydrogen 2.859 N/A ILE 965.A N GLY 946.A O no hydrogen 3.461 N/A GLY 966.A N VAL 714.A O no hydrogen 2.929 N/A VAL 967.A N ALA 907.A O no hydrogen 3.469 N/A ILE 968.A N PHE 712.A O no hydrogen 2.966 N/A TYR 969.A N GLU 906.A OE2 no hydrogen 3.241 N/A TYR 969.A OH GLN 689.A O no hydrogen 3.133 N/A TYR 969.A OH TYR 703.A OH no hydrogen 3.275 N/A GLN 971.A N ALA 859.A O no hydrogen 2.800 N/A ARG 972.A NH1 ARG 850.A O no hydrogen 2.818 N/A LEU 973.A N LYS 857.A O no hydrogen 3.229 N/A HIS 974.A N GLN 665.A O no hydrogen 3.146 N/A HIS 975.A NE2 GLN 665.A OE1 no hydrogen 2.988 N/A MET 976.A N HIS 974.A O no hydrogen 2.975 N/A VAL 977.A N ASP 856.A OD1 no hydrogen 3.386 N/A ASP 979.A N MET 976.A O no hydrogen 3.101 N/A LYS 980.A N VAL 977.A O no hydrogen 3.385 N/A ILE 981.A N VAL 977.A O no hydrogen 3.148 N/A HIS 982.A NE2 GLY 1004.A O no hydrogen 2.649 N/A ARG 984.A NH1 PRO 988.A O no hydrogen 3.292 N/A ARG 984.A NH1 GLU 1003.A O no hydrogen 2.389 N/A ARG 984.A NH2 PRO 988.A O no hydrogen 2.989 N/A GLN 990.A N GLN 995.A O no hydrogen 2.777 N/A LYS 994.A N GLN 990.A O no hydrogen 2.862 N/A GLN 995.A NE2 ASP 1034.A OD2 no hydrogen 2.742 N/A THR 997.A N PRO 988.A O no hydrogen 3.420 N/A THR 997.A OG1 ARG 1002.A O no hydrogen 2.875 N/A ARG 1000.A NH1 SER 822.A OG no hydrogen 3.159 N/A ARG 1000.A NH1 ILE 981.A O no hydrogen 2.539 N/A ARG 1002.A N GLY 999.A O no hydrogen 3.398 N/A ARG 1002.A NE GLU 998.A O no hydrogen 2.700 N/A GLY 1004.A N GLY 999.A O no hydrogen 2.710 N/A GLY 1005.A N THR 997.A O no hydrogen 2.994 N/A GLY 1009.A N GLU 1012.A OE1 no hydrogen 2.812 N/A ARG 1013.A N GLY 1009.A O no hydrogen 3.043 N/A ASP 1014.A N GLU 1010.A O no hydrogen 2.901 N/A VAL 1015.A N MET 1011.A O no hydrogen 2.948 N/A LEU 1016.A N GLU 1012.A O no hydrogen 2.896 N/A VAL 1017.A N ARG 1013.A O no hydrogen 2.905 N/A GLY 1018.A N ASP 1014.A O no hydrogen 2.888 N/A HIS 1019.A N VAL 1015.A O no hydrogen 3.295 N/A HIS 1019.A N LEU 1016.A O no hydrogen 3.244 N/A GLY 1020.A N VAL 1017.A O no hydrogen 2.865 N/A ALA 1021.A N LEU 1016.A O no hydrogen 3.358 N/A ILE 1026.A N ALA 1022.A O no hydrogen 3.150 N/A GLU 1027.A N MET 1023.A O no hydrogen 2.902 N/A ARG 1028.A N LEU 1024.A O no hydrogen 2.888 N/A ARG 1028.A NH2 GLU 1027.A OE1 no hydrogen 3.357 N/A LEU 1029.A N LEU 1025.A O no hydrogen 2.929 N/A LEU 1030.A N ILE 1026.A O no hydrogen 2.773 N/A GLU 1031.A N ILE 1026.A O no hydrogen 3.383 N/A THR 1036.A N MET 1073.A O no hydrogen 3.101 N/A VAL 1038.A N VAL 1071.A O no hydrogen 2.952 N/A VAL 1040.A N SER 1069.A O no hydrogen 3.124 N/A CYS 1041.A N HIS 1046.A O no hydrogen 3.095 N/A GLU 1042.A N ARG 1067.A O no hydrogen 2.822 N/A GLY 1045.A N CYS 1041.A O no hydrogen 2.687 N/A ALA 1048.A N TRP 1039.A O no hydrogen 2.641 N/A LEU 1049.A N TYR 1058.A O no hydrogen 2.635 N/A ASP 1051.A N ARG 1056.A O no hydrogen 2.698 N/A ARG 1054.A N ASP 1051.A OD1 no hydrogen 2.949 N/A ARG 1056.A N ASP 1051.A O no hydrogen 3.276 N/A TYR 1058.A N LEU 1049.A O no hydrogen 2.862 N/A CYS 1059.A N GLU 1064.A O no hydrogen 3.195 N/A CYS 1062.A N CYS 1059.A O no hydrogen 3.310 N/A GLY 1063.A N CYS 1059.A O no hydrogen 2.532 N/A GLU 1065.A N GLU 1064.A OE2 no hydrogen 2.560 N/A GLU 1066.A N GLU 1064.A OE2 no hydrogen 2.533 N/A SER 1069.A N VAL 1040.A O no hydrogen 3.327 N/A SER 1069.A OG GLU 1042.A OE2 no hydrogen 2.803 N/A VAL 1071.A N VAL 1038.A O no hydrogen 2.883 N/A MET 1073.A N THR 1036.A O no hydrogen 3.138 N/A TYR 1075.A N ASP 1034.A O no hydrogen 2.712 N/A PHE 1077.A N SER 1074.A O no hydrogen 2.867 N/A PHE 1077.A N SER 1074.A OG no hydrogen 3.411 N/A LYS 1078.A N SER 1074.A O no hydrogen 3.203 N/A LYS 1078.A NZ ASP 1082.A OD2 no hydrogen 2.905 N/A LEU 1079.A N TYR 1075.A O no hydrogen 2.908 N/A LEU 1080.A N ALA 1076.A O no hydrogen 2.869 N/A LEU 1081.A N PHE 1077.A O no hydrogen 2.863 N/A ASP 1082.A N LYS 1078.A O no hydrogen 2.927 N/A GLU 1083.A N LEU 1079.A O no hydrogen 2.912 N/A LEU 1084.A N LEU 1080.A O no hydrogen 2.866 N/A LYS 1085.A N LEU 1081.A O no hydrogen 2.841 N/A ALA 1086.A N ASP 1082.A O no hydrogen 2.903 N/A LYS 1092.A NZ ASN 1094.A OD1 no hydrogen 2.948 N/A LEU 1093.A N GLY 1045.A O no hydrogen 3.441 N/A ARG 1098.A NE GLU 1097.A O no hydrogen 2.742 N/A