Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 5k1v_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): TRP 11.A NE1 ARG 15.A O no hydrogen 2.915 N/A ARG 15.A NE GLU 160.A OE1 no hydrogen 3.217 N/A LEU 23.A N GLU 45.A O no hydrogen 2.867 N/A TYR 25.A N ASN 166.A O no hydrogen 2.826 N/A ASP 26.A N LYS 43.A O no hydrogen 2.880 N/A LEU 27.A N SER 168.A O no hydrogen 2.485 N/A PHE 28.A N SER 41.A O no hydrogen 2.989 N/A VAL 29.A N LYS 170.A O no hydrogen 2.769 N/A HIS 30.A N VAL 39.A O no hydrogen 2.965 N/A ASN 32.A N ASP 37.A O no hydrogen 2.730 N/A THR 34.A N ASN 32.A OD1 no hydrogen 2.877 N/A SER 35.A N ASN 32.A OD1 no hydrogen 2.943 N/A SER 35.A OG ASP 37.A OD1 no hydrogen 2.350 N/A ASP 37.A N ASN 32.A O no hydrogen 3.078 N/A PHE 38.A N ALA 117.A O no hydrogen 2.941 N/A VAL 39.A N HIS 30.A O no hydrogen 3.114 N/A ALA 40.A N PHE 115.A O no hydrogen 2.804 N/A SER 41.A N PHE 28.A O no hydrogen 3.062 N/A GLU 42.A N MET 113.A O no hydrogen 2.945 N/A LYS 43.A N ASP 26.A O no hydrogen 2.976 N/A ILE 44.A N VAL 111.A O no hydrogen 2.863 N/A GLU 45.A N HIS 24.A O no hydrogen 2.935 N/A LEU 47.A N VAL 20.A O no hydrogen 3.256 N/A LEU 47.A N ILE 21.A O no hydrogen 2.849 N/A SER 49.A N VAL 19.A O no hydrogen 3.158 N/A THR 52.A OG1 ASN 50.A O no hydrogen 3.337 N/A ILE 55.A N LEU 97.A O no hydrogen 2.843 N/A LEU 57.A N ILE 95.A O no hydrogen 3.156 N/A HIS 58.A N CYS 157.A O no hydrogen 2.628 N/A SER 59.A N GLU 93.A O no hydrogen 3.056 N/A LYS 60.A N ARG 152.A O no hydrogen 2.800 N/A LYS 60.A NZ GLU 93.A OE2 no hydrogen 2.934 N/A GLU 63.A N GLN 116.A O no hydrogen 2.990 N/A THR 65.A N ASP 114.A O no hydrogen 2.841 N/A THR 65.A OG1 ASP 114.A O no hydrogen 3.065 N/A THR 68.A N ALA 112.A O no hydrogen 2.975 N/A LEU 69.A N LYS 82.A O no hydrogen 2.900 N/A GLN 70.A NE2 PRO 80.A O no hydrogen 3.397 N/A SER 71.A N TYR 77.A O no hydrogen 2.431 N/A SER 71.A OG ASP 74.A O no hydrogen 3.441 N/A SER 71.A OG LYS 108.A O no hydrogen 3.507 N/A GLU 73.A N SER 71.A OG no hydrogen 2.954 N/A ASP 74.A N SER 71.A OG no hydrogen 2.758 N/A ARG 76.A NE ASP 74.A OD2 no hydrogen 3.177 N/A ARG 76.A NH1 GLU 101.A OE1 no hydrogen 2.969 N/A ARG 76.A NH1 LYS 102.A O no hydrogen 3.458 N/A ARG 76.A NH2 ASP 74.A OD1 no hydrogen 2.933 N/A ARG 76.A NH2 ASP 74.A OD2 no hydrogen 3.152 N/A ARG 76.A NH2 LYS 102.A O no hydrogen 3.236 N/A TYR 77.A N ASP 74.A O no hydrogen 3.100 N/A TYR 77.A OH GLU 101.A O no hydrogen 2.495 N/A MET 78.A N SER 75.A O no hydrogen 2.527 N/A LEU 84.A N ALA 67.A O no hydrogen 2.601 N/A LYS 85.A N LEU 98.A O no hydrogen 3.381 N/A LEU 87.A N ALA 96.A O no hydrogen 2.816 N/A HIS 92.A N TYR 89.A O no hydrogen 3.345 N/A HIS 92.A ND1 ALA 91.A O no hydrogen 2.595 N/A GLU 93.A N PRO 90.A O no hydrogen 2.417 N/A GLN 94.A N TYR 89.A O no hydrogen 3.131 N/A GLN 94.A NE2 GLU 13.A O no hydrogen 2.874 N/A GLN 94.A NE2 ARG 15.A O no hydrogen 3.210 N/A ILE 95.A N LEU 57.A O no hydrogen 2.813 N/A ALA 96.A N LEU 87.A O no hydrogen 2.435 N/A LEU 97.A N ILE 55.A O no hydrogen 2.579 N/A LEU 98.A N LYS 85.A O no hydrogen 2.831 N/A VAL 99.A N GLN 53.A O no hydrogen 3.262 N/A GLU 101.A N TYR 77.A OH no hydrogen 3.011 N/A LEU 103.A N THR 52.A O no hydrogen 2.982 N/A THR 104.A N TYR 109.A OH no hydrogen 2.705 N/A THR 104.A OG1 ASP 74.A OD1 no hydrogen 3.299 N/A HIS 106.A N VAL 48.A O no hydrogen 3.018 N/A LEU 107.A N THR 104.A O no hydrogen 3.279 N/A LYS 108.A N GLU 73.A OE1 no hydrogen 3.062 N/A TYR 109.A N VAL 46.A O no hydrogen 3.179 N/A VAL 111.A N ILE 44.A O no hydrogen 3.078 N/A ALA 112.A N THR 68.A O no hydrogen 2.970 N/A MET 113.A N GLU 42.A O no hydrogen 3.187 N/A ASP 114.A N ASN 66.A O no hydrogen 3.165 N/A PHE 115.A N ALA 40.A O no hydrogen 2.652 N/A GLN 116.A N GLU 63.A O no hydrogen 3.015 N/A ALA 117.A N PHE 38.A O no hydrogen 3.133 N/A LYS 118.A NZ SER 35.A O no hydrogen 3.413 N/A LEU 119.A N LEU 36.A O no hydrogen 3.112 N/A GLY 120.A N PHE 126.A O no hydrogen 2.757 N/A GLU 124.A N GLY 122.A O no hydrogen 2.216 N/A GLY 125.A N ASP 145.A O no hydrogen 2.987 N/A TYR 127.A N VAL 143.A O no hydrogen 2.873 N/A TYR 127.A OH ASP 277.A O no hydrogen 2.773 N/A LYS 128.A N GLY 120.A O no hydrogen 3.326 N/A LYS 128.A NZ GLY 120.A O no hydrogen 3.496 N/A SER 129.A N LEU 141.A O no hydrogen 3.070 N/A SER 129.A OG THR 130.A O no hydrogen 3.519 N/A SER 129.A OG ASP 277.A OD2 no hydrogen 2.670 N/A THR 130.A N ASP 277.A OD2 no hydrogen 2.936 N/A TYR 131.A N ARG 139.A O no hydrogen 3.025 N/A TYR 131.A OH ASP 217.A OD1 no hydrogen 3.166 N/A TYR 131.A OH ASP 217.A OD2 no hydrogen 2.928 N/A THR 133.A N GLU 137.A O no hydrogen 2.869 N/A LEU 134.A N ASP 238.A OD2 no hydrogen 2.956 N/A GLY 135.A N THR 133.A OG1 no hydrogen 2.941 N/A GLY 136.A N THR 133.A O no hydrogen 2.850 N/A GLU 137.A N THR 133.A OG1 no hydrogen 3.138 N/A ARG 139.A N TYR 131.A O no hydrogen 3.044 N/A ARG 139.A NH1 TYR 131.A OH no hydrogen 3.467 N/A ARG 139.A NH2 GLU 137.A OE1 no hydrogen 3.105 N/A LEU 141.A N SER 129.A O no hydrogen 2.915 N/A ALA 142.A N VAL 215.A O no hydrogen 3.028 N/A VAL 143.A N TYR 127.A O no hydrogen 2.912 N/A ASP 145.A N GLY 125.A O no hydrogen 2.863 N/A GLN 150.A N PHE 146.A O no hydrogen 2.773 N/A ARG 152.A N ASP 159.A OD2 no hydrogen 3.380 N/A ARG 152.A NE ASP 159.A OD2 no hydrogen 2.736 N/A ARG 152.A NH1 GLU 93.A OE1 no hydrogen 2.493 N/A ARG 152.A NH2 ASP 159.A O no hydrogen 3.083 N/A MET 153.A N GLN 150.A O no hydrogen 3.004 N/A PHE 155.A N ALA 151.A O no hydrogen 3.323 N/A CYS 157.A N HIS 58.A O no hydrogen 2.928 N/A CYS 157.A SG PHE 155.A O no hydrogen 3.423 N/A PHE 158.A N TYR 25.A OH no hydrogen 3.018 N/A ASP 159.A N HIS 58.A ND1 no hydrogen 3.124 N/A GLU 160.A N PHE 158.A O no hydrogen 2.922 N/A PHE 163.A N GLU 160.A O no hydrogen 3.137 N/A LYS 164.A N LEU 162.A O no hydrogen 2.814 N/A LYS 164.A NZ ASN 326.A O no hydrogen 3.438 N/A LYS 164.A NZ LEU 327.A O no hydrogen 2.934 N/A LYS 164.A NZ ARG 435.A O no hydrogen 3.568 N/A ALA 165.A N MET 206.A O no hydrogen 3.071 N/A ASN 166.A N LEU 23.A O no hydrogen 2.813 N/A ASN 166.A ND2 THR 203.A O no hydrogen 3.214 N/A PHE 167.A N THR 203.A OG1 no hydrogen 3.145 N/A SER 168.A N TYR 25.A O no hydrogen 2.887 N/A SER 168.A OG HIS 24.A NE2 no hydrogen 3.077 N/A SER 168.A OG THR 202.A OG1 no hydrogen 1.917 N/A LYS 170.A N LEU 27.A O no hydrogen 2.762 N/A ILE 171.A N ASP 198.A O no hydrogen 3.182 N/A ARG 172.A N VAL 29.A O no hydrogen 3.187 N/A ARG 172.A NH2 GLU 197.A OE1 no hydrogen 2.316 N/A ARG 173.A N LEU 196.A O no hydrogen 2.870 N/A ARG 173.A NE ASP 198.A OD2 no hydrogen 2.908 N/A ARG 173.A NH1 GLU 174.A O no hydrogen 3.276 N/A ARG 173.A NH2 ASP 198.A OD1 no hydrogen 3.239 N/A ARG 173.A NH2 ASP 198.A OD2 no hydrogen 3.504 N/A ARG 176.A NE GLU 174.A OE1 no hydrogen 2.852 N/A ILE 178.A N CYS 216.A O no hydrogen 2.745 N/A LEU 180.A N ILE 214.A O no hydrogen 2.974 N/A SER 181.A OG ASN 182.A OD1 no hydrogen 3.020 N/A SER 181.A OG ALA 212.A O no hydrogen 2.555 N/A ASN 182.A N SER 181.A OG no hydrogen 2.396 N/A ASN 182.A ND2 LEU 210.A O no hydrogen 2.835 N/A ASN 182.A ND2 TRP 286.A O no hydrogen 3.331 N/A LYS 185.A NZ THR 188.A OG1 no hydrogen 2.964 N/A VAL 186.A N HIS 199.A O no hydrogen 2.990 N/A LYS 187.A N HIS 199.A O no hydrogen 3.495 N/A THR 188.A OG1 ASP 198.A OD1 no hydrogen 2.819 N/A ILE 189.A N GLU 197.A O no hydrogen 3.089 N/A LEU 191.A N LEU 195.A O no hydrogen 2.932 N/A LEU 196.A N ARG 173.A O no hydrogen 2.921 N/A GLU 197.A N ILE 189.A O no hydrogen 3.200 N/A ASP 198.A N ILE 171.A O no hydrogen 2.788 N/A HIS 199.A N LYS 187.A O no hydrogen 2.823 N/A GLU 201.A N PRO 184.A O no hydrogen 3.173 N/A THR 202.A OG1 SER 168.A OG no hydrogen 1.917 N/A THR 203.A N PHE 167.A O no hydrogen 2.635 N/A THR 203.A OG1 VAL 204.A O no hydrogen 2.326 N/A LYS 205.A NZ LEU 23.A O no hydrogen 2.809 N/A LYS 205.A NZ ASN 166.A OD1 no hydrogen 2.786 N/A MET 206.A N ALA 165.A O no hydrogen 3.005 N/A SER 207.A OG PRO 161.A O no hydrogen 3.095 N/A THR 208.A OG1 ASP 159.A OD1 no hydrogen 2.430 N/A LEU 210.A N SER 207.A O no hydrogen 3.242 N/A VAL 211.A N THR 208.A O no hydrogen 2.933 N/A ALA 212.A N ASN 182.A OD1 no hydrogen 2.861 N/A TYR 213.A N THR 144.A OG1 no hydrogen 3.217 N/A ILE 214.A N LEU 180.A O no hydrogen 2.965 N/A VAL 215.A N ALA 142.A O no hydrogen 2.912 N/A CYS 216.A N ILE 178.A O no hydrogen 3.320 N/A HIS 219.A N ALA 235.A O no hydrogen 2.986 N/A LEU 221.A N ILE 233.A O no hydrogen 3.135 N/A SER 222.A OG SER 232.A OG no hydrogen 3.201 N/A GLY 223.A N VAL 231.A O no hydrogen 3.107 N/A THR 225.A N VAL 229.A O no hydrogen 2.845 N/A THR 225.A OG1 SER 227.A OG no hydrogen 3.089 N/A SER 226.A N ASP 255.A OD1 no hydrogen 3.060 N/A SER 226.A OG ASP 255.A OD1 no hydrogen 3.001 N/A SER 227.A OG THR 225.A OG1 no hydrogen 3.089 N/A SER 227.A OG GLU 258.A OE1 no hydrogen 2.515 N/A SER 227.A OG GLU 258.A OE2 no hydrogen 3.046 N/A GLY 228.A N THR 225.A O no hydrogen 3.001 N/A VAL 229.A N THR 225.A OG1 no hydrogen 2.851 N/A LYS 230.A N SER 268.A O no hydrogen 2.882 N/A VAL 231.A N GLY 223.A O no hydrogen 2.990 N/A SER 232.A N LEU 270.A O no hydrogen 3.037 N/A SER 232.A OG SER 222.A OG no hydrogen 3.201 N/A ILE 233.A N LEU 221.A O no hydrogen 2.866 N/A TYR 234.A N LEU 272.A O no hydrogen 2.837 N/A ALA 235.A N HIS 219.A O no hydrogen 3.112 N/A LYS 239.A N SER 236.A O no hydrogen 2.816 N/A LYS 239.A NZ GLU 293.A OE2 no hydrogen 2.768 N/A LYS 239.A NZ MET 752.A O no hydrogen 3.322 N/A ARG 240.A N PRO 237.A O no hydrogen 3.276 N/A GLN 242.A N LYS 239.A O no hydrogen 2.882 N/A GLN 242.A NE2 MET 752.A O no hydrogen 2.694 N/A THR 243.A N ARG 240.A O no hydrogen 2.897 N/A THR 243.A OG1 ARG 240.A O no hydrogen 2.515 N/A HIS 244.A ND1 ASN 241.A O no hydrogen 3.099 N/A TYR 245.A OH THR 312.A OG1 no hydrogen 2.615 N/A LEU 247.A N THR 243.A O no hydrogen 3.269 N/A GLN 248.A N HIS 244.A O no hydrogen 3.043 N/A ALA 249.A N TYR 245.A O no hydrogen 2.900 N/A SER 250.A N ALA 246.A O no hydrogen 2.921 N/A SER 250.A OG ALA 246.A O no hydrogen 2.333 N/A SER 250.A OG LEU 247.A O no hydrogen 2.864 N/A LEU 251.A N LEU 247.A O no hydrogen 3.116 N/A LYS 252.A N GLN 248.A O no hydrogen 3.104 N/A LYS 252.A NZ THR 354.A O no hydrogen 3.179 N/A LEU 253.A N ALA 249.A O no hydrogen 2.786 N/A LEU 254.A N SER 250.A O no hydrogen 2.672 N/A ASP 255.A N LEU 251.A O no hydrogen 2.991 N/A PHE 256.A N LYS 252.A O no hydrogen 2.899 N/A TYR 257.A N LEU 253.A O no hydrogen 2.957 N/A TYR 257.A OH ALA 316.A O no hydrogen 2.692 N/A TYR 257.A OH MET 346.A O no hydrogen 3.330 N/A GLU 258.A N LEU 254.A O no hydrogen 3.050 N/A LYS 259.A N ASP 255.A O no hydrogen 3.304 N/A TYR 260.A N PHE 256.A O no hydrogen 2.914 N/A TYR 260.A OH GLU 418.A OE2 no hydrogen 2.533 N/A PHE 261.A N TYR 257.A O no hydrogen 2.976 N/A ASP 262.A N LYS 259.A O no hydrogen 2.908 N/A ILE 263.A N GLU 258.A O no hydrogen 3.264 N/A TYR 265.A N GLU 258.A OE2 no hydrogen 2.681 N/A TYR 265.A OH LYS 269.A O no hydrogen 2.607 N/A LYS 269.A NZ SER 181.A O no hydrogen 2.995 N/A LYS 269.A NZ GLY 287.A O no hydrogen 3.051 N/A LEU 270.A N LYS 230.A O no hydrogen 2.691 N/A ASP 271.A N GLY 287.A O no hydrogen 2.891 N/A LEU 272.A N SER 232.A O no hydrogen 2.826 N/A ILE 273.A N ILE 289.A O no hydrogen 2.910 N/A ALA 274.A N TYR 234.A O no hydrogen 3.002 N/A ILE 275.A N TYR 291.A O no hydrogen 2.866 N/A ASP 277.A N SER 129.A OG no hydrogen 3.095 N/A PHE 278.A N GLN 789.A OE1 no hydrogen 2.373 N/A MET 283.A N THR 290.A O no hydrogen 2.954 N/A GLU 284.A N GLU 284.A OE1 no hydrogen 3.164 N/A ASN 285.A ND2 LEU 288.A O no hydrogen 2.498 N/A LEU 288.A N ASN 285.A O no hydrogen 2.879 N/A ILE 289.A N ASP 271.A O no hydrogen 3.039 N/A THR 290.A N MET 283.A O no hydrogen 3.116 N/A THR 290.A OG1 MET 283.A O no hydrogen 3.535 N/A TYR 291.A N ILE 273.A O no hydrogen 3.111 N/A ARG 292.A N GLY 281.A O no hydrogen 3.186 N/A ARG 292.A NE ALA 279.A O no hydrogen 3.075 N/A ARG 292.A NE PRO 280.A O no hydrogen 3.193 N/A ARG 292.A NH1 GLN 789.A O no hydrogen 3.418 N/A ARG 292.A NH2 ALA 279.A O no hydrogen 2.893 N/A ARG 292.A NH2 GLN 789.A O no hydrogen 3.055 N/A SER 295.A N ARG 292.A O no hydrogen 2.529 N/A SER 295.A OG GLY 281.A O no hydrogen 2.884 N/A SER 295.A OG ARG 292.A O no hydrogen 3.511 N/A LEU 296.A N GLU 293.A O no hydrogen 3.307 N/A LEU 297.A N GLU 293.A O no hydrogen 2.794 N/A PHE 298.A N GLN 242.A O no hydrogen 3.234 N/A ASP 299.A N SER 303.A OG no hydrogen 2.919 N/A LYS 301.A N ASP 299.A OD1 no hydrogen 3.116 N/A LYS 301.A NZ ASN 721.A OD1 no hydrogen 2.542 N/A THR 302.A N ASP 299.A O no hydrogen 3.080 N/A THR 302.A OG1 ASP 299.A OD2 no hydrogen 2.507 N/A THR 302.A OG1 SER 753.A OG no hydrogen 2.914 N/A SER 303.A N ASP 299.A O no hydrogen 2.884 N/A SER 303.A OG ASP 299.A O no hydrogen 2.950 N/A SER 304.A N ASP 307.A OD2 no hydrogen 2.513 N/A SER 306.A N SER 304.A OG no hydrogen 3.063 N/A ASP 307.A N SER 304.A OG no hydrogen 3.326 N/A LYS 308.A N SER 304.A O no hydrogen 3.018 N/A LEU 309.A N ALA 305.A O no hydrogen 3.141 N/A TRP 310.A N SER 306.A O no hydrogen 2.853 N/A VAL 311.A N ASP 307.A O no hydrogen 2.830 N/A THR 312.A N LYS 308.A O no hydrogen 2.903 N/A THR 312.A OG1 TYR 245.A OH no hydrogen 2.615 N/A THR 312.A OG1 LYS 308.A O no hydrogen 2.665 N/A ARG 313.A N LEU 309.A O no hydrogen 2.960 N/A ARG 313.A NE GLU 347.A OE1 no hydrogen 2.688 N/A VAL 314.A N TRP 310.A O no hydrogen 2.892 N/A ILE 315.A N VAL 311.A O no hydrogen 2.984 N/A ALA 316.A N THR 312.A O no hydrogen 2.692 N/A HIS 317.A N ARG 313.A O no hydrogen 2.744 N/A HIS 317.A NE2 GLU 340.A OE1 no hydrogen 2.986 N/A GLU 318.A N VAL 314.A O no hydrogen 2.821 N/A LEU 319.A N ILE 315.A O no hydrogen 3.171 N/A ALA 320.A N ALA 316.A O no hydrogen 3.195 N/A HIS 321.A N GLU 318.A O no hydrogen 3.236 N/A HIS 321.A ND1 PHE 324.A O no hydrogen 2.917 N/A HIS 321.A NE2 GLU 340.A OE1 no hydrogen 2.843 N/A GLN 322.A N LEU 319.A O no hydrogen 2.993 N/A GLN 322.A NE2 GLU 284.A O no hydrogen 2.877 N/A GLN 322.A NE2 GLU 318.A O no hydrogen 3.392 N/A PHE 324.A N ALA 320.A O no hydrogen 2.729 N/A GLY 325.A N VAL 328.A O no hydrogen 2.869 N/A ASN 326.A N HIS 321.A O no hydrogen 2.639 N/A ASN 326.A ND2 GLU 284.A O no hydrogen 2.901 N/A LEU 327.A N GLN 322.A O no hydrogen 2.717 N/A VAL 328.A N TRP 323.A O no hydrogen 3.236 N/A THR 329.A N ARG 435.A O no hydrogen 3.224 N/A THR 329.A OG1 GLY 325.A O no hydrogen 2.536 N/A THR 329.A OG1 ASN 326.A O no hydrogen 3.405 N/A GLU 331.A N ALA 437.A O no hydrogen 2.710 N/A TRP 332.A NE1 ALA 387.A O no hydrogen 3.054 N/A ASP 335.A N TRP 332.A O no hydrogen 3.007 N/A ILE 336.A N TRP 333.A O no hydrogen 3.434 N/A TRP 337.A NE1 ASN 439.A OD1 no hydrogen 3.078 N/A LEU 338.A N ASP 335.A O no hydrogen 2.756 N/A LYS 339.A NZ GLU 147.A OE2 no hydrogen 2.894 N/A LYS 339.A NZ GLU 284.A OE1 no hydrogen 3.208 N/A LYS 339.A NZ GLU 284.A OE2 no hydrogen 2.786 N/A LYS 339.A NZ GLU 340.A OE2 no hydrogen 2.745 N/A GLU 340.A N ILE 336.A O no hydrogen 2.884 N/A GLY 341.A N TRP 337.A O no hydrogen 2.703 N/A ALA 343.A N LYS 339.A O no hydrogen 3.165 N/A LYS 344.A N GLU 340.A O no hydrogen 3.045 N/A LYS 344.A NZ GLU 347.A OE2 no hydrogen 3.438 N/A TYR 345.A N GLY 341.A O no hydrogen 2.917 N/A MET 346.A N PHE 342.A O no hydrogen 2.618 N/A GLU 347.A N ALA 343.A O no hydrogen 3.117 N/A GLU 347.A N LYS 344.A O no hydrogen 3.138 N/A LEU 348.A N TYR 345.A O no hydrogen 2.794 N/A ALA 350.A N MET 346.A O no hydrogen 3.097 N/A VAL 351.A N GLU 347.A O no hydrogen 3.029 N/A ASN 352.A N LEU 348.A O no hydrogen 3.176 N/A ALA 353.A N ILE 349.A O no hydrogen 2.915 N/A THR 354.A N ALA 350.A O no hydrogen 2.809 N/A THR 354.A OG1 ALA 350.A O no hydrogen 2.950 N/A TYR 355.A N VAL 351.A O no hydrogen 2.694 N/A TYR 355.A OH GLN 248.A OE1 no hydrogen 2.508 N/A GLU 357.A N GLU 357.A OE1 no hydrogen 2.726 N/A LEU 358.A N TYR 355.A O no hydrogen 2.792 N/A GLN 359.A N PRO 356.A O no hydrogen 2.918 N/A PHE 364.A N ASP 361.A O no hydrogen 3.394 N/A ASN 366.A N TYR 363.A O no hydrogen 3.114 N/A ASN 366.A ND2 TYR 363.A O no hydrogen 3.451 N/A VAL 367.A N PHE 364.A O no hydrogen 2.973 N/A CYS 368.A N LEU 365.A O no hydrogen 2.797 N/A CYS 368.A SG PHE 364.A O no hydrogen 3.810 N/A PHE 369.A N LEU 365.A O no hydrogen 2.767 N/A GLU 370.A N ASN 366.A O no hydrogen 2.979 N/A VAL 371.A N CYS 368.A O no hydrogen 3.148 N/A ILE 372.A N CYS 368.A O no hydrogen 3.319 N/A ILE 372.A N PHE 369.A O no hydrogen 2.693 N/A THR 373.A N PHE 369.A O no hydrogen 3.421 N/A THR 373.A OG1 GLU 370.A O no hydrogen 3.323 N/A ASP 375.A N VAL 371.A O no hydrogen 2.685 N/A SER 376.A OG THR 373.A O no hydrogen 3.490 N/A SER 376.A OG GLN 504.A OE1 no hydrogen 3.044 N/A LEU 377.A N LYS 374.A O no hydrogen 2.995 N/A SER 379.A N GLU 872.A OE1 no hydrogen 2.884 N/A SER 379.A OG THR 869.A OG1 no hydrogen 2.777 N/A SER 380.A N LEU 377.A O no hydrogen 3.398 N/A SER 380.A OG ASP 375.A OD1 no hydrogen 2.754 N/A SER 380.A OG ARG 381.A O no hydrogen 3.506 N/A ARG 381.A NE ASP 398.A OD2 no hydrogen 3.060 N/A ARG 381.A NH1 ILE 383.A O no hydrogen 2.909 N/A ARG 381.A NH2 ASP 398.A OD1 no hydrogen 2.537 N/A ARG 381.A NH2 SER 401.A OG no hydrogen 2.504 N/A SER 384.A N THR 478.A O no hydrogen 3.329 N/A SER 384.A OG ASP 335.A OD1 no hydrogen 2.816 N/A GLU 388.A N GLN 392.A OE1 no hydrogen 2.501 N/A THR 389.A N GLN 392.A OE1 no hydrogen 2.948 N/A GLN 392.A N THR 389.A OG1 no hydrogen 3.006 N/A ILE 393.A N THR 389.A O no hydrogen 2.937 N/A GLN 394.A N PRO 390.A O no hydrogen 2.873 N/A GLN 394.A NE2 ASP 824.A OD2 no hydrogen 3.385 N/A GLU 395.A N THR 391.A O no hydrogen 3.098 N/A GLU 395.A N GLN 392.A O no hydrogen 2.946 N/A MET 396.A N ILE 393.A O no hydrogen 3.220 N/A PHE 397.A N GLN 394.A O no hydrogen 3.375 N/A GLU 399.A N GLU 399.A OE1 no hydrogen 2.485 N/A VAL 400.A N ASP 398.A OD1 no hydrogen 3.293 N/A SER 401.A N ASP 398.A OD1 no hydrogen 3.403 N/A SER 401.A OG MET 396.A O no hydrogen 2.491 N/A TYR 402.A N ASP 398.A O no hydrogen 3.113 N/A ASN 403.A ND2 VAL 367.A O no hydrogen 2.948 N/A LYS 404.A N GLU 399.A O no hydrogen 2.934 N/A LYS 404.A NZ ASP 375.A OD1 no hydrogen 3.315 N/A LYS 404.A NZ ASP 375.A OD2 no hydrogen 2.900 N/A LYS 404.A NZ GLY 482.A O no hydrogen 3.486 N/A GLY 405.A N VAL 400.A O no hydrogen 3.138 N/A ALA 406.A N TYR 402.A O no hydrogen 2.914 N/A CYS 407.A N ASN 403.A O no hydrogen 2.762 N/A CYS 407.A SG ASN 403.A O no hydrogen 3.289 N/A ILE 408.A N LYS 404.A O no hydrogen 2.970 N/A LEU 409.A N GLY 405.A O no hydrogen 3.232 N/A ASN 410.A N ALA 406.A O no hydrogen 3.008 N/A ASN 410.A N CYS 407.A O no hydrogen 2.906 N/A MET 411.A N CYS 407.A O no hydrogen 2.895 N/A LEU 412.A N ILE 408.A O no hydrogen 2.784 N/A LYS 413.A N LEU 409.A O no hydrogen 3.071 N/A LYS 413.A NZ ASN 410.A OD1 no hydrogen 3.555 N/A ASP 414.A N ASN 410.A O no hydrogen 3.381 N/A ASP 414.A N MET 411.A O no hydrogen 2.843 N/A PHE 415.A N MET 411.A O no hydrogen 3.158 N/A LEU 416.A N LEU 412.A O no hydrogen 2.998 N/A GLY 417.A N LYS 413.A O no hydrogen 2.622 N/A PHE 421.A N GLY 417.A O no hydrogen 2.948 N/A GLN 422.A N GLU 418.A O no hydrogen 2.777 N/A GLN 422.A NE2 TYR 260.A O no hydrogen 3.378 N/A LYS 423.A N GLU 419.A O no hydrogen 3.303 N/A GLY 424.A N LYS 420.A O no hydrogen 2.944 N/A ILE 425.A N PHE 421.A O no hydrogen 2.782 N/A ILE 426.A N GLN 422.A O no hydrogen 2.952 N/A GLN 427.A N LYS 423.A O no hydrogen 2.925 N/A TYR 428.A N GLY 424.A O no hydrogen 3.060 N/A LEU 429.A N ILE 425.A O no hydrogen 2.933 N/A LYS 430.A N ILE 426.A O no hydrogen 3.212 N/A LYS 430.A NZ ASP 262.A OD2 no hydrogen 2.844 N/A LYS 431.A N GLN 427.A O no hydrogen 2.934 N/A SER 433.A N LYS 430.A O no hydrogen 3.412 N/A SER 433.A OG LEU 429.A O no hydrogen 2.636 N/A SER 433.A OG LYS 430.A O no hydrogen 3.227 N/A ARG 435.A N PHE 432.A O no hydrogen 3.010 N/A ARG 435.A NE LYS 431.A O no hydrogen 3.359 N/A ARG 435.A NH2 LYS 431.A O no hydrogen 2.831 N/A ASN 436.A ND2 PRO 161.A O no hydrogen 2.872 N/A ASN 436.A ND2 MET 330.A O no hydrogen 3.568 N/A ALA 437.A N THR 329.A O no hydrogen 3.001 N/A LYS 438.A N ASP 441.A OD2 no hydrogen 2.951 N/A ASN 439.A N ASP 335.A OD2 no hydrogen 2.441 N/A ASN 439.A ND2 THR 478.A OG1 no hydrogen 3.249 N/A ASP 441.A N LYS 438.A O no hydrogen 2.932 N/A LEU 442.A N ASN 439.A O no hydrogen 3.079 N/A SER 444.A N ASP 440.A O no hydrogen 3.025 N/A SER 444.A OG ASP 440.A O no hydrogen 3.044 N/A SER 445.A N ASP 441.A O no hydrogen 2.948 N/A SER 445.A OG ASP 441.A O no hydrogen 2.758 N/A LEU 446.A N LEU 442.A O no hydrogen 2.743 N/A SER 447.A N TRP 443.A O no hydrogen 2.581 N/A SER 447.A OG TRP 443.A O no hydrogen 2.763 N/A SER 447.A OG SER 444.A O no hydrogen 2.816 N/A SER 447.A OG ASN 448.A OD1 no hydrogen 2.652 N/A ASN 448.A N SER 444.A O no hydrogen 2.893 N/A SER 449.A OG LEU 446.A O no hydrogen 3.333 N/A SER 449.A OG SER 447.A O no hydrogen 3.485 N/A SER 458.A OG ASN 459.A OD1 no hydrogen 3.518 N/A GLY 465.A N LEU 461.A O no hydrogen 3.052 N/A GLU 466.A N ALA 462.A O no hydrogen 2.599 N/A ASN 467.A N PHE 463.A O no hydrogen 2.752 N/A GLU 469.A N GLY 465.A O no hydrogen 3.088 N/A VAL 470.A N GLU 466.A O no hydrogen 3.033 N/A LYS 471.A N ASN 467.A O no hydrogen 3.065 N/A LYS 471.A NZ ASP 440.A OD1 no hydrogen 2.790 N/A GLU 472.A N ALA 468.A O no hydrogen 2.971 N/A MET 473.A N GLU 469.A O no hydrogen 2.858 N/A THR 475.A N LYS 471.A O no hydrogen 3.429 N/A THR 475.A OG1 GLU 472.A O no hydrogen 2.453 N/A THR 476.A N MET 473.A O no hydrogen 2.730 N/A THR 476.A OG1 MET 473.A O no hydrogen 2.467 N/A THR 478.A N MET 474.A O no hydrogen 3.213 N/A THR 478.A OG1 MET 474.A O no hydrogen 3.423 N/A THR 478.A OG1 THR 475.A O no hydrogen 3.100 N/A LEU 479.A N THR 475.A O no hydrogen 3.207 N/A GLN 480.A N THR 476.A O no hydrogen 3.230 N/A GLN 480.A NE2 THR 476.A O no hydrogen 3.196 N/A GLN 480.A NE2 LEU 521.A O no hydrogen 2.625 N/A LYS 481.A NZ ASN 378.A O no hydrogen 2.782 N/A LYS 481.A NZ ASN 378.A OD1 no hydrogen 3.193 N/A LEU 485.A N GLU 500.A O no hydrogen 2.446 N/A LEU 486.A N ILE 568.A O no hydrogen 2.743 N/A VAL 487.A N GLN 498.A O no hydrogen 2.938 N/A VAL 488.A N HIS 570.A O no hydrogen 2.940 N/A LYS 489.A N ARG 496.A O no hydrogen 3.017 N/A GLN 490.A NE2 THR 554.A O no hydrogen 3.081 N/A ASP 491.A N SER 494.A O no hydrogen 2.810 N/A SER 494.A N ASP 491.A O no hydrogen 3.077 N/A LEU 495.A N LEU 548.A O no hydrogen 3.021 N/A ARG 496.A N LYS 489.A O no hydrogen 2.966 N/A ARG 496.A NH2 ASP 491.A OD2 no hydrogen 3.548 N/A LEU 497.A N ASP 546.A O no hydrogen 2.643 N/A GLN 498.A N VAL 487.A O no hydrogen 2.972 N/A GLN 499.A N LYS 544.A O no hydrogen 3.067 N/A GLN 499.A NE2 TRP 522.A O no hydrogen 3.113 N/A GLN 499.A NE2 SER 543.A O no hydrogen 3.174 N/A GLU 500.A N LEU 485.A O no hydrogen 2.908 N/A ARG 501.A N GLN 517.A OE1 no hydrogen 3.259 N/A ARG 501.A NH1 LEU 516.A O no hydrogen 3.028 N/A ARG 501.A NH2 ASN 378.A OD1 no hydrogen 2.799 N/A PHE 502.A N ILE 483.A O no hydrogen 3.013 N/A GLN 504.A NE2 GLN 604.A OE1 no hydrogen 3.250 N/A GLN 508.A NE2 GLU 500.A OE2 no hydrogen 2.833 N/A ASP 510.A N PHE 507.A O no hydrogen 3.055 N/A GLU 512.A N ASP 510.A OD2 no hydrogen 3.219 N/A TRP 513.A N ASP 510.A O no hydrogen 3.109 N/A ALA 515.A N GLU 512.A O no hydrogen 3.106 N/A LEU 516.A N GLU 512.A O no hydrogen 3.301 N/A GLN 517.A N ARG 514.A O no hydrogen 3.423 N/A GLN 517.A NE2 ARG 501.A O no hydrogen 3.198 N/A GLU 518.A N ALA 515.A O no hydrogen 3.059 N/A LEU 521.A N GLN 480.A OE1 no hydrogen 2.802 N/A TRP 522.A N GLN 499.A OE1 no hydrogen 2.487 N/A HIS 523.A ND1 GLU 469.A OE2.B no hydrogen 3.200 N/A LEU 526.A N HIS 539.A O no hydrogen 2.988 N/A TYR 528.A N HIS 537.A O no hydrogen 3.069 N/A SER 529.A N LYS 558.A O no hydrogen 3.040 N/A THR 530.A N SER 533.A O no hydrogen 3.269 N/A THR 530.A OG1 SER 532.A OG no hydrogen 3.409 N/A THR 530.A OG1 SER 533.A O no hydrogen 3.379 N/A SER 531.A N TRP 556.A O no hydrogen 3.212 N/A SER 531.A OG THR 554.A OG1 no hydrogen 3.116 N/A SER 531.A OG TRP 556.A O no hydrogen 3.070 N/A SER 532.A OG THR 530.A OG1 no hydrogen 3.409 N/A SER 533.A N THR 530.A O no hydrogen 3.104 N/A SER 533.A N THR 530.A OG1 no hydrogen 3.250 N/A HIS 537.A N TYR 528.A O no hydrogen 3.064 N/A HIS 539.A N LEU 526.A O no hydrogen 3.174 N/A LYS 542.A NZ GLU 469.A OE1.B no hydrogen 2.492 N/A LYS 542.A NZ GLU 469.A OE2.A no hydrogen 3.182 N/A SER 543.A OG THR 545.A O no hydrogen 3.298 N/A ASP 546.A N LEU 497.A O no hydrogen 2.896 N/A LEU 548.A N LEU 495.A O no hydrogen 2.932 N/A LEU 550.A N CYS 493.A O no hydrogen 2.624 N/A LYS 553.A N PRO 551.A O no hydrogen 2.554 N/A THR 554.A OG1 SER 531.A OG no hydrogen 3.116 N/A SER 555.A N THR 554.A OG1 no hydrogen 2.720 N/A TRP 556.A N SER 531.A OG no hydrogen 2.909 N/A TRP 556.A NE1 GLN 582.A OE1 no hydrogen 2.862 N/A LYS 558.A N SER 529.A O no hydrogen 2.812 N/A LYS 558.A NZ PHE 559.A O no hydrogen 3.182 N/A LYS 558.A NZ ASN 560.A O no hydrogen 2.881 N/A LYS 558.A NZ ASP 594.A OD1 no hydrogen 2.790 N/A PHE 559.A N TYR 571.A OH no hydrogen 2.837 N/A ASN 560.A N THR 527.A O no hydrogen 3.345 N/A ASN 560.A ND2 GLY 565.A O no hydrogen 3.036 N/A ASN 560.A ND2 TYR 567.A O no hydrogen 3.198 N/A VAL 561.A N THR 527.A OG1 no hydrogen 3.184 N/A ASP 562.A N ASP 594.A OD1 no hydrogen 2.437 N/A SER 563.A N ASN 560.A O no hydrogen 3.191 N/A SER 563.A OG LYS 593.A O no hydrogen 3.251 N/A ASN 564.A N VAL 561.A O no hydrogen 3.508 N/A GLY 565.A N ASN 560.A OD1 no hydrogen 3.094 N/A TYR 566.A OH ASP 375.A OD2 no hydrogen 2.567 N/A TYR 567.A N GLY 565.A O no hydrogen 2.765 N/A ILE 568.A N PRO 484.A O no hydrogen 3.171 N/A VAL 569.A N ASP 601.A OD2 no hydrogen 3.018 N/A HIS 570.A N LEU 486.A O no hydrogen 2.828 N/A TRP 576.A NE1 HIS 570.A ND1 no hydrogen 2.655 N/A GLN 578.A N HIS 574.A O no hydrogen 2.580 N/A LEU 579.A N GLY 575.A O no hydrogen 2.795 N/A ILE 580.A N TRP 576.A O no hydrogen 3.002 N/A THR 581.A N ASP 577.A O no hydrogen 2.866 N/A THR 581.A OG1 ASP 577.A O no hydrogen 3.312 N/A GLN 582.A N GLN 578.A O no hydrogen 2.782 N/A GLN 582.A NE2 GLN 582.A O no hydrogen 3.147 N/A GLN 582.A NE2 ASN 586.A O no hydrogen 2.929 N/A LEU 583.A N LEU 579.A O no hydrogen 2.694 N/A ASN 584.A N THR 581.A O no hydrogen 2.855 N/A ASN 584.A ND2 ILE 580.A O no hydrogen 2.911 N/A GLN 585.A N THR 581.A O no hydrogen 3.197 N/A GLN 585.A N GLN 582.A O no hydrogen 3.399 N/A THR 588.A OG1 ASN 586.A OD1 no hydrogen 2.770 N/A LEU 589.A N ASN 586.A O no hydrogen 2.963 N/A LEU 590.A N HIS 587.A O no hydrogen 2.810 N/A ARG 591.A NE ASP 562.A OD2 no hydrogen 2.827 N/A ARG 591.A NH2 ASP 562.A OD2 no hydrogen 2.982 N/A LYS 593.A NZ ASP 361.A OD1 no hydrogen 3.287 N/A LYS 593.A NZ ASP 361.A OD2 no hydrogen 2.704 N/A ARG 595.A N ARG 591.A O no hydrogen 2.803 N/A ARG 595.A NE LEU 590.A O no hydrogen 3.370 N/A ARG 595.A NH1 GLU 626.A OE2 no hydrogen 2.837 N/A VAL 596.A N PRO 592.A O no hydrogen 2.983 N/A GLY 597.A N LYS 593.A O no hydrogen 3.024 N/A LEU 598.A N ASP 594.A O no hydrogen 2.872 N/A ILE 599.A N ARG 595.A O no hydrogen 2.921 N/A HIS 600.A N VAL 596.A O no hydrogen 3.229 N/A HIS 600.A ND1 ASP 601.A OD1 no hydrogen 3.230 N/A ASP 601.A N GLY 597.A O no hydrogen 2.754 N/A VAL 602.A N LEU 598.A O no hydrogen 2.588 N/A PHE 603.A N ILE 599.A O no hydrogen 3.465 N/A GLN 604.A N HIS 600.A O no hydrogen 3.057 N/A LEU 605.A N VAL 602.A O no hydrogen 3.028 N/A GLY 609.A N VAL 606.A O no hydrogen 3.149 N/A ARG 610.A N LEU 605.A O no hydrogen 3.034 N/A THR 612.A OG1 ASP 614.A OD1 no hydrogen 2.542 N/A LYS 615.A N THR 612.A O no hydrogen 2.694 N/A LEU 617.A N LEU 613.A O no hydrogen 2.976 N/A ASP 618.A N LYS 615.A O no hydrogen 2.859 N/A MET 619.A N LYS 615.A O no hydrogen 2.840 N/A MET 619.A N ALA 616.A O no hydrogen 3.125 N/A THR 620.A N ALA 616.A O no hydrogen 3.286 N/A THR 620.A OG1 LEU 617.A O no hydrogen 3.206 N/A THR 620.A OG1 TYR 661.A OH no hydrogen 3.398 N/A TYR 621.A OH ASN 895.A OD1 no hydrogen 2.819 N/A TYR 622.A N MET 619.A O no hydrogen 3.190 N/A TYR 622.A OH GLU 626.A OE2 no hydrogen 2.675 N/A LEU 623.A N THR 620.A O no hydrogen 3.136 N/A GLN 624.A N TYR 621.A O no hydrogen 3.391 N/A HIS 625.A N TYR 622.A O no hydrogen 2.878 N/A GLU 626.A N TYR 622.A O no hydrogen 3.192 N/A GLU 626.A N LEU 623.A O no hydrogen 2.962 N/A THR 627.A N GLU 626.A OE1 no hydrogen 2.815 N/A SER 628.A N GLU 626.A OE1 no hydrogen 3.085 N/A ALA 631.A N SER 628.A O no hydrogen 3.046 N/A LEU 632.A N SER 628.A O no hydrogen 3.100 N/A LEU 633.A N SER 629.A O no hydrogen 2.847 N/A GLU 634.A N PRO 630.A O no hydrogen 3.237 N/A GLY 635.A N ALA 631.A O no hydrogen 3.218 N/A LEU 636.A N LEU 632.A O no hydrogen 2.868 N/A SER 637.A N GLU 634.A O no hydrogen 3.003 N/A SER 637.A OG GLU 634.A O no hydrogen 2.920 N/A TYR 638.A N GLU 634.A O no hydrogen 3.333 N/A TYR 638.A N GLY 635.A O no hydrogen 2.716 N/A TYR 638.A OH GLU 634.A OE2 no hydrogen 3.233 N/A GLU 640.A N LEU 636.A O no hydrogen 3.164 N/A SER 641.A N SER 637.A O no hydrogen 2.914 N/A PHE 642.A N TYR 638.A O no hydrogen 2.957 N/A TYR 643.A N LEU 639.A O no hydrogen 3.049 N/A HIS 644.A N GLU 640.A O no hydrogen 3.088 N/A MET 645.A N SER 641.A O no hydrogen 2.896 N/A MET 646.A N PHE 642.A O no hydrogen 2.710 N/A ASP 647.A N TYR 643.A O no hydrogen 2.772 N/A ARG 648.A N MET 645.A O no hydrogen 3.242 N/A ARG 648.A NE ARG 800.A O no hydrogen 3.115 N/A ARG 649.A N MET 646.A O no hydrogen 2.908 N/A SER 652.A OG ASN 650.A O no hydrogen 2.803 N/A SER 655.A N ILE 651.A O no hydrogen 2.992 N/A SER 655.A OG ILE 651.A O no hydrogen 3.257 N/A SER 655.A OG SER 652.A O no hydrogen 3.163 N/A GLU 656.A N SER 652.A O no hydrogen 2.984 N/A ASN 657.A N ASP 653.A O no hydrogen 3.324 N/A ASN 657.A N ILE 654.A O no hydrogen 3.136 N/A ASN 657.A ND2 ASP 653.A O no hydrogen 3.412 N/A LEU 658.A N ILE 654.A O no hydrogen 2.873 N/A LYS 659.A N SER 655.A O no hydrogen 2.791 N/A ARG 660.A N GLU 656.A O no hydrogen 3.184 N/A TYR 661.A N ASN 657.A O no hydrogen 2.761 N/A TYR 661.A OH THR 620.A OG1 no hydrogen 3.398 N/A LEU 662.A N LEU 658.A O no hydrogen 2.925 N/A LEU 663.A N LYS 659.A O no hydrogen 3.029 N/A GLN 664.A N ARG 660.A O no hydrogen 2.996 N/A TYR 665.A N TYR 661.A O no hydrogen 3.084 N/A TYR 665.A OH TYR 621.A O no hydrogen 2.688 N/A LYS 667.A NZ ASP 671.A OD2 no hydrogen 3.140 N/A ILE 670.A N PHE 666.A O no hydrogen 2.738 N/A ASP 671.A N PRO 668.A O no hydrogen 2.964 N/A ARG 672.A N VAL 669.A O no hydrogen 3.291 N/A GLN 673.A NE2 VAL 669.A O no hydrogen 2.882 N/A SER 674.A OG SER 676.A OG no hydrogen 3.223 N/A SER 676.A OG SER 674.A OG no hydrogen 3.223 N/A LYS 678.A N SER 676.A OG no hydrogen 2.598 N/A SER 680.A N ASP 683.A OD2 no hydrogen 3.200 N/A TRP 682.A NE1 GLN 359.A O no hydrogen 2.954 N/A ARG 684.A N SER 680.A O no hydrogen 2.781 N/A ARG 684.A NE ASP 725.A OD2 no hydrogen 2.733 N/A MET 685.A N VAL 681.A O no hydrogen 2.648 N/A LEU 686.A N TRP 682.A O no hydrogen 2.954 N/A ARG 687.A N ASP 683.A O no hydrogen 3.051 N/A ARG 687.A NH2 LYS 678.A O no hydrogen 2.505 N/A ARG 687.A NH2 ASP 725.A OD2 no hydrogen 3.490 N/A SER 688.A N ARG 684.A O no hydrogen 3.243 N/A SER 688.A OG ARG 684.A O no hydrogen 3.524 N/A SER 688.A OG ASP 725.A O no hydrogen 2.299 N/A ALA 689.A N MET 685.A O no hydrogen 3.053 N/A LEU 690.A N LEU 686.A O no hydrogen 3.087 N/A LEU 691.A N ARG 687.A O no hydrogen 2.931 N/A LYS 692.A N SER 688.A O no hydrogen 2.799 N/A LYS 692.A NZ ASP 696.A OD2 no hydrogen 2.706 N/A LYS 692.A NZ TYR 762.A OH no hydrogen 3.224 N/A LEU 693.A N ALA 689.A O no hydrogen 2.861 N/A ALA 694.A N LEU 690.A O no hydrogen 2.693 N/A CYS 695.A N LEU 691.A O no hydrogen 2.850 N/A CYS 695.A SG LEU 691.A O no hydrogen 3.429 N/A CYS 695.A SG CYS 702.A O no hydrogen 3.168 N/A ASP 696.A N LYS 692.A O no hydrogen 2.756 N/A ASP 696.A N LEU 693.A O no hydrogen 3.166 N/A LEU 697.A N LEU 693.A O no hydrogen 2.973 N/A LEU 697.A N ALA 694.A O no hydrogen 2.935 N/A HIS 699.A N ALA 694.A O no hydrogen 3.150 N/A CYS 702.A N HIS 699.A O no hydrogen 2.801 N/A GLN 704.A N ALA 700.A O no hydrogen 3.052 N/A GLN 704.A N PRO 701.A O no hydrogen 2.810 N/A LYS 705.A N PRO 701.A O no hydrogen 2.945 N/A ALA 706.A N CYS 702.A O no hydrogen 3.259 N/A ALA 707.A N ILE 703.A O no hydrogen 2.956 N/A GLU 708.A N GLN 704.A O no hydrogen 2.973 N/A GLU 708.A N LYS 705.A O no hydrogen 3.175 N/A LEU 709.A N LYS 705.A O no hydrogen 3.125 N/A PHE 710.A N ALA 706.A O no hydrogen 2.919 N/A SER 711.A N ALA 707.A O no hydrogen 3.173 N/A SER 711.A OG GLU 715.A OE2 no hydrogen 3.396 N/A GLN 712.A N GLU 708.A O no hydrogen 2.855 N/A TRP 713.A N LEU 709.A O no hydrogen 2.879 N/A MET 714.A N PHE 710.A O no hydrogen 2.877 N/A GLU 715.A N SER 711.A O no hydrogen 3.006 N/A SER 716.A N GLN 712.A O no hydrogen 3.215 N/A SER 716.A OG GLN 712.A O no hydrogen 2.760 N/A SER 716.A OG TRP 713.A O no hydrogen 3.019 N/A GLY 718.A N TRP 713.A O no hydrogen 3.374 N/A LYS 719.A N SER 716.A O no hydrogen 3.210 N/A LEU 720.A N SER 716.A OG no hydrogen 2.861 N/A THR 724.A N ASP 677.A OD2 no hydrogen 2.968 N/A THR 724.A OG1 ASP 677.A OD1 no hydrogen 2.996 N/A ASP 725.A N ASP 677.A OD1 no hydrogen 2.737 N/A VAL 726.A N PRO 723.A O no hydrogen 3.293 N/A LEU 727.A N THR 724.A O no hydrogen 3.043 N/A VAL 730.A N VAL 726.A O no hydrogen 2.958 N/A TYR 731.A N LEU 727.A O no hydrogen 3.019 N/A TYR 731.A OH GLU 756.A OE2 no hydrogen 2.895 N/A SER 732.A N LYS 728.A O no hydrogen 3.029 N/A SER 732.A OG LYS 728.A O no hydrogen 2.151 N/A SER 732.A OG ILE 729.A O no hydrogen 2.960 N/A VAL 733.A N ILE 729.A O no hydrogen 2.919 N/A GLY 734.A N VAL 730.A O no hydrogen 2.930 N/A ALA 735.A N SER 732.A O no hydrogen 2.953 N/A GLN 736.A N VAL 733.A O no hydrogen 3.368 N/A GLN 736.A NE2 SER 732.A O no hydrogen 2.999 N/A GLN 736.A NE2 THR 766.A O no hydrogen 2.873 N/A TRP 741.A N THR 737.A O no hydrogen 3.104 N/A TRP 741.A NE1 LEU 764.A O no hydrogen 3.023 N/A ASN 742.A N THR 738.A O no hydrogen 2.939 N/A TYR 743.A N ALA 739.A O no hydrogen 2.814 N/A LEU 744.A N GLY 740.A O no hydrogen 2.617 N/A LEU 745.A N TRP 741.A O no hydrogen 2.940 N/A GLU 746.A N ASN 742.A O no hydrogen 3.121 N/A GLN 747.A N TYR 743.A O no hydrogen 2.849 N/A GLN 747.A NE2 GLU 756.A OE2 no hydrogen 3.414 N/A TYR 748.A N LEU 744.A O no hydrogen 2.901 N/A GLU 749.A N LEU 745.A O no hydrogen 3.281 N/A LEU 750.A N GLN 747.A O no hydrogen 3.338 N/A SER 751.A N GLN 747.A O no hydrogen 3.186 N/A SER 751.A OG SER 753.A O no hydrogen 3.365 N/A SER 751.A OG GLU 756.A OE1 no hydrogen 2.685 N/A SER 753.A N SER 751.A OG no hydrogen 3.194 N/A SER 753.A OG THR 302.A OG1 no hydrogen 2.914 N/A SER 754.A OG GLU 293.A OE2 no hydrogen 2.628 N/A ALA 755.A N SER 753.A OG no hydrogen 3.258 N/A GLU 756.A N SER 753.A OG no hydrogen 3.240 N/A GLN 757.A N SER 753.A O no hydrogen 2.994 N/A GLN 757.A NE2 TYR 748.A O no hydrogen 2.735 N/A ASN 758.A N SER 754.A O no hydrogen 3.206 N/A LYS 759.A N ALA 755.A O no hydrogen 3.060 N/A LYS 759.A NZ ASP 307.A OD2 no hydrogen 2.943 N/A ILE 760.A N GLU 756.A O no hydrogen 2.817 N/A LEU 761.A N GLN 757.A O no hydrogen 2.988 N/A TYR 762.A N ASN 758.A O no hydrogen 3.170 N/A ALA 763.A N LYS 759.A O no hydrogen 3.091 N/A LEU 764.A N ILE 760.A O no hydrogen 2.729 N/A SER 765.A N TYR 762.A O no hydrogen 2.813 N/A SER 765.A OG LEU 761.A O no hydrogen 3.414 N/A SER 765.A OG TYR 762.A O no hydrogen 2.735 N/A THR 766.A N ALA 763.A O no hydrogen 3.065 N/A THR 766.A OG1 ALA 763.A O no hydrogen 2.883 N/A LYS 768.A NZ GLN 736.A OE1 no hydrogen 3.528 N/A LYS 768.A NZ THR 766.A O no hydrogen 2.949 N/A HIS 769.A N SER 767.A OG no hydrogen 3.130 N/A GLN 770.A NE2 LYS 803.A O no hydrogen 2.744 N/A LYS 772.A NZ THR 738.A OG1 no hydrogen 2.913 N/A LEU 773.A N HIS 769.A O no hydrogen 3.134 N/A LEU 774.A N GLN 770.A O no hydrogen 3.091 N/A LYS 775.A N GLU 771.A O no hydrogen 3.073 N/A LEU 776.A N LYS 772.A O no hydrogen 3.257 N/A ILE 777.A N LEU 773.A O no hydrogen 3.202 N/A GLU 778.A N LEU 774.A O no hydrogen 2.804 N/A LEU 779.A N LYS 775.A O no hydrogen 2.659 N/A GLY 780.A N LEU 776.A O no hydrogen 2.701 N/A MET 781.A N ILE 777.A O no hydrogen 2.817 N/A GLU 782.A N GLU 778.A O no hydrogen 2.907 N/A GLY 783.A N LEU 779.A O no hydrogen 2.968 N/A LYS 787.A NZ THR 130.A O no hydrogen 2.938 N/A LYS 787.A NZ ASP 277.A OD1 no hydrogen 2.832 N/A LYS 787.A NZ ASP 277.A OD2 no hydrogen 3.024 N/A ASN 790.A N LYS 787.A O no hydrogen 2.765 N/A LEU 791.A N THR 788.A O no hydrogen 2.871 N/A LEU 794.A N ASN 790.A O no hydrogen 3.175 N/A LEU 795.A N LEU 791.A O no hydrogen 2.915 N/A HIS 796.A N ALA 792.A O no hydrogen 2.958 N/A ALA 797.A N ALA 793.A O no hydrogen 2.742 N/A ILE 798.A N LEU 794.A O no hydrogen 2.950 N/A ALA 799.A N LEU 795.A O no hydrogen 2.819 N/A ARG 800.A N ALA 797.A O no hydrogen 3.307 N/A ARG 801.A N ILE 798.A O no hydrogen 3.161 N/A GLY 804.A N ARG 801.A O no hydrogen 2.829 N/A GLN 805.A N ARG 801.A O no hydrogen 3.320 N/A GLN 805.A NE2 ARG 648.A O no hydrogen 3.084 N/A ALA 808.A N GLY 804.A O no hydrogen 2.931 N/A TRP 809.A N GLN 805.A O no hydrogen 3.312 N/A ASP 810.A N GLN 806.A O no hydrogen 2.918 N/A PHE 811.A N LEU 807.A O no hydrogen 2.832 N/A VAL 812.A N ALA 808.A O no hydrogen 2.852 N/A ARG 813.A N TRP 809.A O no hydrogen 2.968 N/A ARG 813.A NH1 GLU 849.A OE1 no hydrogen 2.870 N/A ARG 813.A NH2 ASP 810.A OD1 no hydrogen 3.163 N/A GLU 814.A N ASP 810.A O no hydrogen 3.002 N/A ASN 815.A N VAL 812.A O no hydrogen 2.866 N/A ASN 815.A ND2 PHE 811.A O no hydrogen 2.927 N/A LEU 819.A N ASN 815.A O no hydrogen 3.022 N/A LEU 820.A N TRP 816.A O no hydrogen 3.148 N/A LEU 820.A N THR 817.A O no hydrogen 3.167 N/A LYS 821.A N THR 817.A O no hydrogen 3.389 N/A LYS 821.A N HIS 818.A O no hydrogen 2.955 N/A LYS 822.A N LEU 819.A O no hydrogen 3.056 N/A LYS 822.A NZ MET 781.A O no hydrogen 2.784 N/A PHE 823.A N LEU 819.A O no hydrogen 3.072 N/A SER 827.A N ASP 824.A O no hydrogen 2.711 N/A SER 827.A OG ASP 824.A O no hydrogen 2.187 N/A ILE 830.A N SER 827.A O no hydrogen 3.220 N/A ARG 831.A N SER 827.A O no hydrogen 3.135 N/A ARG 831.A NH1 PHE 397.A O no hydrogen 2.668 N/A ARG 831.A NH2 GLN 394.A O no hydrogen 3.518 N/A MET 832.A N TYR 828.A O no hydrogen 2.886 N/A ILE 833.A N ASP 829.A O no hydrogen 2.949 N/A ILE 834.A N ILE 830.A O no hydrogen 2.830 N/A SER 835.A N ARG 831.A O no hydrogen 3.143 N/A GLY 836.A N MET 832.A O no hydrogen 2.971 N/A THR 837.A N ILE 834.A O no hydrogen 3.356 N/A THR 837.A OG1 ILE 833.A O no hydrogen 2.504 N/A THR 837.A OG1 ILE 834.A O no hydrogen 2.940 N/A THR 838.A N SER 835.A O no hydrogen 3.266 N/A THR 838.A OG1 ILE 834.A O no hydrogen 3.024 N/A ALA 839.A N SER 835.A O no hydrogen 2.919 N/A HIS 840.A NE2 GLY 836.A O no hydrogen 3.179 N/A PHE 841.A N THR 838.A O no hydrogen 3.110 N/A LYS 846.A N SER 843.A OG no hydrogen 2.923 N/A LYS 846.A NZ GLN 806.A OE1 no hydrogen 2.612 N/A LYS 846.A NZ GLU 849.A OE2 no hydrogen 3.452 N/A LEU 847.A N SER 843.A O no hydrogen 3.032 N/A GLN 848.A N LYS 844.A O no hydrogen 3.048 N/A GLU 849.A N ASP 845.A O no hydrogen 3.225 N/A VAL 850.A N LYS 846.A O no hydrogen 2.920 N/A LYS 851.A N LEU 847.A O no hydrogen 2.978 N/A LEU 852.A N GLN 848.A O no hydrogen 3.219 N/A PHE 853.A N GLU 849.A O no hydrogen 3.111 N/A PHE 854.A N VAL 850.A O no hydrogen 3.016 N/A GLU 855.A N LYS 851.A O no hydrogen 3.048 N/A SER 856.A N LEU 852.A O no hydrogen 2.826 N/A LEU 857.A N PHE 853.A O no hydrogen 3.064 N/A GLU 858.A N PHE 854.A O no hydrogen 2.916 N/A GLU 858.A N GLU 855.A O no hydrogen 3.012 N/A SER 862.A OG GLY 861.A O no hydrogen 2.944 N/A HIS 863.A ND1 GLU 858.A OE2 no hydrogen 2.710 N/A ASP 865.A N GLU 395.A OE1 no hydrogen 2.796 N/A PHE 867.A N LEU 864.A O no hydrogen 2.834 N/A GLN 868.A N ASP 865.A O no hydrogen 3.256 N/A THR 869.A N ASP 865.A O no hydrogen 3.389 N/A THR 869.A OG1 SER 379.A OG no hydrogen 2.777 N/A THR 869.A OG1 ASP 865.A O no hydrogen 3.322 N/A VAL 870.A N ILE 866.A O no hydrogen 3.056 N/A LEU 871.A N PHE 867.A O no hydrogen 3.190 N/A GLU 872.A N GLN 868.A O no hydrogen 2.756 N/A THR 873.A N THR 869.A O no hydrogen 2.976 N/A THR 873.A OG1 THR 869.A O no hydrogen 3.004 N/A ILE 874.A N VAL 870.A O no hydrogen 2.807 N/A THR 875.A N LEU 871.A O no hydrogen 2.967 N/A THR 875.A OG1 LEU 871.A O no hydrogen 3.273 N/A LYS 876.A N GLU 872.A O no hydrogen 2.893 N/A LYS 876.A NZ GLN 504.A OE1 no hydrogen 2.985 N/A ASN 877.A N THR 873.A O no hydrogen 3.084 N/A ASN 877.A ND2 ALA 839.A O no hydrogen 3.236 N/A ASN 877.A ND2 PHE 841.A O no hydrogen 2.814 N/A ILE 878.A N ILE 874.A O no hydrogen 2.964 N/A LYS 879.A N THR 875.A O no hydrogen 2.815 N/A LYS 879.A NZ GLY 505.A O no hydrogen 2.130 N/A TRP 880.A N LYS 876.A O no hydrogen 2.733 N/A LEU 881.A N ASN 877.A O no hydrogen 3.013 N/A GLU 882.A N ILE 878.A O no hydrogen 2.988 N/A LYS 883.A N LYS 879.A O no hydrogen 3.084 N/A ASN 884.A N LEU 881.A O no hydrogen 3.227 N/A LEU 885.A N LEU 881.A O no hydrogen 2.655 N/A LEU 888.A N ASN 884.A O no hydrogen 3.184 N/A LEU 888.A N LEU 885.A O no hydrogen 3.047 N/A ARG 889.A N LEU 885.A O no hydrogen 3.086 N/A ARG 889.A NH1 ASP 653.A OD2 no hydrogen 2.254 N/A THR 890.A N PRO 886.A O no hydrogen 2.901 N/A THR 890.A OG1 PRO 886.A O no hydrogen 3.384 N/A TRP 891.A N THR 887.A O no hydrogen 2.864 N/A TRP 891.A NE1 ASP 618.A OD1 no hydrogen 2.733 N/A LEU 892.A N LEU 888.A O no hydrogen 3.172 N/A MET 893.A N ARG 889.A O no hydrogen 2.926 N/A VAL 894.A N THR 890.A O no hydrogen 2.732 N/A ASN 895.A N TRP 891.A O no hydrogen 3.060 N/A THR 896.A N LEU 892.A O no hydrogen 3.086 N/A THR 896.A OG1 LEU 892.A O no hydrogen 3.340 N/A ARG 897.A N VAL 894.A O no hydrogen 3.217 N/A HIS 898.A ND1.A HIS 899.A ND1 no hydrogen 3.339 N/A