Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 6ik6_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): SER 3.A N ASN 14.A OD1 no hydrogen 3.226 N/A SER 5.A N ILE 12.A O no hydrogen 2.730 N/A TYR 6.A N SER 5.A OG no hydrogen 2.734 N/A TYR 6.A OH PRO 203.A O no hydrogen 2.801 N/A ASP 7.A N ALA 10.A O no hydrogen 3.149 N/A ARG 9.A N ASP 7.A OD2 no hydrogen 2.596 N/A ARG 9.A NE LEU 323.A O no hydrogen 3.212 N/A ARG 9.A NE SER 326.A O no hydrogen 3.063 N/A ARG 9.A NH2 LEU 323.A O no hydrogen 3.329 N/A ALA 10.A N ASP 7.A OD2 no hydrogen 3.311 N/A ILE 12.A N SER 5.A O no hydrogen 2.321 N/A ASN 14.A N SER 3.A O no hydrogen 2.607 N/A ASN 14.A ND2 GLU 146.A OE2 no hydrogen 2.894 N/A LYS 16.A N ILE 13.A O no hydrogen 3.344 N/A ARG 17.A NE ASP 7.A OD1 no hydrogen 2.844 N/A ARG 17.A NH1 VAL 324.A O no hydrogen 2.657 N/A ARG 17.A NH2 ASP 7.A OD1 no hydrogen 3.115 N/A ARG 17.A NH2 TYR 327.A OH no hydrogen 3.467 N/A LYS 18.A N ILE 11.A O no hydrogen 3.117 N/A ILE 19.A N GLU 320.A OE2 no hydrogen 3.198 N/A LEU 20.A N SER 263.A O no hydrogen 3.038 N/A ILE 21.A N ASP 48.A OD2 no hydrogen 3.134 N/A SER 22.A N PHE 265.A O no hydrogen 2.957 N/A SER 22.A OG VAL 49.A O no hydrogen 3.340 N/A SER 22.A OG ASN 266.A OD1 no hydrogen 2.776 N/A GLY 23.A N VAL 49.A O no hydrogen 3.208 N/A SER 24.A N TYR 267.A O no hydrogen 2.983 N/A SER 24.A OG TYR 267.A O no hydrogen 3.318 N/A ILE 25.A N GLU 51.A O no hydrogen 2.802 N/A TYR 27.A OH HIS 59.A NE2 no hydrogen 2.791 N/A ARG 29.A N HIS 26.A O no hydrogen 2.955 N/A ARG 29.A NE ASN 275.A OD1 no hydrogen 2.884 N/A ARG 29.A NH1 HIS 26.A ND1 no hydrogen 3.166 N/A ARG 29.A NH1 ALA 98.A O no hydrogen 3.192 N/A ARG 29.A NH2 ALA 98.A O no hydrogen 3.064 N/A ARG 29.A NH2 GLU 99.A O no hydrogen 3.338 N/A ARG 29.A NH2 ASN 275.A OD1 no hydrogen 2.691 N/A SER 30.A N TYR 27.A O no hydrogen 3.389 N/A THR 31.A OG1 SER 674.A OG no hydrogen 2.753 N/A MET 34.A N THR 31.A O no hydrogen 2.695 N/A TRP 35.A N THR 31.A O no hydrogen 3.105 N/A TRP 35.A NE1 TYR 27.A O no hydrogen 3.059 N/A LEU 38.A N MET 34.A O no hydrogen 3.019 N/A ILE 39.A N TRP 35.A O no hydrogen 2.941 N/A GLN 40.A N PRO 36.A O no hydrogen 2.880 N/A GLN 40.A NE2 ASP 44.A OD1 no hydrogen 3.397 N/A GLN 40.A NE2 ASP 44.A OD2 no hydrogen 3.271 N/A LYS 41.A N ASP 37.A O no hydrogen 2.861 N/A LYS 41.A NZ GLY 299.A O no hydrogen 3.026 N/A ALA 42.A N LEU 38.A O no hydrogen 2.712 N/A LYS 43.A N ILE 39.A O no hydrogen 2.946 N/A LYS 43.A NZ ALA 84.A O no hydrogen 2.041 N/A ASP 44.A N GLN 40.A O no hydrogen 2.956 N/A GLY 45.A N ALA 42.A O no hydrogen 2.657 N/A GLY 46.A N LYS 43.A O no hydrogen 2.833 N/A LEU 47.A N ALA 42.A O no hydrogen 3.336 N/A ASP 48.A N ILE 21.A O no hydrogen 2.696 N/A VAL 49.A N ILE 21.A O no hydrogen 2.987 N/A ILE 50.A N TYR 87.A O no hydrogen 2.582 N/A GLU 51.A N GLY 23.A O no hydrogen 2.642 N/A THR 52.A N ASN 89.A O no hydrogen 3.222 N/A THR 52.A OG1 ILE 25.A O no hydrogen 3.118 N/A THR 52.A OG1 TYR 53.A O no hydrogen 3.052 N/A TYR 53.A OH ASN 159.A OD1 no hydrogen 2.749 N/A VAL 54.A N ARG 91.A O no hydrogen 3.003 N/A PHE 55.A N TYR 27.A OH no hydrogen 3.283 N/A TRP 56.A NE1 GLU 60.A OE1 no hydrogen 3.145 N/A ASN 57.A N GLY 104.A O no hydrogen 2.650 N/A ASN 57.A ND2 ASN 101.A O no hydrogen 2.879 N/A ASN 57.A ND2 PHE 105.A O no hydrogen 3.081 N/A HIS 59.A N PHE 55.A O no hydrogen 2.995 N/A HIS 59.A N TRP 56.A O no hydrogen 2.824 N/A HIS 59.A ND1 ASN 67.A O no hydrogen 2.845 N/A HIS 59.A NE2 TYR 27.A OH no hydrogen 2.791 N/A GLU 60.A N TRP 56.A O no hydrogen 2.882 N/A GLY 64.A N GLU 60.A OE2 no hydrogen 3.193 N/A ASN 67.A N HIS 59.A O no hydrogen 2.623 N/A PHE 68.A N GLU 69.A OE2 no hydrogen 2.789 N/A GLU 69.A N ASN 67.A OD1 no hydrogen 2.919 N/A ARG 71.A NE PRO 28.A O no hydrogen 3.123 N/A TYR 72.A N GLU 69.A O no hydrogen 3.120 N/A ASP 73.A N GLY 70.A O no hydrogen 3.005 N/A ARG 76.A N ASP 73.A OD1 no hydrogen 2.651 N/A PHE 77.A N ASP 73.A O no hydrogen 3.205 N/A ILE 78.A N LEU 74.A O no hydrogen 3.072 N/A LYS 79.A N VAL 75.A O no hydrogen 3.162 N/A MET 80.A N ARG 76.A O no hydrogen 3.062 N/A VAL 81.A N PHE 77.A O no hydrogen 3.048 N/A GLN 82.A N ILE 78.A O no hydrogen 2.843 N/A ARG 83.A N LYS 79.A O no hydrogen 2.785 N/A ALA 84.A N VAL 81.A O no hydrogen 2.810 N/A GLY 85.A N GLN 82.A O no hydrogen 2.735 N/A LEU 86.A N VAL 81.A O no hydrogen 3.287 N/A TYR 87.A N ASP 48.A O no hydrogen 2.924 N/A VAL 88.A N PRO 151.A O no hydrogen 2.805 N/A ASN 89.A N ILE 50.A O no hydrogen 2.946 N/A ASN 89.A ND2 GLU 51.A OE2 no hydrogen 2.653 N/A LEU 90.A N MET 154.A O no hydrogen 2.978 N/A ARG 91.A N THR 52.A O no hydrogen 2.920 N/A ARG 91.A NE GLN 156.A OE1 no hydrogen 3.049 N/A ARG 91.A NH2 GLN 156.A OE1 no hydrogen 3.400 N/A ARG 91.A NH2 GLU 229.A OE2 no hydrogen 2.582 N/A ILE 92.A N GLN 156.A O no hydrogen 2.770 N/A GLY 93.A N GLN 156.A O no hydrogen 3.297 N/A TYR 95.A OH ASN 526.A O no hydrogen 2.683 N/A VAL 96.A N GLY 103.A O no hydrogen 2.909 N/A CYS 97.A SG ASN 526.A O no hydrogen 3.606 N/A TRP 100.A N CYS 97.A O no hydrogen 3.033 N/A TRP 100.A NE1 ASN 57.A OD1 no hydrogen 2.886 N/A ASN 101.A N SER 280.A O no hydrogen 2.640 N/A ASN 101.A ND2 ASP 442.A OD2 no hydrogen 3.144 N/A PHE 102.A N LEU 524.A O no hydrogen 3.351 N/A GLY 103.A N TRP 100.A O no hydrogen 2.668 N/A GLY 104.A N ASN 101.A O no hydrogen 2.996 N/A TRP 108.A NE1 GLU 60.A O no hydrogen 2.850 N/A LEU 109.A N PRO 106.A O no hydrogen 3.055 N/A LYS 110.A N VAL 107.A O no hydrogen 2.880 N/A LYS 110.A NZ ASP 532.A OD2 no hydrogen 3.387 N/A TYR 111.A N TRP 108.A O no hydrogen 2.912 N/A VAL 112.A N LEU 109.A O no hydrogen 3.160 N/A MET 115.A N VAL 112.A O no hydrogen 3.408 N/A ARG 118.A NE GLU 158.A OE1 no hydrogen 2.931 N/A ARG 118.A NH2 GLU 158.A OE2 no hydrogen 3.114 N/A ASN 121.A ND2 GLY 114.A O no hydrogen 3.018 N/A PHE 124.A N ASN 121.A OD1 no hydrogen 2.958 N/A LYS 125.A N ASN 121.A O no hydrogen 2.788 N/A LYS 125.A NZ ASN 120.A OD1 no hydrogen 2.702 N/A VAL 126.A N GLN 122.A O no hydrogen 3.047 N/A ALA 127.A N PRO 123.A O no hydrogen 3.225 N/A MET 128.A N PHE 124.A O no hydrogen 2.842 N/A GLN 129.A N LYS 125.A O no hydrogen 2.875 N/A GLY 130.A N VAL 126.A O no hydrogen 2.874 N/A PHE 131.A N ALA 127.A O no hydrogen 2.994 N/A VAL 132.A N MET 128.A O no hydrogen 2.788 N/A GLN 133.A N GLN 129.A O no hydrogen 2.839 N/A LYS 134.A N GLY 130.A O no hydrogen 2.967 N/A ILE 135.A N PHE 131.A O no hydrogen 3.000 N/A ILE 135.A N VAL 132.A O no hydrogen 2.850 N/A VAL 136.A N VAL 132.A O no hydrogen 2.783 N/A ASN 137.A N GLN 133.A O no hydrogen 2.586 N/A MET 138.A N LYS 134.A O no hydrogen 3.109 N/A MET 139.A N ILE 135.A O no hydrogen 3.018 N/A LYS 140.A N VAL 136.A O no hydrogen 2.764 N/A LYS 140.A NZ LEU 186.A O no hydrogen 2.290 N/A LYS 140.A NZ LYS 187.A O no hydrogen 2.884 N/A SER 141.A N ASN 137.A O no hydrogen 2.676 N/A SER 141.A OG ASN 137.A O no hydrogen 3.336 N/A GLU 142.A N MET 139.A O no hydrogen 3.176 N/A ASN 143.A N LYS 140.A O no hydrogen 2.597 N/A LEU 144.A N MET 139.A O no hydrogen 3.052 N/A GLU 146.A N ILE 152.A O no hydrogen 3.080 N/A SER 147.A OG THR 188.A O no hydrogen 2.655 N/A GLN 148.A N PHE 145.A O no hydrogen 2.801 N/A GLN 148.A NE2 LYS 140.A O no hydrogen 3.669 N/A GLY 149.A N GLU 146.A O no hydrogen 2.901 N/A GLY 150.A N PHE 145.A O no hydrogen 2.873 N/A ILE 152.A N LEU 144.A O no hydrogen 3.028 N/A ILE 153.A N VAL 88.A O no hydrogen 2.940 N/A ALA 155.A N PRO 191.A O no hydrogen 3.199 N/A GLN 156.A N LEU 90.A O no hydrogen 2.869 N/A GLN 156.A NE2 GLU 158.A O no hydrogen 2.506 N/A GLN 156.A NE2 ASN 159.A OD1 no hydrogen 3.048 N/A ILE 157.A N ILE 193.A O no hydrogen 3.210 N/A GLU 158.A N GLY 93.A O no hydrogen 2.535 N/A ASN 159.A N GLU 158.A OE2 no hydrogen 2.508 N/A TYR 161.A OH ARG 118.A O no hydrogen 2.960 N/A GLU 165.A N TYR 161.A O no hydrogen 2.763 N/A TRP 166.A N GLY 162.A O no hydrogen 2.895 N/A GLU 167.A N PRO 163.A O no hydrogen 3.356 N/A ILE 168.A N VAL 164.A O no hydrogen 2.986 N/A GLY 169.A N GLU 165.A O no hydrogen 2.778 N/A LYS 173.A N GLY 169.A O no hydrogen 3.065 N/A ALA 174.A N ALA 170.A O no hydrogen 3.005 N/A TYR 175.A N PRO 171.A O no hydrogen 2.746 N/A TYR 175.A OH GLU 158.A OE1 no hydrogen 3.228 N/A THR 176.A N GLY 172.A O no hydrogen 2.876 N/A THR 176.A OG1 GLU 165.A OE1 no hydrogen 3.290 N/A THR 176.A OG1 LYS 173.A O no hydrogen 3.172 N/A THR 176.A OG1 ASP 199.A OD2 no hydrogen 3.443 N/A LYS 177.A N LYS 173.A O no hydrogen 3.009 N/A LYS 177.A NZ GLN 181.A OE1 no hydrogen 2.569 N/A TRP 178.A N ALA 174.A O no hydrogen 2.844 N/A ALA 179.A N TYR 175.A O no hydrogen 2.825 N/A ALA 180.A N THR 176.A O no hydrogen 3.001 N/A GLN 181.A N LYS 177.A O no hydrogen 3.073 N/A MET 182.A N TRP 178.A O no hydrogen 2.862 N/A ALA 183.A N ALA 179.A O no hydrogen 2.942 N/A VAL 184.A N ALA 180.A O no hydrogen 3.036 N/A GLY 185.A N GLN 181.A O no hydrogen 2.795 N/A LEU 186.A N ALA 183.A O no hydrogen 3.184 N/A LYS 187.A N VAL 184.A O no hydrogen 2.643 N/A ILE 193.A N ALA 155.A O no hydrogen 3.007 N/A MET 194.A N ILE 205.A O no hydrogen 3.011 N/A CYS 195.A SG GLN 156.A OE1 no hydrogen 3.615 N/A CYS 195.A SG ASN 159.A OD1 no hydrogen 3.280 N/A LYS 196.A N THR 207.A O no hydrogen 3.181 N/A LYS 196.A NZ ASN 209.A O no hydrogen 3.506 N/A ALA 200.A N GLN 197.A O no hydrogen 2.883 N/A VAL 204.A N PRO 201.A O no hydrogen 2.823 N/A ILE 205.A N TRP 192.A O no hydrogen 2.996 N/A THR 207.A N MET 194.A O no hydrogen 2.926 N/A THR 207.A OG1 MET 194.A O no hydrogen 3.359 N/A THR 207.A OG1 THR 228.A OG1 no hydrogen 3.021 N/A CYS 208.A N MET 226.A O no hydrogen 3.263 N/A GLY 210.A N GLU 229.A O no hydrogen 2.914 N/A TYR 212.A OH ASP 249.A OD1 no hydrogen 2.892 N/A CYS 213.A SG TYR 212.A O no hydrogen 3.430 N/A PHE 216.A N CYS 213.A O no hydrogen 3.134 N/A ASN 219.A N ASP 206.A OD1 no hydrogen 2.889 N/A ASN 219.A ND2 GLU 198.A O no hydrogen 2.683 N/A ASN 219.A ND2 ALA 200.A O no hydrogen 2.822 N/A TYR 222.A OH ASP 202.A OD2 no hydrogen 2.857 N/A LYS 223.A N LYS 220.A O no hydrogen 3.124 N/A LYS 223.A NZ ASP 202.A OD1 no hydrogen 2.805 N/A LYS 223.A NZ VAL 204.A O no hydrogen 3.277 N/A LYS 223.A NZ ASN 219.A OD1 no hydrogen 2.779 N/A LYS 225.A NZ GLU 214.A O no hydrogen 2.725 N/A LYS 225.A NZ PHE 216.A O no hydrogen 3.048 N/A LYS 225.A NZ ASN 260.A O no hydrogen 2.689 N/A TRP 227.A N PHE 264.A O no hydrogen 2.724 N/A TRP 227.A NE1 GLY 210.A O no hydrogen 3.204 N/A THR 228.A N CYS 208.A O no hydrogen 3.044 N/A THR 228.A OG1 THR 207.A OG1 no hydrogen 3.021 N/A THR 228.A OG1 CYS 208.A O no hydrogen 3.197 N/A THR 228.A OG1 ASN 209.A OD1 no hydrogen 2.845 N/A VAL 230.A N ASN 266.A O no hydrogen 2.589 N/A TRP 231.A N GLY 210.A O no hydrogen 3.220 N/A TRP 231.A NE1 GLU 229.A OE1 no hydrogen 2.892 N/A THR 232.A N TYR 268.A O no hydrogen 2.684 N/A THR 232.A OG1 TYR 268.A O no hydrogen 3.138 N/A THR 232.A OG1 MET 269.A O no hydrogen 2.710 N/A LYS 237.A NZ ASP 496.A OD2 no hydrogen 3.500 N/A PHE 238.A N PHE 284.A O no hydrogen 2.659 N/A GLY 240.A N LYS 237.A O no hydrogen 2.886 N/A ILE 242.A N THR 659.A O no hydrogen 2.724 N/A GLN 244.A N CYS 657.A O no hydrogen 2.889 N/A ARG 245.A N ASP 292.A OD2 no hydrogen 3.223 N/A ARG 245.A NE ASP 249.A OD2 no hydrogen 2.757 N/A ARG 245.A NH1 PHE 211.A O no hydrogen 3.022 N/A ARG 245.A NH1 TRP 231.A O no hydrogen 2.857 N/A ARG 245.A NH2 PHE 211.A O no hydrogen 2.843 N/A ARG 245.A NH2 ASP 249.A OD2 no hydrogen 2.753 N/A GLU 248.A N GLU 248.A OE1 no hydrogen 2.331 N/A ASP 249.A N PRO 246.A O no hydrogen 3.020 N/A ILE 250.A N PRO 246.A O no hydrogen 3.053 N/A ALA 251.A N ALA 247.A O no hydrogen 2.869 N/A PHE 252.A N GLU 248.A O no hydrogen 2.969 N/A SER 253.A N ASP 249.A O no hydrogen 2.864 N/A SER 253.A OG PHE 211.A O no hydrogen 3.382 N/A SER 253.A OG ILE 250.A O no hydrogen 2.841 N/A VAL 254.A N ILE 250.A O no hydrogen 2.901 N/A ALA 255.A N ALA 251.A O no hydrogen 2.785 N/A ARG 256.A N PHE 252.A O no hydrogen 2.803 N/A PHE 257.A N SER 253.A O no hydrogen 3.269 N/A VAL 258.A N VAL 254.A O no hydrogen 2.804 N/A GLN 259.A N ALA 255.A O no hydrogen 2.749 N/A ASN 260.A N PHE 257.A O no hydrogen 3.181 N/A ASN 260.A ND2 GLU 214.A O no hydrogen 2.801 N/A ASN 261.A N TYR 342.A OH no hydrogen 2.864 N/A GLY 262.A N PHE 257.A O no hydrogen 2.719 N/A SER 263.A N LYS 225.A O no hydrogen 3.055 N/A PHE 264.A N LYS 225.A O no hydrogen 3.416 N/A PHE 265.A N LEU 20.A O no hydrogen 3.316 N/A ASN 266.A N TRP 227.A O no hydrogen 2.709 N/A ASN 266.A ND2 SER 24.A OG no hydrogen 2.818 N/A ASN 266.A ND2 THR 228.A O no hydrogen 3.122 N/A TYR 267.A N SER 22.A O no hydrogen 3.248 N/A TYR 267.A OH HIS 313.A NE2 no hydrogen 2.843 N/A TYR 268.A N VAL 230.A O no hydrogen 2.605 N/A TYR 268.A OH TYR 289.A OH no hydrogen 2.947 N/A TYR 270.A N SER 24.A O no hydrogen 3.024 N/A HIS 271.A N SER 24.A O no hydrogen 3.002 N/A HIS 271.A NE2 GLU 297.A O no hydrogen 3.134 N/A THR 274.A N ARG 29.A O no hydrogen 2.980 N/A THR 274.A OG1 GLU 297.A OE2 no hydrogen 2.362 N/A ASN 275.A N THR 287.A O no hydrogen 2.687 N/A ASN 275.A ND2 ALA 286.A O no hydrogen 3.212 N/A ASN 275.A ND2 THR 287.A O no hydrogen 3.623 N/A ARG 278.A NE ASP 445.A OD1 no hydrogen 3.075 N/A ARG 278.A NH1 ASP 442.A O no hydrogen 2.885 N/A ARG 278.A NH2 ASP 442.A O no hydrogen 3.269 N/A ARG 278.A NH2 ASP 442.A OD1 no hydrogen 3.162 N/A ARG 278.A NH2 ASP 445.A OD1 no hydrogen 2.902 N/A SER 280.A OG PHE 276.A O no hydrogen 2.558 N/A SER 281.A N SER 280.A OG no hydrogen 2.743 N/A SER 281.A OG GLY 282.A O no hydrogen 3.213 N/A SER 281.A OG ILE 285.A O no hydrogen 2.522 N/A LEU 283.A N LEU 524.A O no hydrogen 2.989 N/A PHE 284.A N VAL 522.A O no hydrogen 2.993 N/A ILE 285.A N GLY 282.A O no hydrogen 2.715 N/A ALA 286.A N THR 236.A O no hydrogen 2.924 N/A THR 287.A OG1 ARG 632.A O no hydrogen 2.461 N/A SER 288.A N GLN 666.A OE1 no hydrogen 2.760 N/A SER 288.A OG GLU 297.A OE1 no hydrogen 3.123 N/A TYR 289.A N GLY 273.A O no hydrogen 2.974 N/A TYR 289.A OH GLU 99.A OE1 no hydrogen 2.864 N/A TYR 289.A OH TYR 268.A OH no hydrogen 2.947 N/A ASP 290.A N SER 288.A OG no hydrogen 3.318 N/A ALA 293.A N ASP 290.A O no hydrogen 3.127 N/A LEU 295.A N TYR 270.A O no hydrogen 2.899 N/A ASP 296.A N LEU 300.A O no hydrogen 2.920 N/A GLU 297.A N ASP 290.A OD2 no hydrogen 3.022 N/A TYR 298.A N ASP 296.A OD1 no hydrogen 3.004 N/A GLY 299.A N ASP 296.A O no hydrogen 2.823 N/A LEU 300.A N ASP 296.A OD1 no hydrogen 2.904 N/A ASN 302.A N PRO 294.A O no hydrogen 2.894 N/A ASN 302.A ND2 ASP 292.A OD1 no hydrogen 3.273 N/A ASN 302.A ND2 ALA 293.A O no hydrogen 2.837 N/A LYS 305.A NZ ARG 245.A O no hydrogen 3.155 N/A LYS 305.A NZ ASP 292.A O no hydrogen 2.561 N/A LYS 305.A NZ ASP 292.A OD2 no hydrogen 3.055 N/A TYR 306.A N ASN 302.A O no hydrogen 2.995 N/A TYR 306.A OH LYS 41.A O no hydrogen 2.303 N/A GLY 307.A N GLU 303.A OE1 no hydrogen 2.853 N/A HIS 308.A N PRO 304.A O no hydrogen 2.900 N/A HIS 308.A NE2 THR 391.A O no hydrogen 2.677 N/A LEU 309.A N LYS 305.A O no hydrogen 3.005 N/A ARG 310.A N TYR 306.A O no hydrogen 2.968 N/A ASP 311.A N GLY 307.A O no hydrogen 2.943 N/A LEU 312.A N HIS 308.A O no hydrogen 2.989 N/A HIS 313.A N LEU 309.A O no hydrogen 3.007 N/A HIS 313.A ND1 GLY 45.A O no hydrogen 2.688 N/A HIS 313.A NE2 TYR 267.A OH no hydrogen 2.843 N/A LYS 314.A N ARG 310.A O no hydrogen 3.030 N/A ALA 315.A N ASP 311.A O no hydrogen 3.054 N/A ILE 316.A N LEU 312.A O no hydrogen 2.948 N/A LYS 317.A N HIS 313.A O no hydrogen 2.889 N/A LYS 317.A NZ ILE 19.A O no hydrogen 3.322 N/A LYS 317.A NZ ASP 48.A OD2 no hydrogen 3.497 N/A LEU 318.A N LYS 314.A O no hydrogen 3.098 N/A SER 319.A N ALA 315.A O no hydrogen 3.189 N/A SER 319.A OG ALA 315.A O no hydrogen 2.915 N/A GLU 320.A N LYS 317.A O no hydrogen 3.372 N/A LEU 323.A N SER 319.A O no hydrogen 2.968 N/A VAL 324.A N GLU 320.A O no hydrogen 2.947 N/A SER 325.A OG PRO 321.A O no hydrogen 2.271 N/A SER 326.A OG ALA 322.A O no hydrogen 2.538 N/A TYR 327.A OH ASP 8.A OD1 no hydrogen 3.176 N/A TYR 327.A OH ASP 8.A OD2 no hydrogen 3.091 N/A ALA 328.A N ASN 261.A OD1 no hydrogen 3.264 N/A ALA 329.A N VAL 341.A O no hydrogen 3.203 N/A THR 331.A N ALA 339.A O no hydrogen 2.854 N/A LEU 333.A N GLN 337.A O no hydrogen 2.669 N/A ASN 336.A N GLN 337.A OE1 no hydrogen 3.158 N/A GLN 337.A N GLY 334.A O no hydrogen 3.380 N/A GLN 337.A NE2 ASN 355.A OD1 no hydrogen 2.823 N/A GLU 338.A N SER 354.A OG no hydrogen 3.327 N/A ALA 339.A N THR 331.A O no hydrogen 2.835 N/A HIS 340.A N PHE 352.A O no hydrogen 2.920 N/A HIS 340.A NE2 GLU 338.A OE2 no hydrogen 2.977 N/A VAL 341.A N ALA 329.A O no hydrogen 2.948 N/A TYR 342.A N ALA 350.A O no hydrogen 2.632 N/A TYR 342.A OH VAL 258.A O no hydrogen 2.927 N/A TYR 342.A OH GLN 259.A O no hydrogen 3.174 N/A SER 344.A N ALA 348.A O no hydrogen 2.705 N/A SER 344.A OG SER 325.A O no hydrogen 3.388 N/A SER 346.A N SER 344.A OG no hydrogen 3.100 N/A ALA 350.A N TYR 342.A O no hydrogen 3.151 N/A ALA 351.A N LEU 381.A O no hydrogen 3.261 N/A PHE 352.A N HIS 340.A O no hydrogen 2.676 N/A LEU 353.A N SER 379.A O no hydrogen 2.954 N/A SER 354.A N GLU 338.A O no hydrogen 2.943 N/A SER 354.A OG GLU 338.A O no hydrogen 3.075 N/A SER 354.A OG TYR 356.A OH no hydrogen 3.394 N/A ASN 355.A N SER 377.A O no hydrogen 2.791 N/A ASN 355.A ND2 TYR 360.A O no hydrogen 3.242 N/A ASN 355.A ND2 LEU 373.A O no hydrogen 3.248 N/A ASN 355.A ND2 PRO 374.A O no hydrogen 2.945 N/A TYR 356.A N ASN 336.A O no hydrogen 2.897 N/A TYR 356.A OH GLU 338.A OE2 no hydrogen 2.507 N/A ASP 357.A N ASN 355.A OD1 no hydrogen 3.152 N/A ARG 359.A N ASP 357.A OD1 no hydrogen 2.768 N/A TYR 360.A N ASP 357.A OD1 no hydrogen 2.765 N/A VAL 362.A N LEU 373.A O no hydrogen 2.964 N/A LYS 363.A NZ THR 365.A OG1 no hydrogen 3.316 N/A VAL 364.A N TYR 371.A O no hydrogen 3.255 N/A PHE 366.A N ARG 369.A O no hydrogen 2.957 N/A ARG 369.A N PHE 366.A O no hydrogen 3.247 N/A TYR 371.A N VAL 364.A O no hydrogen 3.220 N/A TYR 371.A OH LYS 385.A O no hydrogen 2.441 N/A LEU 373.A N VAL 362.A O no hydrogen 2.668 N/A TRP 376.A N ASP 357.A O no hydrogen 2.889 N/A TRP 376.A NE1 ASP 249.A OD1 no hydrogen 2.833 N/A SER 377.A N ASN 355.A O no hydrogen 3.234 N/A SER 377.A OG PRO 374.A O no hydrogen 2.931 N/A ILE 378.A N THR 391.A OG1 no hydrogen 2.832 N/A SER 379.A N LEU 353.A O no hydrogen 2.763 N/A ILE 380.A N TYR 389.A O no hydrogen 3.002 N/A LEU 381.A N ALA 351.A O no hydrogen 2.929 N/A CYS 384.A N LEU 381.A O no hydrogen 2.682 N/A THR 386.A N ASP 383.A OD1 no hydrogen 2.777 N/A THR 386.A OG1 ASP 383.A OD1 no hydrogen 2.614 N/A THR 386.A OG1 ASP 383.A OD2 no hydrogen 2.955 N/A TYR 389.A OH HIS 308.A O no hydrogen 2.611 N/A ASN 390.A ND2 SER 377.A OG no hydrogen 2.920 N/A ASN 390.A ND2 SER 379.A OG no hydrogen 2.976 N/A THR 391.A N ILE 378.A O no hydrogen 2.864 N/A THR 391.A OG1 ILE 378.A O no hydrogen 3.395 N/A ALA 392.A N ASN 390.A OD1 no hydrogen 2.894 N/A GLN 393.A N ASN 390.A O no hydrogen 2.742 N/A SER 396.A OG GLU 303.A OE1 no hydrogen 3.187 N/A LYS 402.A N SER 702.A O no hydrogen 2.794 N/A THR 404.A N ARG 700.A O no hydrogen 2.895 N/A THR 404.A OG1 ARG 700.A O no hydrogen 3.340 N/A GLY 408.A N SER 697.A OG no hydrogen 3.354 N/A GLN 413.A N LYS 599.A O no hydrogen 3.176 N/A SER 414.A N VAL 584.A O no hydrogen 2.951 N/A TYR 415.A N TRP 597.A O no hydrogen 2.936 N/A GLU 417.A N LEU 595.A O no hydrogen 2.893 N/A ASP 423.A N ASP 426.A OD2 no hydrogen 2.728 N/A SER 425.A N ASP 423.A OD1 no hydrogen 3.068 N/A ASP 426.A N ASP 423.A O no hydrogen 3.147 N/A ALA 430.A N TRP 559.A O no hydrogen 3.011 N/A GLN 436.A N ALA 536.A O no hydrogen 3.087 N/A GLN 436.A NE2 ASP 445.A O no hydrogen 2.771 N/A GLN 436.A NE2 SER 519.A O no hydrogen 3.070 N/A LYS 437.A N GLU 435.A OE1 no hydrogen 3.096 N/A LYS 437.A NZ TRP 534.A O no hydrogen 2.337 N/A ASN 438.A N GLU 435.A OE2 no hydrogen 3.030 N/A VAL 439.A N GLU 435.A O no hydrogen 3.301 N/A VAL 439.A N GLN 436.A O no hydrogen 2.913 N/A THR 440.A N GLN 436.A O no hydrogen 2.753 N/A THR 440.A OG1 GLN 436.A O no hydrogen 3.021 N/A ARG 441.A N LYS 437.A O no hydrogen 2.498 N/A ARG 441.A NE ASN 438.A O no hydrogen 2.981 N/A SER 443.A N THR 440.A O no hydrogen 2.653 N/A SER 444.A OG GLU 568.A OE1 no hydrogen 3.445 N/A SER 444.A OG GLU 568.A OE2 no hydrogen 2.577 N/A TYR 446.A N SER 444.A OG no hydrogen 3.084 N/A TYR 446.A OH GLU 688.A OE2 no hydrogen 2.898 N/A LEU 447.A N SER 519.A O no hydrogen 3.210 N/A TRP 448.A N LYS 562.A O no hydrogen 2.983 N/A TYR 449.A N LEU 517.A O no hydrogen 2.745 N/A TYR 449.A OH TRP 434.A O no hydrogen 2.488 N/A MET 450.A N SER 560.A O no hydrogen 2.890 N/A THR 451.A N ILE 515.A O no hydrogen 3.098 N/A THR 451.A OG1 LYS 558.A O no hydrogen 2.682 N/A VAL 453.A N ASN 513.A O no hydrogen 2.819 N/A ILE 455.A N GLY 511.A O no hydrogen 2.798 N/A GLY 460.A N ASN 548.A OD1 no hydrogen 2.584 N/A LYS 463.A N GLY 460.A O no hydrogen 3.303 N/A ASN 464.A ND2 GLY 460.A O no hydrogen 3.091 N/A LYS 466.A N ASN 464.A O no hydrogen 2.744 N/A LYS 466.A NZ GLY 546.A O no hydrogen 3.332 N/A TYR 469.A N SER 545.A O no hydrogen 2.871 N/A LEU 470.A N GLY 504.A O no hydrogen 2.904 N/A THR 471.A N THR 543.A O no hydrogen 2.998 N/A THR 471.A OG1 SER 503.A OG no hydrogen 2.909 N/A VAL 472.A N TYR 502.A O no hydrogen 2.844 N/A MET 473.A N PRO 541.A O no hydrogen 3.275 N/A SER 474.A N LEU 500.A O no hydrogen 3.059 N/A ALA 475.A N GLY 537.A O no hydrogen 2.801 N/A GLY 476.A N SER 474.A OG no hydrogen 3.302 N/A HIS 477.A N VAL 520.A O no hydrogen 2.700 N/A VAL 478.A N VAL 520.A O no hydrogen 3.070 N/A LEU 479.A N VAL 491.A O no hydrogen 2.795 N/A HIS 480.A N LEU 518.A O no hydrogen 3.124 N/A HIS 480.A ND1 THR 490.A OG1 no hydrogen 2.826 N/A HIS 480.A NE2 GLU 688.A OE1 no hydrogen 2.685 N/A VAL 481.A N GLY 489.A O no hydrogen 3.044 N/A PHE 482.A N SER 516.A O no hydrogen 2.671 N/A VAL 483.A N LYS 486.A O no hydrogen 2.568 N/A ASN 484.A N LYS 514.A O no hydrogen 2.528 N/A ASN 484.A ND2 ASN 513.A OD1 no hydrogen 2.758 N/A LYS 486.A N VAL 483.A O no hydrogen 3.193 N/A SER 488.A N VAL 481.A O no hydrogen 2.884 N/A THR 490.A OG1 HIS 480.A ND1 no hydrogen 2.826 N/A VAL 491.A N LEU 479.A O no hydrogen 2.899 N/A GLY 493.A N HIS 477.A O no hydrogen 3.012 N/A THR 494.A N ASN 497.A O no hydrogen 2.753 N/A THR 494.A OG1 ASN 497.A O no hydrogen 3.337 N/A ASN 497.A N THR 494.A OG1 no hydrogen 2.862 N/A LEU 500.A N SER 474.A O no hydrogen 2.937 N/A TYR 502.A N VAL 472.A O no hydrogen 2.888 N/A SER 503.A OG TYR 469.A OH no hydrogen 3.049 N/A SER 503.A OG THR 471.A OG1 no hydrogen 2.909 N/A GLY 504.A N LEU 470.A O no hydrogen 3.022 N/A VAL 506.A N PRO 468.A O no hydrogen 3.151 N/A LYS 507.A NZ ASP 467.A OD1 no hydrogen 2.891 N/A GLY 511.A N ILE 455.A O no hydrogen 2.671 N/A ASN 513.A N VAL 453.A O no hydrogen 2.654 N/A ASN 513.A ND2 VAL 453.A O no hydrogen 3.675 N/A ASN 513.A ND2 ARG 509.A O no hydrogen 3.232 N/A ASN 513.A ND2 GLY 511.A O no hydrogen 3.170 N/A LYS 514.A N ASN 484.A OD1 no hydrogen 2.750 N/A LYS 514.A NZ ALA 422.A O no hydrogen 3.193 N/A LYS 514.A NZ ASN 452.A OD1 no hydrogen 2.343 N/A ILE 515.A N THR 451.A O no hydrogen 3.266 N/A SER 516.A N PHE 482.A O no hydrogen 2.551 N/A SER 516.A OG PRO 420.A O no hydrogen 2.474 N/A LEU 517.A N TYR 449.A O no hydrogen 2.725 N/A LEU 518.A N HIS 480.A O no hydrogen 3.164 N/A SER 519.A N LEU 447.A O no hydrogen 3.123 N/A SER 519.A OG GLN 436.A OE1 no hydrogen 2.830 N/A VAL 520.A N VAL 478.A O no hydrogen 3.157 N/A SER 521.A N ASP 445.A O no hydrogen 3.095 N/A VAL 522.A N HIS 477.A ND1 no hydrogen 2.940 N/A LEU 524.A N ASN 101.A OD1 no hydrogen 2.983 N/A TYR 531.A N GLY 528.A O no hydrogen 3.074 N/A TYR 531.A OH PHE 102.A O no hydrogen 2.553 N/A THR 533.A N HIS 530.A O no hydrogen 2.911 N/A THR 533.A OG1 HIS 530.A O no hydrogen 2.711 N/A TRP 534.A N TYR 531.A O no hydrogen 3.366 N/A ALA 536.A N GLU 435.A OE1 no hydrogen 3.106 N/A GLY 537.A N GLY 476.A O no hydrogen 2.899 N/A THR 543.A N THR 471.A O no hydrogen 3.119 N/A LEU 544.A N ARG 552.A O no hydrogen 2.900 N/A SER 545.A N TYR 469.A O no hydrogen 3.098 N/A SER 545.A OG TYR 469.A O no hydrogen 3.488 N/A ARG 552.A N LEU 544.A O no hydrogen 2.667 N/A ARG 552.A NE GLU 549.A OE2 no hydrogen 2.760 N/A ARG 552.A NH1 ASN 454.A O no hydrogen 2.849 N/A ARG 552.A NH2 GLU 549.A OE2 no hydrogen 2.540 N/A LEU 554.A N VAL 542.A O no hydrogen 2.845 N/A ALA 555.A N ASN 553.A OD1 no hydrogen 2.640 N/A GLN 557.A NE2 THR 451.A OG1 no hydrogen 3.397 N/A TRP 559.A N ALA 430.A O no hydrogen 2.888 N/A TRP 559.A NE1 LEU 554.A O no hydrogen 3.099 N/A SER 560.A N MET 450.A O no hydrogen 2.781 N/A SER 560.A OG ASP 426.A OD2 no hydrogen 3.225 N/A TYR 561.A N LEU 428.A O no hydrogen 2.918 N/A TYR 561.A OH GLY 432.A O no hydrogen 3.012 N/A LYS 562.A N TRP 448.A O no hydrogen 3.287 N/A GLY 564.A N TYR 446.A O no hydrogen 2.877 N/A LEU 565.A N GLU 568.A OE2 no hydrogen 2.918 N/A LYS 566.A N GLU 417.A OE2 no hydrogen 2.774 N/A GLY 567.A N GLU 417.A OE1 no hydrogen 3.063 N/A SER 569.A N LEU 565.A O no hydrogen 2.969 N/A LEU 570.A N LYS 566.A O no hydrogen 2.821 N/A SER 571.A N GLU 568.A O no hydrogen 2.749 N/A SER 571.A OG GLU 568.A O no hydrogen 3.412 N/A LEU 572.A N GLY 567.A O no hydrogen 3.025 N/A SER 574.A N SER 571.A O no hydrogen 3.372 N/A SER 574.A OG SER 571.A O no hydrogen 3.282 N/A GLY 577.A N SER 574.A OG no hydrogen 3.052 N/A SER 580.A OG GLY 577.A O no hydrogen 3.015 N/A VAL 584.A N SER 414.A O no hydrogen 2.796 N/A MET 589.A N GLY 586.A O no hydrogen 2.470 N/A ALA 590.A N SER 414.A OG no hydrogen 3.258 N/A LYS 592.A N GLY 691.A O no hydrogen 2.968 N/A GLN 593.A NE2 PRO 594.A O no hydrogen 2.711 N/A LEU 595.A N GLU 688.A O no hydrogen 3.239 N/A THR 596.A N GLU 687.A O no hydrogen 2.955 N/A THR 596.A OG1 GLN 593.A O no hydrogen 2.820 N/A TRP 597.A N TYR 415.A O no hydrogen 2.749 N/A TRP 597.A NE1 GLU 417.A OE1 no hydrogen 3.080 N/A TYR 598.A N VAL 685.A O no hydrogen 2.776 N/A TYR 598.A OH ALA 590.A O no hydrogen 3.012 N/A LYS 599.A N GLN 413.A O no hydrogen 2.992 N/A ALA 600.A N LEU 683.A O no hydrogen 3.041 N/A PHE 602.A N ASN 681.A O no hydrogen 2.913 N/A ALA 604.A N PRO 678.A O no hydrogen 3.042 N/A ASN 608.A N ASN 608.A OD1 no hydrogen 2.507 N/A ALA 612.A N VAL 699.A O no hydrogen 3.335 N/A LEU 613.A N TYR 669.A O no hydrogen 3.010 N/A ASP 614.A N SER 697.A O no hydrogen 2.663 N/A MET 615.A N ARG 667.A O no hydrogen 3.040 N/A ALA 616.A N ASP 614.A OD1 no hydrogen 3.138 N/A SER 617.A OG ASN 692.A O no hydrogen 2.803 N/A MET 618.A N MET 615.A O no hydrogen 2.976 N/A GLY 619.A N GLU 687.A OE1 no hydrogen 3.144 N/A LYS 620.A N GLU 687.A OE2 no hydrogen 3.023 N/A LYS 620.A NZ GLU 688.A OE2 no hydrogen 3.028 N/A GLY 621.A N HIS 633.A O no hydrogen 2.779 N/A GLN 622.A N PHE 686.A O no hydrogen 3.160 N/A ILE 623.A N GLY 631.A O no hydrogen 3.023 N/A TRP 624.A N VAL 684.A O no hydrogen 3.010 N/A ILE 625.A N GLU 628.A O no hydrogen 2.885 N/A ASN 626.A N LEU 682.A O no hydrogen 2.818 N/A ASN 626.A ND2 TRP 675.A O no hydrogen 3.172 N/A ASN 626.A ND2 ASN 681.A OD1 no hydrogen 2.611 N/A GLU 628.A N ILE 625.A O no hydrogen 2.905 N/A GLY 631.A N ILE 623.A O no hydrogen 3.485 N/A ARG 632.A NE ASP 445.A OD2 no hydrogen 3.128 N/A ARG 632.A NH2 ASP 445.A OD1 no hydrogen 2.581 N/A ARG 632.A NH2 ASP 445.A OD2 no hydrogen 3.091 N/A HIS 633.A N GLY 621.A O no hydrogen 3.028 N/A TRP 634.A N TYR 669.A OH no hydrogen 2.827 N/A GLY 636.A N GLY 619.A O no hydrogen 2.870 N/A TYR 637.A N TRP 634.A O no hydrogen 2.977 N/A TYR 637.A OH GLY 493.A O no hydrogen 3.023 N/A ALA 639.A N GLN 663.A O no hydrogen 2.725 N/A GLN 640.A N GLY 239.A O no hydrogen 3.086 N/A SER 644.A OG ASP 642.A OD1 no hydrogen 3.508 N/A TYR 648.A OH PRO 375.A O no hydrogen 2.547 N/A ALA 649.A N SER 647.A OG no hydrogen 3.198 N/A PHE 652.A N TYR 212.A OH no hydrogen 2.713 N/A GLU 654.A N GLU 654.A OE1 no hydrogen 2.781 N/A LYS 655.A N ASN 653.A OD1 no hydrogen 2.764 N/A LYS 656.A N ASN 653.A O no hydrogen 2.951 N/A LYS 656.A NZ SER 647.A O no hydrogen 2.926 N/A LYS 656.A NZ ALA 649.A O no hydrogen 2.785 N/A LYS 656.A NZ GLY 650.A O no hydrogen 3.473 N/A GLN 658.A NE2 ASP 642.A O no hydrogen 2.718 N/A THR 659.A N ILE 242.A O no hydrogen 2.932 N/A ASN 660.A ND2 PRO 664.A O no hydrogen 3.202 N/A CYS 661.A SG GLY 641.A O no hydrogen 3.007 N/A GLY 662.A N ALA 639.A O no hydrogen 2.894 N/A GLN 663.A N ASN 660.A O no hydrogen 3.287 N/A SER 665.A N TYR 637.A O no hydrogen 2.818 N/A SER 665.A OG GLY 240.A O no hydrogen 3.165 N/A SER 665.A OG TYR 637.A O no hydrogen 3.227 N/A GLN 666.A NE2 TRP 668.A O no hydrogen 3.078 N/A ARG 667.A NE ASP 614.A OD1 no hydrogen 2.871 N/A ARG 667.A NH2 ASP 614.A OD2 no hydrogen 2.648 N/A TYR 669.A N LEU 613.A O no hydrogen 3.119 N/A TYR 669.A OH GLN 666.A O no hydrogen 2.852 N/A VAL 671.A N LEU 611.A O no hydrogen 2.560 N/A ARG 673.A NE ASP 609.A O no hydrogen 2.469 N/A ARG 673.A NH1 PRO 605.A O no hydrogen 3.515 N/A ARG 673.A NH2 PRO 605.A O no hydrogen 3.275 N/A SER 674.A OG THR 31.A OG1 no hydrogen 2.753 N/A TRP 675.A N PRO 672.A O no hydrogen 2.951 N/A LEU 676.A N ARG 673.A O no hydrogen 2.880 N/A LYS 677.A N ASN 681.A OD1 no hydrogen 2.997 N/A SER 679.A OG ASN 603.A OD1 no hydrogen 2.674 N/A GLY 680.A N ASN 603.A OD1 no hydrogen 3.167 N/A ASN 681.A N PHE 602.A O no hydrogen 2.889 N/A ASN 681.A ND2 PHE 602.A O no hydrogen 3.636 N/A ASN 681.A ND2 LYS 677.A O no hydrogen 2.496 N/A LEU 682.A N ASN 626.A OD1 no hydrogen 3.016 N/A LEU 683.A N ALA 600.A O no hydrogen 2.831 N/A VAL 684.A N TRP 624.A O no hydrogen 3.290 N/A VAL 685.A N TYR 598.A O no hydrogen 3.158 N/A PHE 686.A N GLN 622.A O no hydrogen 3.060 N/A GLU 687.A N THR 596.A O no hydrogen 2.955 N/A GLU 688.A N LYS 620.A O no hydrogen 2.535 N/A TRP 689.A N GLU 687.A OE2 no hydrogen 2.765 N/A GLY 690.A N GLU 687.A OE2 no hydrogen 2.598 N/A ASN 692.A N SER 617.A O no hydrogen 3.064 N/A THR 694.A OG1 ASN 692.A OD1 no hydrogen 2.444 N/A GLY 695.A N ASN 692.A O no hydrogen 2.882 N/A ILE 696.A N PRO 693.A O no hydrogen 2.752 N/A SER 697.A OG LEU 698.A O no hydrogen 2.804 N/A VAL 699.A N ALA 612.A O no hydrogen 2.875 N/A ARG 700.A N THR 404.A O no hydrogen 2.631 N/A ARG 700.A NH1 GLY 606.A O no hydrogen 2.402 N/A ARG 701.A N PRO 610.A O no hydrogen 2.997 N/A ARG 701.A NE ASP 296.A OD2 no hydrogen 3.246 N/A ARG 701.A NH2 ASP 296.A OD2 no hydrogen 2.583 N/A SER 702.A N LYS 402.A O no hydrogen 3.062 N/A ARG 703.A NE SER 399.A OG no hydrogen 2.962 N/A ARG 703.A NH1 ASP 296.A OD2 no hydrogen 2.605 N/A SER 704.A N SER 400.A O no hydrogen 3.188 N/A