Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 6qub_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): VAL 2.A N THR 74.A O no hydrogen 2.825 N/A SER 4.A OG ASP 78.A OD2 no hydrogen 2.738 N/A LYS 5.A N ASP 3.A OD1 no hydrogen 3.367 N/A GLN 6.A N ASP 3.A O no hydrogen 3.436 N/A ARG 8.A NE ASP 270.A OD1 no hydrogen 2.646 N/A ARG 8.A NE ASP 270.A OD2 no hydrogen 3.426 N/A ARG 8.A NH2 VAL 163.A O no hydrogen 3.210 N/A ARG 8.A NH2 ASP 270.A OD1 no hydrogen 3.563 N/A ARG 8.A NH2 ASP 270.A OD2 no hydrogen 2.923 N/A THR 9.A N ASN 7.A OD1 no hydrogen 3.058 N/A THR 9.A OG1 THR 156.A OG1 no hydrogen 3.218 N/A SER 10.A N LEU 155.A O no hydrogen 2.879 N/A PHE 12.A N VAL 153.A O no hydrogen 2.928 N/A ASP 13.A N ASP 11.A OD1 no hydrogen 2.909 N/A ASN 15.A N ASP 40.A OD1 no hydrogen 2.867 N/A TRP 16.A N VAL 39.A O no hydrogen 2.837 N/A TRP 16.A NE1 PHE 12.A O no hydrogen 2.879 N/A LYS 17.A N ARG 70.A O no hydrogen 2.716 N/A LYS 17.A NZ ASP 33.A O no hydrogen 3.022 N/A LYS 17.A NZ ASP 33.A OD1 no hydrogen 3.424 N/A PHE 18.A N GLN 37.A O no hydrogen 2.776 N/A MET 19.A N TRP 68.A O no hydrogen 3.126 N/A SER 21.A N THR 66.A O no hydrogen 2.973 N/A SER 23.A N SER 21.A OG no hydrogen 3.231 N/A SER 23.A OG SER 21.A OG no hydrogen 3.183 N/A VAL 24.A N SER 21.A OG no hydrogen 3.091 N/A GLN 27.A N GLN 27.A OE1 no hydrogen 3.132 N/A ALA 30.A N ASP 28.A OD2 no hydrogen 2.777 N/A PHE 31.A N ASP 28.A O no hydrogen 3.062 N/A SER 34.A N ASP 32.A OD1 no hydrogen 3.041 N/A SER 34.A OG ASP 32.A OD1 no hydrogen 2.755 N/A TRP 36.A N ASP 33.A O no hydrogen 3.002 N/A GLN 37.A N PHE 18.A O no hydrogen 2.954 N/A VAL 39.A N TRP 16.A O no hydrogen 2.854 N/A LEU 41.A N ASP 13.A O no hydrogen 2.849 N/A HIS 43.A N ILE 149.A O no hydrogen 2.927 N/A HIS 43.A ND1 TYR 69.A OH no hydrogen 2.664 N/A TYR 45.A N SER 147.A O no hydrogen 2.871 N/A TYR 45.A OH GLY 65.A O no hydrogen 2.711 N/A SER 46.A N ASP 44.A OD1 no hydrogen 2.840 N/A SER 46.A OG PRO 63.A O no hydrogen 2.602 N/A SER 46.A OG SER 147.A OG no hydrogen 2.649 N/A ILE 47.A N ASP 44.A OD1 no hydrogen 3.409 N/A GLN 49.A N SER 46.A O no hydrogen 3.000 N/A GLN 49.A NE2 TYR 45.A O no hydrogen 2.712 N/A GLN 49.A NE2 GLY 64.A O no hydrogen 3.126 N/A SER 52.A N TYR 61.A O no hydrogen 3.147 N/A SER 52.A OG SER 54.A OG no hydrogen 3.056 N/A SER 54.A OG SER 52.A OG no hydrogen 3.056 N/A ASN 55.A N SER 52.A O no hydrogen 2.985 N/A ASN 55.A ND2 TYR 61.A O no hydrogen 2.835 N/A GLU 58.A N GLY 582.A O no hydrogen 3.106 N/A SER 59.A N GLU 56.A O no hydrogen 3.210 N/A SER 59.A OG GLU 56.A O no hydrogen 3.435 N/A ALA 60.A N ALA 57.A O no hydrogen 2.851 N/A TYR 61.A N GLU 56.A O no hydrogen 2.828 N/A LEU 62.A N SER 59.A O no hydrogen 3.492 N/A GLY 65.A N ASN 136.A O no hydrogen 2.935 N/A THR 66.A OG1 ASP 22.A OD1 no hydrogen 2.662 N/A GLY 67.A N VAL 134.A O no hydrogen 2.797 N/A TRP 68.A N MET 19.A O no hydrogen 2.974 N/A TYR 69.A N VAL 132.A O no hydrogen 2.762 N/A TYR 69.A OH HIS 43.A ND1 no hydrogen 2.664 N/A ARG 70.A N LYS 17.A O no hydrogen 2.936 N/A ARG 70.A NE ASP 33.A OD2 no hydrogen 2.739 N/A ARG 70.A NH1 ALA 26.A O no hydrogen 2.878 N/A ARG 70.A NH1 ASP 28.A O no hydrogen 2.838 N/A ARG 70.A NH2 PRO 29.A O no hydrogen 3.219 N/A ARG 70.A NH2 ASP 33.A OD2 no hydrogen 3.278 N/A LYS 71.A N ILE 130.A O no hydrogen 3.103 N/A LYS 71.A NZ PHE 12.A O no hydrogen 3.226 N/A LYS 71.A NZ ALA 14.A O no hydrogen 2.800 N/A SER 72.A OG THR 129.A OG1 no hydrogen 3.129 N/A PHE 73.A N ASN 128.A O no hydrogen 2.695 N/A ILE 75.A N GLY 126.A O no hydrogen 3.190 N/A ASP 76.A N VAL 2.A O no hydrogen 2.755 N/A ASP 78.A N ASP 76.A OD1 no hydrogen 2.776 N/A LEU 79.A N ASP 76.A O no hydrogen 3.163 N/A ALA 80.A N ARG 77.A O no hydrogen 3.105 N/A LYS 82.A N LEU 79.A O no hydrogen 2.996 N/A ARG 83.A N THR 158.A O no hydrogen 2.756 N/A ILE 84.A N THR 119.A OG1 no hydrogen 2.876 N/A ALA 85.A N THR 156.A O no hydrogen 2.880 N/A ILE 86.A N PHE 116.A O no hydrogen 3.013 N/A ASN 87.A N THR 154.A O no hydrogen 2.847 N/A ASN 87.A ND2 THR 154.A O no hydrogen 3.539 N/A ASN 87.A ND2 THR 154.A OG1 no hydrogen 2.975 N/A ASN 87.A ND2 THR 156.A OG1 no hydrogen 2.836 N/A PHE 88.A N PHE 114.A O no hydrogen 2.770 N/A ASP 89.A N ASP 152.A O no hydrogen 3.228 N/A TYR 92.A N GLY 148.A O no hydrogen 2.969 N/A TYR 92.A OH SER 140.A OG no hydrogen 3.011 N/A ASN 94.A N PRO 108.A O no hydrogen 3.014 N/A ASN 94.A ND2 GLU 135.A O no hydrogen 3.033 N/A ALA 95.A N HIS 107.A O no hydrogen 2.900 N/A THR 96.A N LYS 133.A O no hydrogen 2.805 N/A VAL 97.A N GLY 105.A O no hydrogen 3.050 N/A TRP 98.A N VAL 131.A O no hydrogen 2.937 N/A PHE 99.A N VAL 102.A O no hydrogen 2.881 N/A ASN 100.A N THR 129.A O no hydrogen 2.905 N/A ASN 100.A ND2 ASN 121.A O no hydrogen 2.829 N/A ASN 100.A ND2 ASN 128.A OD1 no hydrogen 2.877 N/A VAL 102.A N PHE 99.A O no hydrogen 3.115 N/A LEU 104.A N VAL 97.A O no hydrogen 2.727 N/A THR 106.A N ASN 387.A OD1 no hydrogen 3.117 N/A HIS 107.A N ALA 95.A O no hydrogen 2.878 N/A HIS 107.A NE2 ASP 402.A OD1 no hydrogen 2.757 N/A TYR 109.A OH VAL 360.A O no hydrogen 2.779 N/A SER 112.A OG ASP 402.A OD1 no hydrogen 2.591 N/A PHE 114.A N PHE 88.A O no hydrogen 2.928 N/A SER 115.A N.A LEU 390.A O no hydrogen 2.896 N/A SER 115.A N.B LEU 390.A O no hydrogen 2.885 N/A SER 115.A OG.B ASN 87.A OD1 no hydrogen 2.715 N/A PHE 116.A N ILE 86.A O no hydrogen 3.023 N/A LEU 118.A N ILE 84.A O no hydrogen 2.672 N/A THR 119.A N ASP 117.A OD1 no hydrogen 3.315 N/A THR 119.A OG1 ILE 84.A O no hydrogen 3.342 N/A THR 119.A OG1 ASP 117.A OD1 no hydrogen 2.778 N/A ASN 121.A N LEU 118.A O no hydrogen 3.269 N/A ALA 122.A N THR 119.A O no hydrogen 3.292 N/A LYS 123.A N ASN 128.A OD1 no hydrogen 2.813 N/A LYS 123.A NZ GLU 127.A O no hydrogen 3.169 N/A GLY 125.A N ILE 75.A O no hydrogen 2.749 N/A GLY 126.A N LYS 123.A O no hydrogen 3.227 N/A ASN 128.A N PHE 73.A O no hydrogen 2.741 N/A ASN 128.A ND2 LYS 123.A O no hydrogen 3.029 N/A THR 129.A N ASN 100.A OD1 no hydrogen 2.990 N/A THR 129.A OG1 SER 72.A OG no hydrogen 3.129 N/A ILE 130.A N LYS 71.A O no hydrogen 3.076 N/A VAL 131.A N TRP 98.A O no hydrogen 2.996 N/A VAL 132.A N TYR 69.A O no hydrogen 2.852 N/A LYS 133.A N THR 96.A O no hydrogen 2.876 N/A VAL 134.A N GLY 67.A O no hydrogen 2.685 N/A GLU 135.A N MET 93.A O no hydrogen 2.992 N/A GLU 135.A N ASN 94.A O no hydrogen 3.239 N/A ASN 136.A N GLY 65.A O no hydrogen 3.139 N/A ASN 136.A ND2 SER 147.A OG no hydrogen 2.745 N/A SER 140.A OG TYR 92.A OH no hydrogen 3.011 N/A SER 140.A OG ASN 136.A OD1 no hydrogen 3.033 N/A SER 141.A OG TRP 143.A O no hydrogen 2.777 N/A ARG 142.A NE ASP 362.A OD2 no hydrogen 2.930 N/A ARG 142.A NH2 ASP 362.A OD1 no hydrogen 3.038 N/A ARG 142.A NH2 ASP 362.A OD2 no hydrogen 3.173 N/A TRP 143.A N SER 141.A OG no hydrogen 3.217 N/A TRP 143.A NE1 TYR 111.A OH no hydrogen 2.917 N/A TYR 144.A N LEU 574.A O no hydrogen 3.116 N/A TYR 144.A OH ASP 44.A OD2 no hydrogen 2.660 N/A SER 145.A OG GLY 146.A O no hydrogen 2.904 N/A SER 147.A N ASP 44.A OD1 no hydrogen 3.101 N/A SER 147.A OG SER 46.A OG no hydrogen 2.649 N/A GLY 148.A N TYR 92.A O no hydrogen 2.801 N/A ILE 149.A N TYR 69.A OH no hydrogen 3.198 N/A TYR 150.A OH GLY 110.A O no hydrogen 2.577 N/A ARG 151.A NH1 ASP 89.A O no hydrogen 2.981 N/A ARG 151.A NH1 TYR 111.A O no hydrogen 2.786 N/A ARG 151.A NH2 PRO 340.A O no hydrogen 2.793 N/A VAL 153.A N ASP 13.A OD1 no hydrogen 2.945 N/A THR 154.A N ASN 87.A O no hydrogen 2.995 N/A LEU 155.A N SER 10.A O no hydrogen 2.950 N/A THR 156.A N ALA 85.A O no hydrogen 2.860 N/A THR 156.A OG1 THR 9.A OG1 no hydrogen 3.218 N/A VAL 157.A N ARG 8.A O no hydrogen 2.831 N/A THR 158.A N ARG 83.A O no hydrogen 2.882 N/A THR 158.A OG1 ASP 159.A O no hydrogen 2.774 N/A VAL 161.A N ASP 159.A OD1 no hydrogen 3.001 N/A HIS 162.A N ALA 192.A O no hydrogen 3.102 N/A HIS 162.A ND1 VAL 163.A O no hydrogen 2.830 N/A HIS 162.A NE2 ASP 194.A OD2 no hydrogen 2.810 N/A VAL 163.A N ASP 270.A OD2 no hydrogen 2.860 N/A GLY 164.A N LYS 190.A O no hydrogen 2.782 N/A ASN 165.A ND2 ASN 87.A OD1 no hydrogen 3.631 N/A ALA 169.A N THR 188.A O no hydrogen 2.920 N/A ILE 170.A N ASN 412.A OD1 no hydrogen 3.323 N/A LYS 171.A N ASN 186.A O no hydrogen 2.903 N/A LYS 171.A NZ SER 452.A OG no hydrogen 2.905 N/A LEU 175.A N THR 172.A O no hydrogen 3.263 N/A THR 177.A N SER 174.A O no hydrogen 3.141 N/A THR 177.A OG1 SER 174.A O no hydrogen 3.264 N/A GLN 178.A N SER 174.A O no hydrogen 2.870 N/A GLN 178.A NE2 THR 184.A OG1 no hydrogen 3.135 N/A ASN 179.A N LEU 175.A O no hydrogen 2.817 N/A GLY 181.A N GLN 178.A O no hydrogen 2.881 N/A VAL 183.A N ALA 242.A O no hydrogen 2.907 N/A THR 184.A N GLN 178.A OE1 no hydrogen 2.899 N/A MET 185.A N ILE 240.A O no hydrogen 2.772 N/A ASN 186.A N LYS 171.A O no hydrogen 2.781 N/A LEU 187.A N SER 238.A O no hydrogen 2.746 N/A THR 188.A N ALA 169.A O no hydrogen 3.006 N/A THR 189.A N VAL 236.A O no hydrogen 2.841 N/A LYS 190.A N GLY 167.A O no hydrogen 2.846 N/A LYS 190.A NZ ASP 235.A OD1 no hydrogen 2.959 N/A LYS 190.A NZ ASP 235.A OD2 no hydrogen 3.315 N/A VAL 191.A N ALA 234.A O no hydrogen 2.908 N/A ALA 192.A N HIS 162.A O no hydrogen 2.795 N/A ASN 193.A N ALA 232.A O no hydrogen 2.833 N/A ASN 193.A ND2 ALA 197.A O no hydrogen 2.857 N/A ASN 193.A ND2 ILE 228.A O no hydrogen 2.911 N/A ASP 194.A N GLY 160.A O no hydrogen 2.948 N/A THR 195.A N ASN 193.A OD1 no hydrogen 3.092 N/A THR 195.A OG1 ASN 193.A OD1 no hydrogen 2.664 N/A ALA 197.A N THR 195.A OG1 no hydrogen 3.297 N/A ALA 199.A N ILE 228.A O no hydrogen 2.901 N/A ILE 201.A N LYS 226.A O no hydrogen 3.044 N/A THR 202.A N LEU 263.A O no hydrogen 3.005 N/A LEU 203.A N THR 223.A OG1 no hydrogen 2.993 N/A LYS 204.A N GLU 261.A O no hydrogen 2.943 N/A GLN 205.A N VAL 221.A O no hydrogen 2.868 N/A GLN 205.A NE2 THR 260.A OG1 no hydrogen 3.274 N/A THR 206.A N ARG 259.A O no hydrogen 2.898 N/A VAL 207.A N GLY 219.A O no hydrogen 3.029 N/A PHE 208.A N THR 257.A O no hydrogen 2.998 N/A LYS 210.A N LEU 255.A O no hydrogen 3.020 N/A LYS 210.A NZ GLU 275.A OE1 no hydrogen 2.899 N/A GLY 212.A N PRO 209.A O no hydrogen 2.920 N/A ALA 216.A N LYS 213.A O no hydrogen 3.051 N/A ALA 217.A N THR 214.A O no hydrogen 3.063 N/A ILE 218.A N VAL 207.A O no hydrogen 2.821 N/A VAL 221.A N GLN 205.A O no hydrogen 2.988 N/A THR 223.A N LEU 203.A O no hydrogen 2.964 N/A THR 223.A OG1 ALA 224.A O no hydrogen 3.386 N/A LYS 226.A N ILE 201.A O no hydrogen 2.791 N/A LYS 226.A NZ SER 227.A O no hydrogen 2.671 N/A SER 227.A OG.A ASN 200.A OD1 no hydrogen 2.557 N/A ILE 228.A N ALA 199.A O no hydrogen 2.824 N/A GLY 231.A N ASN 193.A O no hydrogen 2.774 N/A ALA 232.A N ALA 229.A O no hydrogen 3.091 N/A ALA 234.A N VAL 191.A O no hydrogen 2.957 N/A VAL 236.A N THR 189.A O no hydrogen 2.755 N/A SER 238.A N LEU 187.A O no hydrogen 2.907 N/A SER 238.A OG GLN 205.A OE1 no hydrogen 2.505 N/A THR 239.A OG1 ASN 186.A OD1 no hydrogen 3.275 N/A ILE 240.A N MET 185.A O no hydrogen 2.843 N/A ALA 242.A N VAL 183.A O no hydrogen 2.848 N/A ALA 243.A N ILE 218.A O no hydrogen 2.734 N/A LYS 246.A N TYR 256.A OH no hydrogen 2.874 N/A TRP 248.A N PHE 278.A O no hydrogen 2.633 N/A TRP 248.A NE1 ASN 350.A O no hydrogen 2.816 N/A SER 249.A N ASN 252.A O no hydrogen 3.076 N/A ASN 252.A N SER 249.A OG no hydrogen 3.142 N/A ASN 254.A N ASN 252.A O no hydrogen 2.737 N/A TYR 256.A N TYR 276.A O no hydrogen 2.828 N/A THR 257.A N PHE 208.A O no hydrogen 2.729 N/A VAL 258.A N THR 274.A O no hydrogen 2.920 N/A ARG 259.A N THR 206.A O no hydrogen 2.769 N/A ARG 259.A NE ASP 273.A OD1 no hydrogen 2.770 N/A ARG 259.A NE ASP 273.A OD2 no hydrogen 3.351 N/A ARG 259.A NH2 ASP 273.A OD2 no hydrogen 2.801 N/A THR 260.A N TYR 272.A O no hydrogen 2.820 N/A GLU 261.A N LYS 204.A O no hydrogen 2.823 N/A VAL 262.A N ASP 270.A O no hydrogen 2.891 N/A LEU 263.A N THR 202.A O no hydrogen 2.810 N/A ASN 264.A N LYS 267.A O no hydrogen 3.055 N/A LYS 267.A N ASN 264.A O no hydrogen 3.217 N/A LEU 269.A N VAL 262.A O no hydrogen 2.616 N/A TYR 272.A N THR 260.A O no hydrogen 2.845 N/A THR 274.A N VAL 258.A O no hydrogen 3.011 N/A TYR 276.A N TYR 256.A O no hydrogen 2.956 N/A ARG 279.A NE PRO 414.A O no hydrogen 2.853 N/A ARG 279.A NH1 VAL 416.A O no hydrogen 3.019 N/A ARG 279.A NH2 ARG 279.A O no hydrogen 2.916 N/A TRP 280.A N ASN 292.A OD1 no hydrogen 3.048 N/A GLY 282.A N SER 290.A O.A no hydrogen 3.037 N/A GLY 282.A N SER 290.A O.B no hydrogen 3.098 N/A ASP 284.A N GLY 288.A O no hydrogen 2.794 N/A THR 286.A N ASP 284.A OD2 no hydrogen 2.813 N/A SER 287.A N ASP 284.A OD2 no hydrogen 2.905 N/A SER 287.A OG ASP 284.A OD2 no hydrogen 3.178 N/A GLY 288.A N ASP 284.A O no hydrogen 3.054 N/A SER 290.A N.A GLY 282.A O no hydrogen 2.941 N/A SER 290.A N.B GLY 282.A O no hydrogen 2.935 N/A LEU 291.A N GLU 294.A O no hydrogen 2.833 N/A ASN 292.A N TRP 280.A O no hydrogen 2.732 N/A ASN 292.A ND2 TRP 248.A O no hydrogen 2.855 N/A GLU 294.A N LEU 291.A O no hydrogen 3.078 N/A VAL 296.A N PHE 289.A O no hydrogen 2.999 N/A LYS 297.A NZ VAL 556.A O no hydrogen 3.422 N/A LYS 297.A NZ ARG 559.A O no hydrogen 2.825 N/A LYS 297.A NZ VAL 562.A O no hydrogen 2.784 N/A LEU 298.A N ALA 563.A O no hydrogen 3.022 N/A LYS 299.A N ASN 332.A OD1 no hydrogen 2.870 N/A LYS 299.A NZ TRP 619.A O no hydrogen 2.786 N/A GLY 300.A N THR 565.A O no hydrogen 2.744 N/A VAL 301.A N SER 333.A O no hydrogen 3.163 N/A SER 302.A N VAL 567.A O no hydrogen 2.725 N/A SER 302.A OG TYR 566.A O no hydrogen 3.316 N/A MET 303.A N ARG 335.A O no hydrogen 3.130 N/A HIS 305.A NE2 SER 145.A O no hydrogen 2.859 N/A GLN 307.A N GLY 311.A O no hydrogen 2.722 N/A GLN 307.A NE2 HIS 305.A O no hydrogen 3.132 N/A GLN 307.A NE2 GLN 322.A OE1 no hydrogen 3.119 N/A GLY 308.A N ASP 306.A OD1 no hydrogen 2.966 N/A LEU 310.A N GLN 307.A O no hydrogen 3.291 N/A GLY 311.A N GLY 308.A O no hydrogen 2.790 N/A ALA 312.A N ASP 44.A OD2 no hydrogen 2.750 N/A ALA 314.A N TYR 150.A O no hydrogen 2.927 N/A ASN 315.A ND2 LYS 762.A O no hydrogen 2.916 N/A ARG 317.A NH1 GLU 320.A OE1 no hydrogen 2.865 N/A ARG 317.A NH1 GLU 324.A OE1 no hydrogen 3.060 N/A ARG 317.A NH1 GLU 324.A OE2 no hydrogen 3.457 N/A ARG 317.A NH2 GLU 324.A OE1 no hydrogen 3.539 N/A ARG 317.A NH2 ASP 753.A OD2 no hydrogen 2.888 N/A ALA 318.A N ASN 315.A OD1 no hydrogen 3.078 N/A ILE 319.A N ASN 315.A O no hydrogen 2.981 N/A GLU 320.A N ARG 316.A O no hydrogen 2.798 N/A ARG 321.A N ARG 317.A O no hydrogen 2.820 N/A ARG 321.A NH1 ALA 605.A O no hydrogen 3.444 N/A ARG 321.A NH2 ALA 605.A O no hydrogen 2.788 N/A GLN 322.A N ALA 318.A O no hydrogen 3.131 N/A GLN 322.A NE2 ASP 306.A O no hydrogen 3.687 N/A VAL 323.A N ILE 319.A O no hydrogen 3.180 N/A GLU 324.A N GLU 320.A O no hydrogen 2.898 N/A ILE 325.A N ARG 321.A O no hydrogen 2.944 N/A LEU 326.A N GLN 322.A O no hydrogen 2.945 N/A GLN 327.A N VAL 323.A O no hydrogen 2.762 N/A GLN 327.A NE2 LYS 352.A O no hydrogen 3.198 N/A LYS 328.A N GLU 324.A O no hydrogen 3.085 N/A LYS 328.A NZ GLU 734.A OE2 no hydrogen 2.903 N/A MET 329.A N LEU 326.A O no hydrogen 2.901 N/A GLY 330.A N GLN 327.A O no hydrogen 2.799 N/A VAL 331.A N LEU 326.A O no hydrogen 3.115 N/A ASN 332.A N LYS 299.A O no hydrogen 3.029 N/A ASN 332.A ND2 LYS 297.A O no hydrogen 3.034 N/A SER 333.A OG LEU 355.A O no hydrogen 2.771 N/A SER 333.A OG TYR 566.A OH no hydrogen 2.686 N/A ILE 334.A N LEU 355.A O no hydrogen 2.823 N/A ARG 335.A N VAL 301.A O no hydrogen 2.969 N/A ARG 335.A NE GLU 359.A OE1 no hydrogen 3.332 N/A ARG 335.A NH1 GLU 510.A OE1 no hydrogen 3.043 N/A ARG 335.A NH2 GLU 359.A OE1 no hydrogen 2.781 N/A ARG 335.A NH2 ASN 423.A OD1 no hydrogen 2.778 N/A THR 336.A N VAL 357.A O no hydrogen 3.069 N/A THR 336.A OG1 ASN 339.A O no hydrogen 2.987 N/A THR 336.A OG1 GLU 359.A O no hydrogen 3.460 N/A THR 337.A N ARG 335.A O no hydrogen 2.869 N/A HIS 338.A ND1 GLU 359.A OE2 no hydrogen 2.709 N/A ASN 339.A N THR 336.A O no hydrogen 2.903 N/A ALA 341.A N GLU 358.A OE2 no hydrogen 3.030 N/A LYS 343.A N ASP 89.A OD2 no hydrogen 2.872 N/A LYS 343.A NZ ARG 409.A O no hydrogen 3.172 N/A LYS 343.A NZ ASP 410.A OD1 no hydrogen 2.840 N/A LEU 345.A N ALA 342.A O no hydrogen 2.905 N/A ILE 346.A N ALA 342.A O no hydrogen 3.297 N/A ASP 347.A N LYS 343.A O no hydrogen 2.689 N/A VAL 348.A N ALA 344.A O no hydrogen 2.923 N/A CYS 349.A N LEU 345.A O no hydrogen 2.924 N/A CYS 349.A SG LEU 345.A O no hydrogen 3.406 N/A ASN 350.A N ILE 346.A O no hydrogen 2.921 N/A ASN 350.A ND2 GLU 275.A OE2 no hydrogen 2.846 N/A GLU 351.A N ASP 347.A O no hydrogen 3.047 N/A LYS 352.A N VAL 348.A O no hydrogen 2.719 N/A LYS 352.A NZ GLU 324.A OE2 no hydrogen 2.776 N/A GLY 353.A N CYS 349.A O no hydrogen 2.980 N/A VAL 354.A N CYS 349.A O no hydrogen 3.267 N/A LEU 355.A N ASN 332.A O no hydrogen 2.952 N/A VAL 356.A N SER 415.A O no hydrogen 2.692 N/A VAL 357.A N ILE 334.A O no hydrogen 2.897 N/A GLU 358.A N MET 418.A O no hydrogen 3.146 N/A GLU 359.A N THR 336.A OG1 no hydrogen 2.884 N/A VAL 360.A N SER 420.A O no hydrogen 2.814 N/A TRP 364.A NE1 LEU 421.A O no hydrogen 2.672 N/A ARG 366.A NH1 SER 430.A O no hydrogen 2.737 N/A ARG 366.A NH1 SER 432.A O no hydrogen 3.117 N/A SER 367.A OG ASN 371.A O no hydrogen 3.428 N/A SER 367.A OG ASP 374.A OD1 no hydrogen 2.576 N/A LYS 368.A N ASP 374.A OD2 no hydrogen 3.031 N/A LYS 368.A NZ ASP 362.A OD1 no hydrogen 2.837 N/A LYS 368.A NZ ASN 423.A O no hydrogen 2.787 N/A LYS 368.A NZ GLU 424.A O no hydrogen 3.091 N/A ASN 369.A N GLY 428.A O no hydrogen 3.144 N/A ASN 371.A N LYS 368.A O no hydrogen 2.777 N/A ASN 371.A ND2 GLU 58.A OE2 no hydrogen 3.124 N/A GLU 373.A N PRO 139.A O no hydrogen 2.979 N/A ASP 374.A N ASN 371.A O no hydrogen 3.002 N/A TYR 375.A OH ASP 402.A OD2 no hydrogen 2.652 N/A GLY 376.A N ASP 374.A OD1 no hydrogen 2.850 N/A LYS 377.A N ASP 374.A O no hydrogen 3.080 N/A TRP 378.A N TYR 375.A O no hydrogen 2.745 N/A PHE 379.A N TYR 375.A O no hydrogen 2.902 N/A GLN 381.A N TRP 378.A O no hydrogen 2.927 N/A GLN 381.A NE2 LYS 377.A O no hydrogen 2.790 N/A ASN 387.A N ALA 384.A O no hydrogen 3.073 N/A ASN 387.A ND2 THR 106.A O no hydrogen 2.992 N/A ALA 388.A N LEU 104.A O no hydrogen 3.003 N/A VAL 389.A N ASN 387.A OD1 no hydrogen 3.119 N/A LEU 390.A N SER 115.A O.A no hydrogen 2.734 N/A LEU 390.A N SER 115.A O.B no hydrogen 2.785 N/A ASP 393.A N THR 404.A OG1 no hydrogen 2.933 N/A LYS 394.A NZ ASN 387.A O no hydrogen 2.827 N/A LYS 394.A NZ VAL 389.A O no hydrogen 2.786 N/A THR 397.A OG1 PHE 379.A O no hydrogen 3.473 N/A TRP 398.A N GLN 381.A O no hydrogen 2.966 N/A ALA 399.A N PHE 379.A O no hydrogen 3.055 N/A LYS 400.A NZ ASP 395.A OD1 no hydrogen 2.923 N/A LYS 400.A NZ ASP 395.A OD2 no hydrogen 3.322 N/A LYS 400.A NZ GLU 396.A OE2 no hydrogen 2.803 N/A PHE 401.A N THR 397.A O no hydrogen 3.170 N/A ASP 402.A N TRP 398.A O no hydrogen 2.844 N/A LEU 403.A N ALA 399.A O no hydrogen 2.902 N/A THR 404.A N LYS 400.A O no hydrogen 2.944 N/A THR 404.A OG1 LYS 400.A O no hydrogen 2.716 N/A THR 404.A OG1 PHE 401.A O no hydrogen 3.170 N/A SER 405.A N PHE 401.A O no hydrogen 2.817 N/A SER 405.A OG PRO 113.A O no hydrogen 2.585 N/A THR 406.A N ASP 402.A O no hydrogen 3.228 N/A THR 406.A OG1 ASP 402.A O no hydrogen 2.952 N/A ILE 407.A N LEU 403.A O no hydrogen 3.048 N/A ASN 408.A N THR 404.A O no hydrogen 2.767 N/A ASN 408.A ND2 GLY 391.A O no hydrogen 2.997 N/A ARG 409.A N SER 405.A O no hydrogen 3.061 N/A ARG 409.A NE ASP 410.A OD1 no hydrogen 2.953 N/A ARG 409.A NE ASP 410.A OD2 no hydrogen 3.284 N/A ARG 409.A NH1 ASP 89.A OD1 no hydrogen 2.880 N/A ARG 409.A NH1 ALA 341.A O no hydrogen 3.005 N/A ARG 409.A NH2 ALA 341.A O no hydrogen 2.659 N/A ARG 409.A NH2 ASP 410.A OD2 no hydrogen 2.900 N/A ASP 410.A N THR 406.A O no hydrogen 3.111 N/A ASP 410.A N ILE 407.A O no hydrogen 3.184 N/A ARG 411.A NH1 ALA 450.A O no hydrogen 2.808 N/A ARG 411.A NH2 ASN 408.A OD1 no hydrogen 2.834 N/A ARG 411.A NH2 ALA 450.A O no hydrogen 3.000 N/A ASN 412.A ND2 VAL 168.A O no hydrogen 2.892 N/A ASN 412.A ND2 THR 274.A OG1 no hydrogen 3.017 N/A ALA 413.A N ASP 410.A O no hydrogen 2.984 N/A SER 415.A N ASN 350.A OD1 no hydrogen 3.140 N/A SER 415.A OG ASN 350.A OD1 no hydrogen 2.806 N/A VAL 416.A N ALA 413.A O no hydrogen 3.213 N/A ILE 417.A N VAL 356.A O no hydrogen 2.843 N/A TRP 419.A N PRO 455.A O no hydrogen 3.053 N/A TRP 419.A NE1 ASP 451.A OD2 no hydrogen 2.748 N/A SER 420.A N GLU 358.A O no hydrogen 2.967 N/A SER 420.A OG GLU 359.A OE1 no hydrogen 2.632 N/A LEU 421.A N THR 457.A O no hydrogen 2.711 N/A ASN 423.A N ASP 362.A O no hydrogen 3.100 N/A ASN 423.A ND2 ASP 362.A OD1 no hydrogen 3.413 N/A GLU 424.A N GLY 459.A O no hydrogen 2.772 N/A GLU 427.A N GLU 424.A O no hydrogen 2.903 N/A SER 432.A OG SER 434.A OG no hydrogen 3.173 N/A SER 434.A N SER 432.A OG no hydrogen 3.037 N/A SER 434.A OG SER 432.A OG no hydrogen 3.173 N/A PHE 436.A N VAL 433.A O no hydrogen 3.101 N/A THR 439.A N GLY 435.A O no hydrogen 3.171 N/A THR 439.A OG1 GLY 435.A O no hydrogen 3.337 N/A SER 440.A N PHE 436.A O no hydrogen 2.867 N/A ALA 441.A N PRO 437.A O no hydrogen 2.929 N/A LYS 442.A N ALA 438.A O no hydrogen 3.093 N/A LEU 443.A N THR 439.A O no hydrogen 3.009 N/A VAL 444.A N SER 440.A O no hydrogen 2.853 N/A ALA 445.A N ALA 441.A O no hydrogen 2.854 N/A TRP 446.A N LYS 442.A O no hydrogen 2.956 N/A TRP 446.A NE1 GLU 396.A OE2 no hydrogen 2.951 N/A THR 447.A N LEU 443.A O no hydrogen 2.930 N/A THR 447.A OG1 LEU 443.A O no hydrogen 2.793 N/A LYS 448.A N VAL 444.A O no hydrogen 2.903 N/A LYS 448.A NZ ASN 480.A OD1 no hydrogen 2.508 N/A ALA 449.A N ALA 445.A O no hydrogen 3.127 N/A ALA 450.A N TRP 446.A O no hydrogen 2.837 N/A ASP 451.A N THR 447.A O no hydrogen 2.821 N/A THR 453.A N ASP 451.A OD1 no hydrogen 3.099 N/A THR 453.A OG1 ASP 451.A OD1 no hydrogen 2.645 N/A THR 453.A OG1 ASP 451.A OD2 no hydrogen 3.394 N/A ARG 454.A NE VAL 416.A O no hydrogen 2.762 N/A ARG 454.A NH1 ARG 411.A O no hydrogen 2.757 N/A ARG 454.A NH1 ASP 451.A OD2 no hydrogen 2.939 N/A ARG 454.A NH2 ARG 411.A O no hydrogen 2.887 N/A ARG 454.A NH2 ALA 413.A O no hydrogen 2.806 N/A THR 457.A N TRP 419.A O no hydrogen 2.734 N/A THR 457.A OG1 TYR 458.A O no hydrogen 3.369 N/A THR 457.A OG1 VAL 483.A O no hydrogen 2.548 N/A THR 457.A OG1 TYR 507.A OH no hydrogen 2.762 N/A GLY 459.A N GLY 422.A O no hydrogen 2.941 N/A ASP 460.A N GLY 485.A O no hydrogen 3.035 N/A ASN 461.A ND2 GLU 427.A OE1 no hydrogen 2.887 N/A LYS 462.A N ASP 460.A OD1 no hydrogen 3.000 N/A LYS 462.A NZ GLU 427.A OE1 no hydrogen 3.005 N/A LYS 464.A NZ TYR 488.A O no hydrogen 2.891 N/A ALA 465.A N LYS 462.A O no hydrogen 3.148 N/A ASN 466.A N ILE 463.A O no hydrogen 3.027 N/A TRP 467.A N LYS 462.A O no hydrogen 3.239 N/A GLU 469.A N GLU 469.A OE1 no hydrogen 2.768 N/A SER 470.A N TRP 467.A O no hydrogen 3.067 N/A SER 470.A OG ASP 460.A OD2 no hydrogen 2.694 N/A ASN 471.A N TRP 467.A O no hydrogen 3.416 N/A THR 472.A N ASN 468.A O no hydrogen 3.050 N/A THR 472.A OG1 ASN 468.A O no hydrogen 3.470 N/A MET 473.A N GLU 469.A O no hydrogen 2.909 N/A GLY 474.A N SER 470.A O no hydrogen 2.919 N/A ASP 475.A N ASN 471.A O no hydrogen 3.035 N/A ASN 476.A N THR 472.A O no hydrogen 3.036 N/A LEU 477.A N MET 473.A O no hydrogen 2.856 N/A THR 478.A N GLY 474.A O no hydrogen 2.967 N/A THR 478.A OG1 GLY 474.A O no hydrogen 2.868 N/A ALA 479.A N ASP 475.A O no hydrogen 2.785 N/A ASN 480.A N LEU 477.A O no hydrogen 3.053 N/A ASN 480.A ND2 ASN 476.A O no hydrogen 2.858 N/A GLY 481.A N THR 478.A O no hydrogen 3.356 N/A GLY 482.A N LEU 477.A O no hydrogen 2.719 N/A VAL 483.A N MET 456.A O no hydrogen 2.964 N/A VAL 484.A N ALA 505.A O no hydrogen 2.850 N/A THR 486.A N TYR 507.A O no hydrogen 3.024 N/A THR 486.A OG1 SER 489.A OG no hydrogen 2.664 N/A ASN 487.A N ASP 460.A O no hydrogen 2.821 N/A ASN 487.A ND2 ASN 423.A OD1 no hydrogen 3.061 N/A ASN 487.A ND2 GLU 424.A OE2 no hydrogen 3.128 N/A TYR 488.A N GLU 510.A O no hydrogen 2.813 N/A TYR 488.A OH GLU 510.A OE2 no hydrogen 2.528 N/A TYR 488.A OH SER 513.A OG no hydrogen 2.671 N/A SER 489.A OG THR 486.A OG1 no hydrogen 2.664 N/A SER 489.A OG ASN 493.A OD1 no hydrogen 2.595 N/A GLY 491.A N ASP 555.A OD2 no hydrogen 2.961 N/A ASN 493.A N ASP 490.A OD1 no hydrogen 2.968 N/A TYR 494.A N ASP 490.A O no hydrogen 2.873 N/A ASP 495.A N GLY 491.A O no hydrogen 3.039 N/A LYS 496.A N ALA 492.A O no hydrogen 2.885 N/A LYS 496.A NZ ASN 466.A OD1 no hydrogen 2.996 N/A ILE 497.A N ASN 493.A O no hydrogen 2.782 N/A ARG 498.A N TYR 494.A O no hydrogen 2.974 N/A ARG 498.A NH1.A THR 286.A OG1 no hydrogen 3.331 N/A ARG 498.A NH2.A THR 286.A OG1 no hydrogen 3.401 N/A ARG 498.A NH2.A PRO 502.A O no hydrogen 3.299 N/A THR 499.A N ASP 495.A O no hydrogen 2.958 N/A THR 499.A OG1 ASP 495.A O no hydrogen 3.127 N/A THR 500.A N LYS 496.A O no hydrogen 2.710 N/A THR 500.A OG1 LYS 496.A O no hydrogen 2.863 N/A HIS 501.A N ILE 497.A O no hydrogen 2.728 N/A TRP 504.A N HIS 501.A O no hydrogen 3.045 N/A TRP 504.A NE1 ASP 475.A OD1 no hydrogen 2.778 N/A TYR 507.A N VAL 484.A O no hydrogen 3.158 N/A TYR 507.A OH THR 457.A OG1 no hydrogen 2.762 N/A GLY 508.A N GLY 564.A O no hydrogen 2.957 N/A SER 509.A N THR 486.A O no hydrogen 3.079 N/A SER 509.A OG ASN 487.A OD1 no hydrogen 2.534 N/A THR 511.A N TYR 566.A O no hydrogen 3.277 N/A THR 511.A OG1 THR 565.A OG1 no hydrogen 2.569 N/A SER 513.A N THR 511.A O no hydrogen 3.004 N/A SER 513.A OG TYR 488.A OH no hydrogen 2.671 N/A ILE 515.A N SER 541.A O no hydrogen 2.953 N/A ASN 516.A N TYR 598.A O no hydrogen 2.922 N/A ASN 516.A ND2 THR 536.A O no hydrogen 2.943 N/A SER 517.A N LEU 535.A O no hydrogen 3.020 N/A SER 517.A OG GLN 534.A OE1 no hydrogen 2.652 N/A ARG 518.A NE ASP 603.A OD2 no hydrogen 2.874 N/A ARG 518.A NH1 PHE 818.A O no hydrogen 3.010 N/A ARG 518.A NH1 SER 819.A O no hydrogen 3.337 N/A ARG 518.A NH2 ASN 801.A O no hydrogen 2.989 N/A ARG 518.A NH2 PHE 818.A O no hydrogen 2.852 N/A ILE 520.A N SER 537.A OG no hydrogen 2.842 N/A TYR 521.A OH ASP 610.A OD1 no hydrogen 3.392 N/A TYR 521.A OH ASP 610.A OD2 no hydrogen 2.646 N/A ARG 523.A NH1 ASN 522.A OD1 no hydrogen 2.836 N/A ARG 523.A NH1 ASP 532.A OD2 no hydrogen 2.837 N/A ARG 523.A NH2 ASP 532.A OD1 no hydrogen 2.664 N/A ARG 523.A NH2 ASP 532.A OD2 no hydrogen 3.292 N/A GLY 527.A N SER 541.A OG no hydrogen 2.708 N/A GLN 529.A NE2 PRO 579.A O no hydrogen 2.933 N/A SER 530.A OG ASP 532.A OD1 no hydrogen 3.076 N/A SER 530.A OG GLN 534.A O no hydrogen 2.523 N/A LYS 533.A NZ SER 590.A O no hydrogen 3.135 N/A LYS 533.A NZ PRO 592.A O no hydrogen 2.778 N/A GLN 534.A N ASP 532.A OD1 no hydrogen 3.043 N/A GLN 534.A NE2 SER 803.A OG no hydrogen 2.978 N/A LEU 535.A N SER 517.A OG no hydrogen 2.843 N/A THR 536.A OG1 ARG 523.A O no hydrogen 2.612 N/A SER 537.A N ILE 520.A O no hydrogen 2.867 N/A SER 537.A OG SER 517.A O no hydrogen 2.675 N/A SER 537.A OG ILE 520.A O no hydrogen 3.422 N/A TYR 538.A N THR 536.A OG1 no hydrogen 3.202 N/A TYR 538.A OH PRO 646.A O no hydrogen 2.745 N/A ASN 540.A ND2 THR 524.A O no hydrogen 2.960 N/A SER 541.A OG ILE 515.A O no hydrogen 2.777 N/A VAL 543.A N SER 513.A O no hydrogen 3.383 N/A GLY 546.A N VAL 543.A O no hydrogen 2.954 N/A ALA 547.A N ALA 512.A O no hydrogen 2.759 N/A ALA 549.A N ASP 539.A OD1 no hydrogen 2.965 N/A SER 550.A N ASP 539.A OD2 no hydrogen 2.881 N/A SER 550.A OG ASP 539.A OD2 no hydrogen 3.465 N/A SER 550.A OG HIS 700.A ND1 no hydrogen 2.829 N/A SER 551.A N VAL 548.A O no hydrogen 2.854 N/A ALA 552.A N VAL 548.A O no hydrogen 3.052 N/A TRP 553.A N ALA 549.A O no hydrogen 3.126 N/A TYR 554.A N SER 550.A O no hydrogen 2.992 N/A ASP 555.A N SER 551.A O no hydrogen 3.137 N/A VAL 556.A N TRP 553.A O no hydrogen 3.016 N/A VAL 557.A N TRP 553.A O no hydrogen 2.814 N/A ARG 559.A N VAL 556.A O no hydrogen 3.141 N/A ARG 559.A NE ASP 495.A OD1 no hydrogen 2.865 N/A ARG 559.A NH1 ASP 495.A OD2 no hydrogen 2.960 N/A ARG 559.A NH2 ASP 555.A O no hydrogen 2.886 N/A VAL 562.A N ARG 559.A O no hydrogen 3.134 N/A ALA 563.A N ILE 506.A O no hydrogen 3.068 N/A THR 565.A N LEU 298.A O no hydrogen 2.863 N/A TYR 566.A N GLY 508.A O no hydrogen 3.004 N/A TYR 566.A OH SER 333.A OG no hydrogen 2.686 N/A VAL 567.A N GLY 300.A O no hydrogen 2.900 N/A TRP 568.A N THR 511.A O no hydrogen 2.937 N/A TRP 568.A NE1 TYR 573.A OH no hydrogen 3.035 N/A THR 569.A N PHE 599.A O no hydrogen 3.124 N/A THR 569.A OG1 PHE 571.A O no hydrogen 2.784 N/A GLY 570.A N SER 302.A O no hydrogen 2.961 N/A ASP 572.A N VAL 602.A O no hydrogen 2.735 N/A TYR 573.A N SER 597.A OG no hydrogen 2.904 N/A TYR 573.A OH GLU 576.A OE1 no hydrogen 2.582 N/A LEU 574.A N ASP 306.A OD2 no hydrogen 2.904 N/A GLY 575.A N LYS 595.A O no hydrogen 2.854 N/A GLU 576.A N GLU 58.A O no hydrogen 2.950 N/A TRP 580.A N PRO 577.A O no hydrogen 2.759 N/A GLY 586.A N ASN 55.A O no hydrogen 3.337 N/A VAL 588.A N TYR 61.A OH no hydrogen 3.101 N/A SER 593.A OG VAL 588.A O no hydrogen 3.036 N/A SER 593.A OG GLY 589.A O no hydrogen 3.301 N/A LYS 595.A N SER 804.A O no hydrogen 2.885 N/A LYS 595.A NZ ASN 596.A OD1 no hydrogen 3.076 N/A LYS 595.A NZ SER 804.A O no hydrogen 3.031 N/A LYS 595.A NZ ASP 806.A O no hydrogen 2.953 N/A ASN 596.A N SER 804.A OG no hydrogen 3.076 N/A ASN 596.A ND2 SER 597.A O no hydrogen 2.938 N/A SER 597.A N TYR 573.A O no hydrogen 2.835 N/A SER 597.A OG ASP 572.A OD1 no hydrogen 2.895 N/A SER 597.A OG TYR 573.A O no hydrogen 3.434 N/A TYR 598.A OH LYS 533.A O no hydrogen 2.676 N/A GLY 600.A N ASP 572.A OD1 no hydrogen 2.596 N/A ILE 601.A N THR 569.A O no hydrogen 3.029 N/A VAL 602.A N GLY 570.A O no hydrogen 2.944 N/A ASP 603.A N PHE 607.A O no hydrogen 3.035 N/A THR 604.A OG1 ASP 800.A OD1 no hydrogen 3.408 N/A THR 604.A OG1 ASP 800.A OD2 no hydrogen 2.806 N/A GLY 606.A N ASP 603.A O no hydrogen 3.051 N/A PHE 607.A N ASP 603.A OD1 no hydrogen 2.695 N/A LYS 609.A N ILE 601.A O no hydrogen 2.939 N/A LYS 609.A NZ ASN 516.A O no hydrogen 2.797 N/A LYS 609.A NZ ASP 572.A OD1 no hydrogen 3.382 N/A LYS 609.A NZ ASP 572.A OD2 no hydrogen 2.757 N/A LYS 609.A NZ TYR 598.A O no hydrogen 3.302 N/A LYS 609.A NZ GLY 600.A O no hydrogen 2.751 N/A TYR 612.A N LYS 609.A O no hydrogen 2.929 N/A TYR 612.A OH ILE 325.A O no hydrogen 2.669 N/A TYR 613.A N ASP 610.A O no hydrogen 3.010 N/A TYR 615.A N THR 611.A O no hydrogen 2.989 N/A GLN 616.A N TYR 612.A O no hydrogen 2.862 N/A GLN 616.A NE2 LYS 328.A O no hydrogen 3.051 N/A GLN 616.A NE2 GLU 734.A OE1 no hydrogen 3.066 N/A SER 617.A N TYR 613.A O no hydrogen 2.907 N/A SER 617.A OG TYR 613.A O no hydrogen 3.501 N/A SER 617.A OG PHE 614.A O no hydrogen 2.529 N/A GLN 618.A N PHE 614.A O no hydrogen 3.059 N/A GLN 618.A N TYR 615.A O no hydrogen 2.867 N/A GLN 618.A NE2 SER 617.A OG no hydrogen 3.126 N/A TRP 619.A N TYR 615.A O no hydrogen 2.786 N/A ASN 620.A N GLN 616.A O no hydrogen 3.149 N/A ASN 620.A ND2 LYS 328.A O no hydrogen 2.786 N/A ASP 622.A N ASN 620.A OD1 no hydrogen 2.924 N/A HIS 624.A ND1 ASP 652.A OD2 no hydrogen 2.913 N/A THR 625.A N ASP 652.A OD1 no hydrogen 2.886 N/A THR 625.A OG1 GLN 616.A OE1 no hydrogen 2.703 N/A LEU 626.A N GLU 734.A O no hydrogen 2.866 N/A HIS 627.A N TYR 650.A O no hydrogen 2.852 N/A HIS 627.A NE2 ASP 610.A OD1 no hydrogen 2.772 N/A ILE 628.A N ASN 736.A O no hydrogen 2.784 N/A LEU 629.A N VAL 648.A O no hydrogen 2.982 N/A TRP 632.A NE1 ALA 712.A O no hydrogen 2.729 N/A ASN 633.A ND2 THR 742.A OG1 no hydrogen 3.020 N/A ASN 635.A ND2 ASP 781.A OD2 no hydrogen 2.887 N/A VAL 636.A N ASN 633.A O no hydrogen 3.105 N/A LYS 639.A NZ GLU 634.A OE1 no hydrogen 2.703 N/A GLY 640.A N ASN 644.A O no hydrogen 2.949 N/A ASN 643.A N GLY 640.A O no hydrogen 3.196 N/A ASN 644.A N SER 641.A O no hydrogen 3.104 N/A VAL 645.A N VAL 709.A O no hydrogen 2.746 N/A VAL 647.A N TRP 707.A O no hydrogen 2.618 N/A VAL 648.A N LEU 629.A O no hydrogen 2.824 N/A VAL 649.A N LEU 705.A O no hydrogen 2.891 N/A TYR 650.A N HIS 627.A O no hydrogen 2.874 N/A THR 651.A OG1 THR 625.A O no hydrogen 2.664 N/A ALA 653.A N THR 651.A OG1 no hydrogen 2.917 N/A LYS 655.A N TYR 721.A O no hydrogen 2.991 N/A LYS 655.A NZ GLU 673.A OE2 no hydrogen 2.696 N/A LYS 655.A NZ ASN 725.A OD1 no hydrogen 2.404 N/A VAL 656.A N LYS 674.A O no hydrogen 2.998 N/A LYS 657.A N GLU 719.A O no hydrogen 2.997 N/A LYS 657.A NZ TYR 721.A OH no hydrogen 2.909 N/A LEU 658.A N GLY 672.A O no hydrogen 2.888 N/A TYR 659.A N SER 717.A O no hydrogen 2.800 N/A TYR 659.A OH GLU 719.A OE1 no hydrogen 2.848 N/A PHE 660.A N ARG 669.A O no hydrogen 2.946 N/A THR 661.A N THR 715.A O no hydrogen 2.825 N/A LYS 663.A N GLU 713.A O no hydrogen 3.196 N/A SER 665.A N PRO 662.A O no hydrogen 3.050 N/A SER 665.A OG GLU 667.A O no hydrogen 3.409 N/A GLU 667.A N SER 665.A OG no hydrogen 3.033 N/A LYS 668.A NZ GLU 719.A OE2 no hydrogen 2.569 N/A ARG 669.A N PHE 660.A O no hydrogen 2.848 N/A ILE 671.A N LEU 658.A O no hydrogen 2.880 N/A LYS 674.A N VAL 656.A O no hydrogen 3.046 N/A LYS 674.A NZ THR 706.A O no hydrogen 2.586 N/A PHE 676.A N ALA 654.A O no hydrogen 2.779 N/A THR 677.A N VAL 689.A O no hydrogen 2.732 N/A THR 677.A OG1 GLU 691.A OE1 no hydrogen 3.367 N/A LYS 679.A N TYR 687.A O no hydrogen 2.750 N/A LYS 679.A NZ GLU 691.A OE2 no hydrogen 2.884 N/A THR 681.A N TYR 685.A O no hydrogen 2.786 N/A THR 681.A OG1 ASP 560.A OD1 no hydrogen 2.659 N/A THR 681.A OG1 ASP 560.A OD2 no hydrogen 3.402 N/A ALA 683.A N ASP 560.A OD2 no hydrogen 2.897 N/A GLY 684.A N THR 681.A O no hydrogen 2.965 N/A TYR 685.A N THR 681.A OG1 no hydrogen 3.209 N/A TYR 687.A N LYS 679.A O no hydrogen 3.001 N/A GLN 688.A NE2 ASP 652.A O no hydrogen 3.470 N/A GLN 688.A NE2 ALA 653.A O no hydrogen 2.913 N/A VAL 689.A N THR 677.A O no hydrogen 2.965 N/A TYR 690.A N ASN 702.A O no hydrogen 2.779 N/A TYR 690.A OH ASP 694.A OD2 no hydrogen 2.488 N/A LYS 695.A N GLY 692.A O no hydrogen 2.991 N/A ASP 696.A N ASN 702.A OD1 no hydrogen 2.755 N/A THR 698.A N ASP 696.A OD1 no hydrogen 2.765 N/A HIS 700.A ND1 SER 550.A OG no hydrogen 2.829 N/A LYS 701.A N THR 698.A O no hydrogen 3.112 N/A LYS 701.A NZ ASP 696.A OD2 no hydrogen 3.444 N/A ASN 702.A N ALA 699.A O no hydrogen 2.857 N/A ASN 702.A ND2 ASP 696.A O no hydrogen 2.875 N/A ASN 702.A ND2 ALA 699.A O no hydrogen 3.651 N/A MET 703.A N HIS 700.A O no hydrogen 3.168 N/A TYR 704.A N LYS 701.A O no hydrogen 3.400 N/A LEU 705.A N VAL 649.A O no hydrogen 3.250 N/A TRP 707.A N VAL 647.A O no hydrogen 2.761 N/A VAL 709.A N VAL 645.A O no hydrogen 2.920 N/A TRP 711.A N ASN 643.A O no hydrogen 3.420 N/A GLY 714.A N THR 741.A OG1 no hydrogen 3.138 N/A THR 715.A N THR 661.A O no hydrogen 2.933 N/A THR 715.A OG1 THR 740.A OG1 no hydrogen 2.578 N/A ILE 716.A N VAL 739.A O no hydrogen 2.878 N/A SER 717.A N TYR 659.A O no hydrogen 3.128 N/A ALA 718.A N ALA 737.A O no hydrogen 3.009 N/A GLU 719.A N LYS 657.A O no hydrogen 2.856 N/A TYR 721.A N LYS 655.A O no hydrogen 2.726 N/A TYR 721.A OH GLU 719.A OE1 no hydrogen 2.869 N/A ASP 722.A N ARG 726.A O no hydrogen 2.989 N/A ASN 724.A N ASP 722.A OD1 no hydrogen 2.792 N/A ASN 725.A N ASP 722.A O no hydrogen 3.101 N/A ARG 726.A N ASP 722.A OD1 no hydrogen 3.097 N/A ILE 728.A N ALA 720.A O no hydrogen 2.873 N/A THR 733.A N GLU 730.A O no hydrogen 3.221 N/A THR 733.A OG1 GLU 730.A O no hydrogen 3.109 N/A GLU 734.A N HIS 624.A O no hydrogen 2.831 N/A ASN 736.A N HIS 627.A ND1 no hydrogen 3.013 N/A VAL 739.A N ILE 716.A O no hydrogen 2.811 N/A THR 740.A OG1 GLY 714.A O no hydrogen 2.949 N/A THR 740.A OG1 THR 715.A OG1 no hydrogen 2.578 N/A THR 741.A N GLY 714.A O no hydrogen 2.986 N/A THR 741.A OG1 TRP 632.A O no hydrogen 2.924 N/A THR 741.A OG1 GLY 714.A O no hydrogen 3.441 N/A THR 742.A N ASN 633.A OD1 no hydrogen 2.906 N/A THR 742.A OG1 GLY 743.A O no hydrogen 2.882 N/A GLY 743.A N ASP 773.A OD2 no hydrogen 2.869 N/A ALA 746.A N THR 772.A O no hydrogen 2.825 N/A LYS 747.A N THR 772.A O no hydrogen 3.201 N/A LYS 747.A NZ ALA 774.A O no hydrogen 3.446 N/A LEU 748.A N GLN 845.A O no hydrogen 2.985 N/A LYS 749.A N ASP 770.A O no hydrogen 2.954 N/A LYS 749.A NZ ASP 751.A OD1.A no hydrogen 2.359 N/A ALA 750.A N SER 847.A OG no hydrogen 2.967 N/A ASP 751.A N.A GLU 768.A O no hydrogen 2.960 N/A ASP 751.A N.B GLU 768.A O no hydrogen 2.961 N/A ASP 753.A N TYR 766.A O no hydrogen 2.780 N/A ARG 754.A NH1 ASP 763.A OD1 no hydrogen 2.990 N/A ARG 754.A NH2 ASP 763.A OD2 no hydrogen 2.895 N/A LYS 755.A NZ ASP 751.A OD1.B no hydrogen 2.420 N/A LYS 755.A NZ ALA 752.A O no hydrogen 2.828 N/A THR 756.A OG1 ALA 852.A O no hydrogen 3.550 N/A ILE 757.A N ALA 852.A O no hydrogen 2.859 N/A THR 758.A N ASP 763.A OD2 no hydrogen 2.808 N/A THR 758.A OG1 ASP 763.A OD2 no hydrogen 3.503 N/A ALA 759.A N THR 854.A O no hydrogen 2.808 N/A GLY 761.A N SER 828.A OG no hydrogen 3.247 N/A GLY 761.A N THR 829.A O no hydrogen 3.052 N/A LYS 762.A N ASP 760.A OD1 no hydrogen 2.919 N/A LYS 762.A NZ ASP 11.A OD2 no hydrogen 2.822 N/A ASP 763.A N ASP 760.A OD1 no hydrogen 2.900 N/A LEU 764.A N ASP 763.A OD1 no hydrogen 2.878 N/A SER 765.A N VAL 826.A O no hydrogen 2.843 N/A SER 765.A OG ARG 754.A O no hydrogen 2.842 N/A TYR 766.A N ASP 753.A OD1 no hydrogen 2.927 N/A ILE 767.A N ALA 824.A O no hydrogen 2.824 N/A GLU 768.A N ASP 751.A O.A no hydrogen 3.055 N/A GLU 768.A N ASP 751.A O.B no hydrogen 3.036 N/A VAL 769.A N VAL 822.A O no hydrogen 2.878 N/A ASP 770.A N LYS 749.A O no hydrogen 2.878 N/A VAL 771.A N GLY 820.A O no hydrogen 2.870 N/A THR 772.A N LYS 747.A O no hydrogen 3.040 N/A THR 772.A OG1 ASP 773.A O no hydrogen 2.959 N/A ASP 773.A N HIS 777.A O no hydrogen 2.831 N/A ASN 775.A N ASP 773.A OD1 no hydrogen 2.911 N/A GLY 776.A N ASP 773.A O no hydrogen 3.288 N/A HIS 777.A N ASP 773.A OD1 no hydrogen 2.932 N/A HIS 777.A ND1 ASP 773.A OD2 no hydrogen 3.246 N/A VAL 779.A N VAL 771.A O no hydrogen 2.860 N/A ALA 782.A N VAL 779.A O no hydrogen 3.095 N/A ARG 785.A NH1 ASP 808.A OD2 no hydrogen 2.885 N/A ARG 785.A NH1 ASN 814.A OD1 no hydrogen 2.923 N/A ARG 785.A NH2 ASP 808.A OD2 no hydrogen 2.978 N/A VAL 786.A N ARG 815.A O no hydrogen 2.908 N/A THR 787.A N LYS 840.A O no hydrogen 2.884 N/A PHE 788.A N ASP 813.A O no hydrogen 2.773 N/A ASP 789.A N THR 838.A O no hydrogen 2.878 N/A LYS 791.A N THR 836.A O no hydrogen 2.839 N/A LYS 791.A NZ ASP 789.A OD1 no hydrogen 2.447 N/A ALA 793.A N GLU 834.A O no hydrogen 2.988 N/A GLY 794.A N GLY 792.A O no hydrogen 2.826 N/A LYS 795.A N GLN 827.A O no hydrogen 2.858 N/A VAL 797.A N ILE 825.A O no hydrogen 2.793 N/A GLY 798.A N ILE 825.A O no hydrogen 3.279 N/A VAL 799.A N TYR 810.A O no hydrogen 3.131 N/A ASP 800.A N LEU 823.A O no hydrogen 2.989 N/A ASN 801.A ND2 ASP 806.A OD2 no hydrogen 2.838 N/A ASN 801.A ND2 LYS 816.A O no hydrogen 2.752 N/A GLY 802.A N ASP 800.A OD1 no hydrogen 2.947 N/A SER 803.A N ASN 801.A OD1 no hydrogen 3.026 N/A SER 804.A OG ASN 596.A O no hydrogen 2.539 N/A ASP 806.A N SER 803.A O no hydrogen 3.124 N/A HIS 807.A NE2 SER 593.A O no hydrogen 2.621 N/A ASP 808.A N ASP 806.A OD1 no hydrogen 2.914 N/A SER 809.A OG GLN 811.A OE1 no hydrogen 3.103 N/A GLN 811.A N SER 809.A OG no hydrogen 3.080 N/A GLN 811.A NE2 ILE 47.A O no hydrogen 2.997 N/A ALA 812.A N SER 809.A O no hydrogen 3.187 N/A ASN 814.A ND2 ASP 813.A OD1 no hydrogen 2.896 N/A ARG 815.A N VAL 786.A O no hydrogen 3.048 N/A ARG 815.A NH1 ASP 808.A O no hydrogen 2.934 N/A ALA 817.A N ASN 784.A O no hydrogen 2.848 N/A PHE 818.A N LYS 821.A O no hydrogen 2.935 N/A SER 819.A OG ARG 518.A O no hydrogen 2.690 N/A GLY 820.A N ALA 782.A O no hydrogen 3.033 N/A LYS 821.A N PHE 818.A O no hydrogen 3.151 N/A VAL 822.A N VAL 769.A O no hydrogen 2.964 N/A LEU 823.A N ASP 800.A O no hydrogen 2.748 N/A ALA 824.A N ILE 767.A O no hydrogen 2.997 N/A ILE 825.A N GLY 798.A O no hydrogen 2.763 N/A VAL 826.A N SER 765.A O no hydrogen 3.086 N/A GLN 827.A N LYS 795.A O no hydrogen 2.806 N/A GLN 827.A NE2 LYS 762.A O no hydrogen 2.933 N/A SER 828.A N ASP 763.A O no hydrogen 3.132 N/A SER 828.A OG THR 758.A O no hydrogen 2.566 N/A SER 828.A OG ASP 760.A OD1 no hydrogen 3.509 N/A SER 828.A OG THR 829.A O no hydrogen 3.442 N/A THR 829.A OG1 GLU 831.A O no hydrogen 3.287 N/A LYS 830.A NZ ASP 40.A OD2 no hydrogen 3.035 N/A GLU 831.A N THR 829.A OG1 no hydrogen 3.290 N/A GLY 833.A N THR 853.A O no hydrogen 3.438 N/A GLY 833.A N THR 853.A OG1 no hydrogen 2.839 N/A ILE 835.A N ILE 851.A O no hydrogen 2.740 N/A THR 836.A N LYS 791.A O no hydrogen 2.846 N/A VAL 837.A N VAL 849.A O no hydrogen 2.957 N/A THR 838.A N ASP 789.A O no hydrogen 2.998 N/A THR 838.A OG1 THR 848.A OG1 no hydrogen 3.364 N/A ALA 839.A N SER 847.A O no hydrogen 2.746 N/A LYS 840.A N THR 787.A O no hydrogen 2.829 N/A LEU 844.A N ALA 841.A O no hydrogen 3.078 N/A GLN 845.A N ALA 746.A O no hydrogen 3.017 N/A SER 847.A N ALA 839.A O no hydrogen 3.054 N/A THR 848.A OG1 THR 838.A OG1 no hydrogen 3.364 N/A VAL 849.A N VAL 837.A O no hydrogen 2.860 N/A ILE 851.A N ILE 835.A O no hydrogen 2.818 N/A ALA 852.A N LYS 755.A O no hydrogen 2.918 N/A THR 853.A N GLY 833.A O no hydrogen 2.916 N/A THR 853.A OG1 GLY 833.A O no hydrogen 3.248 N/A THR 854.A N ILE 757.A O no hydrogen 2.952 N/A THR 854.A OG1 ILE 757.A O no hydrogen 3.446 N/A