Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4kxu_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): SER 2.A OG.A TYR 3.A O no hydrogen 2.862 N/A LYS 10.A N ASP 7.A OD1 no hydrogen 2.750 N/A LYS 10.A NZ PHE 52.A O no hydrogen 3.422 N/A LYS 10.A NZ HIS 53.A ND1 no hydrogen 3.049 N/A LEU 11.A N ASP 7.A O no hydrogen 2.891 N/A GLN 12.A N GLN 8.A O.A no hydrogen 2.738 N/A GLN 12.A N GLN 8.A O.B no hydrogen 2.894 N/A GLN 12.A NE2 ASP 16.A OD1 no hydrogen 2.966 N/A ALA 13.A N GLN 9.A O.A no hydrogen 2.904 N/A ALA 13.A N GLN 9.A O.B no hydrogen 2.873 N/A LEU 14.A N LYS 10.A O no hydrogen 2.897 N/A LYS 15.A N LEU 11.A O no hydrogen 2.952 N/A ASP 16.A N GLN 12.A O no hydrogen 2.813 N/A THR 17.A N ALA 13.A O no hydrogen 2.865 N/A THR 17.A OG1 ALA 13.A O no hydrogen 2.752 N/A ALA 18.A N LEU 14.A O no hydrogen 2.892 N/A ASN 19.A N LYS 15.A O no hydrogen 2.933 N/A ARG 20.A N ASP 16.A O no hydrogen 2.835 N/A ARG 20.A NE GLU 87.A OE2 no hydrogen 2.797 N/A ARG 20.A NH1 GLU 87.A OE2 no hydrogen 3.421 N/A ARG 20.A NH2 SER 279.A O no hydrogen 2.873 N/A LEU 21.A N THR 17.A O no hydrogen 2.875 N/A ARG 22.A N ALA 18.A O no hydrogen 2.971 N/A ARG 22.A NE ARG 245.A O no hydrogen 2.823 N/A ARG 22.A NH1 ASN 19.A OD1 no hydrogen 2.999 N/A ARG 22.A NH1 GLU 45.A OE2 no hydrogen 2.860 N/A ARG 22.A NH2 CYS 41.A O no hydrogen 3.041 N/A ARG 22.A NH2 GLU 45.A OE1 no hydrogen 2.844 N/A ARG 22.A NH2 GLU 45.A OE2 no hydrogen 3.294 N/A ILE 23.A N ASN 19.A O no hydrogen 2.956 N/A SER 24.A N.A ARG 20.A O no hydrogen 2.930 N/A SER 24.A N.B ARG 20.A O no hydrogen 2.917 N/A SER 24.A OG.B ARG 20.A O no hydrogen 3.297 N/A SER 25.A N.A LEU 21.A O no hydrogen 3.017 N/A SER 25.A N.B LEU 21.A O no hydrogen 2.882 N/A SER 25.A OG.A LEU 21.A O no hydrogen 2.897 N/A ILE 26.A N ARG 22.A O no hydrogen 3.013 N/A GLN 27.A N ILE 23.A O no hydrogen 2.817 N/A ALA 28.A N SER 24.A O.A no hydrogen 2.779 N/A ALA 28.A N SER 24.A O.B no hydrogen 3.050 N/A THR 29.A N SER 25.A O.A no hydrogen 3.215 N/A THR 29.A N SER 25.A O.B no hydrogen 2.973 N/A THR 29.A OG1 SER 25.A O.A no hydrogen 2.749 N/A THR 29.A OG1 SER 25.A O.B no hydrogen 2.936 N/A THR 29.A OG1 ILE 26.A O no hydrogen 3.346 N/A THR 30.A N ILE 26.A O no hydrogen 2.849 N/A THR 30.A OG1 ILE 26.A O no hydrogen 3.119 N/A THR 30.A OG1 LEU 261.A O.A no hydrogen 2.865 N/A THR 30.A OG1 LEU 261.A O.B no hydrogen 2.621 N/A ALA 31.A N GLN 27.A O no hydrogen 2.920 N/A ALA 32.A N ALA 28.A O no hydrogen 2.920 N/A GLY 33.A N THR 29.A O no hydrogen 2.862 N/A GLY 33.A N THR 30.A O no hydrogen 3.299 N/A THR 38.A OG1 TRP 256.A O no hydrogen 3.394 N/A SER 39.A N HIS 36.A O no hydrogen 3.051 N/A CYS 40.A N HIS 36.A O no hydrogen 3.180 N/A CYS 40.A SG SER 25.A OG.B no hydrogen 3.026 N/A CYS 40.A SG HIS 36.A O no hydrogen 3.546 N/A CYS 40.A SG ALA 77.A O no hydrogen 3.827 N/A CYS 41.A N PRO 37.A O no hydrogen 2.931 N/A CYS 41.A SG PRO 37.A O no hydrogen 3.427 N/A SER 42.A N THR 38.A O no hydrogen 3.432 N/A SER 42.A OG SER 39.A O no hydrogen 3.408 N/A SER 42.A OG ASP 182.A OD1 no hydrogen 3.322 N/A SER 42.A OG ASP 182.A OD2 no hydrogen 2.698 N/A ALA 43.A N CYS 40.A O no hydrogen 3.015 N/A ALA 44.A N CYS 41.A O no hydrogen 3.432 N/A GLU 45.A N GLU 45.A OE1 no hydrogen 2.980 N/A MET 47.A N ALA 43.A O no hydrogen 2.896 N/A ALA 48.A N ALA 44.A O no hydrogen 2.960 N/A VAL 49.A N GLU 45.A O no hydrogen 2.946 N/A LEU 50.A N ILE 46.A O no hydrogen 2.921 N/A PHE 51.A N MET 47.A O no hydrogen 2.964 N/A PHE 52.A N ALA 48.A O no hydrogen 2.897 N/A HIS 53.A N VAL 49.A O no hydrogen 2.921 N/A HIS 53.A NE2 HIS 4.A O no hydrogen 2.908 N/A THR 54.A N VAL 49.A O no hydrogen 2.929 N/A THR 54.A OG1 VAL 49.A O no hydrogen 3.450 N/A MET 55.A N.A LEU 50.A O no hydrogen 2.793 N/A MET 55.A N.B LEU 50.A O no hydrogen 2.818 N/A ARG 56.A N ASP 68.A OD2 no hydrogen 2.812 N/A ARG 56.A NH1 HIS 53.A O no hydrogen 2.920 N/A ARG 56.A NH1 MET 55.A O.A no hydrogen 2.958 N/A ARG 56.A NH1 MET 55.A O.B no hydrogen 2.961 N/A TYR 57.A N THR 286.A O no hydrogen 2.952 N/A TYR 57.A OH PHE 51.A O no hydrogen 2.795 N/A LYS 58.A N.A ASN 67.A OD1 no hydrogen 2.853 N/A LYS 58.A N.B ASN 67.A OD1 no hydrogen 2.828 N/A LYS 58.A NZ.A GLU 290.A OE2 no hydrogen 2.960 N/A ASP 61.A N LYS 58.A O.A no hydrogen 3.009 N/A ASP 61.A N LYS 58.A O.B no hydrogen 3.091 N/A ARG 63.A NH1 PRO 112.A O no hydrogen 2.827 N/A ARG 63.A NH1 THR 117.A O no hydrogen 2.878 N/A ASN 64.A N ASP 61.A O no hydrogen 2.992 N/A ASN 64.A ND2 ASP 61.A OD2 no hydrogen 3.087 N/A HIS 66.A N ASN 64.A OD1 no hydrogen 2.946 N/A ASN 67.A N ASN 64.A O no hydrogen 3.120 N/A ASN 67.A ND2 ASP 61.A O no hydrogen 3.039 N/A ASN 67.A ND2 PRO 62.A O no hydrogen 2.919 N/A ASP 68.A N ARG 56.A O no hydrogen 2.856 N/A ARG 69.A N ARG 147.A O no hydrogen 2.893 N/A ARG 69.A NH1 PRO 65.A O no hydrogen 2.943 N/A ARG 69.A NH1 ASN 67.A O no hydrogen 2.826 N/A VAL 71.A N TYR 149.A O no hydrogen 2.826 N/A SER 73.A N LEU 151.A O no hydrogen 2.838 N/A SER 73.A OG GLU 156.A OE2 no hydrogen 2.591 N/A LYS 74.A N LEU 151.A O no hydrogen 3.305 N/A LYS 74.A NZ SER 39.A O no hydrogen 2.827 N/A LYS 74.A NZ ASP 182.A OD2 no hydrogen 2.733 N/A ALA 77.A N LYS 74.A O no hydrogen 3.013 N/A ALA 78.A N GLY 75.A O no hydrogen 2.923 N/A ILE 80.A N ALA 77.A O no hydrogen 2.930 N/A LEU 81.A N ALA 77.A O no hydrogen 3.502 N/A TYR 82.A N ALA 78.A O no hydrogen 2.932 N/A TYR 82.A OH ASP 107.A O no hydrogen 2.659 N/A ALA 83.A N PRO 79.A O no hydrogen 2.959 N/A VAL 84.A N.A ILE 80.A O no hydrogen 2.973 N/A VAL 84.A N.B ILE 80.A O no hydrogen 2.976 N/A TRP 85.A N LEU 81.A O no hydrogen 3.225 N/A ALA 86.A N TYR 82.A O no hydrogen 2.987 N/A GLU 87.A N ALA 83.A O no hydrogen 2.841 N/A ALA 88.A N VAL 84.A O.A no hydrogen 2.741 N/A ALA 88.A N VAL 84.A O.B no hydrogen 2.903 N/A GLY 89.A N ALA 86.A O no hydrogen 2.939 N/A PHE 90.A N TRP 85.A O no hydrogen 2.944 N/A LEU 91.A N.A TRP 85.A O no hydrogen 3.177 N/A LEU 91.A N.B TRP 85.A O no hydrogen 3.151 N/A GLU 95.A N ALA 92.A O no hydrogen 3.018 N/A LEU 96.A N GLU 93.A O.A no hydrogen 3.164 N/A LEU 96.A N GLU 93.A O.B no hydrogen 2.973 N/A LEU 96.A N GLU 93.A O.C no hydrogen 3.349 N/A LEU 97.A N ALA 94.A O no hydrogen 3.286 N/A ASN 98.A N GLU 95.A O no hydrogen 2.898 N/A ASN 98.A ND2 GLU 95.A OE1 no hydrogen 2.914 N/A LEU 99.A N LEU 96.A O no hydrogen 3.284 N/A ARG 100.A N LEU 106.A O no hydrogen 2.874 N/A ARG 100.A NH1 SER 34.A OG no hydrogen 2.928 N/A ARG 100.A NH2 GLY 108.A O no hydrogen 3.523 N/A LYS 101.A N ASN 98.A O no hydrogen 3.062 N/A LYS 101.A NZ ASN 98.A OD1 no hydrogen 2.801 N/A SER 104.A N LYS 101.A O no hydrogen 3.007 N/A SER 104.A OG GLU 95.A OE2 no hydrogen 2.773 N/A LEU 106.A N SER 104.A OG no hydrogen 2.952 N/A VAL 111.A N GLN 114.A OE1 no hydrogen 3.197 N/A LYS 113.A NZ ASP 105.A OD1 no hydrogen 2.835 N/A LYS 113.A NZ ASP 107.A OD1 no hydrogen 2.840 N/A LYS 113.A NZ ASP 107.A OD2 no hydrogen 3.055 N/A GLN 114.A N VAL 111.A O no hydrogen 2.961 N/A GLN 114.A NE2 TYR 82.A OH no hydrogen 2.929 N/A GLN 114.A NE2 ASP 105.A O no hydrogen 2.903 N/A THR 117.A N GLN 114.A O no hydrogen 3.006 N/A THR 117.A OG1 GLN 114.A OE1 no hydrogen 2.853 N/A ALA 120.A N SER 405.A OG no hydrogen 3.013 N/A THR 121.A OG1.A LEU 72.A O no hydrogen 2.606 N/A THR 121.A OG1.B LEU 72.A O no hydrogen 2.782 N/A SER 123.A OG ASP 397.A OD1 no hydrogen 3.554 N/A SER 123.A OG ASP 397.A OD2 no hydrogen 2.579 N/A GLY 125.A N GLU 156.A OE2 no hydrogen 2.709 N/A GLN 126.A NE2 SER 123.A OG no hydrogen 3.379 N/A GLY 127.A N SER 73.A OG no hydrogen 3.014 N/A ALA 130.A N GLN 126.A O no hydrogen 3.326 N/A ALA 131.A N GLY 127.A O no hydrogen 2.875 N/A CYS 132.A N LEU 128.A O no hydrogen 2.807 N/A CYS 132.A SG LEU 128.A O no hydrogen 3.411 N/A CYS 132.A SG ALA 165.A O no hydrogen 3.516 N/A GLY 133.A N GLY 129.A O no hydrogen 3.042 N/A MET 134.A N ALA 130.A O no hydrogen 2.986 N/A ALA 135.A N ALA 131.A O no hydrogen 2.835 N/A TYR 136.A N CYS 132.A O no hydrogen 2.821 N/A THR 137.A N GLY 133.A O no hydrogen 2.937 N/A THR 137.A OG1 GLY 133.A O no hydrogen 2.915 N/A GLY 138.A N MET 134.A O no hydrogen 2.872 N/A LYS 139.A N ALA 135.A O no hydrogen 2.938 N/A LYS 139.A NZ TYR 140.A OH no hydrogen 3.565 N/A LYS 139.A NZ LYS 173.A O.A no hydrogen 2.776 N/A LYS 139.A NZ LYS 173.A O.B no hydrogen 2.780 N/A LYS 139.A NZ ASP 175.A OD1.A no hydrogen 3.040 N/A LYS 139.A NZ ASP 175.A OD2.B no hydrogen 2.498 N/A TYR 140.A N TYR 136.A O no hydrogen 2.871 N/A TYR 140.A OH TYR 172.A O no hydrogen 2.657 N/A PHE 141.A N THR 137.A O no hydrogen 2.958 N/A ASP 142.A N THR 137.A O no hydrogen 2.758 N/A ALA 144.A N GLY 138.A O no hydrogen 2.923 N/A SER 145.A N.A ASP 291.A OD1 no hydrogen 2.945 N/A SER 145.A N.B ASP 291.A OD1 no hydrogen 2.878 N/A SER 145.A OG.A GLN 289.A OE1 no hydrogen 3.499 N/A SER 145.A OG.A ASP 291.A OD1 no hydrogen 3.040 N/A SER 145.A OG.A ASP 291.A OD2 no hydrogen 3.013 N/A SER 145.A OG.B GLN 289.A OE1 no hydrogen 3.019 N/A SER 145.A OG.B ASP 291.A OD2 no hydrogen 2.299 N/A TYR 146.A OH ASP 142.A OD2 no hydrogen 2.704 N/A ARG 147.A N ASP 68.A OD1 no hydrogen 2.879 N/A ARG 147.A NE TYR 149.A OH no hydrogen 3.055 N/A ARG 147.A NH1 ASP 175.A O.A no hydrogen 3.469 N/A ARG 147.A NH1 ASP 175.A O.B no hydrogen 3.450 N/A VAL 148.A N ASN 176.A O no hydrogen 2.935 N/A TYR 149.A N ARG 69.A O no hydrogen 2.877 N/A CYS 150.A N VAL 178.A O no hydrogen 2.921 N/A CYS 150.A SG VAL 71.A O no hydrogen 3.847 N/A LEU 151.A N VAL 71.A O no hydrogen 2.978 N/A LEU 152.A N ILE 180.A O no hydrogen 2.899 N/A GLY 153.A N GLU 156.A OE1 no hydrogen 2.839 N/A GLY 155.A N ASP 154.A OD1 no hydrogen 3.098 N/A LEU 157.A N.A ASP 154.A O no hydrogen 3.009 N/A LEU 157.A N.B ASP 154.A O no hydrogen 3.149 N/A SER 158.A N GLY 155.A O no hydrogen 2.974 N/A SER 158.A OG GLY 155.A O no hydrogen 3.479 N/A GLU 159.A N GLU 156.A O no hydrogen 3.008 N/A SER 161.A OG GLY 125.A O no hydrogen 2.655 N/A VAL 162.A N GLU 159.A O no hydrogen 3.009 N/A TRP 163.A NE1 LEU 157.A O.A no hydrogen 2.803 N/A TRP 163.A NE1 LEU 157.A O.B no hydrogen 2.948 N/A GLU 164.A N GLY 160.A O no hydrogen 3.082 N/A ALA 165.A N SER 161.A O no hydrogen 3.140 N/A MET 166.A N.A VAL 162.A O no hydrogen 2.835 N/A MET 166.A N.B VAL 162.A O no hydrogen 2.890 N/A ALA 167.A N TRP 163.A O no hydrogen 2.963 N/A PHE 168.A N GLU 164.A O no hydrogen 2.915 N/A ALA 169.A N ALA 165.A O no hydrogen 2.965 N/A SER 170.A N.A MET 166.A O.A no hydrogen 3.213 N/A SER 170.A N.A MET 166.A O.B no hydrogen 3.355 N/A SER 170.A N.B MET 166.A O.A no hydrogen 3.245 N/A SER 170.A N.B MET 166.A O.B no hydrogen 3.387 N/A SER 170.A N.C ALA 167.A O no hydrogen 3.202 N/A SER 170.A OG.A MET 166.A O.A no hydrogen 3.552 N/A SER 170.A OG.A MET 166.A O.B no hydrogen 3.386 N/A SER 170.A OG.A ALA 167.A O no hydrogen 3.132 N/A SER 170.A OG.A PHE 208.A O no hydrogen 2.749 N/A SER 170.A OG.C MET 166.A O.A no hydrogen 3.521 N/A SER 170.A OG.C MET 166.A O.B no hydrogen 3.354 N/A SER 170.A OG.C PHE 208.A O no hydrogen 2.584 N/A ILE 171.A N ALA 167.A O no hydrogen 2.967 N/A TYR 172.A N PHE 168.A O no hydrogen 2.933 N/A TYR 172.A OH GLU 360.A O no hydrogen 2.639 N/A LYS 173.A N.A SER 170.A O.A no hydrogen 3.221 N/A LYS 173.A N.A SER 170.A O.B no hydrogen 3.167 N/A LYS 173.A N.A SER 170.A O.C no hydrogen 3.134 N/A LYS 173.A N.B SER 170.A O.A no hydrogen 3.174 N/A LYS 173.A N.B SER 170.A O.B no hydrogen 3.123 N/A LYS 173.A N.B SER 170.A O.C no hydrogen 3.085 N/A LYS 173.A NZ.B ILE 171.A O no hydrogen 3.546 N/A LEU 174.A N ALA 169.A O no hydrogen 2.996 N/A ASP 175.A N.A LYS 173.A O.A no hydrogen 2.819 N/A ASP 175.A N.A LYS 173.A O.B no hydrogen 2.979 N/A ASP 175.A N.B LYS 173.A O.A no hydrogen 2.837 N/A ASP 175.A N.B LYS 173.A O.B no hydrogen 2.996 N/A ASN 176.A ND2 ALA 135.A O no hydrogen 2.946 N/A LEU 177.A N LEU 174.A O no hydrogen 3.192 N/A VAL 178.A N VAL 148.A O no hydrogen 2.885 N/A ALA 179.A N THR 235.A O no hydrogen 2.923 N/A ILE 180.A N CYS 150.A O no hydrogen 2.794 N/A LEU 181.A N ILE 237.A O no hydrogen 2.862 N/A ASP 182.A N LEU 152.A O no hydrogen 2.846 N/A ILE 183.A N ALA 239.A O no hydrogen 2.878 N/A ASN 184.A N ASP 182.A O no hydrogen 2.945 N/A ASN 184.A ND2 SER 42.A OG no hydrogen 3.109 N/A ARG 185.A N ASP 154.A OD2 no hydrogen 2.811 N/A ARG 185.A NE ASP 252.A OD1 no hydrogen 2.803 N/A ARG 185.A NH1 GLN 195.A OE1 no hydrogen 2.907 N/A ARG 185.A NH2 ASP 252.A O no hydrogen 3.026 N/A ARG 185.A NH2 ASP 252.A OD1 no hydrogen 3.169 N/A LEU 186.A N ASN 184.A OD1 no hydrogen 3.408 N/A GLY 187.A N ASP 190.A O no hydrogen 2.945 N/A ALA 192.A N ARG 185.A O no hydrogen 2.882 N/A GLN 195.A N ALA 192.A O no hydrogen 2.997 N/A HIS 196.A NE2 ILE 183.A O no hydrogen 2.866 N/A HIS 196.A NE2 THR 241.A O no hydrogen 2.799 N/A GLN 197.A N LEU 194.A O no hydrogen 2.916 N/A MET 198.A N HIS 196.A O no hydrogen 2.899 N/A ILE 200.A N.A GLN 197.A O no hydrogen 3.115 N/A ILE 200.A N.B GLN 197.A O no hydrogen 2.921 N/A TYR 201.A N GLN 197.A O no hydrogen 3.437 N/A GLN 202.A N MET 198.A O no hydrogen 2.964 N/A GLN 202.A NE2 ALA 212.A O no hydrogen 3.242 N/A LYS 203.A N ASP 199.A O.A no hydrogen 2.890 N/A LYS 203.A N ASP 199.A O.B no hydrogen 2.965 N/A ARG 204.A N ILE 200.A O.A no hydrogen 2.905 N/A ARG 204.A N ILE 200.A O.B no hydrogen 3.023 N/A CYS 205.A N TYR 201.A O no hydrogen 3.001 N/A CYS 205.A SG TYR 201.A O no hydrogen 3.419 N/A GLU 206.A N GLN 202.A O no hydrogen 2.869 N/A ALA 207.A N LYS 203.A O no hydrogen 2.887 N/A PHE 208.A N ARG 204.A O no hydrogen 3.218 N/A PHE 208.A N CYS 205.A O no hydrogen 3.193 N/A GLY 209.A N GLU 206.A O no hydrogen 2.952 N/A TRP 210.A N CYS 205.A O no hydrogen 3.096 N/A TRP 210.A NE1 MET 166.A O.A no hydrogen 2.863 N/A TRP 210.A NE1 MET 166.A O.B no hydrogen 2.781 N/A HIS 211.A N PRO 234.A O no hydrogen 2.946 N/A ILE 213.A N ALA 236.A O no hydrogen 2.897 N/A VAL 215.A N ILE 238.A O no hydrogen 2.961 N/A ASP 216.A N GLU 222.A OE1 no hydrogen 2.894 N/A GLY 217.A N LYS 240.A O no hydrogen 2.865 N/A HIS 218.A N ASP 216.A OD1 no hydrogen 2.879 N/A HIS 218.A ND1 GLU 45.A OE1 no hydrogen 2.838 N/A SER 219.A N ASP 216.A O no hydrogen 3.046 N/A GLU 222.A N SER 219.A OG no hydrogen 3.192 N/A LEU 223.A N SER 219.A O no hydrogen 3.056 N/A CYS 224.A N VAL 220.A O no hydrogen 2.886 N/A CYS 224.A SG VAL 220.A O no hydrogen 3.360 N/A LYS 225.A N GLU 221.A O.A no hydrogen 3.004 N/A LYS 225.A N GLU 221.A O.B no hydrogen 3.208 N/A ALA 226.A N GLU 222.A O no hydrogen 2.960 N/A PHE 227.A N LEU 223.A O no hydrogen 2.914 N/A GLY 228.A N LYS 225.A O no hydrogen 3.149 N/A LYS 231.A NZ.B ALA 226.A O no hydrogen 2.835 N/A LYS 231.A NZ.B GLN 229.A O.A no hydrogen 1.785 N/A LYS 231.A NZ.B GLN 229.A O.B no hydrogen 2.475 N/A LYS 231.A NZ.B GLN 229.A OE1.A no hydrogen 2.598 N/A GLN 233.A NE2.A GLY 209.A O no hydrogen 3.038 N/A THR 235.A N LEU 177.A O no hydrogen 3.161 N/A THR 235.A OG1 GLN 233.A O.A no hydrogen 3.260 N/A THR 235.A OG1 GLN 233.A O.B no hydrogen 3.168 N/A ALA 236.A N HIS 211.A O no hydrogen 2.780 N/A ILE 237.A N ALA 179.A O no hydrogen 2.819 N/A ILE 238.A N ILE 213.A O no hydrogen 2.805 N/A ALA 239.A N LEU 181.A O no hydrogen 2.940 N/A LYS 240.A N VAL 215.A O no hydrogen 2.917 N/A THR 241.A N ILE 183.A O no hydrogen 3.010 N/A THR 241.A OG1 ASP 182.A OD1 no hydrogen 2.627 N/A PHE 242.A N HIS 218.A NE2 no hydrogen 2.927 N/A LYS 243.A NZ GLY 187.A O no hydrogen 2.967 N/A LYS 243.A NZ HIS 257.A ND1 no hydrogen 2.936 N/A GLY 244.A N THR 38.A O no hydrogen 2.964 N/A ARG 245.A N PHE 242.A O no hydrogen 3.041 N/A ARG 245.A NH1 GLU 251.A OE2 no hydrogen 2.886 N/A GLY 246.A N GLU 251.A OE1 no hydrogen 2.984 N/A ILE 247.A N GLY 244.A O no hydrogen 2.972 N/A THR 248.A OG1.A GLU 272.A OE1.B no hydrogen 2.545 N/A THR 248.A OG1.A GLU 272.A OE2.A no hydrogen 2.793 N/A THR 248.A OG1.A GLU 272.A OE2.B no hydrogen 3.430 N/A THR 248.A OG1.B GLU 272.A OE1.A no hydrogen 3.281 N/A THR 248.A OG1.B GLU 272.A OE1.B no hydrogen 3.000 N/A THR 248.A OG1.B GLU 272.A OE2.A no hydrogen 2.842 N/A VAL 250.A N ILE 247.A O no hydrogen 2.985 N/A GLU 251.A N ILE 247.A O no hydrogen 2.990 N/A ASP 252.A N LYS 243.A O no hydrogen 2.850 N/A LYS 253.A N VAL 250.A O no hydrogen 3.024 N/A LYS 253.A NZ GLY 249.A O.B no hydrogen 3.267 N/A LYS 259.A N TRP 256.A O no hydrogen 3.292 N/A LYS 263.A NZ.A THR 30.A O no hydrogen 2.954 N/A LYS 263.A NZ.B GLU 267.A OE2 no hydrogen 2.894 N/A ALA 266.A N PRO 262.A O.A no hydrogen 2.856 N/A ALA 266.A N PRO 262.A O.B no hydrogen 2.827 N/A GLU 267.A N LYS 263.A O.A no hydrogen 3.120 N/A GLU 267.A N LYS 263.A O.B no hydrogen 3.008 N/A GLN 268.A N ASN 264.A O no hydrogen 3.399 N/A GLN 268.A NE2 GLU 272.A OE1.A no hydrogen 2.816 N/A ILE 269.A N MET 265.A O no hydrogen 2.897 N/A ILE 270.A N ALA 266.A O no hydrogen 2.833 N/A GLN 271.A N GLU 267.A O no hydrogen 3.102 N/A GLU 272.A N.A GLN 268.A O no hydrogen 3.149 N/A GLU 272.A N.B GLN 268.A O no hydrogen 3.192 N/A ILE 273.A N ILE 269.A O no hydrogen 2.903 N/A TYR 274.A N.A ILE 270.A O no hydrogen 2.759 N/A TYR 274.A N.B ILE 270.A O no hydrogen 2.915 N/A SER 275.A N.A GLN 271.A O no hydrogen 3.037 N/A SER 275.A N.A GLU 272.A O.A no hydrogen 3.120 N/A SER 275.A N.B GLN 271.A O no hydrogen 3.296 N/A SER 275.A N.B GLU 272.A O.A no hydrogen 3.082 N/A SER 275.A OG.A GLU 272.A O.A no hydrogen 2.635 N/A SER 275.A OG.A GLU 272.A O.B no hydrogen 2.800 N/A SER 275.A OG.B GLN 271.A O no hydrogen 2.949 N/A GLN 276.A N.A ILE 273.A O no hydrogen 2.889 N/A GLN 276.A N.B ILE 273.A O no hydrogen 2.976 N/A GLN 276.A NE2.A GLU 272.A O.A no hydrogen 3.459 N/A GLN 276.A NE2.A GLU 272.A O.B no hydrogen 3.103 N/A GLN 276.A NE2.B GLU 272.A O.B no hydrogen 3.689 N/A GLN 276.A NE2.B SER 275.A OG.A no hydrogen 3.165 N/A ILE 277.A N TYR 274.A O.A no hydrogen 3.078 N/A ILE 277.A N TYR 274.A O.B no hydrogen 2.872 N/A GLN 278.A N.A ASP 16.A OD1 no hydrogen 2.948 N/A GLN 278.A N.B ASP 16.A OD1 no hydrogen 2.932 N/A SER 279.A N ASP 16.A OD2 no hydrogen 2.942 N/A LYS 281.A N SER 279.A OG no hydrogen 3.008 N/A LYS 282.A NZ GLU 87.A OE1 no hydrogen 2.765 N/A LYS 282.A NZ GLU 93.A OE1.A no hydrogen 3.211 N/A LYS 282.A NZ GLU 93.A OE1.C no hydrogen 3.133 N/A ASP 291.A N GLN 289.A O no hydrogen 3.052 N/A ALA 292.A N HIS 66.A ND1 no hydrogen 3.214 N/A ALA 298.A N ASP 296.A OD2.A no hydrogen 3.080 N/A ILE 300.A N ASN 462.A OD1 no hydrogen 2.876 N/A MET 302.A N GLU 458.A OE2 no hydrogen 2.749 N/A SER 304.A OG LEU 305.A O no hydrogen 3.414 N/A TYR 308.A N.A ASN 482.A OD1.A no hydrogen 3.064 N/A TYR 308.A OH.A GLN 322.A OE1 no hydrogen 2.860 N/A TYR 308.A OH.B GLN 322.A OE1 no hydrogen 3.193 N/A GLY 311.A N ILE 478.A O no hydrogen 2.877 N/A ASP 312.A N LYS 309.A O no hydrogen 2.940 N/A LYS 313.A NZ GLY 311.A O no hydrogen 2.482 N/A ILE 314.A N ASN 476.A O.A no hydrogen 3.069 N/A ILE 314.A N ASN 476.A O.B no hydrogen 2.933 N/A ARG 317.A N SER 472.A O no hydrogen 3.137 N/A ARG 317.A NH2 SER 344.A O no hydrogen 2.913 N/A LYS 318.A N.A ALA 315.A O no hydrogen 3.018 N/A LYS 318.A N.B ALA 315.A O no hydrogen 2.948 N/A ALA 319.A N ALA 315.A O no hydrogen 3.034 N/A TYR 320.A N THR 316.A O no hydrogen 2.876 N/A GLY 321.A N ARG 317.A O no hydrogen 3.362 N/A GLN 322.A N LYS 318.A O.A no hydrogen 2.952 N/A GLN 322.A N LYS 318.A O.B no hydrogen 3.063 N/A ALA 323.A N ALA 319.A O no hydrogen 2.843 N/A LEU 324.A N TYR 320.A O no hydrogen 2.833 N/A ALA 325.A N GLY 321.A O no hydrogen 3.050 N/A LYS 326.A N GLN 322.A O no hydrogen 2.992 N/A LYS 326.A NZ SER 304.A O no hydrogen 3.243 N/A LYS 326.A NZ SER 304.A OG no hydrogen 3.251 N/A LYS 326.A NZ LEU 305.A O no hydrogen 2.927 N/A LYS 326.A NZ GLU 454.A OE1 no hydrogen 2.743 N/A LEU 327.A N.A ALA 323.A O no hydrogen 2.855 N/A LEU 327.A N.B ALA 323.A O no hydrogen 2.921 N/A GLY 328.A N LEU 324.A O no hydrogen 2.954 N/A HIS 329.A N LYS 326.A O no hydrogen 3.075 N/A HIS 329.A NE2 GLU 353.A OE1 no hydrogen 2.782 N/A ALA 330.A N LEU 327.A O.A no hydrogen 2.886 N/A ALA 330.A N LEU 327.A O.B no hydrogen 2.944 N/A SER 331.A N LEU 327.A O.A no hydrogen 3.286 N/A SER 331.A N LEU 327.A O.B no hydrogen 3.295 N/A ARG 333.A N SER 331.A OG no hydrogen 3.367 N/A ARG 333.A NH1 ASP 296.A OD2.B no hydrogen 2.997 N/A ARG 333.A NH1 ALA 298.A O no hydrogen 2.730 N/A ILE 334.A N SER 331.A O no hydrogen 3.506 N/A ILE 335.A N VAL 382.A O no hydrogen 3.112 N/A ALA 336.A N ARG 357.A O no hydrogen 2.975 N/A LEU 337.A N PHE 384.A O no hydrogen 2.912 N/A ASP 338.A N ILE 359.A O no hydrogen 3.333 N/A ASP 340.A N GLU 360.A OE2 no hydrogen 2.840 N/A THR 341.A N ASP 338.A OD1 no hydrogen 2.904 N/A THR 341.A OG1 ASP 338.A OD1 no hydrogen 2.698 N/A LYS 342.A NZ GLU 360.A OE1 no hydrogen 2.835 N/A SER 344.A N THR 341.A O no hydrogen 2.838 N/A THR 345.A N THR 341.A O no hydrogen 2.896 N/A THR 345.A OG1 ASP 338.A OD2 no hydrogen 2.708 N/A THR 345.A OG1 THR 341.A O no hydrogen 3.292 N/A THR 345.A OG1 SER 347.A OG no hydrogen 3.353 N/A SER 347.A N THR 345.A OG1 no hydrogen 3.198 N/A SER 347.A OG ASP 338.A OD2 no hydrogen 2.734 N/A SER 347.A OG THR 345.A OG1 no hydrogen 3.353 N/A GLU 348.A N LYS 342.A O no hydrogen 3.111 N/A ILE 349.A N PHE 346.A O no hydrogen 3.078 N/A LYS 351.A N SER 347.A O no hydrogen 3.122 N/A LYS 352.A N GLU 348.A O no hydrogen 2.941 N/A GLU 353.A N ILE 349.A O no hydrogen 3.196 N/A HIS 354.A N PHE 350.A O no hydrogen 2.793 N/A HIS 354.A NE2 ALA 325.A O no hydrogen 2.836 N/A ARG 357.A N HIS 354.A O no hydrogen 2.952 N/A ARG 357.A NH1 GLY 328.A O no hydrogen 3.394 N/A ARG 357.A NH1 ILE 334.A O no hydrogen 2.847 N/A ARG 357.A NH2 GLY 328.A O no hydrogen 2.854 N/A PHE 358.A N PRO 355.A O no hydrogen 3.267 N/A ILE 359.A N ALA 336.A O no hydrogen 2.791 N/A CYS 361.A N ASP 338.A O no hydrogen 2.876 N/A CYS 361.A SG ILE 359.A O no hydrogen 3.668 N/A TYR 362.A N GLU 360.A OE2 no hydrogen 2.876 N/A GLN 366.A NE2.A GLU 164.A OE2 no hydrogen 3.252 N/A ASN 367.A N GLU 164.A OE1 no hydrogen 2.882 N/A MET 368.A N ALA 364.A O no hydrogen 3.001 N/A VAL 369.A N GLU 365.A O no hydrogen 3.136 N/A SER 370.A N GLN 366.A O.A no hydrogen 3.152 N/A SER 370.A N GLN 366.A O.B no hydrogen 3.221 N/A SER 370.A OG GLN 366.A O.A no hydrogen 3.542 N/A SER 370.A OG GLN 366.A O.B no hydrogen 3.408 N/A ILE 371.A N ASN 367.A O no hydrogen 2.781 N/A ALA 372.A N MET 368.A O no hydrogen 3.028 N/A VAL 373.A N VAL 369.A O no hydrogen 2.904 N/A GLY 374.A N SER 370.A O no hydrogen 2.906 N/A CYS 375.A N ILE 371.A O no hydrogen 2.845 N/A CYS 375.A SG GLY 133.A O no hydrogen 3.713 N/A CYS 375.A SG THR 137.A OG1 no hydrogen 3.386 N/A CYS 375.A SG ILE 371.A O no hydrogen 3.367 N/A ALA 376.A N ALA 372.A O no hydrogen 2.970 N/A ALA 376.A N VAL 373.A O no hydrogen 3.224 N/A THR 377.A N GLY 374.A O no hydrogen 3.248 N/A THR 377.A OG1 GLY 374.A O no hydrogen 2.736 N/A ARG 378.A NE ASP 118.A OD1 no hydrogen 3.243 N/A ARG 378.A NE ASP 118.A OD2 no hydrogen 3.478 N/A ARG 378.A NH1 ASN 64.A O no hydrogen 2.856 N/A ARG 378.A NH2 ASP 118.A OD2 no hydrogen 2.756 N/A ASN 379.A N ALA 376.A O no hydrogen 2.981 N/A ARG 380.A N THR 377.A O no hydrogen 3.239 N/A ARG 380.A NE ASP 142.A OD1 no hydrogen 3.076 N/A ARG 380.A NH1 ASP 142.A OD1 no hydrogen 2.843 N/A ARG 380.A NH1 PRO 293.A O no hydrogen 2.790 N/A THR 381.A OG1 CYS 375.A O no hydrogen 2.855 N/A VAL 382.A N ARG 333.A O no hydrogen 2.834 N/A PHE 384.A N ILE 335.A O no hydrogen 2.887 N/A CYS 385.A N.A ASN 410.A O no hydrogen 2.833 N/A CYS 385.A N.B ASN 410.A O no hydrogen 2.806 N/A CYS 385.A N.C ASN 410.A O no hydrogen 2.856 N/A CYS 385.A SG.A MET 368.A O no hydrogen 3.990 N/A CYS 385.A SG.C ASN 410.A O no hydrogen 3.780 N/A SER 386.A N LEU 337.A O no hydrogen 2.891 N/A SER 386.A OG LEU 337.A O no hydrogen 3.461 N/A SER 386.A OG ASP 338.A OD2 no hydrogen 2.717 N/A THR 387.A N CYS 412.A O no hydrogen 3.362 N/A ALA 389.A N SER 414.A O.A no hydrogen 2.848 N/A ALA 389.A N SER 414.A O.B no hydrogen 2.786 N/A PHE 391.A N PHE 388.A O no hydrogen 2.891 N/A PHE 392.A N ALA 389.A O no hydrogen 3.074 N/A THR 393.A N ALA 390.A O no hydrogen 3.219 N/A THR 393.A OG1 ALA 390.A O no hydrogen 2.773 N/A ARG 394.A N.A PHE 391.A O no hydrogen 3.058 N/A ARG 394.A N.B PHE 391.A O no hydrogen 3.110 N/A ALA 395.A N PHE 392.A O no hydrogen 2.960 N/A PHE 396.A N THR 393.A O no hydrogen 3.385 N/A GLN 398.A N GLN 398.A OE1 no hydrogen 2.876 N/A GLN 398.A NE2 GLN 366.A OE1.A no hydrogen 3.152 N/A ILE 399.A N ALA 395.A O no hydrogen 2.931 N/A ARG 400.A N PHE 396.A O no hydrogen 2.792 N/A ARG 400.A NE ASP 397.A OD1 no hydrogen 2.904 N/A ARG 400.A NH2 ASP 397.A OD1 no hydrogen 2.851 N/A MET 401.A N ASP 397.A O no hydrogen 2.890 N/A ALA 402.A N GLN 398.A O no hydrogen 2.844 N/A ALA 403.A N ILE 399.A O no hydrogen 3.129 N/A ILE 404.A N ARG 400.A O no hydrogen 3.212 N/A SER 405.A N MET 401.A O no hydrogen 2.814 N/A SER 405.A OG MET 401.A O no hydrogen 2.803 N/A GLU 406.A N ALA 403.A O no hydrogen 2.949 N/A SER 407.A N.A ALA 402.A O no hydrogen 2.950 N/A SER 407.A N.B ALA 402.A O no hydrogen 2.913 N/A SER 407.A OG.B ALA 402.A O no hydrogen 3.199 N/A ASN 410.A N PRO 383.A O.A no hydrogen 3.101 N/A ASN 410.A N PRO 383.A O.B no hydrogen 3.051 N/A ASN 410.A ND2 PRO 383.A O.A no hydrogen 2.961 N/A ASN 410.A ND2 PRO 383.A O.B no hydrogen 3.130 N/A LEU 411.A N.A CYS 467.A O no hydrogen 2.772 N/A LEU 411.A N.B CYS 467.A O no hydrogen 2.784 N/A CYS 412.A N CYS 385.A O.A no hydrogen 2.803 N/A CYS 412.A N CYS 385.A O.B no hydrogen 2.962 N/A CYS 412.A N CYS 385.A O.C no hydrogen 2.850 N/A CYS 412.A SG ILE 469.A O no hydrogen 3.577 N/A GLY 413.A N ILE 469.A O no hydrogen 2.959 N/A SER 414.A N.A THR 387.A O no hydrogen 2.980 N/A SER 414.A N.B THR 387.A O no hydrogen 2.909 N/A SER 414.A OG.A THR 387.A O no hydrogen 3.538 N/A SER 414.A OG.A HIS 415.A ND1 no hydrogen 2.781 N/A SER 414.A OG.B HIS 415.A ND1 no hydrogen 2.828 N/A HIS 415.A ND1 SER 414.A OG.A no hydrogen 2.781 N/A HIS 415.A ND1 SER 414.A OG.B no hydrogen 2.828 N/A CYS 416.A N THR 471.A O no hydrogen 3.324 N/A CYS 416.A SG TYR 446.A OH no hydrogen 3.733 N/A CYS 416.A SG THR 471.A O no hydrogen 3.382 N/A CYS 416.A SG SER 472.A OG no hydrogen 3.359 N/A GLY 417.A N ALA 429.A O no hydrogen 2.830 N/A VAL 418.A N ASP 560.A OD1 no hydrogen 2.770 N/A SER 419.A N ASP 560.A OD2 no hydrogen 3.091 N/A GLY 421.A N VAL 418.A O no hydrogen 2.978 N/A GLU 422.A N GLU 422.A OE1 no hydrogen 2.823 N/A GLY 424.A N GLY 421.A O no hydrogen 3.327 N/A SER 426.A OG.A GLN 427.A OE1.A no hydrogen 2.670 N/A SER 426.A OG.A GLN 427.A OE1.B no hydrogen 2.875 N/A GLN 427.A N.A GLY 424.A O no hydrogen 3.237 N/A GLN 427.A N.B GLY 424.A O no hydrogen 3.050 N/A MET 428.A N PRO 425.A O no hydrogen 3.042 N/A ALA 429.A N HIS 415.A O no hydrogen 3.490 N/A LEU 430.A N GLU 431.A OE2 no hydrogen 2.915 N/A LEU 433.A N HIS 561.A NE2 no hydrogen 3.080 N/A ALA 434.A N HIS 561.A NE2 no hydrogen 3.261 N/A MET 435.A N.A GLU 431.A O no hydrogen 2.910 N/A MET 435.A N.B GLU 431.A O no hydrogen 2.986 N/A PHE 436.A N ASP 432.A O no hydrogen 2.884 N/A ARG 437.A N LEU 433.A O no hydrogen 2.854 N/A ARG 437.A NH1 GLY 565.A O no hydrogen 2.898 N/A SER 438.A N ALA 434.A O no hydrogen 3.249 N/A SER 438.A N MET 435.A O.A no hydrogen 3.178 N/A SER 438.A N MET 435.A O.B no hydrogen 3.233 N/A SER 438.A OG MET 435.A O.A no hydrogen 2.740 N/A SER 438.A OG MET 435.A O.B no hydrogen 2.827 N/A VAL 439.A N PHE 436.A O no hydrogen 3.145 N/A THR 441.A OG1.A PRO 440.A O.A no hydrogen 2.566 N/A THR 441.A OG1.B PRO 440.A O.A no hydrogen 1.954 N/A SER 442.A N VAL 439.A O no hydrogen 3.071 N/A SER 442.A OG PHE 436.A O no hydrogen 2.756 N/A SER 442.A OG VAL 439.A O no hydrogen 2.983 N/A THR 443.A N ILE 466.A O.A no hydrogen 3.007 N/A THR 443.A N ILE 466.A O.B no hydrogen 3.175 N/A VAL 444.A N LYS 537.A O no hydrogen 2.884 N/A PHE 445.A N PHE 468.A O no hydrogen 2.803 N/A TYR 446.A N PHE 534.A O no hydrogen 2.817 N/A SER 448.A OG ASP 532.A OD1 no hydrogen 2.617 N/A SER 448.A OG ASP 532.A OD2 no hydrogen 3.369 N/A ALA 452.A N ASP 449.A OD1 no hydrogen 2.884 N/A THR 453.A N ASP 449.A O no hydrogen 2.969 N/A THR 453.A OG1 ASP 449.A O no hydrogen 2.807 N/A GLU 454.A N GLY 450.A O no hydrogen 3.040 N/A LYS 455.A N VAL 451.A O no hydrogen 2.992 N/A ALA 456.A N ALA 452.A O no hydrogen 2.856 N/A VAL 457.A N THR 453.A O no hydrogen 2.946 N/A GLU 458.A N GLU 454.A O no hydrogen 3.143 N/A LEU 459.A N LYS 455.A O no hydrogen 2.924 N/A ALA 460.A N ALA 456.A O no hydrogen 2.819 N/A ALA 461.A N VAL 457.A O no hydrogen 3.036 N/A ASN 462.A N LEU 459.A O no hydrogen 3.050 N/A ASN 462.A ND2 ILE 300.A O no hydrogen 2.770 N/A ASN 462.A ND2 GLU 458.A O no hydrogen 3.059 N/A THR 463.A N ALA 460.A O no hydrogen 3.033 N/A THR 463.A OG1 LEU 459.A O no hydrogen 2.711 N/A GLY 465.A N ASN 408.A OD1 no hydrogen 2.856 N/A ILE 466.A N.A THR 441.A O.B no hydrogen 3.174 N/A ILE 466.A N.A THR 441.A OG1.A no hydrogen 3.226 N/A ILE 466.A N.B THR 441.A O.B no hydrogen 3.170 N/A ILE 466.A N.B THR 441.A OG1.A no hydrogen 3.252 N/A CYS 467.A N ILE 409.A O no hydrogen 3.097 N/A CYS 467.A SG ALA 460.A O no hydrogen 3.836 N/A CYS 467.A SG THR 463.A O no hydrogen 3.680 N/A PHE 468.A N THR 443.A O no hydrogen 2.902 N/A ILE 469.A N LEU 411.A O.A no hydrogen 2.852 N/A ILE 469.A N LEU 411.A O.B no hydrogen 2.854 N/A ARG 470.A N PHE 445.A O no hydrogen 2.940 N/A ARG 470.A NE ASP 432.A OD1 no hydrogen 3.419 N/A ARG 470.A NE ASP 432.A OD2 no hydrogen 2.720 N/A ARG 470.A NH1 TYR 446.A OH no hydrogen 2.938 N/A ARG 470.A NH1 ASP 560.A O no hydrogen 2.924 N/A ARG 470.A NH2 ASP 432.A OD1 no hydrogen 2.744 N/A ARG 470.A NH2 ASP 560.A O no hydrogen 3.066 N/A THR 471.A N GLY 413.A O no hydrogen 2.894 N/A SER 472.A N THR 316.A OG1 no hydrogen 2.868 N/A ASN 476.A N.A ILE 314.A O no hydrogen 3.242 N/A ILE 478.A N ASP 312.A O no hydrogen 2.770 N/A ILE 479.A N ASP 449.A OD2 no hydrogen 2.727 N/A TYR 480.A N ASP 449.A OD2 no hydrogen 3.040 N/A TYR 480.A OH ASP 532.A OD2 no hydrogen 2.646 N/A ASN 482.A ND2.A TYR 308.A O.A no hydrogen 2.769 N/A ASN 482.A ND2.A TYR 308.A O.B no hydrogen 2.788 N/A ASN 482.A ND2.B TYR 308.A O.A no hydrogen 3.380 N/A ASN 482.A ND2.B TYR 308.A O.B no hydrogen 3.300 N/A GLU 484.A N ASN 481.A O no hydrogen 3.063 N/A GLN 487.A NE2.A ASP 485.A OD1 no hydrogen 3.313 N/A GLN 487.A NE2.A ASP 485.A OD2 no hydrogen 3.050 N/A GLY 489.A N THR 535.A OG1 no hydrogen 3.041 N/A GLN 490.A N GLN 487.A O.A no hydrogen 3.214 N/A GLN 490.A N GLN 487.A O.B no hydrogen 3.088 N/A ALA 491.A N ASP 540.A OD2 no hydrogen 2.870 N/A LYS 492.A N ASP 532.A O no hydrogen 2.890 N/A LYS 492.A NZ GLU 484.A OE2 no hydrogen 2.731 N/A LYS 492.A NZ ASP 485.A O no hydrogen 2.730 N/A LYS 492.A NZ GLN 490.A OE1 no hydrogen 3.468 N/A VAL 494.A N VAL 530.A O no hydrogen 2.853 N/A LEU 495.A N VAL 530.A O no hydrogen 3.404 N/A SER 497.A N ASP 500.A OD2 no hydrogen 2.890 N/A SER 497.A OG ASP 500.A OD1 no hydrogen 2.707 N/A GLN 501.A N.A ASN 527.A O no hydrogen 2.829 N/A GLN 501.A N.B ASN 527.A O no hydrogen 2.865 N/A THR 503.A N ARG 554.A O no hydrogen 2.922 N/A THR 503.A OG1 THR 551.A OG1 no hydrogen 2.877 N/A VAL 504.A N ARG 529.A O no hydrogen 2.723 N/A ILE 505.A N LEU 556.A O no hydrogen 2.807 N/A GLY 506.A N LEU 531.A O no hydrogen 3.240 N/A ALA 507.A N THR 510.A OG1 no hydrogen 3.049 N/A GLY 508.A N SER 448.A OG no hydrogen 3.020 N/A THR 510.A N ALA 507.A O no hydrogen 3.036 N/A THR 510.A OG1 ALA 507.A O no hydrogen 3.007 N/A THR 510.A OG1 VAL 558.A O no hydrogen 2.723 N/A LEU 511.A N GLY 508.A O no hydrogen 2.992 N/A HIS 512.A N GLY 508.A O no hydrogen 3.448 N/A HIS 512.A NE2 SER 448.A O no hydrogen 2.824 N/A GLU 513.A N VAL 509.A O.A no hydrogen 2.912 N/A GLU 513.A N VAL 509.A O.B no hydrogen 2.981 N/A ALA 514.A N THR 510.A O no hydrogen 2.867 N/A LEU 515.A N LEU 511.A O no hydrogen 2.927 N/A ALA 516.A N HIS 512.A O no hydrogen 2.989 N/A ALA 517.A N GLU 513.A O no hydrogen 2.804 N/A ALA 518.A N ALA 514.A O no hydrogen 2.887 N/A GLU 519.A N LEU 515.A O no hydrogen 3.253 N/A LEU 520.A N ALA 516.A O no hydrogen 3.098 N/A LEU 521.A N ALA 517.A O no hydrogen 2.868 N/A LYS 522.A N ALA 518.A O no hydrogen 3.040 N/A LYS 523.A N LEU 520.A O no hydrogen 3.215 N/A GLU 524.A N LEU 521.A O no hydrogen 2.850 N/A LYS 525.A N LYS 522.A O no hydrogen 2.881 N/A ILE 526.A N LEU 521.A O no hydrogen 3.081 N/A ARG 529.A N VAL 502.A O.A no hydrogen 2.942 N/A ARG 529.A N VAL 502.A O.B no hydrogen 2.915 N/A ARG 529.A NE ASP 500.A OD2 no hydrogen 2.878 N/A ARG 529.A NH2 SER 497.A O no hydrogen 2.975 N/A ARG 529.A NH2 ASP 500.A OD2 no hydrogen 3.276 N/A VAL 530.A N LEU 495.A O no hydrogen 2.929 N/A LEU 531.A N VAL 504.A O no hydrogen 2.902 N/A ASP 532.A N LYS 492.A O no hydrogen 2.822 N/A THR 535.A N PRO 533.A O.A no hydrogen 2.874 N/A THR 535.A N PRO 533.A O.B no hydrogen 2.888 N/A THR 535.A OG1 PRO 538.A O no hydrogen 2.746 N/A ILE 536.A N VAL 444.A O no hydrogen 2.834 N/A LYS 537.A NZ ARG 437.A O no hydrogen 2.861 N/A LYS 537.A NZ VAL 439.A O no hydrogen 2.886 N/A LYS 537.A NZ SER 442.A OG no hydrogen 3.058 N/A ARG 541.A N LEU 539.A O.A no hydrogen 2.770 N/A ARG 541.A NE ALA 574.A O no hydrogen 2.730 N/A ARG 541.A NH2 ALA 574.A O no hydrogen 3.281 N/A ARG 541.A NH2 GLU 578.A OE2 no hydrogen 2.864 N/A LYS 542.A NZ ASP 546.A OD2 no hydrogen 2.945 N/A LEU 543.A N ASP 540.A OD1 no hydrogen 3.126 N/A ILE 544.A N ASP 540.A O no hydrogen 3.081 N/A LEU 545.A N ARG 541.A O no hydrogen 2.892 N/A ASP 546.A N LYS 542.A O no hydrogen 2.819 N/A SER 547.A N LEU 543.A O no hydrogen 2.899 N/A SER 547.A OG LEU 543.A O no hydrogen 2.742 N/A ALA 548.A N ILE 544.A O no hydrogen 2.889 N/A ARG 549.A N LEU 545.A O no hydrogen 2.845 N/A ALA 550.A N ASP 546.A O no hydrogen 3.300 N/A ALA 550.A N SER 547.A O no hydrogen 2.951 N/A THR 551.A N ALA 548.A O no hydrogen 2.964 N/A THR 551.A OG1 THR 503.A OG1 no hydrogen 2.877 N/A THR 551.A OG1 SER 547.A O no hydrogen 3.342 N/A THR 551.A OG1 ALA 548.A O no hydrogen 3.368 N/A THR 551.A OG1 ARG 554.A O no hydrogen 3.080 N/A LYS 552.A NZ GLN 501.A OE1.B no hydrogen 3.419 N/A GLY 553.A N ALA 548.A O no hydrogen 2.756 N/A ARG 554.A N THR 551.A O no hydrogen 2.984 N/A ARG 554.A NH1 GLN 501.A O.A no hydrogen 2.866 N/A ARG 554.A NH1 GLN 501.A O.B no hydrogen 3.028 N/A ILE 555.A N THR 582.A O no hydrogen 2.947 N/A LEU 556.A N THR 503.A O no hydrogen 2.842 N/A THR 557.A N.A THR 584.A O no hydrogen 2.879 N/A THR 557.A N.B THR 584.A O no hydrogen 2.894 N/A VAL 558.A N ILE 505.A O no hydrogen 2.913 N/A GLU 559.A N LEU 586.A O no hydrogen 3.032 N/A HIS 561.A ND1 TYR 562.A O no hydrogen 2.808 N/A TYR 562.A N LEU 430.A O no hydrogen 2.857 N/A TYR 563.A OH ALA 587.A O no hydrogen 3.275 N/A GLU 564.A N GLU 564.A OE1 no hydrogen 2.776 N/A GLY 565.A N GLU 569.A OE1 no hydrogen 2.799 N/A ILE 567.A N GLU 559.A OE1 no hydrogen 2.757 N/A GLY 568.A N GLU 559.A OE2 no hydrogen 2.849 N/A ALA 570.A N GLY 566.A O no hydrogen 2.945 N/A VAL 571.A N ILE 567.A O no hydrogen 2.879 N/A SER 572.A N GLY 568.A O no hydrogen 2.898 N/A SER 572.A OG GLY 568.A O no hydrogen 2.955 N/A SER 572.A OG HIS 585.A NE2.B no hydrogen 2.513 N/A SER 573.A N.A GLU 569.A O no hydrogen 2.926 N/A SER 573.A N.B GLU 569.A O no hydrogen 2.960 N/A SER 573.A OG.A GLU 569.A O no hydrogen 2.909 N/A SER 573.A OG.B GLU 569.A O no hydrogen 3.312 N/A ALA 574.A N ALA 570.A O no hydrogen 3.056 N/A VAL 575.A N VAL 571.A O no hydrogen 3.053 N/A VAL 576.A N SER 572.A O no hydrogen 2.936 N/A GLU 578.A N VAL 575.A O no hydrogen 3.034 N/A ILE 581.A N GLU 578.A O no hydrogen 3.122 N/A THR 582.A N GLY 553.A O no hydrogen 2.889 N/A THR 584.A N ILE 555.A O no hydrogen 2.888 N/A HIS 585.A NE2.A GLU 559.A OE2 no hydrogen 2.568 N/A HIS 585.A NE2.B SER 572.A OG no hydrogen 2.513 N/A LEU 586.A N THR 557.A O.A no hydrogen 2.764 N/A LEU 586.A N THR 557.A O.B no hydrogen 2.831 N/A ALA 587.A N TYR 563.A OH no hydrogen 3.152 N/A VAL 588.A N HIS 561.A O no hydrogen 2.962 N/A ARG 590.A NH1 ASN 589.A OD1 no hydrogen 2.824 N/A ARG 593.A NH1 SER 594.A O no hydrogen 2.858 N/A SER 594.A OG GLU 422.A O no hydrogen 2.678 N/A LYS 596.A N GLU 599.A OE1 no hydrogen 2.936 N/A LEU 600.A N LYS 596.A O no hydrogen 2.970 N/A LEU 601.A N PRO 597.A O no hydrogen 2.973 N/A LYS 602.A N ALA 598.A O no hydrogen 3.118 N/A MET 603.A N GLU 599.A O no hydrogen 2.861 N/A PHE 604.A N LEU 600.A O no hydrogen 2.934 N/A GLY 605.A N LYS 602.A O no hydrogen 3.098 N/A ILE 606.A N LEU 601.A O no hydrogen 2.967 N/A ARG 608.A N GLU 513.A OE1 no hydrogen 2.831 N/A ARG 608.A NE GLU 513.A OE1 no hydrogen 2.888 N/A ARG 608.A NH2 GLU 513.A OE1 no hydrogen 3.567 N/A ARG 608.A NH2 GLU 513.A OE2 no hydrogen 2.898 N/A ASP 609.A N ASP 607.A OD1.B no hydrogen 3.103 N/A ALA 610.A N ASP 607.A OD1.A no hydrogen 3.134 N/A ALA 610.A N ASP 607.A OD2.B no hydrogen 2.903 N/A ILE 611.A N ASP 607.A O.A no hydrogen 2.925 N/A ILE 611.A N ASP 607.A O.B no hydrogen 2.957 N/A ALA 612.A N ARG 608.A O no hydrogen 2.930 N/A GLN 613.A N ASP 609.A O no hydrogen 3.020 N/A ALA 614.A N ALA 610.A O no hydrogen 3.020 N/A VAL 615.A N ILE 611.A O no hydrogen 2.924 N/A ARG 616.A N ALA 612.A O no hydrogen 2.987 N/A ARG 616.A NE GLU 524.A OE1 no hydrogen 2.838 N/A ARG 616.A NH1 GLN 613.A OE1 no hydrogen 3.108 N/A ARG 616.A NH2 GLU 524.A OE1 no hydrogen 3.386 N/A ARG 616.A NH2 GLU 524.A OE2 no hydrogen 3.045 N/A GLY 617.A N GLN 613.A O no hydrogen 2.965 N/A LEU 618.A N ALA 614.A O no hydrogen 3.006 N/A ILE 619.A N VAL 615.A O no hydrogen 3.002 N/A THR 620.A N ARG 616.A O no hydrogen 3.121 N/A THR 620.A OG1 ARG 616.A O no hydrogen 3.355 N/A THR 620.A OG1 GLY 617.A O no hydrogen 3.114 N/A