Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 8dv1_D.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ILE 1.A N GLU 2.A OE1 no hydrogen 3.524 N/A GLU 2.A N GLU 2.A OE1 no hydrogen 2.932 N/A GLU 3.A N GLU 3.A OE1 no hydrogen 2.793 N/A GLN 4.A N ILE 1.A O no hydrogen 2.895 N/A ALA 5.A N ILE 1.A O no hydrogen 3.468 N/A LYS 6.A N GLU 2.A O no hydrogen 2.978 N/A LYS 6.A NZ ASP 10.A OD1 no hydrogen 2.802 N/A LYS 6.A NZ ASP 10.A OD2 no hydrogen 3.524 N/A THR 7.A OG1 GLU 3.A O no hydrogen 2.696 N/A PHE 8.A N GLN 4.A O no hydrogen 2.824 N/A LEU 9.A N ALA 5.A O no hydrogen 2.934 N/A ASP 10.A N LYS 6.A O no hydrogen 2.955 N/A PHE 11.A N THR 7.A O no hydrogen 3.055 N/A PHE 12.A N PHE 8.A O no hydrogen 2.783 N/A ASP 13.A N LEU 9.A O no hydrogen 3.032 N/A SER 14.A N ASP 10.A O no hydrogen 3.306 N/A SER 14.A OG ASP 10.A O no hydrogen 2.728 N/A GLN 15.A N PHE 12.A O no hydrogen 3.003 N/A ALA 16.A N PHE 12.A O no hydrogen 2.779 N/A GLU 17.A N ASP 13.A O no hydrogen 3.159 N/A ASP 18.A N GLN 15.A O no hydrogen 3.103 N/A LEU 19.A N GLN 15.A O no hydrogen 3.113 N/A PHE 20.A N ALA 16.A O no hydrogen 2.979 N/A TYR 21.A OH ASP 335.A OD2 no hydrogen 2.681 N/A GLN 22.A N ASP 18.A O no hydrogen 2.980 N/A GLN 22.A NE2 ASP 18.A OD2 no hydrogen 2.820 N/A SER 23.A N LEU 19.A O no hydrogen 3.061 N/A SER 24.A N PHE 20.A O no hydrogen 2.774 N/A SER 24.A OG LEU 331.A O no hydrogen 2.727 N/A LEU 25.A N TYR 21.A O no hydrogen 2.828 N/A ALA 26.A N GLN 22.A O no hydrogen 2.976 N/A SER 27.A N SER 23.A O no hydrogen 3.026 N/A TRP 28.A N SER 24.A O no hydrogen 3.047 N/A ASN 29.A N LEU 25.A O no hydrogen 2.843 N/A TYR 30.A N ALA 26.A O no hydrogen 2.973 N/A ASN 31.A N SER 27.A O no hydrogen 3.062 N/A THR 32.A N TRP 28.A O no hydrogen 2.983 N/A THR 32.A OG1 TRP 28.A O no hydrogen 3.494 N/A THR 32.A OG1 ASN 29.A O no hydrogen 3.219 N/A ASN 33.A N ASN 29.A O no hydrogen 2.910 N/A ILE 34.A N LYS 321.A O no hydrogen 2.988 N/A THR 35.A OG1 GLU 36.A OE1 no hydrogen 3.449 N/A GLU 36.A N GLU 36.A OE1 no hydrogen 2.616 N/A ASN 38.A ND2 ASN 33.A O no hydrogen 2.863 N/A VAL 39.A N THR 35.A O no hydrogen 3.060 N/A GLN 40.A N GLU 36.A O no hydrogen 2.980 N/A GLN 40.A NE2 ASN 44.A OD1 no hydrogen 2.895 N/A ASN 41.A N GLU 37.A O no hydrogen 3.047 N/A MET 42.A N ASN 38.A O no hydrogen 2.849 N/A ASN 43.A N VAL 39.A O no hydrogen 3.001 N/A ASN 44.A N GLN 40.A O no hydrogen 2.903 N/A ALA 45.A N ASN 41.A O no hydrogen 2.957 N/A GLY 46.A N MET 42.A O no hydrogen 2.845 N/A ASP 47.A N ASN 43.A O no hydrogen 2.980 N/A LYS 48.A N ASN 44.A O no hydrogen 3.004 N/A TRP 49.A N ALA 45.A O no hydrogen 3.017 N/A SER 50.A N GLY 46.A O no hydrogen 2.912 N/A ALA 51.A N ASP 47.A O no hydrogen 2.820 N/A PHE 52.A N LYS 48.A O no hydrogen 2.909 N/A LEU 53.A N TRP 49.A O no hydrogen 2.917 N/A LYS 54.A N SER 50.A O no hydrogen 2.927 N/A GLU 55.A N ALA 51.A O no hydrogen 3.008 N/A GLN 56.A N PHE 52.A O no hydrogen 2.835 N/A SER 57.A N LEU 53.A O no hydrogen 2.823 N/A SER 57.A OG LEU 80.A O no hydrogen 2.636 N/A SER 57.A OG GLN 82.A O no hydrogen 3.459 N/A THR 58.A N LYS 54.A O no hydrogen 3.050 N/A THR 58.A OG1 LYS 54.A O no hydrogen 2.812 N/A LEU 59.A N GLU 55.A O no hydrogen 3.123 N/A ALA 60.A N GLN 56.A O no hydrogen 2.971 N/A GLN 61.A N SER 57.A O no hydrogen 2.973 N/A GLN 61.A NE2 GLN 81.A O no hydrogen 3.011 N/A MET 62.A N LEU 59.A O no hydrogen 2.960 N/A TYR 63.A N ALA 60.A O no hydrogen 3.076 N/A GLN 66.A N GLN 66.A OE1 no hydrogen 2.598 N/A GLU 67.A N PRO 64.A O no hydrogen 3.021 N/A ILE 68.A N LEU 65.A O no hydrogen 3.102 N/A GLN 69.A N GLU 2.A OE2 no hydrogen 2.722 N/A GLN 69.A NE2 GLU 67.A O no hydrogen 2.918 N/A ASN 70.A N GLU 2.A OE2 no hydrogen 2.936 N/A LYS 74.A N ASN 70.A O no hydrogen 3.038 N/A LEU 75.A N LEU 71.A O no hydrogen 2.802 N/A GLN 76.A N THR 72.A O no hydrogen 3.123 N/A GLN 76.A NE2 THR 72.A O no hydrogen 3.331 N/A LEU 77.A N VAL 73.A O no hydrogen 2.881 N/A GLN 78.A N LYS 74.A O no hydrogen 2.846 N/A ALA 79.A N LEU 75.A O no hydrogen 2.975 N/A LEU 80.A N GLN 76.A O no hydrogen 3.250 N/A GLN 81.A N LEU 77.A O no hydrogen 2.768 N/A GLN 81.A NE2 ALA 60.A O no hydrogen 2.706 N/A GLN 81.A NE2 TYR 63.A O no hydrogen 2.775 N/A GLN 82.A NE2 GLN 78.A O no hydrogen 2.827 N/A GLY 84.A N ASN 174.A OD1 no hydrogen 2.739 N/A VAL 87.A N GLY 84.A O no hydrogen 3.354 N/A GLU 90.A N GLU 90.A OE1 no hydrogen 2.652 N/A LYS 92.A N ASP 91.A OD1 no hydrogen 2.695 N/A LYS 92.A NZ GLU 169.A OE2 no hydrogen 2.823 N/A SER 93.A N SER 89.A O no hydrogen 2.883 N/A LYS 94.A N GLU 90.A O no hydrogen 2.937 N/A ARG 95.A N ASP 91.A O no hydrogen 2.817 N/A ARG 95.A NE GLU 162.A OE2 no hydrogen 3.005 N/A ARG 95.A NH1 GLU 162.A OE1 no hydrogen 2.953 N/A LEU 96.A N LYS 92.A O no hydrogen 2.959 N/A ASN 97.A N SER 93.A O no hydrogen 2.945 N/A THR 98.A N LYS 94.A O no hydrogen 2.891 N/A THR 98.A OG1 LYS 94.A O no hydrogen 2.726 N/A ILE 99.A N ARG 95.A O no hydrogen 2.958 N/A LEU 100.A N LEU 96.A O no hydrogen 2.897 N/A ASN 101.A N ASN 97.A O no hydrogen 2.953 N/A THR 102.A N THR 98.A O no hydrogen 2.903 N/A THR 102.A OG1 THR 98.A O no hydrogen 2.655 N/A MET 103.A N ILE 99.A O no hydrogen 2.824 N/A SER 104.A N LEU 100.A O no hydrogen 3.031 N/A SER 104.A OG ASN 488.A OD1 no hydrogen 2.693 N/A THR 105.A N ASN 101.A O no hydrogen 2.959 N/A THR 105.A OG1 ASN 101.A O no hydrogen 2.750 N/A ILE 106.A N THR 102.A O no hydrogen 2.840 N/A TYR 107.A N MET 103.A O no hydrogen 3.116 N/A TYR 107.A OH GLU 125.A OE2 no hydrogen 2.645 N/A SER 108.A N SER 104.A O no hydrogen 2.888 N/A SER 108.A OG SER 104.A O no hydrogen 3.309 N/A SER 108.A OG THR 105.A O no hydrogen 3.498 N/A THR 109.A N THR 105.A O no hydrogen 2.888 N/A THR 109.A OG1 THR 105.A O no hydrogen 2.575 N/A GLY 110.A N TYR 107.A O no hydrogen 3.241 N/A LYS 111.A N THR 109.A O no hydrogen 2.680 N/A VAL 112.A N LEU 122.A O no hydrogen 2.901 N/A ASN 114.A ND2 GLU 120.A OE1 no hydrogen 2.794 N/A ASP 116.A N ASN 114.A OD1 no hydrogen 2.944 N/A ASN 117.A N ASN 114.A O no hydrogen 2.892 N/A ASN 117.A ND2 GLU 120.A OE2 no hydrogen 2.756 N/A GLN 119.A NE2 ASN 117.A OD1 no hydrogen 2.911 N/A GLU 120.A N ASN 117.A O no hydrogen 2.985 N/A CYS 121.A N PRO 118.A O no hydrogen 3.205 N/A CYS 121.A SG PRO 118.A O no hydrogen 3.099 N/A LEU 122.A N VAL 112.A O no hydrogen 3.056 N/A LEU 128.A N PRO 126.A O no hydrogen 2.897 N/A ASN 129.A N LEU 124.A O no hydrogen 2.957 N/A GLU 130.A N GLY 127.A O no hydrogen 2.974 N/A ILE 131.A N LEU 128.A O no hydrogen 3.259 N/A MET 132.A N LEU 128.A O no hydrogen 3.511 N/A ALA 133.A N ASN 129.A O no hydrogen 2.786 N/A ASN 134.A N GLU 130.A O no hydrogen 2.813 N/A ASN 134.A ND2 GLU 130.A OE2 no hydrogen 2.805 N/A SER 135.A N ILE 131.A O no hydrogen 3.149 N/A SER 135.A OG GLU 140.A OE1 no hydrogen 2.591 N/A ASP 137.A N SER 135.A OG no hydrogen 3.156 N/A GLU 140.A N ASP 137.A OD1 no hydrogen 2.910 N/A ARG 141.A N ASP 137.A O no hydrogen 2.893 N/A ARG 141.A NE HIS 245.A O no hydrogen 2.729 N/A ARG 141.A NH1 MET 132.A O no hydrogen 2.767 N/A ARG 141.A NH1 HIS 245.A O no hydrogen 2.696 N/A ARG 141.A NH2 MET 132.A O no hydrogen 2.840 N/A ARG 141.A NH2 SER 135.A O no hydrogen 2.910 N/A LEU 142.A N TYR 138.A O no hydrogen 3.055 N/A TRP 143.A N ASN 139.A O no hydrogen 2.899 N/A ALA 144.A N GLU 140.A O no hydrogen 3.155 N/A TRP 145.A N ARG 141.A O no hydrogen 2.977 N/A GLU 146.A N LEU 142.A O no hydrogen 2.801 N/A SER 147.A N TRP 143.A O no hydrogen 2.898 N/A SER 147.A OG CYS 113.A O no hydrogen 3.498 N/A TRP 148.A N ALA 144.A O no hydrogen 3.092 N/A TRP 148.A NE1 SER 482.A O no hydrogen 3.100 N/A ARG 149.A N TRP 145.A O no hydrogen 3.197 N/A ARG 149.A NE ASP 479.A OD1 no hydrogen 2.547 N/A ARG 149.A NH1 MET 250.A O no hydrogen 2.769 N/A ARG 149.A NH1 ASP 479.A OD1 no hydrogen 2.690 N/A ARG 149.A NH2 MET 250.A O no hydrogen 2.849 N/A SER 150.A N GLU 146.A O no hydrogen 2.890 N/A SER 150.A OG GLU 146.A O no hydrogen 3.357 N/A SER 150.A OG TYR 477.A OH no hydrogen 2.741 N/A GLU 151.A N SER 147.A O no hydrogen 2.830 N/A VAL 152.A N TRP 148.A O no hydrogen 2.930 N/A GLY 153.A N TRP 148.A O no hydrogen 3.204 N/A LYS 154.A N ARG 149.A O no hydrogen 3.128 N/A GLN 155.A N GLN 155.A OE1 no hydrogen 2.463 N/A GLN 155.A NE2 SER 150.A O no hydrogen 2.798 N/A LEU 156.A N VAL 152.A O no hydrogen 3.120 N/A LEU 156.A N GLY 153.A O no hydrogen 3.212 N/A ARG 157.A N GLY 153.A O no hydrogen 3.003 N/A ARG 157.A NE GLU 161.A OE2 no hydrogen 3.050 N/A ARG 157.A NH1 GLU 475.A OE1 no hydrogen 3.451 N/A ARG 157.A NH2 GLU 475.A OE1 no hydrogen 3.200 N/A ARG 157.A NH2 TYR 477.A O no hydrogen 2.842 N/A LEU 159.A N LEU 156.A O no hydrogen 2.785 N/A TYR 160.A N LEU 156.A O no hydrogen 3.312 N/A TYR 160.A N ARG 157.A O no hydrogen 2.854 N/A TYR 160.A OH VAL 486.A O no hydrogen 2.518 N/A GLU 161.A N ARG 157.A O no hydrogen 3.017 N/A GLU 162.A N PRO 158.A O no hydrogen 3.401 N/A TYR 163.A N LEU 159.A O no hydrogen 2.798 N/A VAL 164.A N TYR 160.A O no hydrogen 3.098 N/A VAL 165.A N GLU 162.A O no hydrogen 2.913 N/A LEU 166.A N GLU 162.A O no hydrogen 3.177 N/A LYS 167.A N TYR 163.A O no hydrogen 2.802 N/A LYS 167.A NZ TYR 179.A OH no hydrogen 3.218 N/A LYS 167.A NZ ASP 489.A OD2 no hydrogen 2.732 N/A ASN 168.A N VAL 164.A O no hydrogen 3.127 N/A ASN 168.A ND2 PHE 444.A O no hydrogen 2.909 N/A GLU 169.A N VAL 165.A O no hydrogen 2.833 N/A MET 170.A N LEU 166.A O no hydrogen 3.097 N/A ALA 171.A N LYS 167.A O no hydrogen 2.906 N/A ARG 172.A N ASN 168.A O no hydrogen 2.835 N/A ALA 173.A N GLU 169.A O no hydrogen 2.903 N/A ASN 174.A N MET 170.A O no hydrogen 3.021 N/A ASN 174.A N ALA 171.A O no hydrogen 3.087 N/A ASN 174.A ND2 MET 170.A O no hydrogen 2.782 N/A HIS 175.A N ARG 172.A O no hydrogen 2.845 N/A TYR 176.A N ALA 171.A O no hydrogen 2.873 N/A GLU 177.A N ASP 181.A OD2 no hydrogen 2.903 N/A TYR 179.A N ASN 168.A OD1 no hydrogen 2.852 N/A TYR 179.A OH ASP 489.A OD1 no hydrogen 2.779 N/A ASP 181.A N ASP 178.A OD1 no hydrogen 2.864 N/A TYR 182.A N ASP 178.A O no hydrogen 3.006 N/A TRP 183.A N TYR 179.A O no hydrogen 3.053 N/A ARG 184.A N GLY 180.A O no hydrogen 3.008 N/A ARG 184.A NH1 ASP 181.A OD1 no hydrogen 3.118 N/A GLY 185.A N TYR 182.A O no hydrogen 3.142 N/A ASP 186.A N TRP 183.A O no hydrogen 3.155 N/A TYR 187.A N ARG 184.A O no hydrogen 3.239 N/A TYR 187.A OH GLU 378.A OE2 no hydrogen 2.814 N/A TYR 187.A OH THR 497.A OG1 no hydrogen 2.839 N/A GLU 188.A N GLY 185.A O no hydrogen 3.046 N/A VAL 189.A N TYR 197.A O no hydrogen 3.037 N/A ASN 190.A ND2 GLU 188.A OE2 no hydrogen 3.144 N/A GLY 191.A N ASP 196.A OD1 no hydrogen 2.746 N/A VAL 192.A N ASP 196.A OD1 no hydrogen 2.921 N/A TYR 195.A N VAL 192.A O no hydrogen 2.943 N/A TYR 195.A OH GLU 551.A OE1 no hydrogen 2.740 N/A TYR 197.A N VAL 189.A O no hydrogen 2.925 N/A TYR 197.A OH ASP 205.A OD2 no hydrogen 2.701 N/A ARG 199.A NE ASP 181.A OD1 no hydrogen 3.016 N/A ARG 199.A NH1 ASP 181.A OD2 no hydrogen 2.975 N/A ARG 199.A NH2 GLU 188.A OE1 no hydrogen 3.008 N/A GLN 201.A N SER 198.A O no hydrogen 2.967 N/A GLN 201.A NE2 ASP 205.A OD1 no hydrogen 2.951 N/A LEU 202.A N ARG 199.A O no hydrogen 3.150 N/A ILE 203.A N GLY 200.A O no hydrogen 3.267 N/A GLU 204.A N GLY 200.A O no hydrogen 3.392 N/A ASP 205.A N GLN 201.A O no hydrogen 2.867 N/A VAL 206.A N LEU 202.A O no hydrogen 2.875 N/A GLU 207.A N ILE 203.A O no hydrogen 2.900 N/A HIS 208.A N GLU 204.A O no hydrogen 2.900 N/A THR 209.A N ASP 205.A O no hydrogen 2.929 N/A THR 209.A OG1 ASP 205.A O no hydrogen 2.676 N/A PHE 210.A N VAL 206.A O no hydrogen 2.872 N/A GLU 211.A N GLU 207.A O no hydrogen 3.104 N/A GLU 212.A N HIS 208.A O no hydrogen 3.349 N/A ILE 213.A N THR 209.A O no hydrogen 3.008 N/A LYS 214.A N PHE 210.A O no hydrogen 2.953 N/A LYS 214.A NZ GLU 211.A OE1 no hydrogen 2.838 N/A LEU 216.A N ILE 213.A O no hydrogen 2.913 N/A TYR 217.A N ILE 213.A O no hydrogen 3.452 N/A TYR 217.A OH VAL 465.A O no hydrogen 2.646 N/A GLU 218.A N LYS 214.A O no hydrogen 2.759 N/A HIS 219.A N PRO 215.A O no hydrogen 3.248 N/A HIS 219.A ND1 PRO 215.A O no hydrogen 2.813 N/A LEU 220.A N LEU 216.A O no hydrogen 3.052 N/A HIS 221.A N TYR 217.A O no hydrogen 2.737 N/A HIS 221.A NE2 GLY 466.A O no hydrogen 3.124 N/A ALA 222.A N GLU 218.A O no hydrogen 2.957 N/A TYR 223.A N HIS 219.A O no hydrogen 3.048 N/A TYR 223.A OH THR 262.A O no hydrogen 2.698 N/A VAL 224.A N LEU 220.A O no hydrogen 2.928 N/A ARG 225.A N HIS 221.A O no hydrogen 2.842 N/A ARG 225.A NH1 PHE 583.A O no hydrogen 2.701 N/A ARG 225.A NH1 GLY 585.A O no hydrogen 2.748 N/A ARG 225.A NH2 GLY 240.A O no hydrogen 2.795 N/A ARG 225.A NH2 GLY 585.A O no hydrogen 2.806 N/A ALA 226.A N ALA 222.A O no hydrogen 2.913 N/A LYS 227.A N TYR 223.A O no hydrogen 3.169 N/A LEU 228.A N VAL 224.A O no hydrogen 2.831 N/A MET 229.A N ARG 225.A O no hydrogen 2.968 N/A ASN 230.A N LYS 227.A O no hydrogen 3.010 N/A ALA 231.A N LYS 227.A O no hydrogen 3.447 N/A TYR 232.A N LEU 228.A O no hydrogen 2.741 N/A TYR 235.A N TYR 232.A O no hydrogen 3.080 N/A ILE 236.A N TYR 232.A O no hydrogen 3.308 N/A ILE 239.A N SER 237.A OG no hydrogen 3.304 N/A GLY 240.A N SER 237.A O no hydrogen 3.169 N/A CYS 241.A SG ARG 462.A O no hydrogen 3.752 N/A CYS 241.A SG SER 587.A O no hydrogen 3.141 N/A LEU 242.A N GLY 466.A O no hydrogen 2.873 N/A ALA 244.A N VAL 468.A O no hydrogen 2.816 N/A LEU 246.A N PRO 243.A O no hydrogen 3.165 N/A LEU 247.A N ALA 244.A O no hydrogen 3.274 N/A MET 250.A N ASP 249.A OD1 no hydrogen 2.798 N/A TRP 251.A NE1 SER 482.A O no hydrogen 3.108 N/A TRP 251.A NE1 SER 482.A OG no hydrogen 2.982 N/A GLY 252.A N ASP 249.A O no hydrogen 3.346 N/A TRP 255.A N LEU 424.A O no hydrogen 3.202 N/A ASN 257.A ND2 GLY 248.A O no hydrogen 2.855 N/A LEU 258.A N TRP 255.A O no hydrogen 3.031 N/A TYR 259.A N THR 256.A O no hydrogen 3.164 N/A LEU 261.A N LEU 258.A O no hydrogen 2.796 N/A THR 262.A N LEU 258.A O no hydrogen 3.073 N/A THR 262.A N TYR 259.A O no hydrogen 3.068 N/A THR 262.A OG1 LEU 258.A O no hydrogen 3.286 N/A THR 262.A OG1 TYR 259.A O no hydrogen 3.429 N/A VAL 263.A N TYR 259.A O no hydrogen 2.881 N/A PHE 265.A N ASN 417.A OD1 no hydrogen 2.840 N/A GLN 267.A N GLN 267.A OE1 no hydrogen 2.671 N/A LYS 268.A N PHE 265.A O no hydrogen 3.044 N/A LYS 268.A NZ ASP 411.A OD2 no hydrogen 2.757 N/A ILE 271.A N ASN 270.A OD1 no hydrogen 2.709 N/A THR 274.A N ASP 272.A OD1 no hydrogen 2.865 N/A THR 274.A OG1 ASP 272.A OD1 no hydrogen 2.771 N/A THR 274.A OG1 THR 345.A OG1 no hydrogen 2.726 N/A MET 277.A N VAL 273.A O no hydrogen 3.158 N/A VAL 278.A N THR 274.A O no hydrogen 3.008 N/A ASP 279.A N ASP 275.A O no hydrogen 2.841 N/A GLN 280.A N ALA 276.A O no hydrogen 2.912 N/A GLN 280.A NE2 GLY 402.A O no hydrogen 2.776 N/A ALA 281.A N VAL 278.A O no hydrogen 3.070 N/A TRP 282.A N MET 277.A O no hydrogen 2.855 N/A TRP 282.A NE1 GLN 280.A OE1 no hydrogen 2.930 N/A ARG 286.A N ASP 283.A OD1 no hydrogen 2.772 N/A ARG 286.A NE GLU 290.A OE2 no hydrogen 3.091 N/A ILE 287.A N ASP 283.A O no hydrogen 3.202 N/A PHE 288.A N ALA 284.A O no hydrogen 3.061 N/A LYS 289.A N GLN 285.A O no hydrogen 2.902 N/A LYS 289.A NZ GLU 292.A OE1 no hydrogen 2.932 N/A GLU 290.A N ARG 286.A O no hydrogen 2.865 N/A ALA 291.A N ILE 287.A O no hydrogen 3.077 N/A GLU 292.A N PHE 288.A O no hydrogen 2.831 N/A LYS 293.A N LYS 289.A O no hydrogen 2.970 N/A LYS 293.A NZ GLU 290.A OE1 no hydrogen 3.537 N/A LYS 293.A NZ GLU 290.A OE2 no hydrogen 2.898 N/A PHE 294.A N GLU 290.A O no hydrogen 3.037 N/A PHE 295.A N ALA 291.A O no hydrogen 3.246 N/A VAL 296.A N GLU 292.A O no hydrogen 2.980 N/A SER 297.A N LYS 293.A O no hydrogen 2.948 N/A SER 297.A OG PHE 294.A O no hydrogen 2.679 N/A SER 297.A OG ASN 526.A OD1 no hydrogen 2.806 N/A VAL 298.A N PHE 295.A O no hydrogen 3.161 N/A GLY 299.A N VAL 296.A O no hydrogen 3.001 N/A LEU 300.A N PHE 295.A O no hydrogen 3.196 N/A MET 303.A N GLU 292.A OE2 no hydrogen 2.914 N/A GLN 305.A NE2 GLU 309.A OE2 no hydrogen 2.914 N/A PHE 307.A N THR 304.A OG1 no hydrogen 3.114 N/A TRP 308.A N THR 304.A O no hydrogen 3.219 N/A TRP 308.A NE1 GLU 292.A OE2 no hydrogen 3.096 N/A GLU 309.A N GLN 305.A O no hydrogen 2.983 N/A ASN 310.A N GLY 306.A O no hydrogen 2.789 N/A SER 311.A N PHE 307.A O no hydrogen 3.109 N/A SER 311.A OG PHE 307.A O no hydrogen 2.870 N/A MET 312.A N ILE 338.A O no hydrogen 2.993 N/A THR 314.A OG1 ASP 315.A O no hydrogen 2.802 N/A GLN 320.A N ASN 318.A O no hydrogen 2.792 N/A GLN 320.A NE2 ASN 33.A OD1 no hydrogen 2.614 N/A GLN 320.A NE2 LYS 321.A O no hydrogen 2.779 N/A VAL 323.A N ASN 31.A O no hydrogen 2.966 N/A HIS 325.A ND1 PRO 326.A O no hydrogen 3.080 N/A THR 327.A N LEU 339.A O no hydrogen 2.984 N/A THR 327.A OG1 ALA 328.A O no hydrogen 3.544 N/A TRP 329.A N ARG 337.A O no hydrogen 2.864 N/A LEU 331.A N ASP 335.A O no hydrogen 2.898 N/A GLY 332.A N ASP 330.A OD1 no hydrogen 2.957 N/A LYS 333.A NZ ASP 18.A OD1 no hydrogen 2.675 N/A ASP 335.A N GLY 332.A O no hydrogen 2.855 N/A ARG 337.A N TRP 329.A O no hydrogen 3.089 N/A ARG 337.A NE ASP 335.A OD1 no hydrogen 2.961 N/A ARG 337.A NH1 ASP 335.A OD2 no hydrogen 2.936 N/A ILE 338.A N SER 311.A OG no hydrogen 2.984 N/A LEU 339.A N THR 327.A O no hydrogen 3.010 N/A MET 340.A N MET 312.A O no hydrogen 3.045 N/A THR 342.A N LEU 313.A O no hydrogen 2.828 N/A THR 342.A OG1 LEU 313.A O no hydrogen 2.685 N/A LYS 343.A N ASP 348.A OD2 no hydrogen 2.808 N/A LYS 343.A NZ ASP 315.A OD1 no hydrogen 2.828 N/A LYS 343.A NZ ASP 315.A OD2 no hydrogen 3.179 N/A THR 345.A OG1 THR 274.A OG1 no hydrogen 2.726 N/A MET 346.A N THR 274.A OG1 no hydrogen 3.223 N/A ASP 348.A N THR 345.A O no hydrogen 3.225 N/A PHE 349.A N THR 345.A O no hydrogen 3.075 N/A LEU 350.A N MET 346.A O no hydrogen 3.112 N/A THR 351.A N ASP 347.A O no hydrogen 2.993 N/A THR 351.A OG1 ASP 347.A O no hydrogen 2.759 N/A ALA 352.A N ASP 348.A O no hydrogen 2.797 N/A HIS 353.A N PHE 349.A O no hydrogen 3.260 N/A HIS 353.A ND1 PHE 349.A O no hydrogen 2.719 N/A HIS 354.A N LEU 350.A O no hydrogen 2.964 N/A GLU 355.A N THR 351.A O no hydrogen 2.837 N/A MET 356.A N ALA 352.A O no hydrogen 2.912 N/A GLY 357.A N HIS 353.A O no hydrogen 2.912 N/A HIS 358.A N HIS 354.A O no hydrogen 3.188 N/A HIS 358.A NE2 HIS 354.A NE2 no hydrogen 2.943 N/A ILE 359.A N GLU 355.A O no hydrogen 3.031 N/A GLN 360.A N MET 356.A O no hydrogen 2.810 N/A GLN 360.A NE2 PRO 301.A O no hydrogen 2.874 N/A TYR 361.A N GLY 357.A O no hydrogen 3.091 N/A ASP 362.A N HIS 358.A O no hydrogen 2.965 N/A MET 363.A N ILE 359.A O no hydrogen 2.757 N/A ALA 364.A N GLN 360.A O no hydrogen 2.953 N/A TYR 365.A N TYR 361.A O no hydrogen 3.233 N/A ALA 366.A N MET 363.A O no hydrogen 3.017 N/A GLN 368.A N TYR 365.A O no hydrogen 2.977 N/A GLN 368.A NE2 ARG 539.A O no hydrogen 2.849 N/A LEU 372.A N PRO 369.A O no hydrogen 2.808 N/A ARG 373.A N PHE 370.A O no hydrogen 3.203 N/A ARG 373.A NE GLN 368.A O no hydrogen 2.874 N/A ARG 373.A NH1 GLU 17.A OE2 no hydrogen 2.845 N/A ARG 373.A NH2 GLU 17.A OE1 no hydrogen 2.756 N/A ARG 373.A NH2 GLU 17.A OE2 no hydrogen 3.299 N/A ASN 374.A N LEU 372.A O no hydrogen 2.905 N/A GLY 375.A N ASN 374.A OD1 no hydrogen 2.709 N/A ALA 376.A N TYR 361.A OH no hydrogen 2.883 N/A ASN 377.A ND2 TYR 501.A OH no hydrogen 3.036 N/A GLU 378.A N ASP 186.A OD2 no hydrogen 2.858 N/A GLY 379.A N ASN 377.A OD1 no hydrogen 2.865 N/A PHE 380.A N ASN 377.A O no hydrogen 3.147 N/A HIS 381.A NE2 ASN 374.A OD1 no hydrogen 2.849 N/A ALA 383.A N GLY 379.A O no hydrogen 3.134 N/A VAL 384.A N PHE 380.A O no hydrogen 3.163 N/A GLY 385.A N HIS 381.A O no hydrogen 3.081 N/A GLU 386.A N GLU 382.A O no hydrogen 2.763 N/A ILE 387.A N ALA 383.A O no hydrogen 3.220 N/A MET 388.A N VAL 384.A O no hydrogen 3.329 N/A SER 389.A N GLY 385.A O no hydrogen 3.252 N/A LEU 390.A N GLU 386.A O no hydrogen 2.820 N/A SER 391.A N ILE 387.A O no hydrogen 3.113 N/A SER 391.A OG ILE 387.A O no hydrogen 3.283 N/A ALA 392.A N MET 388.A O no hydrogen 3.136 N/A ALA 393.A N SER 389.A O no hydrogen 2.982 N/A THR 394.A N SER 391.A O no hydrogen 3.171 N/A HIS 397.A N THR 394.A O no hydrogen 2.816 N/A HIS 397.A ND1 ASP 523.A OD2 no hydrogen 2.911 N/A LEU 398.A N THR 394.A O no hydrogen 3.175 N/A LYS 399.A N PRO 395.A O no hydrogen 2.815 N/A LYS 399.A NZ PRO 406.A O no hydrogen 2.871 N/A LYS 399.A NZ PHE 408.A O no hydrogen 2.884 N/A SER 400.A N LYS 396.A O no hydrogen 3.118 N/A SER 400.A OG LYS 396.A O no hydrogen 2.733 N/A ILE 401.A N HIS 397.A O no hydrogen 2.952 N/A GLY 402.A N LYS 399.A O no hydrogen 3.128 N/A LEU 403.A N LEU 398.A O no hydrogen 2.734 N/A LEU 404.A N LEU 398.A O no hydrogen 3.062 N/A ASP 407.A N SER 405.A OG no hydrogen 3.151 N/A PHE 408.A N SER 405.A O no hydrogen 2.786 N/A GLN 409.A NE2 GLU 410.A O no hydrogen 2.893 N/A GLU 413.A N ASN 412.A OD1 no hydrogen 2.649 N/A THR 414.A N ASP 411.A OD1 no hydrogen 2.884 N/A THR 414.A OG1 ASP 411.A OD1 no hydrogen 2.641 N/A GLU 415.A N ASP 411.A O no hydrogen 3.166 N/A ASN 417.A N GLU 413.A O no hydrogen 3.032 N/A ASN 417.A ND2 PHE 265.A O no hydrogen 3.004 N/A PHE 418.A N THR 414.A O no hydrogen 2.958 N/A LEU 419.A N GLU 415.A O no hydrogen 2.951 N/A LEU 420.A N ILE 416.A O no hydrogen 2.917 N/A LYS 421.A N ASN 417.A O no hydrogen 3.077 N/A GLN 422.A N PHE 418.A O no hydrogen 3.201 N/A ALA 423.A N LEU 419.A O no hydrogen 2.815 N/A LEU 424.A N LEU 420.A O no hydrogen 2.905 N/A THR 425.A N LYS 421.A O no hydrogen 3.214 N/A THR 425.A OG1 LYS 421.A O no hydrogen 3.088 N/A ILE 426.A N GLN 422.A O no hydrogen 2.776 N/A VAL 427.A N ALA 423.A O no hydrogen 2.633 N/A GLY 428.A N ALA 423.A O no hydrogen 3.025 N/A THR 429.A N ILE 426.A O no hydrogen 3.039 N/A THR 429.A OG1 ARG 253.A O no hydrogen 2.638 N/A THR 429.A OG1 THR 425.A O no hydrogen 3.143 N/A LEU 430.A N ILE 426.A O no hydrogen 3.074 N/A PHE 432.A N THR 429.A O no hydrogen 2.871 N/A THR 433.A N THR 429.A O no hydrogen 3.133 N/A TYR 434.A N LEU 430.A O no hydrogen 2.954 N/A MET 435.A N PRO 431.A O no hydrogen 3.000 N/A LEU 436.A N PHE 432.A O no hydrogen 2.932 N/A GLU 437.A N THR 433.A O no hydrogen 3.092 N/A LYS 438.A N TYR 434.A O no hydrogen 3.025 N/A LYS 438.A NZ GLU 207.A OE2 no hydrogen 2.773 N/A TRP 439.A N MET 435.A O no hydrogen 2.983 N/A TRP 439.A NE1 TRP 453.A O no hydrogen 3.131 N/A ARG 440.A N LEU 436.A O no hydrogen 2.880 N/A ARG 440.A NE GLU 437.A OE1 no hydrogen 3.012 N/A ARG 440.A NH1 GLU 437.A OE1 no hydrogen 2.812 N/A ARG 440.A NH1 TYR 490.A O no hydrogen 2.787 N/A ARG 440.A NH2 TYR 490.A O no hydrogen 2.981 N/A TRP 441.A N GLU 437.A O no hydrogen 2.827 N/A MET 442.A N LYS 438.A O no hydrogen 3.047 N/A VAL 443.A N TRP 439.A O no hydrogen 2.868 N/A PHE 444.A N ARG 440.A O no hydrogen 2.881 N/A LYS 445.A N TRP 441.A O no hydrogen 2.933 N/A GLY 446.A N VAL 443.A O no hydrogen 3.078 N/A GLU 447.A N MET 442.A O no hydrogen 2.776 N/A ILE 448.A N MET 442.A O no hydrogen 3.371 N/A ASP 451.A N ASP 451.A OD1 no hydrogen 2.545 N/A GLN 452.A N PRO 449.A O no hydrogen 2.853 N/A GLN 452.A NE2 ASP 451.A OD2 no hydrogen 3.120 N/A TRP 453.A NE1 ILE 448.A O no hydrogen 3.048 N/A MET 454.A N GLU 475.A OE1 no hydrogen 2.815 N/A LYS 455.A N GLU 475.A OE2 no hydrogen 2.879 N/A LYS 456.A N GLN 452.A O no hydrogen 3.054 N/A LYS 456.A NZ GLU 459.A OE1 no hydrogen 2.878 N/A TRP 457.A N TRP 453.A O no hydrogen 2.897 N/A TRP 457.A NE1 ASP 479.A OD2 no hydrogen 2.599 N/A TRP 458.A N MET 454.A O no hydrogen 2.945 N/A GLU 459.A N LYS 455.A O no hydrogen 3.058 N/A MET 460.A N LYS 456.A O no hydrogen 2.835 N/A LYS 461.A N TRP 457.A O no hydrogen 2.953 N/A ARG 462.A N TRP 458.A O no hydrogen 3.078 N/A ARG 462.A NE THR 588.A O no hydrogen 3.058 N/A ARG 462.A NH2 GLU 469.A OE1 no hydrogen 3.197 N/A GLU 463.A N GLU 459.A O no hydrogen 2.917 N/A ILE 464.A N MET 460.A O no hydrogen 2.787 N/A VAL 465.A N LYS 461.A O no hydrogen 2.922 N/A GLY 466.A N LYS 461.A O no hydrogen 2.827 N/A VAL 467.A N LYS 461.A O no hydrogen 3.493 N/A VAL 468.A N LEU 242.A O no hydrogen 2.809 N/A GLU 469.A N GLU 469.A OE1 no hydrogen 2.634 N/A HIS 473.A N VAL 471.A O no hydrogen 2.670 N/A THR 476.A N ASP 474.A OD1 no hydrogen 2.918 N/A THR 476.A OG1 ASP 474.A OD1 no hydrogen 2.739 N/A TYR 477.A N ASP 474.A O no hydrogen 3.324 N/A TYR 477.A OH SER 150.A OG no hydrogen 2.741 N/A ALA 481.A N CYS 478.A O no hydrogen 2.823 N/A SER 482.A N ASP 479.A O no hydrogen 2.977 N/A SER 482.A OG ASP 479.A O no hydrogen 2.637 N/A LEU 483.A N PRO 480.A O no hydrogen 2.979 N/A HIS 485.A NE2 TYR 495.A OH no hydrogen 2.800 N/A VAL 486.A N LEU 483.A O no hydrogen 2.927 N/A SER 487.A N LEU 483.A O no hydrogen 3.055 N/A SER 487.A OG PHE 484.A O no hydrogen 3.249 N/A ASN 488.A N PHE 484.A O no hydrogen 2.899 N/A ASN 488.A ND2 PHE 484.A O no hydrogen 3.132 N/A ASP 489.A N VAL 486.A O no hydrogen 3.270 N/A TYR 490.A N HIS 485.A O no hydrogen 2.870 N/A SER 491.A OG GLU 378.A OE1 no hydrogen 2.741 N/A PHE 492.A N GLU 437.A OE2 no hydrogen 2.803 N/A ILE 493.A N GLU 437.A OE2 no hydrogen 2.752 N/A ARG 494.A NE GLU 378.A O no hydrogen 3.450 N/A ARG 494.A NH1 GLU 378.A O no hydrogen 3.068 N/A ARG 494.A NH1 GLU 382.A OE2 no hydrogen 2.996 N/A ARG 494.A NH2 GLU 382.A OE2 no hydrogen 2.940 N/A ARG 494.A NH2 TYR 495.A OH no hydrogen 3.319 N/A TYR 495.A N PHE 492.A O no hydrogen 2.993 N/A TYR 495.A OH HIS 485.A NE2 no hydrogen 2.800 N/A TYR 496.A N ILE 493.A O no hydrogen 2.798 N/A THR 497.A N ILE 493.A O no hydrogen 3.100 N/A THR 497.A OG1 TYR 187.A OH no hydrogen 2.839 N/A THR 497.A OG1 ILE 493.A O no hydrogen 3.418 N/A THR 497.A OG1 ARG 494.A O no hydrogen 3.180 N/A ARG 498.A N ARG 494.A O no hydrogen 2.926 N/A ARG 498.A NE GLU 382.A OE1 no hydrogen 3.200 N/A ARG 498.A NH1 GLU 382.A OE1 no hydrogen 3.073 N/A THR 499.A N TYR 495.A O no hydrogen 3.137 N/A THR 499.A OG1 TYR 495.A O no hydrogen 2.802 N/A LEU 500.A N TYR 496.A O no hydrogen 3.204 N/A TYR 501.A N THR 497.A O no hydrogen 2.927 N/A GLN 502.A N ARG 498.A O no hydrogen 2.822 N/A PHE 503.A N THR 499.A O no hydrogen 3.297 N/A GLN 504.A N LEU 500.A O no hydrogen 3.125 N/A GLN 504.A NE2 ASN 558.A O no hydrogen 3.001 N/A PHE 505.A N TYR 501.A O no hydrogen 2.851 N/A GLN 506.A N GLN 502.A O no hydrogen 2.957 N/A GLN 506.A NE2 SER 391.A OG no hydrogen 2.987 N/A GLU 507.A N PHE 503.A O no hydrogen 3.014 N/A ALA 508.A N GLN 504.A O no hydrogen 3.095 N/A LEU 509.A N PHE 505.A O no hydrogen 2.954 N/A CYS 510.A N GLN 506.A O no hydrogen 2.862 N/A GLN 511.A N GLU 507.A O no hydrogen 3.023 N/A ALA 512.A N ALA 508.A O no hydrogen 3.071 N/A ALA 513.A N LEU 509.A O no hydrogen 2.989 N/A LYS 514.A N GLN 511.A O no hydrogen 2.823 N/A HIS 515.A N CYS 510.A O no hydrogen 3.246 N/A HIS 515.A NE2 LYS 521.A O no hydrogen 2.905 N/A GLY 517.A N HIS 515.A ND1 no hydrogen 2.873 N/A HIS 520.A NE2 GLU 415.A OE1 no hydrogen 2.708 N/A LYS 521.A N PRO 518.A O no hydrogen 3.018 N/A CYS 522.A N LEU 519.A O no hydrogen 3.198 N/A CYS 522.A SG PRO 518.A O no hydrogen 3.949 N/A CYS 522.A SG LEU 519.A O no hydrogen 3.154 N/A SER 525.A N ASP 523.A OD1 no hydrogen 2.847 N/A SER 525.A OG ASP 523.A OD1 no hydrogen 2.698 N/A ASN 526.A N SER 297.A OG no hydrogen 2.969 N/A GLU 529.A N GLU 529.A OE1 no hydrogen 2.588 N/A GLY 531.A N SER 527.A O no hydrogen 3.450 N/A GLN 532.A N THR 528.A O no hydrogen 2.980 N/A GLN 532.A NE2 ASN 536.A OD1 no hydrogen 2.875 N/A LYS 533.A N GLU 529.A O no hydrogen 3.028 N/A LYS 533.A NZ VAL 553.A O no hydrogen 3.170 N/A LEU 534.A N ALA 530.A O no hydrogen 3.096 N/A PHE 535.A N GLY 531.A O no hydrogen 2.936 N/A ASN 536.A N GLN 532.A O no hydrogen 2.996 N/A MET 537.A N LEU 534.A O no hydrogen 2.876 N/A LEU 538.A N LEU 534.A O no hydrogen 3.064 N/A ARG 539.A N PHE 535.A O no hydrogen 3.056 N/A ARG 539.A NE ASN 536.A O no hydrogen 2.985 N/A LEU 540.A N MET 537.A O no hydrogen 3.054 N/A GLY 541.A N LEU 538.A O no hydrogen 3.459 N/A LYS 542.A N LEU 372.A O no hydrogen 3.057 N/A LYS 542.A NZ ALA 376.A O no hydrogen 2.868 N/A SER 543.A N LEU 540.A O no hydrogen 2.973 N/A SER 543.A OG LEU 540.A O no hydrogen 2.648 N/A TRP 546.A NE1 TYR 187.A O no hydrogen 2.784 N/A THR 547.A OG1 TYR 195.A O no hydrogen 2.767 N/A LEU 548.A N PRO 545.A O no hydrogen 2.852 N/A ALA 549.A N PRO 545.A O no hydrogen 2.939 N/A LEU 550.A N TRP 546.A O no hydrogen 2.882 N/A GLU 551.A N THR 547.A O no hydrogen 3.135 N/A ASN 552.A N LEU 548.A O no hydrogen 3.112 N/A VAL 553.A N LEU 550.A O no hydrogen 2.923 N/A VAL 554.A N LEU 550.A O no hydrogen 2.956 N/A GLY 555.A N GLU 551.A O no hydrogen 2.957 N/A LYS 557.A NZ GLY 194.A O no hydrogen 2.825 N/A ASN 558.A ND2 ASP 205.A OD2 no hydrogen 2.771 N/A MET 559.A N ASN 558.A OD1 no hydrogen 2.620 N/A ASN 560.A N GLN 504.A OE1 no hydrogen 2.868 N/A ARG 562.A N ASN 560.A OD1 no hydrogen 2.799 N/A ARG 562.A NH1 ASN 566.A OD1 no hydrogen 2.824 N/A LEU 564.A N VAL 561.A O no hydrogen 2.811 N/A LEU 565.A N VAL 561.A O no hydrogen 3.169 N/A ASN 566.A N ARG 562.A O no hydrogen 2.760 N/A ASN 566.A ND2 GLU 507.A OE2 no hydrogen 3.072 N/A TYR 567.A N PRO 563.A O no hydrogen 2.940 N/A TYR 567.A OH GLN 422.A OE1 no hydrogen 2.561 N/A PHE 568.A N LEU 564.A O no hydrogen 3.080 N/A LEU 571.A N PHE 568.A O no hydrogen 2.712 N/A PHE 572.A N PHE 568.A O no hydrogen 2.953 N/A THR 573.A N GLU 569.A O no hydrogen 2.824 N/A THR 573.A OG1 GLU 569.A O no hydrogen 2.822 N/A TRP 574.A N PRO 570.A O no hydrogen 3.331 N/A LEU 575.A N LEU 571.A O no hydrogen 2.790 N/A LYS 576.A N PHE 572.A O no hydrogen 2.745 N/A ASP 577.A N THR 573.A O no hydrogen 3.064 N/A GLN 578.A N TRP 574.A O no hydrogen 2.797 N/A ASN 579.A ND2 LEU 575.A O no hydrogen 3.140 N/A LYS 580.A NZ ASP 577.A OD1 no hydrogen 2.574 N/A SER 582.A OG ASN 579.A OD1 no hydrogen 2.726 N/A TRP 586.A NE1 ARG 462.A O no hydrogen 2.701 N/A SER 587.A N ILE 239.A O no hydrogen 2.875 N/A SER 587.A OG ILE 239.A O no hydrogen 3.440 N/A SER 587.A OG ASP 589.A OD1 no hydrogen 2.563 N/A THR 588.A OG1 GLU 463.A OE2 no hydrogen 2.749 N/A TRP 590.A N ASP 589.A OD1 no hydrogen 2.585 N/A TYR 593.A OH GLU 469.A OE2 no hydrogen 2.724 N/A ALA 594.A N SER 591.A O no hydrogen 2.968 N/A