Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 2xqr_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLN 2.A NE2 LYS 306.A O no hydrogen 2.819 N/A TYR 4.A OH PRO 501.A O no hydrogen 2.587 N/A ARG 5.A NH2 PRO 12.A O no hydrogen 2.759 N/A THR 6.A N GLN 11.A OE1 no hydrogen 2.941 N/A THR 6.A OG1 HIS 9.A O no hydrogen 3.237 N/A THR 6.A OG1 GLN 11.A OE1 no hydrogen 2.737 N/A GLY 7.A N ASP 480.A OD2 no hydrogen 2.681 N/A PHE 8.A N ASP 480.A OD1 no hydrogen 2.939 N/A HIS 9.A ND1 ASP 480.A OD1 no hydrogen 2.545 N/A HIS 9.A NE2 GLU 485.A OE2 no hydrogen 2.707 N/A ASN 15.A N GLY 307.A O no hydrogen 2.804 N/A TRP 16.A N GLY 40.A O no hydrogen 2.881 N/A TRP 16.A NE1 ASN 18.A OD1 no hydrogen 2.724 N/A MET 17.A N SER 309.A O no hydrogen 2.811 N/A ASN 18.A N GLN 35.A O no hydrogen 2.993 N/A ASN 18.A ND2 ASP 19.A OD2 no hydrogen 3.175 N/A ASN 21.A N PHE 33.A O no hydrogen 2.700 N/A ASN 21.A ND2 SER 79.A OG no hydrogen 2.960 N/A GLY 22.A N GLY 80.A O no hydrogen 3.066 N/A MET 24.A N HIS 31.A O no hydrogen 3.222 N/A TYR 26.A N ILE 29.A O no hydrogen 2.975 N/A TYR 26.A OH LEU 113.A O no hydrogen 2.918 N/A ILE 29.A N TYR 26.A O no hydrogen 3.034 N/A TYR 30.A N SER 53.A O no hydrogen 2.691 N/A TYR 30.A OH ASP 282.A OD1 no hydrogen 3.072 N/A TYR 30.A OH ASP 282.A OD2 no hydrogen 2.645 N/A HIS 31.A N MET 24.A O no hydrogen 2.925 N/A HIS 31.A ND1 HIS 50.A NE2 no hydrogen 2.886 N/A LEU 32.A N SER 51.A O no hydrogen 3.017 N/A PHE 33.A N ASN 21.A O no hydrogen 3.011 N/A TYR 34.A N ALA 49.A O no hydrogen 3.287 N/A GLN 35.A N ASP 19.A O no hydrogen 2.950 N/A GLN 35.A NE2 ASN 21.A OD1 no hydrogen 2.733 N/A GLN 35.A NE2 CYS 77.A O no hydrogen 3.026 N/A TRP 36.A N VAL 47.A O no hydrogen 2.820 N/A TRP 36.A NE1 LYS 14.A O no hydrogen 3.180 N/A ASN 37.A N TRP 16.A O no hydrogen 3.040 N/A ASN 37.A ND2 VAL 42.A O no hydrogen 2.654 N/A LYS 39.A N ASN 37.A OD1 no hydrogen 3.027 N/A ASN 45.A ND2 ASN 37.A OD1 no hydrogen 2.875 N/A VAL 47.A N TRP 36.A O no hydrogen 2.931 N/A TRP 48.A N ILE 66.A O no hydrogen 2.906 N/A TRP 48.A NE1 TRP 78.A O no hydrogen 2.815 N/A ALA 49.A N TYR 34.A O no hydrogen 2.922 N/A HIS 50.A NE2 HIS 31.A ND1 no hydrogen 2.886 N/A SER 51.A N LEU 32.A O no hydrogen 3.003 N/A THR 52.A N ASP 60.A O no hydrogen 3.043 N/A THR 52.A OG1 HIS 62.A NE2 no hydrogen 2.554 N/A SER 53.A N TYR 30.A O no hydrogen 2.935 N/A SER 53.A OG ASN 58.A O no hydrogen 2.889 N/A ASP 55.A N SER 53.A OG no hydrogen 2.982 N/A LEU 56.A N SER 53.A OG no hydrogen 2.732 N/A ILE 57.A N ASP 55.A OD1 no hydrogen 2.719 N/A ASN 58.A N ASP 55.A OD1 no hydrogen 2.834 N/A ASN 58.A ND2 ASP 55.A OD2 no hydrogen 2.698 N/A TRP 59.A N GLN 535.A O no hydrogen 2.795 N/A ASP 60.A N THR 52.A O no hydrogen 2.905 N/A HIS 62.A N HIS 50.A O no hydrogen 2.892 N/A HIS 62.A NE2 THR 52.A OG1 no hydrogen 2.554 N/A ALA 65.A N TRP 48.A O no hydrogen 2.922 N/A SER 69.A N ASP 73.A OD1 no hydrogen 3.065 N/A SER 69.A OG PHE 67.A O no hydrogen 3.342 N/A ASP 73.A N ALA 70.A O no hydrogen 3.093 N/A ILE 74.A N PRO 71.A O no hydrogen 3.213 N/A ASN 75.A N ILE 97.A O no hydrogen 2.949 N/A ASN 75.A ND2 ASP 98.A O no hydrogen 2.916 N/A GLY 76.A N ASP 73.A O no hydrogen 3.178 N/A CYS 77.A N ILE 46.A O no hydrogen 3.213 N/A CYS 77.A SG ASP 73.A OD2 no hydrogen 3.592 N/A TRP 78.A N THR 95.A O no hydrogen 2.753 N/A SER 79.A OG ASP 19.A OD1 no hydrogen 2.681 N/A SER 81.A N LEU 93.A O no hydrogen 2.893 N/A SER 81.A OG PRO 146.A O no hydrogen 2.637 N/A THR 83.A N VAL 91.A O no hydrogen 2.878 N/A LEU 85.A N LYS 89.A O no hydrogen 2.828 N/A GLY 88.A N LEU 85.A O no hydrogen 2.820 N/A LYS 89.A N ASN 87.A OD1 no hydrogen 2.914 N/A LYS 89.A NZ GLU 109.A OE1 no hydrogen 2.556 N/A VAL 91.A N THR 83.A O no hydrogen 2.961 N/A ILE 92.A N ALA 108.A O no hydrogen 2.820 N/A LEU 93.A N SER 81.A O no hydrogen 3.019 N/A TYR 94.A N ASN 106.A O no hydrogen 3.000 N/A TYR 94.A OH ASP 73.A OD2 no hydrogen 2.800 N/A THR 95.A N SER 79.A O no hydrogen 3.132 N/A THR 95.A OG1 GLN 105.A OE1 no hydrogen 2.834 N/A GLY 96.A N VAL 104.A O no hydrogen 2.715 N/A ILE 97.A N GLY 76.A O no hydrogen 2.964 N/A ASP 98.A N GLN 102.A O no hydrogen 2.947 N/A LYS 100.A N ASP 98.A OD1 no hydrogen 3.009 N/A ASN 101.A N ASP 98.A O no hydrogen 2.796 N/A GLN 102.A N ASP 98.A OD1 no hydrogen 2.968 N/A GLN 103.A N ALA 140.A O no hydrogen 2.855 N/A VAL 104.A N GLY 96.A O no hydrogen 2.958 N/A GLN 105.A N MET 130.A O no hydrogen 2.854 N/A GLN 105.A NE2 PHE 143.A O no hydrogen 2.849 N/A ASN 106.A N TYR 94.A O no hydrogen 2.846 N/A ASN 106.A ND2 PHE 72.A O no hydrogen 3.084 N/A ILE 107.A N ASN 127.A OD1 no hydrogen 2.841 N/A ALA 108.A N ILE 92.A O no hydrogen 2.819 N/A GLU 109.A N LYS 122.A O no hydrogen 2.979 N/A LYS 111.A N GLU 120.A O no hydrogen 3.053 N/A SER 114.A N ASN 112.A OD1 no hydrogen 2.911 N/A ASP 115.A N ASN 112.A O no hydrogen 3.121 N/A TYR 117.A N ASP 115.A OD1 no hydrogen 3.099 N/A LEU 118.A N ASP 115.A O no hydrogen 3.119 N/A ARG 119.A N ASP 115.A OD2 no hydrogen 3.062 N/A ARG 119.A NE ASP 115.A OD2 no hydrogen 3.232 N/A ARG 119.A NH2 ASP 115.A OD1 no hydrogen 3.028 N/A TRP 121.A NE1 LEU 118.A O no hydrogen 2.751 N/A LYS 122.A N GLU 109.A O no hydrogen 2.918 N/A LYS 123.A NZ PHE 67.A O no hydrogen 2.808 N/A LYS 123.A NZ SER 69.A OG no hydrogen 2.835 N/A LYS 123.A NZ ASP 73.A OD2 no hydrogen 2.641 N/A LEU 126.A N SER 124.A OG no hydrogen 3.167 N/A ASN 127.A N SER 124.A O no hydrogen 3.205 N/A ASN 127.A ND2 ILE 107.A O no hydrogen 2.965 N/A LEU 129.A N GLN 105.A O no hydrogen 2.858 N/A MET 130.A N GLN 105.A O no hydrogen 3.345 N/A ASP 133.A N ASN 136.A OD1 no hydrogen 2.957 N/A VAL 135.A N ASP 133.A OD1 no hydrogen 3.207 N/A ASN 136.A N ASP 133.A OD1 no hydrogen 3.134 N/A ASN 136.A ND2 ALA 131.A O no hydrogen 2.825 N/A GLY 137.A N ASP 133.A O no hydrogen 2.927 N/A ILE 138.A N ASN 136.A OD1 no hydrogen 2.998 N/A SER 142.A N ASN 139.A O no hydrogen 2.966 N/A PHE 143.A N GLN 103.A OE1 no hydrogen 2.982 N/A ARG 144.A N GLY 162.A O no hydrogen 2.995 N/A ARG 144.A NE GLU 199.A OE1 no hydrogen 3.329 N/A ARG 144.A NH1 GLN 103.A OE1 no hydrogen 2.966 N/A ARG 144.A NH1 SER 141.A O no hydrogen 3.177 N/A ARG 144.A NH2 GLU 199.A OE1 no hydrogen 2.694 N/A ASP 145.A N THR 95.A OG1 no hydrogen 2.871 N/A THR 147.A N ILE 160.A O no hydrogen 3.056 N/A THR 147.A OG1 THR 148.A O no hydrogen 2.898 N/A THR 148.A OG1 ALA 82.A O no hydrogen 2.714 N/A ALA 149.A N THR 83.A OG1 no hydrogen 2.662 N/A TRP 150.A N ARG 158.A O no hydrogen 3.080 N/A TRP 150.A NE1 TYR 247.A OH no hydrogen 2.943 N/A LEU 151.A N SER 217.A OG no hydrogen 2.922 N/A GLY 152.A N LYS 156.A O no hydrogen 3.175 N/A LYS 155.A N GLY 152.A O no hydrogen 2.915 N/A LYS 156.A N ASP 154.A OD2 no hydrogen 3.060 N/A TRP 157.A N SER 176.A O no hydrogen 2.653 N/A ARG 158.A N TRP 150.A O no hydrogen 2.913 N/A ARG 158.A NE ASP 252.A OD1 no hydrogen 3.305 N/A ARG 158.A NH1 ASP 154.A OD2 no hydrogen 2.908 N/A ARG 158.A NH1 LYS 156.A O no hydrogen 2.748 N/A ARG 158.A NH2 ASP 154.A OD1 no hydrogen 3.029 N/A VAL 159.A N TYR 174.A O no hydrogen 2.895 N/A ILE 160.A N THR 147.A OG1 no hydrogen 3.373 N/A ILE 161.A N ILE 172.A O no hydrogen 2.932 N/A GLY 162.A N ARG 144.A O no hydrogen 2.818 N/A SER 163.A N LEU 170.A O no hydrogen 3.200 N/A SER 163.A OG SER 142.A O no hydrogen 2.654 N/A LYS 164.A NZ HIS 166.A O no hydrogen 3.215 N/A ILE 165.A N ARG 168.A O no hydrogen 2.876 N/A ARG 168.A N ILE 165.A O no hydrogen 2.871 N/A ARG 168.A NE ASP 193.A OD2 no hydrogen 2.981 N/A ARG 168.A NH2 ASP 193.A OD1 no hydrogen 3.166 N/A ARG 168.A NH2 ASP 193.A OD2 no hydrogen 3.241 N/A GLY 169.A N ASP 192.A O no hydrogen 2.813 N/A LEU 170.A N SER 163.A O no hydrogen 2.928 N/A ALA 171.A N HIS 190.A O no hydrogen 3.010 N/A ILE 172.A N ILE 161.A O no hydrogen 3.044 N/A THR 173.A OG1 ALA 171.A O no hydrogen 3.545 N/A TYR 174.A N VAL 159.A O no hydrogen 2.794 N/A THR 175.A N GLU 183.A O no hydrogen 2.941 N/A SER 176.A N TRP 157.A O no hydrogen 3.127 N/A SER 176.A OG ASP 178.A OD1 no hydrogen 3.353 N/A SER 176.A OG LYS 181.A O no hydrogen 2.865 N/A PHE 179.A N SER 176.A OG no hydrogen 2.666 N/A LEU 180.A N ASP 178.A OD1 no hydrogen 2.942 N/A LYS 181.A N ASP 178.A OD1 no hydrogen 2.884 N/A TRP 182.A NE1 PHE 179.A O no hydrogen 2.744 N/A GLU 183.A N THR 175.A O no hydrogen 2.933 N/A LYS 184.A NZ SER 185.A O no hydrogen 3.235 N/A SER 185.A N THR 173.A O no hydrogen 2.900 N/A SER 185.A OG THR 173.A O no hydrogen 3.335 N/A LEU 189.A N ALA 171.A O no hydrogen 2.997 N/A ASP 192.A N GLY 169.A O no hydrogen 2.919 N/A GLY 194.A N ARG 167.A O no hydrogen 2.848 N/A SER 195.A OG ASP 192.A O no hydrogen 3.315 N/A SER 195.A OG GLY 196.A O no hydrogen 3.225 N/A GLY 196.A N ARG 167.A O no hydrogen 3.082 N/A TRP 198.A NE1 SER 195.A OG no hydrogen 2.763 N/A GLU 199.A N SER 233.A O no hydrogen 2.716 N/A CYS 200.A N ASP 145.A OD2 no hydrogen 2.747 N/A CYS 200.A SG ASP 19.A OD1 no hydrogen 3.672 N/A CYS 200.A SG ASP 145.A OD2 no hydrogen 3.280 N/A ASP 202.A N LYS 231.A O no hydrogen 2.804 N/A PHE 203.A N ASP 202.A OD1 no hydrogen 3.118 N/A PHE 204.A N VAL 229.A O no hydrogen 3.110 N/A VAL 206.A N LYS 227.A O no hydrogen 2.818 N/A THR 207.A OG1 GLU 224.A OE1 no hydrogen 3.423 N/A THR 207.A OG1 GLU 224.A OE2 no hydrogen 3.174 N/A ARG 208.A N ILE 225.A O no hydrogen 2.726 N/A ARG 208.A NE ARG 208.A O no hydrogen 3.012 N/A GLY 213.A N ASN 286.A O no hydrogen 3.401 N/A SER 217.A N GLU 215.A OE1 no hydrogen 2.673 N/A SER 218.A N GLU 215.A O no hydrogen 2.850 N/A ASN 223.A ND2 GLU 221.A OE2 no hydrogen 3.529 N/A LYS 227.A N VAL 206.A O no hydrogen 2.882 N/A LYS 227.A NZ ASP 257.A OD1 no hydrogen 3.007 N/A LYS 227.A NZ ASP 257.A OD2 no hydrogen 3.208 N/A HIS 228.A N GLY 245.A O no hydrogen 2.873 N/A VAL 229.A N PHE 204.A O no hydrogen 2.819 N/A LEU 230.A N THR 243.A O no hydrogen 3.327 N/A LYS 231.A N ASP 202.A O no hydrogen 2.828 N/A LYS 231.A NZ CYS 200.A O no hydrogen 2.829 N/A LYS 231.A NZ SER 233.A OG no hydrogen 2.754 N/A LYS 231.A NZ ASP 240.A OD2 no hydrogen 3.560 N/A LYS 231.A NZ SER 277.A O no hydrogen 2.678 N/A ILE 232.A N TYR 241.A O no hydrogen 2.908 N/A SER 233.A N GLU 199.A O no hydrogen 2.733 N/A SER 233.A OG ASP 240.A OD1 no hydrogen 2.601 N/A LEU 234.A N HIS 239.A O no hydrogen 3.029 N/A THR 237.A OG1 HIS 239.A ND1 no hydrogen 3.383 N/A THR 237.A OG1 TYR 241.A OH no hydrogen 2.776 N/A LYS 238.A N LEU 234.A O no hydrogen 3.076 N/A LYS 238.A NZ ASP 235.A O no hydrogen 2.844 N/A LYS 238.A NZ ASP 236.A O no hydrogen 2.881 N/A HIS 239.A ND1 TYR 241.A OH no hydrogen 3.229 N/A TYR 241.A N ILE 232.A O no hydrogen 2.863 N/A TYR 241.A OH THR 237.A OG1 no hydrogen 2.776 N/A TYR 242.A N PRO 267.A O no hydrogen 3.017 N/A THR 243.A N LEU 230.A O no hydrogen 3.083 N/A GLY 245.A N HIS 228.A O no hydrogen 2.992 N/A THR 246.A N VAL 255.A O no hydrogen 2.986 N/A TYR 247.A OH ASP 252.A OD2 no hydrogen 2.615 N/A ASP 248.A N LYS 253.A O no hydrogen 2.832 N/A VAL 250.A N ASP 248.A OD2 no hydrogen 3.168 N/A LYS 251.A N ASP 248.A OD2 no hydrogen 3.228 N/A LYS 253.A N ASP 248.A O no hydrogen 3.032 N/A LYS 253.A NZ GLU 187.A OE2 no hydrogen 3.280 N/A PHE 254.A N LEU 189.A O no hydrogen 2.785 N/A VAL 255.A N THR 246.A O no hydrogen 2.950 N/A ASP 257.A N ILE 244.A O no hydrogen 2.886 N/A PHE 260.A N ASP 257.A O no hydrogen 2.829 N/A ASP 263.A N LYS 261.A O no hydrogen 2.882 N/A THR 265.A N ASP 263.A OD1 no hydrogen 3.160 N/A THR 265.A OG1 ASP 263.A OD1 no hydrogen 2.657 N/A ALA 266.A N ASP 263.A O no hydrogen 3.179 N/A ARG 268.A N TYR 271.A OH no hydrogen 3.076 N/A TYR 271.A N CYS 494.A O no hydrogen 2.715 N/A GLY 272.A N ASP 270.A OD2 no hydrogen 2.776 N/A LYS 273.A N THR 496.A O no hydrogen 2.840 N/A LYS 273.A NZ ASN 295.A OD1 no hydrogen 2.966 N/A LYS 273.A NZ SER 297.A OG no hydrogen 2.592 N/A TYR 275.A N TRP 293.A O no hydrogen 2.864 N/A TYR 275.A OH GLU 199.A OE2 no hydrogen 2.685 N/A ALA 276.A N SER 233.A OG no hydrogen 3.233 N/A ALA 276.A N ASP 240.A OD1 no hydrogen 3.245 N/A SER 277.A N ASP 240.A OD2 no hydrogen 2.931 N/A SER 277.A OG ASP 240.A OD2 no hydrogen 2.604 N/A LYS 278.A N TRP 291.A O no hydrogen 2.893 N/A LYS 278.A NZ SER 81.A OG no hydrogen 2.933 N/A LYS 278.A NZ PRO 201.A O no hydrogen 3.494 N/A THR 279.A N ASP 202.A OD2 no hydrogen 2.995 N/A THR 279.A OG1 ASP 202.A OD2 no hydrogen 2.744 N/A PHE 280.A N ILE 289.A O no hydrogen 2.926 N/A ASP 282.A N ARG 287.A O no hydrogen 2.799 N/A ALA 284.A N ASP 282.A OD1 no hydrogen 3.117 N/A ARG 287.A N ASP 282.A O no hydrogen 3.294 N/A ARG 287.A NE ASP 282.A OD2 no hydrogen 2.735 N/A ARG 287.A NH1 GLU 334.A OE1 no hydrogen 3.022 N/A ARG 287.A NH2 TYR 30.A OH no hydrogen 3.420 N/A ARG 287.A NH2 ASP 282.A OD2 no hydrogen 3.112 N/A ARG 287.A NH2 GLU 334.A OE1 no hydrogen 3.412 N/A ARG 287.A NH2 GLU 334.A OE2 no hydrogen 2.683 N/A ARG 288.A NH1 THR 279.A OG1 no hydrogen 3.110 N/A ARG 288.A NH2 VAL 214.A O no hydrogen 2.970 N/A ARG 288.A NH2 THR 216.A OG1 no hydrogen 3.000 N/A ILE 289.A N PHE 280.A O no hydrogen 2.955 N/A LEU 290.A N ARG 316.A O no hydrogen 2.838 N/A TRP 291.A N LYS 278.A O no hydrogen 2.817 N/A TRP 293.A N TYR 275.A O no hydrogen 2.983 N/A THR 294.A N ILE 311.A O no hydrogen 2.786 N/A THR 294.A OG1 LYS 273.A O no hydrogen 2.902 N/A SER 297.A N TYR 500.A OH no hydrogen 2.885 N/A SER 298.A OG ASP 303.A OD1 no hydrogen 2.902 N/A GLU 301.A N GLU 301.A OE2 no hydrogen 3.108 N/A ASP 302.A N SER 299.A OG no hydrogen 3.097 N/A ASP 303.A N SER 299.A O no hydrogen 2.992 N/A VAL 304.A N VAL 300.A O no hydrogen 2.822 N/A GLU 305.A N GLU 301.A O no hydrogen 2.858 N/A LYS 306.A N ASP 302.A O no hydrogen 2.872 N/A LYS 306.A NZ GLU 296.A OE1 no hydrogen 2.766 N/A LYS 306.A NZ SER 298.A OG no hydrogen 2.865 N/A LYS 306.A NZ ASP 303.A OD1 no hydrogen 3.165 N/A GLY 307.A N ASP 303.A O no hydrogen 2.796 N/A TRP 308.A NE1 GLN 2.A OE1 no hydrogen 2.907 N/A SER 309.A N ASN 15.A O no hydrogen 3.217 N/A SER 309.A OG ASP 303.A OD2 no hydrogen 2.652 N/A GLY 310.A N GLU 296.A OE2 no hydrogen 2.915 N/A ILE 311.A N THR 294.A O no hydrogen 2.966 N/A GLN 312.A N PHE 10.A O no hydrogen 3.003 N/A GLN 312.A NE2 ASN 18.A O no hydrogen 3.172 N/A THR 313.A N GLY 292.A O no hydrogen 3.002 N/A THR 313.A OG1 GLY 292.A O no hydrogen 3.393 N/A ILE 314.A N GLU 485.A OE2 no hydrogen 2.866 N/A ARG 316.A N LEU 290.A O no hydrogen 3.165 N/A ARG 316.A NE GLN 329.A OE1 no hydrogen 3.349 N/A ARG 316.A NH2 ASP 270.A OD1 no hydrogen 2.629 N/A ILE 318.A N ARG 288.A O no hydrogen 3.120 N/A TRP 319.A N ILE 328.A O no hydrogen 3.045 N/A ASP 321.A N GLN 326.A O no hydrogen 3.100 N/A SER 323.A N ASP 321.A OD2 no hydrogen 3.191 N/A SER 323.A OG ASP 321.A OD1 no hydrogen 2.858 N/A SER 323.A OG ASP 321.A OD2 no hydrogen 2.802 N/A GLY 324.A N ASP 321.A O no hydrogen 2.944 N/A LYS 325.A N ASP 321.A OD1 no hydrogen 3.288 N/A LYS 325.A N SER 323.A OG no hydrogen 3.377 N/A GLN 326.A N ASP 321.A OD1 no hydrogen 3.340 N/A GLN 326.A NE2 LEU 327.A O no hydrogen 3.028 N/A GLN 326.A NE2 ARG 492.A O no hydrogen 2.842 N/A LEU 327.A N TYR 242.A OH no hydrogen 2.918 N/A ILE 328.A N TRP 319.A O no hydrogen 2.757 N/A GLN 329.A N GLY 491.A O no hydrogen 3.224 N/A GLN 329.A NE2 TYR 269.A O no hydrogen 2.494 N/A TRP 330.A N LYS 317.A O no hydrogen 3.044 N/A VAL 332.A N PRO 315.A O no hydrogen 2.850 N/A ARG 333.A NE GLU 336.A OE2 no hydrogen 3.325 N/A ARG 333.A NH2 GLU 336.A OE2 no hydrogen 3.542 N/A GLU 334.A N GLU 334.A OE1 no hydrogen 2.708 N/A VAL 335.A N VAL 332.A O no hydrogen 3.233 N/A GLU 336.A N ARG 333.A O no hydrogen 3.029 N/A ARG 337.A N GLU 334.A O no hydrogen 3.147 N/A LEU 338.A N VAL 335.A O no hydrogen 3.285 N/A ARG 339.A N GLU 336.A O no hydrogen 3.115 N/A ARG 339.A NE ASP 368.A OD2 no hydrogen 3.087 N/A ARG 339.A NH2 ASP 368.A OD2 no hydrogen 2.942 N/A ARG 339.A NH2 GLU 370.A OE2 no hydrogen 3.083 N/A THR 340.A N SER 530.A O no hydrogen 2.736 N/A LYS 341.A NZ THR 340.A OG1 no hydrogen 3.288 N/A LYS 344.A N ALA 528.A O no hydrogen 2.995 N/A ASN 345.A ND2 ASN 525.A OD1 no hydrogen 2.919 N/A ASN 345.A ND2 ASN 527.A OD1 no hydrogen 2.522 N/A LEU 346.A N LEU 526.A O no hydrogen 2.958 N/A ASN 348.A N LEU 524.A O no hydrogen 3.284 N/A LYS 349.A N VAL 523.A O no hydrogen 3.354 N/A LEU 351.A N VAL 521.A O no hydrogen 2.934 N/A SER 353.A OG GLY 517.A O no hydrogen 2.632 N/A GLY 354.A N ASN 515.A O no hydrogen 2.814 N/A SER 355.A N LYS 352.A O no hydrogen 3.289 N/A SER 355.A N ASN 515.A O no hydrogen 3.058 N/A SER 355.A OG LYS 352.A O no hydrogen 2.860 N/A LEU 357.A N ALA 513.A O no hydrogen 2.603 N/A VAL 359.A N LEU 511.A O no hydrogen 2.787 N/A THR 363.A N SER 530.A OG no hydrogen 2.704 N/A THR 363.A OG1 GLN 366.A O no hydrogen 2.723 N/A GLN 366.A N THR 363.A O no hydrogen 2.793 N/A GLN 366.A NE2 MET 531.A O no hydrogen 3.074 N/A GLN 366.A NE2 SER 533.A OG no hydrogen 3.119 N/A ALA 367.A N ILE 479.A O no hydrogen 2.935 N/A ASP 368.A N TRP 529.A O no hydrogen 2.943 N/A VAL 369.A N ALA 477.A O no hydrogen 2.910 N/A GLU 370.A N ASN 527.A O no hydrogen 2.849 N/A VAL 371.A N LEU 475.A O no hydrogen 2.841 N/A LEU 372.A N ASN 525.A O no hydrogen 2.731 N/A PHE 373.A N LEU 473.A O no hydrogen 2.892 N/A LYS 374.A N ASP 522.A O no hydrogen 3.152 N/A LYS 374.A NZ ASP 522.A OD2 no hydrogen 3.554 N/A LYS 380.A N ASP 377.A O no hydrogen 3.228 N/A ALA 381.A N LEU 378.A O no hydrogen 2.959 N/A ILE 384.A N LYS 431.A O no hydrogen 3.002 N/A TRP 388.A N GLU 385.A O no hydrogen 3.021 N/A GLN 392.A NE2 THR 460.A O no hydrogen 2.665 N/A LEU 393.A N ASP 390.A OD1 no hydrogen 3.436 N/A ILE 394.A N ASP 390.A O no hydrogen 3.275 N/A CYS 395.A N PRO 391.A O no hydrogen 3.226 N/A CYS 395.A SG PRO 391.A O no hydrogen 3.442 N/A CYS 395.A SG MET 443.A O no hydrogen 3.863 N/A CYS 395.A SG TYR 461.A O no hydrogen 3.637 N/A SER 396.A N GLN 392.A O no hydrogen 3.094 N/A SER 396.A OG GLN 392.A O no hydrogen 3.196 N/A LYS 397.A N LEU 393.A O no hydrogen 3.279 N/A MET 398.A N ILE 394.A O no hydrogen 2.827 N/A SER 401.A N ASN 399.A OD1 no hydrogen 2.951 N/A SER 401.A OG ASN 399.A OD1 no hydrogen 2.610 N/A VAL 402.A N ASN 399.A O no hydrogen 2.901 N/A SER 404.A N GLY 407.A O no hydrogen 3.094 N/A SER 404.A OG GLY 407.A O no hydrogen 2.779 N/A GLY 405.A N ASP 382.A OD2 no hydrogen 2.635 N/A PHE 409.A N PHE 427.A O no hydrogen 3.211 N/A GLY 410.A N PHE 514.A O no hydrogen 3.087 N/A LEU 411.A N VAL 425.A O no hydrogen 2.849 N/A MET 412.A N PHE 512.A O no hydrogen 2.772 N/A VAL 413.A N THR 423.A O no hydrogen 2.862 N/A ALA 415.A N HIS 510.A O no hydrogen 3.163 N/A SER 416.A N GLU 421.A O no hydrogen 2.886 N/A SER 416.A OG GLU 420.A OE2 no hydrogen 2.596 N/A SER 416.A OG GLU 421.A O no hydrogen 3.350 N/A LEU 419.A N SER 416.A O no hydrogen 2.979 N/A GLU 420.A N GLU 420.A OE2 no hydrogen 2.837 N/A GLU 421.A N SER 416.A OG no hydrogen 2.904 N/A TYR 422.A N ARG 449.A O no hydrogen 2.591 N/A THR 423.A N VAL 413.A O no hydrogen 2.969 N/A SER 424.A N ASP 446.A O no hydrogen 2.943 N/A VAL 425.A N LEU 411.A O no hydrogen 2.949 N/A TYR 426.A N CYS 444.A O no hydrogen 3.004 N/A TYR 426.A OH MET 398.A O no hydrogen 3.110 N/A PHE 427.A N PHE 409.A O no hydrogen 2.756 N/A ARG 428.A N LEU 442.A O no hydrogen 3.040 N/A ARG 428.A NH1 VAL 402.A O no hydrogen 2.932 N/A ARG 428.A NH1 SER 404.A OG no hydrogen 2.828 N/A ARG 428.A NH2 MET 398.A O no hydrogen 2.895 N/A ARG 428.A NH2 VAL 402.A O no hydrogen 3.041 N/A ILE 429.A N LEU 406.A O no hydrogen 3.116 N/A PHE 430.A N VAL 440.A O no hydrogen 2.799 N/A LYS 431.A N ASP 382.A O no hydrogen 2.731 N/A LYS 431.A NZ GLU 379.A O no hydrogen 2.871 N/A ALA 432.A N LYS 438.A O no hydrogen 2.900 N/A SER 436.A N ARG 433.A O no hydrogen 3.165 N/A SER 436.A OG LYS 438.A O no hydrogen 3.561 N/A LYS 438.A N SER 436.A OG no hydrogen 2.755 N/A VAL 440.A N PHE 430.A O no hydrogen 2.701 N/A LEU 442.A N ARG 428.A O no hydrogen 2.802 N/A MET 443.A N ALA 463.A O no hydrogen 2.876 N/A CYS 444.A N TYR 426.A O no hydrogen 2.934 N/A CYS 444.A SG TYR 426.A OH no hydrogen 3.430 N/A SER 445.A N TYR 461.A O no hydrogen 2.830 N/A SER 445.A OG GLN 447.A OE1 no hydrogen 2.982 N/A ASP 446.A N SER 424.A O no hydrogen 2.730 N/A GLN 447.A NE2 THR 459.A O no hydrogen 2.835 N/A SER 448.A N ASP 446.A OD2 no hydrogen 2.812 N/A SER 448.A OG ASP 446.A OD2 no hydrogen 2.801 N/A ARG 449.A NH2 GLU 420.A O no hydrogen 3.367 N/A SER 450.A OG GLN 447.A O no hydrogen 2.954 N/A SER 451.A OG TYR 500.A O no hydrogen 2.683 N/A LEU 452.A N GLU 421.A OE2 no hydrogen 2.688 N/A LYS 453.A N SER 451.A OG no hydrogen 3.196 N/A LYS 453.A NZ ASP 302.A OD1 no hydrogen 2.901 N/A LYS 453.A NZ ASP 302.A OD2 no hydrogen 2.704 N/A GLU 454.A N GLU 454.A OE1 no hydrogen 2.810 N/A ASN 456.A ND2 LYS 453.A O no hydrogen 3.369 N/A ASN 456.A ND2 TYR 500.A O no hydrogen 3.691 N/A ASP 457.A N SER 297.A O no hydrogen 2.613 N/A LYS 458.A NZ SER 451.A O no hydrogen 2.910 N/A THR 459.A N ASP 457.A OD1 no hydrogen 3.255 N/A THR 459.A OG1 ASP 457.A OD1 no hydrogen 2.961 N/A TYR 461.A N SER 445.A O no hydrogen 2.883 N/A ALA 463.A N MET 443.A O no hydrogen 2.913 N/A VAL 465.A N VAL 441.A O no hydrogen 2.883 N/A ILE 467.A N VAL 465.A O no hydrogen 2.904 N/A HIS 470.A N ASN 468.A OD1 no hydrogen 3.124 N/A HIS 470.A ND1 ASN 468.A OD1 no hydrogen 2.789 N/A GLN 471.A N ASN 468.A O no hydrogen 3.073 N/A LEU 473.A N PHE 373.A O no hydrogen 2.714 N/A LEU 475.A N VAL 371.A O no hydrogen 3.012 N/A ARG 476.A N PHE 487.A O no hydrogen 2.983 N/A ARG 476.A NE ASP 368.A OD1 no hydrogen 3.066 N/A ARG 476.A NE ASP 368.A OD2 no hydrogen 3.378 N/A ARG 476.A NH2 ASP 368.A OD2 no hydrogen 2.758 N/A ALA 477.A N VAL 369.A O no hydrogen 2.775 N/A LEU 478.A N GLU 485.A O no hydrogen 2.871 N/A ILE 479.A N ALA 367.A O no hydrogen 2.688 N/A ASP 480.A N VAL 483.A O no hydrogen 3.020 N/A HIS 481.A N ALA 365.A O no hydrogen 2.677 N/A HIS 481.A NE2 GLN 366.A OE1 no hydrogen 2.629 N/A SER 482.A N ASP 480.A O no hydrogen 2.676 N/A SER 482.A OG TYR 4.A O no hydrogen 2.601 N/A VAL 484.A N SER 497.A O no hydrogen 3.010 N/A GLU 485.A N LEU 478.A O no hydrogen 2.885 N/A SER 486.A N ILE 495.A O no hydrogen 3.090 N/A PHE 487.A N ARG 476.A O no hydrogen 2.796 N/A GLY 488.A N ALA 493.A O no hydrogen 2.747 N/A GLY 489.A N SER 474.A O no hydrogen 3.079 N/A GLY 491.A N GLY 488.A O no hydrogen 3.205 N/A ARG 492.A N GLY 488.A O no hydrogen 3.036 N/A ARG 492.A NH1 GLY 489.A O no hydrogen 2.908 N/A ALA 493.A N GLY 488.A O no hydrogen 3.268 N/A CYS 494.A SG GLY 491.A O no hydrogen 3.978 N/A ILE 495.A N SER 486.A O no hydrogen 2.912 N/A THR 496.A N ASP 270.A OD2 no hydrogen 2.872 N/A THR 496.A OG1 ASP 270.A OD1 no hydrogen 2.589 N/A SER 497.A N VAL 484.A O no hydrogen 2.909 N/A SER 497.A OG GLN 447.A OE1 no hydrogen 3.420 N/A ARG 498.A NE SER 482.A O no hydrogen 2.759 N/A ARG 498.A NH1 THR 294.A O no hydrogen 3.543 N/A ARG 498.A NH1 GLU 296.A OE2 no hydrogen 2.874 N/A ARG 498.A NH2 GLU 296.A OE2 no hydrogen 3.207 N/A ARG 498.A NH2 SER 482.A OG no hydrogen 2.822 N/A VAL 499.A N SER 482.A O no hydrogen 3.133 N/A TYR 500.A OH GLU 296.A OE1 no hydrogen 2.678 N/A LYS 502.A N GLU 421.A OE2 no hydrogen 2.943 N/A LEU 503.A N GLU 421.A OE1 no hydrogen 2.869 N/A ALA 504.A N GLU 421.A OE1 no hydrogen 3.348 N/A ILE 505.A N LEU 503.A O no hydrogen 2.773 N/A SER 508.A N ILE 505.A O no hydrogen 2.810 N/A SER 509.A N GLY 506.A O no hydrogen 3.431 N/A SER 509.A OG GLY 506.A O no hydrogen 3.277 N/A HIS 510.A N ALA 415.A O no hydrogen 2.628 N/A HIS 510.A ND1 GLU 358.A OE2 no hydrogen 2.797 N/A PHE 512.A N MET 412.A O no hydrogen 3.096 N/A ALA 513.A N LEU 357.A O no hydrogen 2.752 N/A PHE 514.A N GLY 410.A O no hydrogen 2.984 N/A ASN 515.A N SER 355.A O no hydrogen 2.912 N/A ASN 515.A ND2 LEU 351.A O no hydrogen 2.712 N/A ASN 515.A ND2 GLN 519.A O no hydrogen 3.137 N/A TYR 516.A N PRO 408.A O no hydrogen 2.784 N/A GLY 517.A N ASN 515.A OD1 no hydrogen 3.125 N/A TYR 518.A N SER 404.A O no hydrogen 2.910 N/A GLN 519.A N GLY 405.A O no hydrogen 3.072 N/A VAL 521.A N LEU 351.A O no hydrogen 3.173 N/A ASP 522.A N LYS 374.A O no hydrogen 3.010 N/A VAL 523.A N LYS 349.A O no hydrogen 2.784 N/A LEU 526.A N LEU 346.A O no hydrogen 2.817 N/A ASN 527.A N GLU 370.A O no hydrogen 2.829 N/A ALA 528.A N LYS 344.A O no hydrogen 2.911 N/A TRP 529.A N ASP 368.A O no hydrogen 2.780 N/A SER 530.A OG THR 363.A OG1 no hydrogen 3.161 N/A MET 531.A N GLN 366.A O no hydrogen 2.931 N/A ASN 532.A N LEU 338.A O no hydrogen 2.935 N/A ALA 534.A N GLY 7.A O no hydrogen 3.003 N/A GLN 535.A N ASN 58.A OD1 no hydrogen 2.828 N/A SER 537.A N TRP 59.A O no hydrogen 2.803 N/A