Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1hj3_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): HIS 1.A ND1 GLY 85.A O no hydrogen 2.939 N/A ARG 4.A N ASN 7.A OD1 no hydrogen 2.626 N/A THR 5.A OG1 MET 386.A O no hydrogen 2.786 N/A ASN 7.A ND2 LYS 2.A O no hydrogen 2.776 N/A ARG 8.A NE GLY 89.A O no hydrogen 3.235 N/A ARG 8.A NH2 GLY 89.A O no hydrogen 3.541 N/A SER 12.A OG GLU 47.A O no hydrogen 3.022 N/A LEU 13.A N PHE 46.A O no hydrogen 3.130 N/A ASN 15.A N GLU 218.A OE2 no hydrogen 2.914 N/A ASN 15.A ND2 SER 217.A O no hydrogen 2.872 N/A LEU 16.A N GLU 218.A OE2 no hydrogen 2.927 N/A ALA 17.A N LEU 13.A O no hydrogen 2.972 N/A GLN 18.A N ASN 15.A O no hydrogen 3.093 N/A GLN 19.A N LEU 16.A O no hydrogen 3.216 N/A VAL 21.A N ASN 39.A OD1 no hydrogen 2.663 N/A VAL 30.A N PRO 27.A O no hydrogen 3.086 N/A SER 34.A N GLN 37.A OE1 no hydrogen 3.056 N/A SER 34.A OG GLN 37.A OE1 no hydrogen 3.309 N/A GLN 37.A N SER 34.A OG no hydrogen 3.148 N/A TYR 38.A N SER 34.A O no hydrogen 2.674 N/A ASN 39.A N ASP 35.A O no hydrogen 2.973 N/A ASN 39.A ND2 VAL 21.A O no hydrogen 2.758 N/A ASN 39.A ND2 ASP 35.A O no hydrogen 2.832 N/A GLU 40.A N ALA 36.A O no hydrogen 2.831 N/A ALA 41.A N GLN 37.A O no hydrogen 3.044 N/A ASN 42.A N TYR 38.A O no hydrogen 2.834 N/A LYS 43.A N ASN 39.A O no hydrogen 2.900 N/A LYS 43.A NZ GLU 47.A OE1 no hydrogen 3.495 N/A LYS 43.A NZ GLU 47.A OE2 no hydrogen 2.649 N/A ILE 44.A N GLU 40.A O no hydrogen 3.192 N/A TYR 45.A N ALA 41.A O no hydrogen 2.779 N/A TYR 45.A OH GLY 54.A O no hydrogen 2.701 N/A PHE 46.A N ASN 42.A O no hydrogen 2.833 N/A GLU 47.A N LYS 43.A O no hydrogen 3.109 N/A ARG 48.A N ILE 44.A O no hydrogen 2.904 N/A CYS 49.A N TYR 45.A O no hydrogen 2.798 N/A CYS 49.A SG ILE 44.A O no hydrogen 4.043 N/A ALA 50.A N TYR 45.A O no hydrogen 2.765 N/A CYS 52.A N CYS 49.A O no hydrogen 3.260 N/A CYS 52.A SG GLU 10.A OE1 no hydrogen 3.876 N/A CYS 52.A SG THR 61.A OG1 no hydrogen 3.510 N/A HIS 53.A N CYS 49.A O no hydrogen 3.006 N/A HIS 53.A ND1 LYS 63.A O no hydrogen 2.726 N/A GLY 54.A N ALA 50.A O no hydrogen 2.662 N/A VAL 55.A N GLU 274.A OE2 no hydrogen 2.936 N/A LEU 56.A N GLU 274.A OE1 no hydrogen 3.005 N/A ARG 57.A N GLY 54.A O no hydrogen 2.992 N/A ARG 57.A NE LEU 65.A O no hydrogen 2.838 N/A ARG 57.A NH2 LEU 106.A O no hydrogen 2.848 N/A GLY 59.A N HIS 53.A O no hydrogen 2.863 N/A ALA 60.A N CYS 52.A O no hydrogen 3.078 N/A ALA 60.A N GLY 62.A O no hydrogen 2.840 N/A THR 61.A OG1 GLU 10.A OE1 no hydrogen 2.898 N/A GLY 62.A N CYS 52.A O no hydrogen 2.804 N/A LYS 63.A NZ ALA 64.A O no hydrogen 3.093 N/A LEU 65.A N ARG 57.A O no hydrogen 2.764 N/A THR 66.A OG1 ASP 68.A OD1 no hydrogen 2.999 N/A THR 70.A N THR 66.A O no hydrogen 3.011 N/A THR 70.A OG1 PRO 67.A O no hydrogen 3.267 N/A THR 70.A OG1 LEU 104.A O no hydrogen 2.640 N/A ARG 71.A N PRO 67.A O no hydrogen 2.886 N/A ARG 71.A NE LEU 105.A O no hydrogen 2.810 N/A ARG 71.A NH2 LEU 105.A O no hydrogen 2.945 N/A ARG 71.A NH2 ASP 107.A OD2 no hydrogen 2.776 N/A LEU 73.A N LEU 69.A O no hydrogen 3.436 N/A GLY 74.A N THR 70.A O no hydrogen 2.927 N/A LEU 78.A N GLY 74.A O no hydrogen 3.140 N/A GLN 79.A N PHE 75.A O no hydrogen 2.655 N/A GLN 79.A NE2 ASP 98.A OD1 no hydrogen 2.742 N/A SER 80.A N ASP 76.A O no hydrogen 2.944 N/A SER 80.A OG ASP 76.A O no hydrogen 3.061 N/A PHE 81.A N TYR 77.A O no hydrogen 2.824 N/A ILE 82.A N LEU 78.A O no hydrogen 2.883 N/A THR 83.A N GLN 79.A O no hydrogen 3.084 N/A THR 83.A OG1 GLN 79.A O no hydrogen 2.772 N/A GLY 85.A N ILE 82.A O no hydrogen 3.151 N/A ALA 88.A N THR 3.A OG1 no hydrogen 2.644 N/A SER 93.A N GLN 96.A OE1 no hydrogen 3.144 N/A SER 93.A OG GLN 96.A OE1 no hydrogen 3.380 N/A VAL 97.A N SER 93.A O no hydrogen 2.884 N/A ASP 98.A N ALA 94.A O no hydrogen 3.325 N/A LEU 99.A N GLU 95.A O no hydrogen 3.145 N/A MET 100.A N GLN 96.A O no hydrogen 2.999 N/A ALA 101.A N VAL 97.A O no hydrogen 3.097 N/A ASN 102.A N ASP 98.A O no hydrogen 2.983 N/A TYR 103.A N LEU 99.A O no hydrogen 2.815 N/A TYR 103.A OH ASN 42.A OD1 no hydrogen 2.693 N/A LEU 104.A N MET 100.A O no hydrogen 3.078 N/A LEU 105.A N ASN 102.A O no hydrogen 2.971 N/A LEU 106.A N TYR 103.A O no hydrogen 3.094 N/A GLY 115.A N GLU 118.A OE1 no hydrogen 2.983 N/A MET 119.A N GLY 115.A O no hydrogen 2.896 N/A ARG 120.A N MET 116.A O no hydrogen 2.882 N/A ARG 120.A NH1 GLU 254.A OE2 no hydrogen 3.139 N/A GLU 121.A N LYS 117.A O no hydrogen 3.133 N/A SER 122.A N GLU 118.A O no hydrogen 3.303 N/A SER 122.A N MET 119.A O no hydrogen 3.067 N/A SER 122.A OG MET 119.A O no hydrogen 2.630 N/A SER 122.A OG LYS 214.A O no hydrogen 3.451 N/A TRP 123.A N ARG 120.A O no hydrogen 3.279 N/A TRP 123.A NE1 THR 252.A O no hydrogen 2.819 N/A LYS 124.A N GLU 212.A O no hydrogen 2.997 N/A HIS 126.A N VAL 210.A O no hydrogen 2.778 N/A HIS 126.A NE2 GLU 212.A OE1 no hydrogen 2.711 N/A VAL 127.A N VAL 210.A O no hydrogen 3.127 N/A ASP 131.A N ALA 128.A O no hydrogen 2.877 N/A ARG 132.A N PRO 129.A O no hydrogen 3.105 N/A ARG 132.A NE VAL 127.A O no hydrogen 2.840 N/A ARG 132.A NH1 TYR 187.A OH no hydrogen 3.028 N/A ARG 132.A NH1 GLU 251.A O no hydrogen 2.775 N/A ARG 132.A NH2 VAL 127.A O no hydrogen 2.952 N/A ARG 132.A NH2 GLU 251.A O no hydrogen 2.860 N/A GLN 136.A NE2 ASN 138.A O no hydrogen 3.327 N/A GLN 136.A NE2 ASN 138.A OD1 no hydrogen 2.806 N/A GLN 136.A NE2 TRP 140.A O no hydrogen 2.840 N/A GLU 137.A N TRP 203.A O no hydrogen 2.759 N/A ASN 138.A ND2 LEU 202.A O no hydrogen 2.773 N/A ASN 138.A ND2 MET 204.A O no hydrogen 2.864 N/A TRP 140.A N ASN 138.A OD1 no hydrogen 2.984 N/A ASN 144.A N ASP 141.A O no hydrogen 3.187 N/A LEU 145.A N LEU 142.A O no hydrogen 3.064 N/A PHE 146.A N ILE 159.A O no hydrogen 2.939 N/A SER 147.A N PHE 534.A O no hydrogen 2.852 N/A SER 147.A OG SER 179.A OG no hydrogen 2.796 N/A VAL 148.A N ALA 157.A O no hydrogen 2.853 N/A THR 149.A N GLY 532.A O no hydrogen 2.836 N/A LEU 150.A N GLN 155.A O no hydrogen 2.903 N/A ARG 151.A N THR 529.A O no hydrogen 3.016 N/A ARG 151.A NH1 ASP 152.A OD1 no hydrogen 3.006 N/A ASP 152.A N THR 529.A OG1 no hydrogen 2.854 N/A ALA 153.A N LEU 150.A O no hydrogen 3.195 N/A GLY 154.A N ARG 151.A O no hydrogen 3.287 N/A GLN 155.A N LEU 150.A O no hydrogen 3.511 N/A GLN 155.A NE2 ASP 171.A OD1 no hydrogen 2.882 N/A ILE 156.A N LEU 170.A O no hydrogen 3.016 N/A ALA 157.A N VAL 148.A O no hydrogen 2.846 N/A LEU 158.A N SER 168.A O no hydrogen 2.915 N/A ILE 159.A N PHE 146.A O no hydrogen 2.878 N/A ASP 160.A N GLU 165.A O no hydrogen 2.843 N/A ALA 162.A N ASP 160.A OD1 no hydrogen 2.821 N/A THR 163.A N ASP 160.A OD1 no hydrogen 2.881 N/A THR 163.A OG1 GLU 165.A OE2 no hydrogen 2.538 N/A TYR 164.A N ASP 160.A O no hydrogen 2.892 N/A TYR 164.A OH GLU 493.A OE1 no hydrogen 2.618 N/A GLU 165.A N THR 163.A OG1 no hydrogen 3.252 N/A LYS 167.A N LEU 158.A O no hydrogen 2.748 N/A SER 168.A N LEU 158.A O no hydrogen 3.445 N/A LEU 170.A N ILE 156.A O no hydrogen 2.878 N/A THR 172.A N GLY 154.A O no hydrogen 2.884 N/A THR 172.A OG1 GLY 173.A O no hydrogen 2.951 N/A ALA 175.A N ARG 151.A O no hydrogen 3.137 N/A HIS 177.A N ILE 191.A O no hydrogen 2.904 N/A SER 179.A OG SER 147.A OG no hydrogen 2.796 N/A ARG 180.A N PHE 189.A O no hydrogen 2.870 N/A ARG 180.A NH1 SER 179.A O no hydrogen 2.844 N/A SER 182.A N TYR 187.A O no hydrogen 2.813 N/A SER 182.A OG SER 184.A OG no hydrogen 3.283 N/A SER 182.A OG ASP 232.A OD1 no hydrogen 3.101 N/A SER 184.A N ASP 232.A OD1 no hydrogen 3.250 N/A SER 184.A OG SER 182.A OG no hydrogen 3.283 N/A SER 184.A OG ASP 232.A OD1 no hydrogen 2.984 N/A SER 184.A OG ASP 232.A OD2 no hydrogen 2.581 N/A GLY 185.A N SER 182.A O no hydrogen 2.945 N/A ARG 186.A N SER 184.A OG no hydrogen 3.309 N/A ARG 186.A NE ASP 201.A OD1 no hydrogen 2.847 N/A ARG 186.A NH1 PRO 133.A O no hydrogen 3.436 N/A ARG 186.A NH2 PRO 133.A O no hydrogen 2.876 N/A ARG 186.A NH2 ASP 201.A OD1 no hydrogen 3.518 N/A ARG 186.A NH2 ASP 201.A OD2 no hydrogen 2.862 N/A TYR 187.A N SER 182.A OG no hydrogen 3.188 N/A LEU 188.A N ILE 200.A O no hydrogen 2.925 N/A PHE 189.A N ARG 180.A O no hydrogen 2.803 N/A VAL 190.A N ASN 198.A O no hydrogen 2.953 N/A ILE 191.A N ILE 178.A O no hydrogen 3.498 N/A GLY 192.A N LYS 196.A O no hydrogen 2.840 N/A ARG 193.A N TYR 174.A O no hydrogen 3.215 N/A ARG 193.A NE ASP 14.A OD1 no hydrogen 3.145 N/A ARG 193.A NH2 ASP 14.A OD1 no hydrogen 3.341 N/A GLY 195.A N GLY 192.A O no hydrogen 2.968 N/A LYS 196.A N ASP 194.A OD1 no hydrogen 3.258 N/A VAL 197.A N ILE 213.A O no hydrogen 2.730 N/A ASN 198.A N VAL 190.A O no hydrogen 3.007 N/A MET 199.A N ALA 211.A O no hydrogen 2.950 N/A ILE 200.A N LEU 188.A O no hydrogen 2.754 N/A ASP 201.A N THR 208.A O no hydrogen 3.361 N/A LEU 202.A N ARG 186.A O no hydrogen 2.994 N/A TRP 203.A N ASP 201.A OD1 no hydrogen 3.028 N/A MET 204.A N ASP 201.A O no hydrogen 3.356 N/A THR 209.A OG1 ASN 198.A OD1 no hydrogen 2.945 N/A VAL 210.A N MET 199.A O no hydrogen 2.763 N/A ALA 211.A N MET 199.A O no hydrogen 3.444 N/A GLU 212.A N LYS 124.A O no hydrogen 2.963 N/A ILE 213.A N VAL 197.A O no hydrogen 3.079 N/A LYS 214.A N SER 122.A OG no hydrogen 2.886 N/A LYS 214.A NZ ASP 194.A O no hydrogen 2.829 N/A LYS 214.A NZ GLY 216.A O no hydrogen 2.752 N/A ILE 215.A N GLY 195.A O no hydrogen 2.862 N/A SER 217.A N TRP 241.A O no hydrogen 2.866 N/A GLU 218.A N TRP 241.A O no hydrogen 3.079 N/A ALA 219.A N ARG 193.A O no hydrogen 2.896 N/A ARG 220.A NH1 GLU 218.A OE1 no hydrogen 3.141 N/A ARG 220.A NH1 ALA 219.A O no hydrogen 2.928 N/A ARG 220.A NH2 GLU 218.A OE1 no hydrogen 3.144 N/A SER 221.A OG ALA 278.A O no hydrogen 2.852 N/A GLU 223.A N ILE 236.A O no hydrogen 2.909 N/A THR 224.A N GLU 223.A OE1 no hydrogen 2.844 N/A THR 224.A OG1 LEU 181.A O no hydrogen 2.697 N/A THR 224.A OG1 GLU 223.A OE1 no hydrogen 3.521 N/A SER 225.A N TYR 234.A O no hydrogen 3.005 N/A SER 225.A OG TRP 230.A O no hydrogen 2.816 N/A SER 225.A OG TYR 234.A O no hydrogen 3.264 N/A LYS 226.A NZ GLU 223.A OE1 no hydrogen 3.325 N/A LYS 226.A NZ GLU 223.A OE2 no hydrogen 3.007 N/A LYS 226.A NZ THR 539.A O no hydrogen 3.024 N/A LYS 226.A NZ ASP 542.A OD1 no hydrogen 2.698 N/A GLY 229.A N GLU 231.A OE1 no hydrogen 3.071 N/A GLY 229.A N GLU 231.A OE2 no hydrogen 3.237 N/A TRP 230.A N MET 227.A O no hydrogen 2.863 N/A GLU 231.A N GLU 231.A OE1 no hydrogen 2.830 N/A LYS 233.A N TRP 230.A O no hydrogen 3.136 N/A TYR 234.A N SER 225.A OG no hydrogen 3.105 N/A ALA 235.A N MET 248.A O no hydrogen 3.001 N/A ILE 236.A N GLU 223.A O no hydrogen 2.872 N/A ALA 237.A N VAL 246.A O no hydrogen 2.970 N/A GLY 238.A N SER 221.A O no hydrogen 2.922 N/A ALA 239.A N GLN 244.A O no hydrogen 3.003 N/A TYR 240.A N GLU 218.A O no hydrogen 2.809 N/A TRP 241.A N GLU 218.A O no hydrogen 3.230 N/A TRP 241.A NE1 PRO 112.A O no hydrogen 2.927 N/A GLN 244.A NE2 PHE 114.A O no hydrogen 2.972 N/A GLN 244.A NE2 ILE 215.A O no hydrogen 3.173 N/A TYR 245.A N GLN 259.A O no hydrogen 2.962 N/A VAL 246.A N ALA 237.A O no hydrogen 2.939 N/A ILE 247.A N LYS 257.A O no hydrogen 2.800 N/A MET 248.A N ALA 235.A O no hydrogen 2.759 N/A ASP 249.A N GLU 254.A O no hydrogen 2.826 N/A GLY 250.A N LYS 233.A O no hydrogen 2.879 N/A GLU 251.A N ASP 249.A OD1 no hydrogen 2.746 N/A THR 252.A N ASP 249.A OD1 no hydrogen 3.003 N/A LEU 253.A N ASP 249.A O no hydrogen 2.853 N/A GLU 254.A N THR 252.A OG1 no hydrogen 3.071 N/A LYS 256.A N ILE 247.A O no hydrogen 2.882 N/A LYS 257.A N ILE 247.A O no hydrogen 3.207 N/A LYS 257.A NZ LEU 307.A O no hydrogen 2.741 N/A GLN 259.A N TYR 245.A O no hydrogen 2.903 N/A THR 261.A N PRO 243.A O no hydrogen 2.958 N/A THR 261.A OG1 PRO 275.A O no hydrogen 2.724 N/A ARG 262.A N SER 260.A OG no hydrogen 3.132 N/A ARG 262.A NE SER 260.A OG no hydrogen 3.056 N/A ARG 262.A NH1 GLU 113.A OE1 no hydrogen 3.377 N/A ARG 262.A NH1 GLU 113.A OE2 no hydrogen 2.786 N/A ARG 262.A NH2 GLU 113.A OE1 no hydrogen 2.907 N/A GLY 263.A N HIS 272.A O no hydrogen 3.367 N/A THR 265.A N GLU 270.A O no hydrogen 2.884 N/A THR 265.A OG1 GLU 270.A O no hydrogen 3.488 N/A TYR 266.A N THR 296.A O no hydrogen 2.945 N/A TYR 266.A OH GLU 318.A OE1 no hydrogen 2.776 N/A GLU 268.A N ASP 267.A OD1 no hydrogen 2.935 N/A GLU 270.A N THR 265.A OG1 no hydrogen 3.227 N/A HIS 272.A N GLY 263.A O no hydrogen 2.783 N/A HIS 272.A NE2 GLY 59.A O no hydrogen 3.010 N/A GLU 274.A N HIS 272.A ND1 no hydrogen 2.980 N/A ARG 276.A N GLU 295.A OE1 no hydrogen 2.809 N/A ARG 276.A NH1 GLY 51.A O no hydrogen 2.801 N/A ARG 276.A NH2 ALA 50.A O no hydrogen 2.857 N/A ARG 276.A NH2 GLU 274.A OE2 no hydrogen 2.921 N/A VAL 277.A N ALA 239.A O no hydrogen 3.163 N/A ALA 278.A N ASN 292.A O no hydrogen 2.867 N/A ALA 279.A N HIS 322.A O no hydrogen 3.025 N/A LEU 281.A N ILE 290.A O no hydrogen 2.811 N/A SER 283.A N GLU 288.A O no hydrogen 2.963 N/A SER 283.A OG ARG 286.A O no hydrogen 3.332 N/A HIS 284.A NE2 ASP 542.A OD2 no hydrogen 2.735 N/A TYR 285.A N SER 283.A OG no hydrogen 3.060 N/A ARG 286.A N SER 283.A OG no hydrogen 3.073 N/A ARG 286.A NE GLU 288.A OE1 no hydrogen 3.020 N/A ARG 286.A NH2 GLU 288.A OE1 no hydrogen 3.100 N/A GLU 288.A N ARG 286.A O no hydrogen 2.726 N/A PHE 289.A N VAL 302.A O no hydrogen 2.850 N/A ILE 290.A N LEU 281.A O no hydrogen 2.842 N/A VAL 291.A N LEU 300.A O no hydrogen 2.859 N/A ASN 292.A N ALA 279.A O no hydrogen 3.035 N/A ASN 292.A ND2 HIS 322.A O no hydrogen 3.161 N/A ASN 292.A ND2 THR 335.A OG1 no hydrogen 2.848 N/A VAL 293.A N LYS 298.A O no hydrogen 2.939 N/A LYS 294.A N ARG 276.A O no hydrogen 2.889 N/A GLY 297.A N VAL 293.A O no hydrogen 3.144 N/A GLY 297.A N LYS 294.A O no hydrogen 3.237 N/A LYS 298.A N VAL 293.A O no hydrogen 3.318 N/A LYS 298.A NZ MET 264.A O no hydrogen 2.877 N/A LYS 298.A NZ GLU 314.A OE2 no hydrogen 2.847 N/A ILE 299.A N ILE 315.A O no hydrogen 2.947 N/A LEU 300.A N VAL 291.A O no hydrogen 2.855 N/A LEU 301.A N THR 313.A O no hydrogen 2.898 N/A VAL 302.A N PHE 289.A O no hydrogen 2.912 N/A ASP 303.A N LYS 311.A O no hydrogen 2.978 N/A TYR 304.A N PRO 287.A O no hydrogen 3.051 N/A THR 305.A N ASP 303.A OD1 no hydrogen 2.819 N/A THR 305.A OG1 ASP 303.A OD1 no hydrogen 2.596 N/A ASP 308.A N ASP 306.A OD1 no hydrogen 2.981 N/A ASN 309.A N ASP 306.A OD1 no hydrogen 2.908 N/A ASN 309.A ND2 ASP 306.A OD2 no hydrogen 2.940 N/A THR 313.A N LEU 301.A O no hydrogen 2.883 N/A ILE 315.A N ILE 299.A O no hydrogen 2.825 N/A ALA 317.A N GLY 297.A O no hydrogen 2.842 N/A ARG 319.A N GLU 318.A OE1 no hydrogen 2.860 N/A ARG 319.A NE GLU 295.A O no hydrogen 2.670 N/A ARG 319.A NH2 GLU 295.A O no hydrogen 2.968 N/A PHE 320.A N LYS 294.A O no hydrogen 2.927 N/A HIS 322.A N ALA 336.A O no hydrogen 2.881 N/A GLY 325.A N ILE 334.A O no hydrogen 2.912 N/A LEU 326.A N TYR 544.A OH no hydrogen 2.952 N/A ASP 327.A N TYR 332.A O no hydrogen 2.933 N/A SER 329.A N ASP 327.A OD2 no hydrogen 3.041 N/A SER 329.A OG ASP 327.A OD1 no hydrogen 3.128 N/A SER 329.A OG ASP 327.A OD2 no hydrogen 2.591 N/A HIS 330.A N ASP 327.A O no hydrogen 2.911 N/A HIS 330.A NE2 ASP 542.A O no hydrogen 2.773 N/A ARG 331.A N ASP 327.A OD1 no hydrogen 3.024 N/A ARG 331.A N SER 329.A OG no hydrogen 3.285 N/A ARG 331.A NE ASP 347.A OD1 no hydrogen 2.918 N/A ARG 331.A NH2 ASP 347.A OD2 no hydrogen 2.864 N/A TYR 332.A N ASP 327.A OD1 no hydrogen 2.783 N/A PHE 333.A N ILE 346.A O no hydrogen 2.908 N/A ILE 334.A N GLY 325.A O no hydrogen 2.865 N/A THR 335.A N VAL 344.A O no hydrogen 2.880 N/A THR 335.A OG1 ASP 323.A O no hydrogen 2.685 N/A ALA 336.A N ASP 323.A O no hydrogen 2.945 N/A ALA 337.A N LYS 342.A O no hydrogen 2.956 N/A ASN 338.A N PHE 320.A O no hydrogen 3.055 N/A ARG 340.A N ALA 337.A O no hydrogen 3.208 N/A ARG 340.A NH1 ASP 267.A OD2 no hydrogen 3.113 N/A ARG 340.A NH1 GLU 318.A OE1 no hydrogen 2.732 N/A ASN 341.A N ASN 338.A O no hydrogen 3.104 N/A LYS 342.A N ALA 337.A O no hydrogen 3.351 N/A LYS 342.A NZ ARG 340.A O no hydrogen 3.384 N/A LYS 342.A NZ ASP 358.A OD2 no hydrogen 3.100 N/A LEU 343.A N GLU 357.A O no hydrogen 2.749 N/A VAL 344.A N THR 335.A O no hydrogen 2.798 N/A VAL 345.A N ALA 355.A O no hydrogen 2.867 N/A ILE 346.A N PHE 333.A O no hydrogen 2.826 N/A ASP 347.A N LYS 352.A O no hydrogen 2.875 N/A THR 348.A N ARG 331.A O no hydrogen 2.955 N/A THR 348.A OG1 ARG 331.A O no hydrogen 2.688 N/A LYS 349.A N ASP 347.A OD1 no hydrogen 2.871 N/A GLU 350.A N ASP 347.A OD1 no hydrogen 3.342 N/A GLY 351.A N ASP 347.A O no hydrogen 2.821 N/A LYS 352.A N ASP 347.A O no hydrogen 3.327 N/A VAL 354.A N VAL 345.A O no hydrogen 2.842 N/A ALA 355.A N VAL 345.A O no hydrogen 3.408 N/A GLU 357.A N LEU 343.A O no hydrogen 3.183 N/A THR 359.A OG1 HIS 385.A NE2 no hydrogen 2.776 N/A GLY 360.A N ASP 358.A OD1 no hydrogen 2.789 N/A GLY 361.A N THR 359.A OG1 no hydrogen 3.023 N/A GLN 362.A N ASP 388.A OD2 no hydrogen 2.905 N/A THR 363.A N ASN 341.A OD1 no hydrogen 2.664 N/A THR 363.A OG1 ASP 6.A OD2 no hydrogen 2.507 N/A HIS 365.A N SER 384.A O no hydrogen 3.007 N/A HIS 365.A ND1 LEU 420.A O no hydrogen 2.620 N/A GLY 367.A N ASP 323.A OD2 no hydrogen 2.843 N/A GLY 369.A N PRO 366.A O no hydrogen 2.874 N/A ALA 370.A N ALA 382.A O no hydrogen 3.168 N/A ASN 371.A N TYR 544.A O no hydrogen 2.858 N/A ASN 371.A ND2 LEU 326.A O no hydrogen 2.864 N/A ASN 371.A ND2 TYR 544.A OXT no hydrogen 2.920 N/A PHE 372.A N VAL 380.A O no hydrogen 2.942 N/A HIS 374.A N GLY 378.A O no hydrogen 2.971 N/A THR 376.A N HIS 374.A ND1 no hydrogen 3.089 N/A THR 376.A OG1 THR 456.A O no hydrogen 3.030 N/A PHE 377.A N HIS 374.A ND1 no hydrogen 3.145 N/A GLY 378.A N HIS 374.A O no hydrogen 2.983 N/A VAL 380.A N PHE 372.A O no hydrogen 2.911 N/A TRP 381.A N ILE 394.A O no hydrogen 3.096 N/A TRP 381.A NE1 ARG 368.A O no hydrogen 3.039 N/A ALA 382.A N ALA 370.A O no hydrogen 2.704 N/A THR 383.A N ALA 392.A O no hydrogen 3.103 N/A THR 383.A OG1 SER 384.A O no hydrogen 2.867 N/A SER 384.A OG SER 419.A OG no hydrogen 2.660 N/A HIS 385.A ND1 SER 390.A O no hydrogen 2.883 N/A HIS 385.A NE2 THR 359.A OG1 no hydrogen 2.776 N/A MET 386.A N THR 363.A O no hydrogen 2.925 N/A GLY 387.A N GLN 362.A O no hydrogen 2.878 N/A SER 390.A N ASP 388.A OD1 no hydrogen 2.954 N/A SER 390.A OG HIS 385.A ND1 no hydrogen 3.075 N/A SER 390.A OG ASP 388.A OD1 no hydrogen 2.752 N/A VAL 391.A N PHE 412.A O no hydrogen 2.774 N/A ALA 392.A N THR 383.A O no hydrogen 2.907 N/A LEU 393.A N ASP 410.A O no hydrogen 3.064 N/A ILE 394.A N TRP 381.A O no hydrogen 3.010 N/A GLY 395.A N LYS 407.A O no hydrogen 3.165 N/A THR 396.A N PRO 379.A O no hydrogen 3.007 N/A GLY 400.A N ASP 397.A OD1 no hydrogen 2.904 N/A HIS 401.A N ASP 397.A O no hydrogen 2.825 N/A HIS 401.A ND1 ASP 397.A OD2 no hydrogen 2.758 N/A ASN 404.A N HIS 401.A O no hydrogen 3.069 N/A ASN 404.A ND2 PHE 377.A O no hydrogen 3.038 N/A ALA 405.A N PRO 402.A O no hydrogen 3.296 N/A TRP 406.A N GLY 395.A O no hydrogen 2.851 N/A LYS 407.A N ASN 404.A O no hydrogen 3.337 N/A LYS 407.A NZ ASP 403.A O no hydrogen 3.406 N/A LEU 409.A N LEU 393.A O no hydrogen 2.838 N/A SER 411.A N ASP 410.A OD1 no hydrogen 2.883 N/A PHE 412.A N VAL 391.A O no hydrogen 3.006 N/A ALA 414.A N ASP 389.A O no hydrogen 2.756 N/A GLY 418.A N MET 386.A O no hydrogen 2.778 N/A SER 419.A N HIS 385.A O no hydrogen 3.261 N/A SER 419.A OG SER 384.A OG no hydrogen 2.660 N/A SER 419.A OG ASP 434.A O no hydrogen 2.648 N/A SER 419.A OG ASP 434.A OD1 no hydrogen 3.476 N/A LEU 420.A N ASP 434.A OD1 no hydrogen 2.922 N/A PHE 421.A N ASP 434.A OD1 no hydrogen 2.950 N/A LYS 423.A N TYR 432.A O no hydrogen 2.846 N/A LYS 423.A NZ GLU 486.A OE1 no hydrogen 3.373 N/A THR 424.A OG1 TYR 430.A O no hydrogen 2.639 N/A ASN 427.A N HIS 425.A ND1 no hydrogen 2.915 N/A ASN 427.A ND2 ASP 490.A O no hydrogen 2.859 N/A SER 428.A N HIS 425.A O no hydrogen 2.921 N/A SER 428.A OG TYR 430.A O no hydrogen 3.416 N/A SER 428.A OG ASP 513.A OD1 no hydrogen 2.611 N/A SER 428.A OG ASP 513.A OD2 no hydrogen 3.210 N/A TYR 430.A N SER 428.A OG no hydrogen 2.897 N/A LEU 431.A N PHE 450.A O no hydrogen 2.913 N/A TYR 432.A N LYS 423.A O no hydrogen 2.897 N/A TYR 432.A OH ASP 513.A OD1 no hydrogen 2.713 N/A VAL 433.A N ALA 448.A O no hydrogen 2.781 N/A ASP 434.A N PHE 421.A O no hydrogen 3.169 N/A THR 436.A OG1 VAL 482.A O no hydrogen 2.722 N/A LEU 437.A N GLY 418.A O no hydrogen 2.826 N/A ASN 438.A N ALA 435.A O no hydrogen 3.019 N/A ASN 438.A ND2 GLY 417.A O no hydrogen 2.929 N/A GLU 440.A N ASN 438.A OD1 no hydrogen 2.878 N/A SER 444.A N GLU 440.A O no hydrogen 2.948 N/A SER 444.A OG GLU 440.A O no hydrogen 3.479 N/A SER 444.A OG ALA 441.A O no hydrogen 3.108 N/A GLY 445.A N ALA 441.A O no hydrogen 2.942 N/A SER 446.A N ILE 443.A O no hydrogen 3.034 N/A SER 446.A OG GLU 442.A O no hydrogen 2.772 N/A VAL 447.A N LEU 467.A O no hydrogen 3.037 N/A ALA 448.A N VAL 433.A O no hydrogen 2.895 N/A VAL 449.A N LYS 465.A O no hydrogen 2.850 N/A PHE 450.A N LEU 431.A O no hydrogen 2.827 N/A ILE 452.A N GLN 429.A O no hydrogen 2.772 N/A LYS 453.A N ASP 451.A OD1 no hydrogen 3.086 N/A ALA 454.A N ASP 451.A O no hydrogen 3.083 N/A MET 455.A N ILE 452.A O no hydrogen 3.039 N/A ASP 458.A N THR 456.A OG1 no hydrogen 3.234 N/A SER 460.A N ASP 458.A OD1 no hydrogen 2.962 N/A SER 460.A OG ASP 458.A OD1 no hydrogen 2.691 N/A LYS 465.A N VAL 449.A O no hydrogen 2.900 N/A LEU 467.A N VAL 447.A O no hydrogen 2.911 N/A ILE 469.A N LEU 467.A O no hydrogen 2.962 N/A ALA 470.A N GLY 445.A O no hydrogen 2.896 N/A TRP 472.A N PRO 468.A O no hydrogen 2.944 N/A ALA 473.A N ILE 469.A O no hydrogen 3.161 N/A ALA 473.A N ALA 470.A O no hydrogen 3.089 N/A GLY 474.A N GLU 471.A O no hydrogen 2.939 N/A ARG 481.A N TRP 499.A O no hydrogen 3.030 N/A ARG 481.A NH1 THR 436.A O no hydrogen 2.912 N/A VAL 482.A N SER 444.A O no hydrogen 2.923 N/A VAL 483.A N SER 497.A O no hydrogen 2.959 N/A GLN 484.A N ASP 434.A OD2 no hydrogen 2.868 N/A GLN 484.A NE2 LYS 533.A O no hydrogen 2.998 N/A GLU 486.A N TRP 495.A O no hydrogen 3.030 N/A ASN 488.A N GLU 493.A O no hydrogen 3.041 N/A ASN 488.A ND2 THR 492.A OG1 no hydrogen 3.008 N/A LYS 489.A N ASN 144.A OD1 no hydrogen 3.029 N/A LYS 489.A NZ GLU 143.A OE1 no hydrogen 2.656 N/A GLY 491.A N ASN 488.A O no hydrogen 3.117 N/A THR 492.A N ASN 488.A OD1 no hydrogen 2.884 N/A GLU 493.A N ASN 488.A OD1 no hydrogen 3.160 N/A VAL 494.A N VAL 511.A O no hydrogen 2.992 N/A TRP 495.A N GLU 486.A O no hydrogen 2.787 N/A PHE 496.A N VAL 509.A O no hydrogen 2.905 N/A SER 497.A N VAL 483.A O no hydrogen 3.083 N/A SER 497.A OG THR 531.A O no hydrogen 2.625 N/A VAL 498.A N ALA 507.A O no hydrogen 2.786 N/A TRP 499.A N ARG 481.A O no hydrogen 2.857 N/A ASN 500.A N SER 506.A OG no hydrogen 2.958 N/A ASN 500.A ND2 GLU 477.A O no hydrogen 3.077 N/A ASN 500.A ND2 GLU 505.A O no hydrogen 2.986 N/A GLY 501.A N GLN 504.A OE1 no hydrogen 2.933 N/A GLN 504.A N GLY 501.A O no hydrogen 2.906 N/A GLU 505.A N GLU 477.A OE2 no hydrogen 3.014 N/A ALA 507.A N VAL 498.A O no hydrogen 3.184 N/A LEU 508.A N ILE 522.A O no hydrogen 2.990 N/A VAL 509.A N PHE 496.A O no hydrogen 2.919 N/A VAL 510.A N HIS 520.A O no hydrogen 2.844 N/A VAL 511.A N VAL 494.A O no hydrogen 2.861 N/A ASP 512.A N GLU 517.A O no hydrogen 2.932 N/A ASP 513.A N THR 492.A O no hydrogen 2.960 N/A THR 515.A N ASP 512.A OD2 no hydrogen 2.992 N/A THR 515.A OG1 ASP 512.A OD2 no hydrogen 2.798 N/A LEU 516.A N ASP 512.A O no hydrogen 2.800 N/A GLU 517.A N THR 515.A OG1 no hydrogen 3.235 N/A LYS 519.A N VAL 510.A O no hydrogen 2.860 N/A LYS 519.A NZ TYR 164.A OH no hydrogen 2.628 N/A HIS 520.A N VAL 510.A O no hydrogen 3.203 N/A ILE 522.A N LEU 508.A O no hydrogen 2.763 N/A LYS 523.A NZ ALA 473.A O no hydrogen 2.761 N/A LYS 523.A NZ GLY 474.A O no hydrogen 3.070 N/A LYS 523.A NZ GLU 505.A OE2 no hydrogen 2.707 N/A ARG 526.A N ASP 524.A OD1 no hydrogen 2.974 N/A ARG 526.A NE ASP 524.A OD1 no hydrogen 2.906 N/A ARG 526.A NH2 ASP 524.A OD2 no hydrogen 3.055 N/A LEU 527.A N ASP 524.A O no hydrogen 2.867 N/A VAL 528.A N ARG 526.A O no hydrogen 2.953 N/A THR 531.A N THR 149.A O no hydrogen 3.041 N/A LYS 533.A N GLN 484.A OE1 no hydrogen 2.811 N/A LYS 533.A NZ VAL 483.A O no hydrogen 3.146 N/A LYS 533.A NZ GLN 484.A O no hydrogen 2.697 N/A LYS 533.A NZ GLN 484.A OE1 no hydrogen 2.917 N/A LYS 533.A NZ SER 497.A OG no hydrogen 2.846 N/A LYS 533.A NZ THR 531.A O no hydrogen 3.269 N/A PHE 534.A N SER 147.A O no hydrogen 2.973 N/A ASN 535.A N GLU 486.A OE2 no hydrogen 2.751 N/A ASN 535.A ND2 GLU 143.A O no hydrogen 3.479 N/A ASN 535.A ND2 ASN 144.A OD1 no hydrogen 3.604 N/A VAL 536.A N LEU 145.A O no hydrogen 2.841 N/A TYR 537.A N GLU 143.A O no hydrogen 3.069 N/A ASN 538.A N ASN 535.A OD1 no hydrogen 2.983 N/A ASN 538.A ND2 PHE 487.A O no hydrogen 2.961 N/A ASN 538.A ND2 ASN 488.A O no hydrogen 2.913 N/A THR 539.A N ASN 535.A O no hydrogen 3.001 N/A THR 539.A OG1 ASN 535.A O no hydrogen 2.698 N/A MET 540.A N VAL 536.A O no hydrogen 2.902 N/A THR 541.A N TYR 537.A O no hydrogen 3.087 N/A THR 541.A OG1 TYR 537.A O no hydrogen 2.716 N/A THR 541.A OG1 THR 543.A OG1 no hydrogen 2.703 N/A ASP 542.A N THR 539.A O no hydrogen 3.388 N/A THR 543.A N ASN 538.A O no hydrogen 2.955 N/A THR 543.A OG1 THR 541.A OG1 no hydrogen 2.703 N/A