Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4qre_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): THR 4.A OG1 LYS 259.A O no hydrogen 3.522 N/A PHE 5.A N ASP 42.A O no hydrogen 2.885 N/A TYR 6.A N ASP 264.A OD2 no hydrogen 2.814 N/A TYR 6.A OH TYR 243.A O no hydrogen 2.651 N/A ILE 7.A N ARG 44.A O no hydrogen 2.995 N/A THR 8.A N ILE 265.A O no hydrogen 3.057 N/A THR 8.A OG1 HIS 266.A ND1 no hydrogen 2.782 N/A THR 9.A N LEU 46.A O no hydrogen 3.002 N/A THR 9.A OG1 PRO 10.A O no hydrogen 2.720 N/A THR 9.A OG1 THR 47.A OG1 no hydrogen 2.593 N/A TYR 12.A N GLY 48.A O no hydrogen 3.174 N/A TYR 12.A OH THR 26.A OG1 no hydrogen 2.881 N/A TYR 13.A OH HIS 52.A O no hydrogen 2.707 N/A SER 15.A N TYR 13.A O no hydrogen 2.851 N/A HIS 19.A N HIS 22.A ND1 no hydrogen 3.014 N/A ILE 20.A N VAL 316.A O no hydrogen 2.977 N/A GLY 21.A N HIS 19.A ND1 no hydrogen 2.965 N/A ALA 23.A N HIS 19.A O no hydrogen 3.076 N/A TYR 24.A N ILE 20.A O no hydrogen 2.748 N/A TYR 24.A OH LEU 338.A O no hydrogen 2.907 N/A SER 25.A N GLY 21.A O no hydrogen 3.502 N/A SER 25.A OG HIS 298.A NE2 no hydrogen 2.679 N/A THR 26.A N HIS 22.A O no hydrogen 3.208 N/A THR 26.A OG1 TYR 12.A OH no hydrogen 2.881 N/A THR 26.A OG1 HIS 22.A O no hydrogen 3.179 N/A VAL 27.A N ALA 23.A O no hydrogen 2.755 N/A ALA 28.A N TYR 24.A O no hydrogen 2.905 N/A GLY 29.A N SER 25.A O no hydrogen 2.906 N/A ASP 30.A N THR 26.A O no hydrogen 2.989 N/A VAL 31.A N VAL 27.A O no hydrogen 2.866 N/A ILE 32.A N ALA 28.A O no hydrogen 3.097 N/A ALA 33.A N GLY 29.A O no hydrogen 2.894 N/A ARG 34.A N ASP 30.A O no hydrogen 2.835 N/A ARG 34.A NE ASP 30.A OD2 no hydrogen 2.800 N/A ARG 34.A NH2 GLU 86.A O no hydrogen 2.797 N/A TYR 35.A N VAL 31.A O no hydrogen 2.884 N/A TYR 35.A OH GLU 412.A OE2 no hydrogen 2.625 N/A LYS 36.A N ILE 32.A O no hydrogen 2.858 N/A ARG 37.A N ALA 33.A O no hydrogen 2.921 N/A ARG 37.A NH1 SER 88.A OG no hydrogen 2.833 N/A ARG 37.A NH2 SER 88.A O no hydrogen 2.950 N/A ARG 37.A NH2 ASP 90.A OD2 no hydrogen 3.092 N/A MET 38.A N ARG 34.A O no hydrogen 3.060 N/A GLN 39.A N TYR 35.A O no hydrogen 2.948 N/A GLN 39.A N LYS 36.A O no hydrogen 3.062 N/A GLN 39.A NE2 GLU 412.A OE2 no hydrogen 2.869 N/A GLY 40.A N ARG 37.A O no hydrogen 3.021 N/A TYR 41.A N LYS 36.A O no hydrogen 3.026 N/A ASP 42.A N GLU 3.A O no hydrogen 2.787 N/A ARG 44.A N PHE 5.A O no hydrogen 2.893 N/A TYR 45.A N ASP 90.A OD2 no hydrogen 2.836 N/A TYR 45.A OH THR 26.A O no hydrogen 2.594 N/A LEU 46.A N ILE 7.A O no hydrogen 3.000 N/A THR 47.A OG1 THR 9.A OG1 no hydrogen 2.593 N/A THR 49.A N ILE 93.A O no hydrogen 2.851 N/A THR 49.A OG1 GLU 51.A OE2 no hydrogen 2.732 N/A ASP 50.A N TYR 12.A O no hydrogen 2.889 N/A GLU 51.A N THR 95.A OG1 no hydrogen 2.907 N/A HIS 52.A ND1 ASP 238.A OD2 no hydrogen 2.649 N/A GLY 53.A N TRP 221.A O no hydrogen 2.925 N/A GLN 57.A N GLY 53.A O no hydrogen 3.372 N/A GLU 58.A N GLN 54.A O no hydrogen 2.943 N/A LYS 59.A N LYS 55.A O no hydrogen 2.886 N/A ALA 60.A N ILE 56.A O no hydrogen 2.957 N/A GLN 61.A N GLN 57.A O no hydrogen 2.971 N/A LYS 62.A N GLU 58.A O no hydrogen 2.925 N/A ALA 63.A N LYS 59.A O no hydrogen 3.119 N/A GLY 64.A N GLN 61.A O no hydrogen 2.929 N/A LYS 65.A N ALA 60.A O no hydrogen 2.970 N/A LYS 65.A NZ GLU 73.A OE2 no hydrogen 3.047 N/A THR 66.A N GLU 69.A OE2 no hydrogen 3.024 N/A GLU 67.A N GLU 67.A OE1 no hydrogen 2.705 N/A GLU 69.A N THR 66.A OG1 no hydrogen 3.102 N/A TYR 70.A N THR 66.A O no hydrogen 2.963 N/A TYR 70.A OH PRO 14.A O no hydrogen 2.829 N/A LEU 71.A N GLU 67.A O no hydrogen 2.908 N/A ASP 72.A N ILE 68.A O no hydrogen 2.808 N/A GLU 73.A N GLU 69.A O no hydrogen 3.162 N/A MET 74.A N TYR 70.A O no hydrogen 3.052 N/A ILE 75.A N LEU 71.A O no hydrogen 2.778 N/A ALA 76.A N ASP 72.A O no hydrogen 2.883 N/A GLY 77.A N GLU 73.A O no hydrogen 3.190 N/A ILE 78.A N MET 74.A O no hydrogen 2.968 N/A LYS 79.A N ILE 75.A O no hydrogen 2.759 N/A GLN 80.A N ALA 76.A O no hydrogen 2.964 N/A GLN 80.A NE2 ALA 76.A O no hydrogen 3.635 N/A LEU 81.A N GLY 77.A O no hydrogen 2.964 N/A TRP 82.A N ILE 78.A O no hydrogen 3.021 N/A ALA 83.A N LYS 79.A O no hydrogen 2.941 N/A LYS 84.A N GLN 80.A O no hydrogen 2.821 N/A LYS 84.A NZ ASN 319.A OD1 no hydrogen 3.214 N/A LYS 84.A NZ ASP 323.A OD1 no hydrogen 2.762 N/A LYS 84.A NZ ASP 323.A OD2 no hydrogen 3.556 N/A LEU 85.A N LEU 81.A O no hydrogen 2.854 N/A GLU 86.A N ALA 83.A O no hydrogen 3.041 N/A ILE 87.A N TRP 82.A O no hydrogen 2.975 N/A SER 88.A N ASP 30.A OD1 no hydrogen 2.700 N/A SER 88.A OG ASP 30.A OD1 no hydrogen 2.678 N/A ASN 89.A ND2 ASP 91.A O no hydrogen 3.066 N/A ASP 90.A N TYR 45.A O no hydrogen 2.739 N/A PHE 92.A N ASP 91.A OD1 no hydrogen 2.800 N/A ILE 93.A N THR 47.A O no hydrogen 2.951 N/A ARG 94.A N GLU 97.A OE2 no hydrogen 3.099 N/A ARG 94.A NE GLU 51.A OE2 no hydrogen 2.790 N/A ARG 94.A NH1 ASP 72.A OD1 no hydrogen 2.998 N/A ARG 94.A NH2 GLU 51.A OE1 no hydrogen 3.068 N/A ARG 94.A NH2 ASP 72.A OD1 no hydrogen 2.932 N/A THR 95.A N THR 49.A O no hydrogen 3.281 N/A THR 96.A OG1 GLU 51.A OE1 no hydrogen 2.803 N/A GLU 97.A N ARG 94.A O no hydrogen 3.023 N/A ARG 99.A NE GLU 97.A OE2 no hydrogen 3.110 N/A ARG 99.A NH1 ASP 91.A OD2 no hydrogen 2.819 N/A ARG 99.A NH2 ASP 91.A OD1 no hydrogen 3.062 N/A ARG 99.A NH2 ASP 91.A OD2 no hydrogen 3.388 N/A ARG 99.A NH2 GLU 97.A OE2 no hydrogen 3.057 N/A HIS 100.A N GLU 97.A O no hydrogen 3.055 N/A HIS 100.A ND1 SER 245.A OG no hydrogen 2.758 N/A HIS 100.A NE2 ASP 238.A OD1 no hydrogen 2.802 N/A LYS 101.A N GLU 97.A O no hydrogen 3.081 N/A HIS 102.A N GLU 98.A O no hydrogen 2.851 N/A VAL 104.A N HIS 100.A O no hydrogen 3.018 N/A GLU 105.A N LYS 101.A O no hydrogen 2.902 N/A GLN 106.A N HIS 102.A O no hydrogen 2.957 N/A VAL 107.A N VAL 103.A O no hydrogen 2.857 N/A PHE 108.A N VAL 104.A O no hydrogen 3.032 N/A GLU 109.A N GLU 105.A O no hydrogen 2.955 N/A ARG 110.A N GLN 106.A O no hydrogen 2.818 N/A ARG 110.A NE GLN 114.A OE1 no hydrogen 2.856 N/A ARG 110.A NH2 GLN 114.A OE1 no hydrogen 3.568 N/A LEU 111.A N VAL 107.A O no hydrogen 2.988 N/A LEU 112.A N PHE 108.A O no hydrogen 2.936 N/A LYS 113.A N GLU 109.A O no hydrogen 2.928 N/A GLN 114.A N ARG 110.A O no hydrogen 2.830 N/A GLN 114.A NE2 ASP 116.A OD2 no hydrogen 2.960 N/A GLN 114.A NE2 ALA 286.A O no hydrogen 3.046 N/A GLY 115.A N LEU 111.A O no hydrogen 2.958 N/A GLY 115.A N LEU 112.A O no hydrogen 3.003 N/A ILE 117.A N LEU 111.A O no hydrogen 3.335 N/A TYR 118.A N PHE 170.A O no hydrogen 2.918 N/A TYR 118.A OH ASP 211.A OD2 no hydrogen 2.315 N/A GLY 120.A N SER 168.A O no hydrogen 2.839 N/A TYR 122.A N GLU 166.A O no hydrogen 2.784 N/A GLY 124.A N VAL 164.A O no hydrogen 2.892 N/A TRP 125.A N TYR 134.A O no hydrogen 2.920 N/A TYR 126.A N GLU 162.A O no hydrogen 2.844 N/A SER 127.A N THR 132.A O no hydrogen 3.184 N/A ASP 130.A N SER 127.A O no hydrogen 3.154 N/A THR 132.A OG1 ASP 130.A O no hydrogen 2.625 N/A TYR 134.A N TRP 125.A O no hydrogen 2.891 N/A TYR 134.A OH ASP 156.A OD1 no hydrogen 2.576 N/A THR 135.A N GLN 138.A OE1 no hydrogen 2.790 N/A GLN 138.A N THR 135.A O no hydrogen 3.228 N/A LEU 139.A N GLU 136.A O no hydrogen 3.393 N/A VAL 140.A N LYS 153.A O no hydrogen 2.796 N/A GLN 143.A N GLY 151.A O no hydrogen 2.974 N/A GLN 143.A NE2 ASP 141.A O no hydrogen 3.423 N/A ILE 150.A N GLN 143.A O no hydrogen 3.079 N/A LYS 153.A N VAL 140.A O no hydrogen 3.102 N/A SER 154.A N HIS 159.A O no hydrogen 3.039 N/A SER 154.A OG ASP 130.A OD2 no hydrogen 3.491 N/A SER 154.A OG TYR 134.A OH no hydrogen 2.623 N/A SER 154.A OG SER 157.A O no hydrogen 3.394 N/A ASP 156.A N SER 154.A OG no hydrogen 2.864 N/A SER 157.A N SER 154.A OG no hydrogen 3.332 N/A SER 157.A OG ASP 130.A OD1 no hydrogen 3.212 N/A SER 157.A OG ASP 130.A OD2 no hydrogen 2.638 N/A HIS 159.A N SER 157.A OG no hydrogen 3.065 N/A VAL 161.A N GLY 152.A O no hydrogen 3.016 N/A GLU 162.A N TYR 126.A O no hydrogen 2.779 N/A VAL 164.A N GLY 124.A O no hydrogen 2.896 N/A LYS 165.A NZ GLU 123.A OE1 no hydrogen 2.993 N/A GLU 166.A N TYR 122.A O no hydrogen 3.103 N/A SER 168.A N GLY 120.A O no hydrogen 2.944 N/A SER 168.A OG TYR 169.A O no hydrogen 3.079 N/A SER 168.A OG SER 215.A O no hydrogen 2.699 N/A TYR 169.A N SER 215.A OG no hydrogen 2.887 N/A PHE 170.A N TYR 118.A O no hydrogen 2.797 N/A PHE 171.A N LEU 212.A O no hydrogen 2.834 N/A ASN 172.A N ASP 116.A O no hydrogen 2.929 N/A SER 174.A OG ASN 172.A OD1 no hydrogen 2.843 N/A LYS 175.A NZ TYR 176.A OH no hydrogen 3.540 N/A TYR 176.A N ILE 173.A O no hydrogen 3.033 N/A TYR 176.A OH ASP 116.A OD1 no hydrogen 2.603 N/A THR 177.A N SER 174.A O no hydrogen 3.069 N/A THR 177.A OG1 SER 174.A O no hydrogen 2.875 N/A LEU 180.A N TYR 176.A O no hydrogen 2.868 N/A LEU 181.A N THR 177.A O no hydrogen 2.990 N/A GLU 182.A N ASP 178.A O no hydrogen 2.963 N/A PHE 183.A N ARG 179.A O no hydrogen 2.941 N/A TYR 184.A N LEU 180.A O no hydrogen 2.967 N/A TYR 184.A OH SER 277.A O no hydrogen 2.641 N/A ASP 185.A N LEU 181.A O no hydrogen 3.052 N/A GLN 186.A N GLU 182.A O no hydrogen 2.954 N/A ASN 187.A N PHE 183.A O no hydrogen 2.830 N/A ASN 187.A N TYR 184.A O no hydrogen 3.153 N/A PHE 190.A N ASN 187.A O no hydrogen 3.052 N/A GLN 192.A N VAL 295.A O no hydrogen 2.960 N/A GLN 192.A NE2 ASP 189.A O no hydrogen 3.426 N/A ARG 196.A N PRO 193.A O no hydrogen 3.160 N/A LYS 197.A N PRO 194.A O no hydrogen 3.033 N/A GLU 199.A N SER 195.A O no hydrogen 3.517 N/A MET 200.A N ARG 196.A O no hydrogen 3.186 N/A ILE 201.A N LYS 197.A O no hydrogen 3.050 N/A ASN 202.A N ASN 198.A O no hydrogen 3.232 N/A ASN 203.A N GLU 199.A O no hydrogen 2.847 N/A PHE 204.A N MET 200.A O no hydrogen 3.043 N/A ILE 205.A N MET 200.A O no hydrogen 3.189 N/A LYS 206.A N ILE 201.A O no hydrogen 2.843 N/A LYS 206.A NZ ASN 202.A O no hydrogen 3.357 N/A LEU 212.A N PHE 171.A O no hydrogen 2.943 N/A VAL 214.A N TYR 169.A O no hydrogen 2.798 N/A SER 215.A OG HIS 231.A ND1 no hydrogen 2.679 N/A ARG 216.A N VAL 232.A O no hydrogen 2.830 N/A ARG 216.A NH1 ALA 213.A O no hydrogen 2.931 N/A ARG 216.A NH1 SER 215.A O no hydrogen 2.897 N/A THR 217.A N GLU 166.A OE1 no hydrogen 2.868 N/A SER 218.A N GLU 166.A OE1 no hydrogen 3.141 N/A SER 218.A OG GLU 166.A OE1 no hydrogen 3.062 N/A SER 218.A OG GLU 166.A OE2 no hydrogen 2.857 N/A ASN 220.A N GLN 57.A OE1 no hydrogen 3.071 N/A TRP 221.A N GLN 57.A OE1 no hydrogen 2.789 N/A TRP 221.A NE1 GLU 51.A O no hydrogen 2.824 N/A HIS 224.A ND1 PRO 229.A O no hydrogen 2.706 N/A HIS 224.A NE2 ASN 220.A O no hydrogen 2.736 N/A VAL 225.A N HIS 231.A O no hydrogen 2.951 N/A SER 227.A N GLU 109.A OE1 no hydrogen 2.880 N/A SER 227.A OG GLU 109.A OE1 no hydrogen 2.858 N/A SER 227.A OG GLU 109.A OE2 no hydrogen 3.047 N/A ASN 228.A N VAL 225.A O no hydrogen 3.002 N/A ASN 228.A ND2 TYR 169.A OH no hydrogen 3.026 N/A HIS 231.A N ASN 228.A O no hydrogen 2.941 N/A HIS 231.A ND1 SER 215.A OG no hydrogen 2.679 N/A HIS 231.A NE2 GLU 167.A OE2 no hydrogen 2.876 N/A VAL 232.A N ARG 216.A O no hydrogen 2.766 N/A VAL 233.A N VAL 223.A O no hydrogen 2.807 N/A TYR 234.A N VAL 214.A O no hydrogen 2.872 N/A ALA 239.A N VAL 235.A O no hydrogen 2.774 N/A LEU 240.A N TRP 236.A O no hydrogen 3.272 N/A VAL 241.A N ILE 237.A O no hydrogen 3.408 N/A ASN 242.A N ALA 239.A O no hydrogen 3.225 N/A ASN 242.A ND2 ALA 239.A O no hydrogen 2.866 N/A TYR 243.A N LEU 240.A O no hydrogen 3.523 N/A TYR 243.A OH HIS 276.A NE2 no hydrogen 2.692 N/A ILE 244.A N VAL 241.A O no hydrogen 3.011 N/A SER 245.A N VAL 241.A O no hydrogen 2.801 N/A SER 245.A OG HIS 100.A ND1 no hydrogen 2.758 N/A SER 245.A OG VAL 241.A O no hydrogen 3.439 N/A SER 245.A OG ASN 242.A O no hydrogen 3.368 N/A ALA 246.A N ASN 242.A O no hydrogen 3.077 N/A LEU 247.A N ILE 244.A O no hydrogen 3.076 N/A GLY 248.A N SER 245.A O no hydrogen 2.935 N/A TYR 249.A N ILE 244.A O no hydrogen 3.321 N/A LEU 250.A N GLU 254.A OE2 no hydrogen 2.823 N/A SER 251.A N GLY 248.A O no hydrogen 3.020 N/A SER 251.A OG GLY 248.A O no hydrogen 2.693 N/A ASP 253.A N SER 251.A OG no hydrogen 2.978 N/A SER 255.A N ASP 253.A OD1 no hydrogen 3.120 N/A SER 255.A OG ASP 253.A OD1 no hydrogen 2.753 N/A ASN 258.A N GLU 254.A O no hydrogen 2.862 N/A LYS 259.A N SER 255.A O no hydrogen 3.237 N/A LYS 259.A N LEU 256.A O no hydrogen 3.129 N/A LYS 259.A NZ ASP 42.A OD2 no hydrogen 2.738 N/A LYS 259.A NZ TYR 260.A OH no hydrogen 3.412 N/A TYR 260.A N LEU 256.A O no hydrogen 2.825 N/A TYR 260.A OH ASP 42.A OD1 no hydrogen 2.567 N/A TYR 260.A OH ASP 42.A OD2 no hydrogen 3.360 N/A TRP 261.A N PHE 257.A O no hydrogen 3.118 N/A TRP 261.A NE1 PRO 290.A O no hydrogen 2.750 N/A ASP 264.A N TYR 6.A O no hydrogen 2.807 N/A ILE 265.A N TYR 6.A O no hydrogen 3.233 N/A HIS 266.A N LYS 294.A O no hydrogen 2.949 N/A HIS 266.A ND1 THR 8.A OG1 no hydrogen 2.782 N/A LEU 267.A N THR 8.A O no hydrogen 2.998 N/A MET 268.A N PHE 296.A O no hydrogen 3.010 N/A LYS 270.A NZ ASP 343.A OD1 no hydrogen 3.344 N/A LYS 270.A NZ ASP 343.A OD2 no hydrogen 2.814 N/A ILE 272.A N ALA 269.A O no hydrogen 3.477 N/A VAL 273.A N LYS 270.A O no hydrogen 3.318 N/A HIS 276.A N ILE 272.A O no hydrogen 3.200 N/A HIS 276.A ND1 ILE 272.A O no hydrogen 2.870 N/A HIS 276.A NE2 TYR 243.A OH no hydrogen 2.692 N/A SER 277.A N ARG 274.A O no hydrogen 3.282 N/A SER 277.A OG VAL 273.A O no hydrogen 2.898 N/A ILE 278.A N ARG 274.A O no hydrogen 2.933 N/A TRP 280.A N PHE 275.A O no hydrogen 2.993 N/A TRP 280.A NE1 HIS 266.A NE2 no hydrogen 3.085 N/A ILE 282.A N ILE 278.A O no hydrogen 3.121 N/A LEU 283.A N ILE 279.A O no hydrogen 2.869 N/A LEU 284.A N TRP 280.A O no hydrogen 2.981 N/A MET 285.A N PRO 281.A O no hydrogen 2.945 N/A ALA 286.A N ILE 282.A O no hydrogen 2.943 N/A LEU 287.A N LEU 283.A O no hydrogen 3.046 N/A LEU 287.A N LEU 284.A O no hydrogen 3.046 N/A ASP 288.A N MET 285.A O no hydrogen 2.994 N/A LEU 289.A N LEU 284.A O no hydrogen 2.900 N/A LYS 293.A N ALA 263.A O no hydrogen 2.919 N/A VAL 295.A N PHE 190.A O no hydrogen 2.778 N/A PHE 296.A N HIS 266.A O no hydrogen 2.864 N/A ALA 297.A N GLN 192.A O no hydrogen 2.862 N/A HIS 298.A N MET 268.A O no hydrogen 2.857 N/A HIS 298.A ND1 GLY 299.A O no hydrogen 2.797 N/A HIS 298.A NE2 SER 25.A OG no hydrogen 2.679 N/A GLY 299.A N PHE 340.A O no hydrogen 2.570 N/A TRP 300.A N ASP 343.A OD1 no hydrogen 2.717 N/A TRP 300.A NE1 GLU 271.A OE1 no hydrogen 2.884 N/A LEU 302.A N GLY 344.A O no hydrogen 2.781 N/A MET 303.A N GLY 306.A O no hydrogen 2.522 N/A LYS 307.A NZ GLU 271.A OE1 no hydrogen 2.989 N/A MET 308.A N ILE 301.A O no hydrogen 3.025 N/A SER 309.A N ASN 314.A OD1 no hydrogen 2.896 N/A LYS 310.A NZ SER 15.A OG no hydrogen 2.908 N/A LYS 312.A N SER 309.A O no hydrogen 2.959 N/A LYS 312.A NZ ASP 305.A O no hydrogen 2.846 N/A LYS 312.A NZ LYS 307.A O no hydrogen 3.174 N/A GLY 313.A N LYS 310.A O no hydrogen 3.301 N/A ASN 314.A ND2 LYS 307.A O no hydrogen 3.046 N/A ASN 319.A N ASP 317.A OD1 no hydrogen 2.893 N/A ILE 320.A N ASP 317.A O no hydrogen 3.116 N/A LEU 321.A N ASP 317.A O no hydrogen 3.470 N/A ILE 322.A N PRO 318.A O no hydrogen 2.992 N/A ASP 323.A N ASN 319.A O no hydrogen 2.938 N/A ARG 324.A N ILE 320.A O no hydrogen 3.031 N/A TYR 325.A N LEU 321.A O no hydrogen 2.858 N/A GLY 326.A N ILE 322.A O no hydrogen 2.868 N/A THR 330.A N GLY 326.A O no hydrogen 3.206 N/A THR 330.A OG1 GLY 326.A O no hydrogen 3.019 N/A ARG 331.A N LEU 327.A O no hydrogen 2.953 N/A ARG 331.A NE PHE 473.A O no hydrogen 2.868 N/A ARG 331.A NH1 ASP 30.A OD2 no hydrogen 2.872 N/A ARG 331.A NH1 LEU 85.A O no hydrogen 2.900 N/A ARG 331.A NH2 ASP 30.A OD2 no hydrogen 2.913 N/A ARG 331.A NH2 PRO 472.A O no hydrogen 3.327 N/A ARG 331.A NH2 PHE 473.A O no hydrogen 3.207 N/A TYR 332.A N ASP 328.A O no hydrogen 2.784 N/A TYR 332.A OH ASP 358.A OD2 no hydrogen 2.520 N/A TYR 333.A N ALA 329.A O no hydrogen 2.951 N/A LEU 334.A N THR 330.A O no hydrogen 3.194 N/A MET 335.A N ARG 331.A O no hydrogen 3.228 N/A ARG 336.A N TYR 332.A O no hydrogen 2.850 N/A ARG 336.A NH1 ARG 336.A O no hydrogen 3.014 N/A GLU 337.A N TYR 333.A O no hydrogen 2.954 N/A SER 342.A N PRO 339.A O no hydrogen 2.748 N/A GLY 344.A N TRP 300.A O no hydrogen 3.053 N/A PHE 346.A N LEU 302.A O no hydrogen 2.870 N/A THR 347.A OG1 GLU 349.A OE1 no hydrogen 2.752 N/A PHE 351.A N THR 347.A O no hydrogen 3.088 N/A VAL 352.A N PRO 348.A O no hydrogen 2.989 N/A GLU 353.A N GLU 349.A O no hydrogen 3.095 N/A ARG 354.A N ALA 350.A O no hydrogen 2.923 N/A ARG 354.A NE GLU 337.A OE2 no hydrogen 2.721 N/A ARG 354.A NH1 ASP 358.A OD2 no hydrogen 2.910 N/A ARG 354.A NH2 GLU 337.A OE2 no hydrogen 3.340 N/A THR 355.A N PHE 351.A O no hydrogen 3.128 N/A THR 355.A OG1 PHE 351.A O no hydrogen 2.839 N/A ASN 356.A N VAL 352.A O no hydrogen 2.763 N/A PHE 357.A N GLU 353.A O no hydrogen 2.945 N/A ASP 358.A N ARG 354.A O no hydrogen 3.292 N/A LEU 359.A N THR 355.A O no hydrogen 3.301 N/A ALA 360.A N THR 355.A O no hydrogen 3.497 N/A ASN 361.A N ASN 356.A O no hydrogen 3.060 N/A ASP 362.A N PHE 357.A O no hydrogen 3.014 N/A LEU 363.A N ASP 358.A O no hydrogen 3.209 N/A GLY 364.A N LEU 359.A O no hydrogen 2.808 N/A ASN 365.A N ALA 360.A O no hydrogen 3.240 N/A ASN 365.A N ASN 361.A O no hydrogen 3.240 N/A LEU 366.A N ASP 362.A O no hydrogen 3.191 N/A VAL 367.A N LEU 363.A O no hydrogen 3.079 N/A ASN 368.A N GLY 364.A O no hydrogen 3.009 N/A ARG 369.A N ASN 365.A O no hydrogen 2.770 N/A ARG 369.A NH1 ASN 431.A OD1 no hydrogen 2.962 N/A ARG 369.A NH2 ASP 435.A OD1 no hydrogen 2.976 N/A THR 370.A N LEU 366.A O no hydrogen 3.116 N/A THR 370.A OG1 LEU 366.A O no hydrogen 2.902 N/A ILE 371.A N VAL 367.A O no hydrogen 3.031 N/A SER 372.A N ASN 368.A O no hydrogen 2.989 N/A SER 372.A OG ASN 368.A O no hydrogen 2.819 N/A MET 373.A N ARG 369.A O no hydrogen 3.059 N/A VAL 374.A N THR 370.A O no hydrogen 3.055 N/A ASN 375.A N ILE 371.A O no hydrogen 2.949 N/A ASN 375.A ND2 THR 511.A O no hydrogen 2.893 N/A LYS 376.A N SER 372.A O no hydrogen 2.953 N/A TYR 377.A N MET 373.A O no hydrogen 2.771 N/A PHE 378.A N VAL 374.A O no hydrogen 2.992 N/A GLY 380.A N VAL 374.A O no hydrogen 3.040 N/A GLU 381.A N PHE 378.A O no hydrogen 2.987 N/A LEU 382.A N ILE 508.A O no hydrogen 2.786 N/A TYR 385.A N LEU 504.A O no hydrogen 2.804 N/A TYR 385.A OH GLU 397.A OE1 no hydrogen 2.659 N/A TYR 385.A OH GLU 397.A OE2 no hydrogen 3.188 N/A GLN 386.A NE2 ASP 450.A OD1 no hydrogen 2.860 N/A LEU 389.A N GLY 387.A O no hydrogen 2.979 N/A HIS 390.A N ASP 393.A OD2 no hydrogen 2.837 N/A LEU 392.A N HIS 390.A ND1 no hydrogen 3.040 N/A ASP 393.A N HIS 390.A O no hydrogen 2.997 N/A MET 396.A N LEU 392.A O no hydrogen 3.156 N/A GLU 397.A N ASP 393.A O no hydrogen 2.756 N/A ALA 398.A N GLU 394.A O no hydrogen 3.023 N/A MET 399.A N GLU 395.A O no hydrogen 2.883 N/A ALA 400.A N MET 396.A O no hydrogen 2.913 N/A LEU 401.A N GLU 397.A O no hydrogen 3.196 N/A GLU 402.A N ALA 398.A O no hydrogen 2.937 N/A THR 403.A N MET 399.A O no hydrogen 2.824 N/A THR 403.A OG1 MET 399.A O no hydrogen 2.730 N/A VAL 404.A N ALA 400.A O no hydrogen 3.172 N/A LYS 405.A N LEU 401.A O no hydrogen 3.037 N/A LYS 405.A NZ GLU 409.A OE1 no hydrogen 2.757 N/A SER 406.A N GLU 402.A O no hydrogen 2.808 N/A TYR 407.A N THR 403.A O no hydrogen 2.878 N/A TYR 407.A OH LEU 469.A O no hydrogen 2.737 N/A THR 408.A N VAL 404.A O no hydrogen 2.945 N/A THR 408.A OG1 VAL 404.A O no hydrogen 2.822 N/A GLU 409.A N LYS 405.A O no hydrogen 3.118 N/A SER 410.A N SER 406.A O no hydrogen 2.997 N/A SER 410.A OG SER 406.A O no hydrogen 3.325 N/A MET 411.A N TYR 407.A O no hydrogen 2.815 N/A GLU 412.A N THR 408.A O no hydrogen 2.815 N/A SER 413.A N GLU 409.A O no hydrogen 3.150 N/A SER 413.A N SER 410.A O no hydrogen 3.248 N/A SER 413.A OG GLU 409.A O no hydrogen 3.034 N/A SER 413.A OG SER 410.A O no hydrogen 3.215 N/A SER 413.A OG GLN 415.A OE1 no hydrogen 3.001 N/A LEU 414.A N MET 411.A O no hydrogen 3.055 N/A GLN 415.A N SER 410.A O no hydrogen 2.810 N/A ALA 419.A N GLN 415.A O no hydrogen 3.017 N/A LEU 420.A N PHE 416.A O no hydrogen 2.893 N/A SER 421.A N SER 417.A O no hydrogen 2.932 N/A SER 421.A OG SER 417.A O no hydrogen 3.133 N/A SER 421.A OG VAL 418.A O no hydrogen 3.012 N/A THR 422.A N VAL 418.A O no hydrogen 2.961 N/A THR 422.A OG1 VAL 418.A O no hydrogen 3.224 N/A VAL 423.A N ALA 419.A O no hydrogen 3.062 N/A TRP 424.A N LEU 420.A O no hydrogen 2.915 N/A TRP 424.A NE1 ASP 358.A O no hydrogen 2.794 N/A LYS 425.A N SER 421.A O no hydrogen 2.921 N/A PHE 426.A N THR 422.A O no hydrogen 3.439 N/A ILE 427.A N VAL 423.A O no hydrogen 2.948 N/A SER 428.A N TRP 424.A O no hydrogen 2.814 N/A SER 428.A OG ASP 362.A OD2 no hydrogen 2.575 N/A SER 428.A OG TRP 424.A O no hydrogen 3.013 N/A ARG 429.A N LYS 425.A O no hydrogen 3.033 N/A ARG 429.A NH1 ARG 429.A O no hydrogen 2.816 N/A ARG 429.A NH1 GLU 436.A OE1 no hydrogen 2.927 N/A ARG 429.A NH2 GLU 436.A OE1 no hydrogen 2.952 N/A THR 430.A N PHE 426.A O no hydrogen 2.936 N/A THR 430.A OG1 PHE 426.A O no hydrogen 2.670 N/A ASN 431.A N ILE 427.A O no hydrogen 3.093 N/A ASN 431.A ND2 ASP 362.A O no hydrogen 2.963 N/A ASN 431.A ND2 ASP 362.A OD1 no hydrogen 2.792 N/A LYS 432.A N SER 428.A O no hydrogen 3.026 N/A TYR 433.A N ARG 429.A O no hydrogen 2.853 N/A TYR 433.A OH ASP 393.A OD1 no hydrogen 2.631 N/A ILE 434.A N THR 430.A O no hydrogen 3.419 N/A ASP 435.A N ASN 431.A O no hydrogen 3.401 N/A GLU 436.A N LYS 432.A O no hydrogen 2.864 N/A THR 437.A N TYR 433.A O no hydrogen 2.976 N/A THR 437.A OG1 TYR 433.A O no hydrogen 2.814 N/A THR 437.A OG1 ILE 434.A O no hydrogen 3.520 N/A THR 438.A N ILE 434.A O no hydrogen 2.990 N/A THR 438.A OG1 THR 437.A O no hydrogen 2.834 N/A VAL 441.A N THR 438.A O no hydrogen 2.654 N/A ALA 443.A N PRO 439.A O no hydrogen 2.996 N/A LYS 444.A N VAL 441.A O no hydrogen 3.217 N/A ASP 445.A N LEU 442.A O no hydrogen 3.316 N/A SER 447.A N ASP 445.A OD1 no hydrogen 2.954 N/A SER 447.A OG ASP 445.A OD1 no hydrogen 2.688 N/A SER 447.A OG ASP 445.A OD2 no hydrogen 3.009 N/A GLN 448.A N ASP 445.A O no hydrogen 2.904 N/A LEU 452.A N GLN 448.A O no hydrogen 2.808 N/A GLY 453.A N LYS 449.A O no hydrogen 2.936 N/A ASN 454.A N ASP 450.A O no hydrogen 3.020 N/A ASN 454.A ND2 ASP 393.A OD2 no hydrogen 2.684 N/A VAL 455.A N MET 451.A O no hydrogen 2.923 N/A MET 456.A N LEU 452.A O no hydrogen 2.993 N/A ALA 457.A N GLY 453.A O no hydrogen 2.820 N/A HIS 458.A N ASN 454.A O no hydrogen 2.882 N/A HIS 458.A ND1 ASN 454.A O no hydrogen 3.008 N/A HIS 458.A NE2 GLU 397.A OE1 no hydrogen 2.625 N/A LEU 459.A N VAL 455.A O no hydrogen 2.977 N/A VAL 460.A N MET 456.A O no hydrogen 3.045 N/A GLU 461.A N ALA 457.A O no hydrogen 2.980 N/A ASN 462.A N HIS 458.A O no hydrogen 2.929 N/A ASN 462.A ND2 THR 430.A OG1 no hydrogen 2.934 N/A ILE 463.A N LEU 459.A O no hydrogen 2.967 N/A ARG 464.A N VAL 460.A O no hydrogen 2.811 N/A ARG 464.A NE GLU 461.A OE1 no hydrogen 2.771 N/A ARG 464.A NH1 PHE 492.A O no hydrogen 2.881 N/A ARG 464.A NH1 SER 497.A OG no hydrogen 2.752 N/A ARG 464.A NH2 GLU 461.A OE1 no hydrogen 3.540 N/A ARG 464.A NH2 GLU 461.A OE2 no hydrogen 2.854 N/A ARG 464.A NH2 SER 497.A O no hydrogen 2.936 N/A TYR 465.A N GLU 461.A O no hydrogen 2.941 N/A TYR 465.A OH LEU 498.A O no hydrogen 3.088 N/A ALA 466.A N ASN 462.A O no hydrogen 3.079 N/A ALA 467.A N ILE 463.A O no hydrogen 2.852 N/A VAL 468.A N ARG 464.A O no hydrogen 3.006 N/A LEU 469.A N TYR 465.A O no hydrogen 3.016 N/A LEU 470.A N ALA 466.A O no hydrogen 2.951 N/A LEU 470.A N ALA 467.A O no hydrogen 3.214 N/A ARG 471.A N VAL 468.A O no hydrogen 3.100 N/A ARG 471.A NH1 MET 493.A O no hydrogen 2.845 N/A ARG 471.A NH1 GLU 494.A OE1 no hydrogen 3.337 N/A ARG 471.A NH1 GLU 494.A OE2 no hydrogen 3.475 N/A PHE 473.A N LEU 470.A O no hydrogen 2.869 N/A LEU 474.A N LEU 470.A O no hydrogen 2.814 N/A THR 475.A OG1 GLU 86.A OE1 no hydrogen 2.685 N/A HIS 476.A N ASP 328.A OD1 no hydrogen 3.082 N/A HIS 476.A NE2 GLU 86.A OE2 no hydrogen 2.688 N/A ALA 477.A N ASP 328.A OD2 no hydrogen 2.712 N/A LYS 479.A NZ GLU 483.A OE1 no hydrogen 2.674 N/A GLU 480.A N HIS 476.A O no hydrogen 3.143 N/A ILE 481.A N ALA 477.A O no hydrogen 2.841 N/A PHE 482.A N PRO 478.A O no hydrogen 2.953 N/A GLU 483.A N LYS 479.A O no hydrogen 2.964 N/A GLN 484.A N GLU 480.A O no hydrogen 3.001 N/A GLN 484.A NE2 GLU 480.A OE2 no hydrogen 2.938 N/A GLN 484.A NE2 LYS 515.A O no hydrogen 2.797 N/A LEU 485.A N ILE 481.A O no hydrogen 2.985 N/A ASN 486.A N GLU 483.A O no hydrogen 3.075 N/A ASN 486.A ND2 MET 509.A O no hydrogen 3.005 N/A ILE 487.A N PHE 482.A O no hydrogen 2.873 N/A ASN 488.A ND2 ASN 486.A OD1 no hydrogen 2.947 N/A GLN 491.A N ASN 489.A OD1 no hydrogen 2.929 N/A GLN 491.A NE2 SER 496.A OG no hydrogen 3.116 N/A PHE 492.A N ASN 489.A O no hydrogen 2.899 N/A MET 493.A N PRO 490.A O no hydrogen 3.005 N/A GLU 494.A N GLN 491.A O no hydrogen 3.282 N/A SER 497.A N GLU 494.A O no hydrogen 3.065 N/A SER 497.A OG GLU 494.A O no hydrogen 2.682 N/A LEU 498.A N PHE 495.A O no hydrogen 2.996 N/A GLU 499.A N SER 496.A O no hydrogen 3.245 N/A TYR 501.A OH ASN 462.A OD1 no hydrogen 2.679 N/A GLY 502.A N GLU 461.A OE2 no hydrogen 2.857 N/A VAL 503.A N GLU 461.A OE2 no hydrogen 3.122 N/A SER 507.A OG GLU 381.A OE2 no hydrogen 2.834 N/A SER 507.A OG LEU 382.A O no hydrogen 3.436 N/A ILE 508.A N LEU 382.A O no hydrogen 3.143 N/A VAL 510.A N GLY 380.A O no hydrogen 2.953 N/A THR 511.A N GLN 484.A O no hydrogen 2.875 N/A GLN 513.A N THR 511.A OG1 no hydrogen 3.173 N/A LYS 515.A N GLN 484.A OE1 no hydrogen 3.240 N/A LYS 515.A NZ GLU 480.A OE2 no hydrogen 3.229 N/A