Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3v5w_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LYS 1.A NZ ASN 160.A OD1 no hydrogen 3.006 N/A ILE 10.A N GLU 7.A O no hydrogen 2.967 N/A ARG 11.A N PRO 8.A O no hydrogen 2.938 N/A ARG 11.A NE GLN 15.A OE1 no hydrogen 3.050 N/A ARG 11.A NH1 ILE 137.A O no hydrogen 3.203 N/A ARG 11.A NH1 SER 139.A O no hydrogen 3.041 N/A ARG 11.A NH1 THR 143.A OG1 no hydrogen 2.821 N/A ARG 11.A NH2 GLN 15.A OE1 no hydrogen 3.286 N/A ARG 11.A NH2 ILE 137.A O no hydrogen 2.510 N/A SER 12.A N SER 9.A O no hydrogen 2.999 N/A SER 12.A OG HIS 524.A O no hydrogen 3.424 N/A MET 14.A N ILE 10.A O no hydrogen 2.923 N/A GLN 15.A N ARG 11.A O no hydrogen 2.839 N/A TYR 17.A N VAL 13.A O no hydrogen 2.985 N/A LEU 18.A N MET 14.A O no hydrogen 2.878 N/A GLU 19.A N GLN 15.A O no hydrogen 3.005 N/A ASP 20.A N LYS 16.A O no hydrogen 3.019 N/A ARG 21.A N LEU 18.A O no hydrogen 3.184 N/A ARG 21.A NH1 TYR 17.A O no hydrogen 3.136 N/A GLY 22.A N GLU 19.A O no hydrogen 3.171 N/A GLU 23.A N LEU 18.A O no hydrogen 2.911 N/A THR 25.A OG1 GLU 27.A OE1 no hydrogen 3.092 N/A LYS 28.A N THR 25.A OG1 no hydrogen 3.182 N/A ILE 29.A N THR 25.A O no hydrogen 3.120 N/A PHE 30.A N PHE 26.A O no hydrogen 2.770 N/A SER 31.A N GLU 27.A O no hydrogen 3.277 N/A SER 31.A OG GLU 27.A O no hydrogen 2.735 N/A SER 31.A OG LYS 28.A O no hydrogen 3.553 N/A GLN 32.A N ILE 29.A O no hydrogen 3.125 N/A GLN 32.A NE2 LYS 28.A O no hydrogen 2.877 N/A LYS 33.A NZ GLN 481.A OE1 no hydrogen 2.628 N/A LEU 34.A N GLN 480.A OE1 no hydrogen 3.099 N/A TYR 36.A N GLN 32.A O no hydrogen 2.892 N/A TYR 36.A OH GLU 58.A OE1 no hydrogen 2.749 N/A LEU 37.A N LYS 33.A O no hydrogen 2.975 N/A LEU 38.A N LEU 34.A O no hydrogen 2.988 N/A PHE 39.A N GLY 35.A O no hydrogen 2.817 N/A ARG 40.A N TYR 36.A O no hydrogen 2.824 N/A ARG 40.A NH2 GLU 58.A OE2 no hydrogen 2.937 N/A ASP 41.A N LEU 37.A O no hydrogen 3.335 N/A PHE 42.A N LEU 38.A O no hydrogen 3.041 N/A CYS 43.A N PHE 39.A O no hydrogen 2.973 N/A CYS 43.A SG PHE 39.A O no hydrogen 3.634 N/A LEU 44.A N ARG 40.A O no hydrogen 2.729 N/A ASN 45.A N ASP 41.A O no hydrogen 2.965 N/A HIS 46.A N PHE 42.A O no hydrogen 2.917 N/A ALA 50.A N LEU 47.A O no hydrogen 3.265 N/A ARG 51.A N LEU 47.A O no hydrogen 3.112 N/A ARG 51.A N GLU 48.A O no hydrogen 3.023 N/A VAL 54.A N ALA 50.A O no hydrogen 3.258 N/A GLU 55.A N ARG 51.A O no hydrogen 2.981 N/A PHE 56.A N PRO 52.A O no hydrogen 3.072 N/A TYR 57.A N LEU 53.A O no hydrogen 2.999 N/A GLU 58.A N VAL 54.A O no hydrogen 3.116 N/A GLU 59.A N GLU 55.A O no hydrogen 3.044 N/A ILE 60.A N PHE 56.A O no hydrogen 2.908 N/A LYS 61.A N TYR 57.A O no hydrogen 2.937 N/A LYS 61.A NZ GLU 64.A OE1 no hydrogen 3.137 N/A LYS 62.A N GLU 58.A O no hydrogen 2.973 N/A LYS 62.A NZ GLU 59.A OE2 no hydrogen 2.826 N/A TYR 63.A N GLU 59.A O no hydrogen 2.962 N/A TYR 63.A OH PRO 113.A O no hydrogen 2.572 N/A GLU 64.A N ILE 60.A O no hydrogen 2.945 N/A LYS 65.A N LYS 62.A O no hydrogen 3.197 N/A LYS 65.A NZ LYS 61.A O no hydrogen 2.890 N/A LEU 66.A N TYR 63.A O no hydrogen 3.118 N/A THR 68.A N GLU 71.A OE1 no hydrogen 2.642 N/A THR 68.A OG1 GLU 71.A OE1 no hydrogen 2.692 N/A GLU 71.A N THR 68.A OG1 no hydrogen 3.100 N/A ARG 72.A N THR 68.A O no hydrogen 3.203 N/A ARG 72.A NE VAL 112.A O no hydrogen 2.657 N/A ARG 72.A NH1 LEU 66.A O no hydrogen 3.269 N/A VAL 73.A N GLU 69.A O no hydrogen 2.783 N/A ALA 74.A N GLU 70.A O no hydrogen 2.909 N/A ARG 75.A N GLU 71.A O no hydrogen 2.830 N/A SER 76.A N ARG 72.A O no hydrogen 2.993 N/A SER 76.A OG ARG 72.A O no hydrogen 2.783 N/A SER 76.A OG VAL 73.A O no hydrogen 3.237 N/A GLU 78.A N ALA 74.A O no hydrogen 3.280 N/A ILE 79.A N ARG 75.A O no hydrogen 2.841 N/A PHE 80.A N SER 76.A O no hydrogen 2.897 N/A ASP 81.A N ARG 77.A O no hydrogen 2.872 N/A SER 82.A N ILE 79.A O no hydrogen 3.254 N/A SER 82.A OG ILE 79.A O no hydrogen 2.571 N/A MET 85.A N SER 82.A OG no hydrogen 3.225 N/A LYS 86.A N SER 82.A O no hydrogen 3.320 N/A LYS 86.A NZ PHE 80.A O no hydrogen 2.698 N/A GLU 87.A N TYR 83.A O no hydrogen 2.742 N/A LEU 88.A N ILE 84.A O no hydrogen 2.751 N/A LEU 89.A N MET 85.A O no hydrogen 2.697 N/A ALA 90.A N LYS 86.A O no hydrogen 2.761 N/A CYS 91.A SG LEU 88.A O no hydrogen 3.523 N/A SER 96.A N GLU 123.A OE1 no hydrogen 3.087 N/A SER 96.A OG GLU 123.A OE2 no hydrogen 2.701 N/A ALA 99.A N SER 96.A OG no hydrogen 2.996 N/A THR 100.A N SER 96.A O no hydrogen 3.104 N/A THR 100.A OG1 SER 96.A O no hydrogen 3.061 N/A THR 100.A OG1 TYR 120.A OH no hydrogen 3.419 N/A GLU 101.A N LYS 97.A O no hydrogen 2.839 N/A HIS 102.A N SER 98.A O no hydrogen 2.796 N/A VAL 103.A N ALA 99.A O no hydrogen 3.055 N/A GLN 104.A N THR 100.A O no hydrogen 2.915 N/A GLY 105.A N GLU 101.A O no hydrogen 2.795 N/A HIS 106.A N HIS 102.A O no hydrogen 3.073 N/A LEU 107.A N VAL 103.A O no hydrogen 2.763 N/A GLY 108.A N GLN 104.A O no hydrogen 2.963 N/A LYS 109.A N GLY 105.A O no hydrogen 3.393 N/A LYS 110.A N LEU 107.A O no hydrogen 2.992 N/A GLN 111.A N HIS 106.A O no hydrogen 3.098 N/A GLN 111.A NE2 HIS 106.A ND1 no hydrogen 2.993 N/A LEU 116.A N PRO 113.A O no hydrogen 3.029 N/A GLN 118.A N ASP 115.A O no hydrogen 3.289 N/A TYR 120.A OH THR 100.A OG1 no hydrogen 3.419 N/A ILE 121.A N PHE 117.A O no hydrogen 2.974 N/A GLU 122.A N GLN 118.A O no hydrogen 3.143 N/A GLU 123.A N PRO 119.A O no hydrogen 3.227 N/A ILE 124.A N TYR 120.A O no hydrogen 2.913 N/A CYS 125.A N ILE 121.A O no hydrogen 3.000 N/A CYS 125.A SG ILE 121.A O no hydrogen 3.467 N/A GLN 126.A N GLU 122.A O no hydrogen 3.106 N/A ASN 127.A N GLU 123.A O no hydrogen 3.272 N/A ASN 127.A N ILE 124.A O no hydrogen 3.112 N/A LEU 128.A N ILE 124.A O no hydrogen 2.986 N/A LEU 128.A N CYS 125.A O no hydrogen 3.243 N/A ARG 129.A N CYS 125.A O no hydrogen 3.068 N/A ARG 129.A NH1 GLU 27.A OE2 no hydrogen 2.471 N/A GLN 134.A N GLY 130.A O no hydrogen 3.029 N/A LYS 135.A N ASP 131.A O no hydrogen 2.981 N/A PHE 136.A N VAL 132.A O no hydrogen 3.125 N/A ILE 137.A N PHE 133.A O no hydrogen 2.890 N/A GLU 138.A N GLN 134.A O no hydrogen 3.115 N/A SER 139.A N PHE 136.A O no hydrogen 2.943 N/A SER 139.A OG PHE 136.A O no hydrogen 2.401 N/A LYS 141.A NZ ASP 41.A OD2 no hydrogen 3.290 N/A ARG 144.A N ASP 140.A O no hydrogen 3.097 N/A ARG 144.A NE GLN 147.A OE1 no hydrogen 2.918 N/A ARG 144.A NH1 ASN 492.A O no hydrogen 3.064 N/A ARG 144.A NH1 ASN 492.A OD1 no hydrogen 3.100 N/A ARG 144.A NH1 ASP 496.A OD1 no hydrogen 3.280 N/A ARG 144.A NH2 ASP 496.A OD1 no hydrogen 2.944 N/A ARG 144.A NH2 GLU 499.A OE1 no hydrogen 3.181 N/A PHE 145.A N LYS 141.A O no hydrogen 3.081 N/A CYS 146.A N PHE 142.A O no hydrogen 2.840 N/A CYS 146.A SG PHE 142.A O no hydrogen 3.527 N/A GLN 147.A N THR 143.A O no hydrogen 3.071 N/A GLN 147.A NE2 PRO 6.A O no hydrogen 2.466 N/A GLN 147.A NE2 GLU 499.A OE2 no hydrogen 3.030 N/A TRP 148.A N ARG 144.A O no hydrogen 3.042 N/A TRP 148.A NE1 ASN 492.A OD1 no hydrogen 2.751 N/A LYS 149.A N PHE 145.A O no hydrogen 2.768 N/A LYS 149.A NZ GLN 32.A OE1 no hydrogen 2.670 N/A LYS 149.A NZ GLU 152.A OE1 no hydrogen 2.768 N/A ASN 150.A N CYS 146.A O no hydrogen 2.922 N/A ASN 150.A ND2 SER 591.A OG no hydrogen 3.240 N/A VAL 151.A N GLN 147.A O no hydrogen 3.413 N/A GLU 152.A N TRP 148.A O no hydrogen 2.919 N/A LEU 153.A N LYS 149.A O no hydrogen 2.971 N/A ASN 154.A N VAL 151.A O no hydrogen 3.096 N/A ASN 154.A ND2 ASP 590.A O no hydrogen 3.348 N/A ILE 155.A N GLU 152.A O no hydrogen 3.385 N/A THR 158.A N ASP 161.A OD2 no hydrogen 2.791 N/A THR 158.A OG1 ASP 161.A OD2 no hydrogen 3.343 N/A ASP 161.A N THR 158.A O no hydrogen 3.089 N/A PHE 162.A N MET 159.A O no hydrogen 2.951 N/A SER 163.A N ARG 180.A O no hydrogen 2.890 N/A SER 163.A OG HIS 165.A NE2 no hydrogen 2.798 N/A HIS 165.A N GLY 178.A O no hydrogen 2.589 N/A ILE 168.A N VAL 176.A O no hydrogen 2.684 N/A ARG 170.A N ALA 451.A O no hydrogen 2.912 N/A GLY 171.A N GLY 174.A O no hydrogen 2.968 N/A GLU 175.A N CYS 192.A O no hydrogen 3.317 N/A VAL 176.A N GLY 169.A O no hydrogen 3.161 N/A TYR 177.A N MET 190.A O no hydrogen 2.869 N/A GLY 178.A N ARG 166.A O no hydrogen 2.878 N/A CYS 179.A N TYR 188.A O no hydrogen 2.969 N/A CYS 179.A SG TYR 188.A O no hydrogen 3.551 N/A ARG 180.A N SER 163.A O no hydrogen 3.014 N/A ARG 180.A NE GLY 185.A O no hydrogen 2.629 N/A ARG 180.A NH2 GLY 185.A O no hydrogen 3.518 N/A LYS 181.A N LYS 186.A O no hydrogen 2.872 N/A LYS 181.A NZ ASP 183.A OD2 no hydrogen 2.695 N/A LYS 181.A NZ GLU 482.A OE2 no hydrogen 3.111 N/A ALA 182.A N ASP 161.A O no hydrogen 2.933 N/A THR 184.A OG1 GLU 482.A OE2 no hydrogen 2.520 N/A GLY 185.A N LYS 181.A O no hydrogen 2.682 N/A LYS 186.A N THR 184.A OG1 no hydrogen 3.408 N/A LYS 186.A NZ GLU 485.A OE1 no hydrogen 3.058 N/A TYR 188.A N CYS 179.A O no hydrogen 2.739 N/A TYR 188.A OH SER 229.A OG no hydrogen 3.346 N/A TYR 188.A OH GLU 482.A OE1 no hydrogen 2.525 N/A ALA 189.A N LEU 242.A O no hydrogen 2.788 N/A MET 190.A N TYR 177.A O no hydrogen 2.848 N/A LYS 191.A N PHE 240.A O no hydrogen 2.938 N/A LYS 191.A NZ GLU 210.A OE1 no hydrogen 2.929 N/A LYS 191.A NZ ASP 306.A OD2 no hydrogen 2.994 N/A CYS 192.A N GLU 175.A O no hydrogen 2.851 N/A LEU 193.A N LEU 238.A O no hydrogen 2.678 N/A ASP 194.A N PHE 173.A O no hydrogen 2.873 N/A LYS 195.A N ASP 236.A O no hydrogen 2.747 N/A LYS 195.A NZ THR 234.A O no hydrogen 2.869 N/A ARG 197.A N ASP 194.A OD1 no hydrogen 3.362 N/A ILE 198.A N ASP 194.A O no hydrogen 3.008 N/A LYS 199.A N LYS 195.A O no hydrogen 3.159 N/A LYS 199.A NZ ASP 464.A OD1 no hydrogen 2.582 N/A LYS 199.A NZ ASP 464.A OD2 no hydrogen 3.090 N/A MET 200.A N LYS 196.A O no hydrogen 3.186 N/A LYS 201.A N ARG 197.A O no hydrogen 3.022 N/A GLN 202.A N LYS 199.A O no hydrogen 3.306 N/A GLY 203.A N ILE 198.A O no hydrogen 2.763 N/A GLU 204.A N GLU 204.A OE2 no hydrogen 2.956 N/A ALA 207.A N GLY 203.A O no hydrogen 3.049 N/A LEU 208.A N GLU 204.A O no hydrogen 2.700 N/A ASN 209.A N THR 205.A O no hydrogen 3.014 N/A ASN 209.A ND2 GLY 308.A O no hydrogen 2.860 N/A ASN 209.A ND2 ALA 310.A O no hydrogen 2.813 N/A GLU 210.A N LEU 206.A O no hydrogen 3.096 N/A ARG 211.A NE PHE 471.A O no hydrogen 2.895 N/A ARG 211.A NH2 ASN 470.A O no hydrogen 2.476 N/A ILE 212.A N LEU 208.A O no hydrogen 3.237 N/A MET 213.A N ASN 209.A O no hydrogen 2.968 N/A LEU 214.A N GLU 210.A O no hydrogen 2.931 N/A SER 215.A N ARG 211.A O no hydrogen 3.039 N/A SER 215.A OG ARG 211.A O no hydrogen 3.518 N/A SER 215.A OG ILE 212.A O no hydrogen 2.748 N/A LEU 216.A N ILE 212.A O no hydrogen 3.107 N/A VAL 217.A N LEU 214.A O no hydrogen 3.262 N/A SER 218.A N LEU 214.A O no hydrogen 2.751 N/A SER 218.A OG LEU 214.A O no hydrogen 2.457 N/A SER 218.A OG MET 228.A O no hydrogen 3.544 N/A GLY 220.A N GLU 477.A OE1 no hydrogen 2.977 N/A VAL 226.A N ILE 304.A O no hydrogen 2.820 N/A CYS 227.A N ASP 243.A OD2 no hydrogen 2.717 N/A CYS 227.A SG VAL 217.A O no hydrogen 4.046 N/A CYS 227.A SG ILE 225.A O no hydrogen 3.658 N/A MET 228.A N SER 218.A OG no hydrogen 2.757 N/A SER 229.A N ILE 241.A O no hydrogen 2.882 N/A SER 229.A OG TYR 188.A OH no hydrogen 3.346 N/A TYR 230.A OH GLU 482.A OE1 no hydrogen 2.483 N/A ALA 231.A N LEU 473.A O no hydrogen 3.021 N/A PHE 232.A N SER 239.A O no hydrogen 2.893 N/A HIS 233.A NE2 TYR 468.A O no hydrogen 2.859 N/A THR 234.A N LYS 237.A O no hydrogen 2.961 N/A LYS 237.A NZ ASP 194.A OD2 no hydrogen 2.583 N/A LEU 238.A N LEU 193.A O no hydrogen 2.756 N/A SER 239.A N PHE 232.A O no hydrogen 2.821 N/A PHE 240.A N LYS 191.A O no hydrogen 3.138 N/A ILE 241.A N TYR 230.A O no hydrogen 2.866 N/A LEU 242.A N ALA 189.A O no hydrogen 2.744 N/A ASP 243.A N CYS 227.A O no hydrogen 3.184 N/A GLY 247.A N LEU 296.A O no hydrogen 3.028 N/A ASP 249.A N ALA 450.A O no hydrogen 3.089 N/A LEU 250.A N ILE 294.A O no hydrogen 3.051 N/A TYR 252.A N ASP 249.A OD2 no hydrogen 3.068 N/A HIS 253.A N ASP 249.A O no hydrogen 3.268 N/A HIS 253.A NE2 GLY 247.A O no hydrogen 2.587 N/A LEU 254.A N LEU 250.A O no hydrogen 2.964 N/A SER 255.A N HIS 251.A O no hydrogen 3.082 N/A SER 255.A OG TYR 252.A O no hydrogen 2.844 N/A GLN 256.A N TYR 252.A O no hydrogen 2.873 N/A HIS 257.A N HIS 253.A O no hydrogen 2.791 N/A HIS 257.A ND1 GLY 258.A O no hydrogen 2.978 N/A GLY 258.A N LEU 254.A O no hydrogen 2.641 N/A PHE 260.A N LEU 355.A O no hydrogen 3.009 N/A MET 265.A N SER 261.A O no hydrogen 2.935 N/A ARG 266.A N GLU 262.A O no hydrogen 2.870 N/A ARG 266.A NH1 PHE 423.A O no hydrogen 3.064 N/A TYR 268.A N ASP 264.A O no hydrogen 3.516 N/A ALA 269.A N MET 265.A O no hydrogen 2.827 N/A ALA 270.A N ARG 266.A O no hydrogen 3.166 N/A GLU 271.A N PHE 267.A O no hydrogen 3.343 N/A ILE 272.A N TYR 268.A O no hydrogen 2.942 N/A ILE 273.A N ALA 269.A O no hydrogen 2.800 N/A LEU 274.A N ALA 270.A O no hydrogen 3.203 N/A GLY 275.A N GLU 271.A O no hydrogen 3.213 N/A LEU 276.A N ILE 272.A O no hydrogen 2.947 N/A GLU 277.A N ILE 273.A O no hydrogen 3.025 N/A HIS 278.A N LEU 274.A O no hydrogen 3.368 N/A HIS 278.A NE2 VAL 217.A O no hydrogen 2.847 N/A MET 279.A N GLY 275.A O no hydrogen 3.391 N/A HIS 280.A N LEU 276.A O no hydrogen 2.854 N/A HIS 280.A NE2 ASP 344.A OD1 no hydrogen 2.702 N/A ASN 281.A N GLU 277.A O no hydrogen 3.060 N/A ARG 282.A N MET 279.A O no hydrogen 2.888 N/A ARG 282.A NH2 THR 219.A OG1 no hydrogen 2.980 N/A PHE 283.A N HIS 280.A O no hydrogen 3.035 N/A VAL 284.A N MET 279.A O no hydrogen 2.909 N/A VAL 285.A N CYS 311.A O no hydrogen 2.980 N/A TYR 286.A N ASP 344.A OD1 no hydrogen 2.862 N/A TYR 286.A OH SER 305.A O no hydrogen 2.279 N/A TYR 286.A OH ASP 306.A O no hydrogen 3.302 N/A ARG 287.A N ASP 344.A OD2 no hydrogen 2.799 N/A ARG 287.A NE LEU 309.A O no hydrogen 2.736 N/A ARG 287.A NH1 TYR 339.A OH no hydrogen 2.858 N/A ARG 287.A NH2 LEU 309.A O no hydrogen 2.997 N/A ASN 293.A N LYS 290.A O no hydrogen 2.950 N/A ASN 293.A ND2 ASP 288.A O no hydrogen 2.635 N/A ASN 293.A ND2 ASP 288.A OD2 no hydrogen 3.012 N/A ILE 294.A N PRO 291.A O no hydrogen 3.345 N/A LEU 295.A N ARG 303.A O no hydrogen 2.849 N/A LEU 296.A N GLY 248.A O no hydrogen 2.984 N/A ASP 297.A N HIS 301.A O no hydrogen 2.796 N/A HIS 299.A N ASP 297.A OD1 no hydrogen 3.152 N/A GLY 300.A N ASP 297.A O no hydrogen 3.153 N/A HIS 301.A N ASP 297.A OD1 no hydrogen 2.729 N/A HIS 301.A ND1 GLU 271.A OE2 no hydrogen 2.688 N/A VAL 302.A N GLU 271.A OE1 no hydrogen 2.924 N/A ARG 303.A N LEU 295.A O no hydrogen 3.052 N/A ARG 303.A NE ILE 225.A O no hydrogen 2.978 N/A ILE 304.A N PHE 224.A O no hydrogen 2.918 N/A SER 305.A N ASN 293.A O no hydrogen 2.870 N/A SER 305.A OG ASP 306.A OD2 no hydrogen 2.816 N/A ALA 310.A N LEU 307.A O no hydrogen 2.867 N/A CYS 311.A N VAL 285.A O no hydrogen 2.916 N/A CYS 311.A SG ASP 312.A O no hydrogen 3.580 N/A PHE 313.A N PHE 283.A O no hydrogen 2.927 N/A SER 314.A N ASP 312.A OD1 no hydrogen 3.012 N/A SER 314.A OG ASP 312.A OD1 no hydrogen 2.493 N/A SER 314.A OG ASP 312.A OD2 no hydrogen 3.423 N/A LYS 317.A NZ ASP 340.A OD2 no hydrogen 3.433 N/A THR 324.A OG1 ASP 288.A OD1 no hydrogen 2.807 N/A HIS 325.A ND1 ASP 374.A OD1 no hydrogen 2.740 N/A TYR 327.A N THR 324.A O no hydrogen 3.029 N/A GLU 331.A N GLU 331.A OE1 no hydrogen 2.688 N/A VAL 332.A N ALA 329.A O no hydrogen 3.059 N/A LEU 333.A N ALA 329.A O no hydrogen 3.077 N/A GLN 334.A N PRO 330.A O no hydrogen 3.193 N/A VAL 337.A N GLN 334.A O no hydrogen 3.156 N/A TYR 339.A N PRO 318.A O no hydrogen 2.823 N/A TYR 339.A OH ALA 320.A O no hydrogen 2.669 N/A SER 342.A N ASP 340.A OD1 no hydrogen 3.261 N/A SER 342.A OG GLU 331.A OE2 no hydrogen 3.002 N/A SER 342.A OG ASP 340.A OD1 no hydrogen 3.459 N/A ALA 343.A N ASP 340.A O no hydrogen 3.258 N/A ASP 344.A N SER 341.A O no hydrogen 2.958 N/A SER 347.A N ALA 343.A O no hydrogen 3.346 N/A SER 347.A OG TYR 327.A O no hydrogen 2.446 N/A SER 347.A OG ALA 343.A O no hydrogen 3.065 N/A LEU 348.A N ASP 344.A O no hydrogen 2.962 N/A CYS 350.A N PHE 346.A O no hydrogen 3.183 N/A CYS 350.A SG GLY 326.A O no hydrogen 3.550 N/A CYS 350.A SG PHE 346.A O no hydrogen 3.443 N/A MET 351.A N SER 347.A O no hydrogen 2.972 N/A LEU 352.A N LEU 348.A O no hydrogen 2.655 N/A PHE 353.A N GLY 349.A O no hydrogen 2.930 N/A LYS 354.A N CYS 350.A O no hydrogen 3.009 N/A LYS 354.A NZ TYR 327.A OH no hydrogen 3.399 N/A LEU 355.A N MET 351.A O no hydrogen 3.048 N/A LEU 356.A N PHE 353.A O no hydrogen 2.971 N/A ARG 357.A N PHE 353.A O no hydrogen 2.864 N/A GLY 358.A N LYS 354.A O no hydrogen 2.709 N/A HIS 359.A ND1 SER 360.A O no hydrogen 3.004 N/A ARG 363.A N SER 360.A O no hydrogen 3.150 N/A GLN 364.A NE2 HIS 365.A NE2 no hydrogen 3.186 N/A THR 367.A N GLN 364.A O no hydrogen 3.082 N/A GLU 372.A N ASP 369.A O no hydrogen 3.167 N/A ASP 374.A N LYS 370.A O no hydrogen 3.176 N/A ARG 375.A N HIS 371.A O no hydrogen 3.250 N/A MET 376.A N GLU 372.A O no hydrogen 3.178 N/A THR 377.A N ILE 373.A O no hydrogen 3.362 N/A THR 377.A OG1 ILE 373.A O no hydrogen 2.774 N/A LEU 378.A N ASP 374.A O no hydrogen 3.228 N/A THR 379.A N ARG 375.A O no hydrogen 2.666 N/A THR 379.A OG1 ARG 375.A O no hydrogen 2.378 N/A MET 380.A N MET 376.A O no hydrogen 3.194 N/A SER 389.A N GLU 262.A OE1 no hydrogen 3.137 N/A SER 389.A OG GLU 262.A OE1 no hydrogen 3.406 N/A SER 389.A OG GLU 262.A OE2 no hydrogen 2.567 N/A GLU 391.A N GLU 391.A OE1 no hydrogen 2.872 N/A LEU 392.A N SER 389.A OG no hydrogen 3.377 N/A ARG 393.A N SER 389.A O no hydrogen 3.039 N/A ARG 393.A NH2 PHE 388.A O no hydrogen 3.006 N/A SER 394.A N PRO 390.A O no hydrogen 3.007 N/A SER 394.A OG PRO 390.A O no hydrogen 3.532 N/A SER 394.A OG GLU 391.A O no hydrogen 2.837 N/A LEU 395.A N GLU 391.A O no hydrogen 2.933 N/A LEU 396.A N LEU 392.A O no hydrogen 3.083 N/A GLU 397.A N ARG 393.A O no hydrogen 2.782 N/A GLY 398.A N SER 394.A O no hydrogen 2.959 N/A LEU 399.A N LEU 395.A O no hydrogen 2.770 N/A LEU 400.A N LEU 396.A O no hydrogen 2.844 N/A GLN 401.A NE2 GLU 397.A O no hydrogen 2.766 N/A ASN 405.A ND2 ASP 403.A OD2 no hydrogen 2.736 N/A ARG 406.A N ASP 403.A O no hydrogen 3.193 N/A ARG 406.A NH1 GLN 401.A OE1 no hydrogen 2.736 N/A ARG 406.A NH2 GLN 401.A OE1 no hydrogen 2.732 N/A ARG 407.A N VAL 404.A O no hydrogen 3.395 N/A ARG 407.A NE GLN 401.A O no hydrogen 2.780 N/A ARG 407.A NH1 GLU 331.A OE2 no hydrogen 3.073 N/A ARG 407.A NH2 GLU 331.A OE1 no hydrogen 3.003 N/A ARG 407.A NH2 GLN 401.A O no hydrogen 3.141 N/A ARG 407.A NH2 ARG 402.A O no hydrogen 3.391 N/A LEU 408.A N GLY 398.A O no hydrogen 3.022 N/A GLY 409.A N GLU 417.A OE1 no hydrogen 3.167 N/A CYS 410.A N ARG 407.A O no hydrogen 2.997 N/A LEU 411.A N GLU 417.A OE1 no hydrogen 3.227 N/A ARG 413.A N GLU 417.A OE2 no hydrogen 2.784 N/A ARG 413.A NH2 GLU 420.A OE1 no hydrogen 3.233 N/A GLN 416.A NE2 GLU 420.A OE1 no hydrogen 2.630 N/A GLU 417.A N GLY 414.A O no hydrogen 2.912 N/A LYS 419.A N ALA 415.A O no hydrogen 2.742 N/A LYS 419.A NZ GLU 277.A OE2 no hydrogen 2.728 N/A GLU 420.A N GLU 417.A O no hydrogen 3.054 N/A PHE 424.A N SER 421.A O no hydrogen 3.046 N/A ARG 425.A N PRO 422.A O no hydrogen 3.125 N/A LEU 427.A N PHE 424.A O no hydrogen 3.051 N/A ASP 428.A N TYR 437.A OH no hydrogen 2.985 N/A GLN 430.A N ASP 428.A OD2 no hydrogen 2.882 N/A GLN 430.A NE2 GLU 67.A O no hydrogen 3.170 N/A VAL 432.A N ASP 428.A O no hydrogen 3.116 N/A PHE 433.A N TRP 429.A O no hydrogen 3.043 N/A LEU 434.A N GLN 430.A O no hydrogen 2.978 N/A GLN 435.A N VAL 432.A O no hydrogen 2.961 N/A LYS 436.A N MET 431.A O no hydrogen 2.897 N/A ASN 449.A ND2 ASP 452.A OD2 no hydrogen 2.939 N/A ALA 453.A N ARG 170.A O no hydrogen 2.867 N/A LYS 459.A NZ GLY 457.A O no hydrogen 3.016 N/A LEU 461.A N ASP 464.A OD1 no hydrogen 2.837 N/A GLN 465.A N LEU 461.A O no hydrogen 3.390 N/A GLN 465.A NE2 PRO 235.A O no hydrogen 2.861 N/A GLU 466.A N ASP 462.A O no hydrogen 3.157 N/A LEU 467.A N ASP 464.A O no hydrogen 3.173 N/A TYR 468.A N GLN 465.A O no hydrogen 3.047 N/A PHE 471.A N TYR 468.A O no hydrogen 3.254 N/A LEU 473.A N ALA 231.A O no hydrogen 2.764 N/A ILE 475.A N SER 229.A O no hydrogen 2.794 N/A SER 476.A OG GLU 152.A OE2 no hydrogen 2.624 N/A ARG 478.A NE SER 218.A O no hydrogen 3.048 N/A ARG 478.A NH2 SER 218.A O no hydrogen 3.439 N/A TRP 479.A N ILE 475.A O no hydrogen 3.053 N/A GLN 480.A N SER 476.A O no hydrogen 2.977 N/A GLN 480.A NE2 GLN 32.A OE1 no hydrogen 2.832 N/A GLN 480.A NE2 GLU 152.A OE1 no hydrogen 3.080 N/A GLN 481.A N GLU 477.A O no hydrogen 3.046 N/A GLN 481.A NE2 GLU 485.A OE2 no hydrogen 2.709 N/A GLU 482.A N ARG 478.A O no hydrogen 2.992 N/A VAL 483.A N TRP 479.A O no hydrogen 2.999 N/A ALA 484.A N GLN 480.A O no hydrogen 2.956 N/A GLU 485.A N GLN 481.A O no hydrogen 3.064 N/A THR 486.A N VAL 483.A O no hydrogen 3.178 N/A THR 486.A OG1 GLU 482.A O no hydrogen 2.499 N/A THR 486.A OG1 VAL 483.A O no hydrogen 3.265 N/A VAL 487.A N VAL 483.A O no hydrogen 3.053 N/A PHE 488.A N VAL 483.A O no hydrogen 2.942 N/A THR 490.A OG1 VAL 487.A O no hydrogen 3.215 N/A ILE 491.A N VAL 487.A O no hydrogen 2.877 N/A ASN 492.A N PHE 488.A O no hydrogen 2.940 N/A ALA 493.A N ASP 489.A O no hydrogen 3.090 N/A GLU 494.A N THR 490.A O no hydrogen 2.861 N/A THR 495.A N ILE 491.A O no hydrogen 2.909 N/A THR 495.A OG1 ILE 491.A O no hydrogen 2.840 N/A ASP 496.A N ASN 492.A O no hydrogen 3.008 N/A ARG 497.A N ALA 493.A O no hydrogen 3.254 N/A LEU 498.A N GLU 494.A O no hydrogen 3.018 N/A GLU 499.A N THR 495.A O no hydrogen 2.949 N/A ALA 500.A N ASP 496.A O no hydrogen 2.969 N/A ARG 501.A N ARG 497.A O no hydrogen 2.927 N/A LYS 502.A NZ GLU 7.A OE2 no hydrogen 2.980 N/A LYS 503.A N GLU 499.A O no hydrogen 3.155 N/A LYS 503.A N ALA 500.A O no hydrogen 3.077 N/A ALA 504.A N ALA 500.A O no hydrogen 3.092 N/A LYS 505.A N ARG 501.A O no hydrogen 3.194 N/A ASN 506.A N LYS 502.A O no hydrogen 3.047 N/A LYS 507.A N LYS 503.A O no hydrogen 2.885 N/A GLN 508.A N ALA 504.A O no hydrogen 3.111 N/A GLN 508.A NE2 ALA 504.A O no hydrogen 3.418 N/A LEU 509.A N LYS 505.A O no hydrogen 3.126 N/A GLY 510.A N LYS 507.A O no hydrogen 3.267 N/A TYR 515.A OH GLU 544.A OE1 no hydrogen 2.461 N/A ALA 516.A N ASP 514.A OD1 no hydrogen 3.084 N/A LEU 517.A N ASP 514.A O no hydrogen 3.294 N/A LYS 519.A NZ TYR 515.A O no hydrogen 2.851 N/A CYS 521.A SG MET 523.A O no hydrogen 3.655 N/A CYS 521.A SG LEU 538.A O no hydrogen 3.491 N/A ILE 522.A N LEU 538.A O no hydrogen 2.765 N/A HIS 524.A N SER 12.A OG no hydrogen 2.911 N/A HIS 524.A ND1 TYR 535.A OH no hydrogen 2.511 N/A GLY 525.A N PHE 536.A O no hydrogen 3.035 N/A MET 527.A N ARG 534.A O no hydrogen 3.058 N/A SER 528.A N GLN 588.A O no hydrogen 2.779 N/A LYS 529.A N GLN 532.A O no hydrogen 2.685 N/A LYS 529.A NZ GLN 532.A OE1 no hydrogen 3.215 N/A MET 530.A N ILE 586.A O no hydrogen 3.008 N/A GLN 532.A N LYS 529.A O no hydrogen 2.902 N/A ARG 533.A NE ASP 590.A OD1 no hydrogen 3.454 N/A ARG 533.A NE ASP 590.A OD2 no hydrogen 3.441 N/A ARG 533.A NH2 ASP 590.A OD2 no hydrogen 3.032 N/A ARG 534.A N MET 527.A O no hydrogen 2.932 N/A ARG 534.A NH1 ARG 533.A O no hydrogen 3.228 N/A TYR 535.A N ARG 546.A O no hydrogen 2.990 N/A TYR 535.A OH HIS 524.A ND1 no hydrogen 2.511 N/A PHE 536.A N GLY 525.A O no hydrogen 2.744 N/A TYR 537.A N GLU 544.A O no hydrogen 2.863 N/A LEU 538.A N MET 523.A O no hydrogen 2.937 N/A PHE 539.A N ARG 542.A O no hydrogen 2.812 N/A ARG 542.A NE GLU 544.A OE2 no hydrogen 2.588 N/A ARG 542.A NH1 ASN 541.A OD1 no hydrogen 3.010 N/A ARG 542.A NH2 GLU 544.A OE2 no hydrogen 3.120 N/A LEU 543.A N LEU 556.A O no hydrogen 2.701 N/A GLU 544.A N TYR 537.A O no hydrogen 2.918 N/A TRP 545.A N SER 554.A O no hydrogen 3.084 N/A ARG 546.A N TYR 535.A O no hydrogen 2.955 N/A ARG 546.A NE TYR 537.A OH no hydrogen 3.069 N/A ARG 546.A NH1 GLY 547.A O no hydrogen 3.002 N/A ARG 546.A NH1 GLU 548.A OE2 no hydrogen 3.201 N/A GLN 553.A NE2 ALA 551.A O no hydrogen 2.734 N/A LEU 556.A N LEU 543.A O no hydrogen 2.809 N/A THR 557.A N GLU 560.A OE2 no hydrogen 3.453 N/A THR 557.A OG1 GLU 560.A OE2 no hydrogen 3.346 N/A MET 558.A N ASN 541.A O no hydrogen 3.026 N/A GLU 560.A N THR 557.A O no hydrogen 3.042 N/A GLU 560.A N THR 557.A OG1 no hydrogen 3.296 N/A ILE 561.A N MET 558.A O no hydrogen 3.235 N/A GLN 562.A N LYS 578.A O no hydrogen 2.732 N/A GLU 565.A N LEU 576.A O no hydrogen 3.095 N/A THR 567.A N CYS 574.A O no hydrogen 2.782 N/A ILE 569.A N ARG 572.A O no hydrogen 2.790 N/A ARG 572.A N ILE 569.A O no hydrogen 3.129 N/A ARG 572.A NH2 CYS 589.A O no hydrogen 2.755 N/A CYS 574.A N THR 567.A O no hydrogen 2.618 N/A CYS 574.A SG ARG 572.A O no hydrogen 4.003 N/A LEU 575.A N LEU 587.A O no hydrogen 2.915 N/A LEU 576.A N GLU 565.A O no hydrogen 2.722 N/A LEU 577.A N PHE 585.A O no hydrogen 2.502 N/A LYS 578.A N SER 563.A O no hydrogen 3.063 N/A ILE 579.A N LYS 583.A O no hydrogen 2.791 N/A ARG 580.A N GLU 560.A O no hydrogen 2.754 N/A LYS 583.A N ILE 579.A O no hydrogen 3.278 N/A PHE 585.A N LEU 577.A O no hydrogen 2.641 N/A LEU 587.A N LEU 575.A O no hydrogen 2.845 N/A GLN 588.A N SER 528.A O no hydrogen 2.710 N/A SER 591.A OG GLU 594.A OE1 no hydrogen 2.226 N/A ASP 592.A N ASN 154.A OD1 no hydrogen 3.399 N/A LEU 595.A N SER 591.A O no hydrogen 3.171 N/A VAL 596.A N ASP 592.A O no hydrogen 3.132 N/A GLN 597.A N PRO 593.A O no hydrogen 2.948 N/A GLN 597.A NE2 ASP 20.A OD2 no hydrogen 3.059 N/A GLN 597.A NE2 GLU 601.A OE2 no hydrogen 2.752 N/A TRP 598.A N GLU 594.A O no hydrogen 2.742 N/A LYS 599.A N LEU 595.A O no hydrogen 2.996 N/A LYS 599.A NZ GLU 566.A OE1 no hydrogen 3.196 N/A LYS 600.A N VAL 596.A O no hydrogen 3.161 N/A LYS 600.A NZ ASP 604.A OD2 no hydrogen 3.081 N/A GLU 601.A N GLN 597.A O no hydrogen 2.844 N/A LEU 602.A N TRP 598.A O no hydrogen 3.164 N/A ARG 603.A N LYS 599.A O no hydrogen 3.273 N/A ARG 603.A NE VAL 564.A O no hydrogen 2.988 N/A ARG 603.A NH2 VAL 564.A O no hydrogen 2.776 N/A ASP 604.A N LYS 600.A O no hydrogen 3.066 N/A ALA 605.A N GLU 601.A O no hydrogen 2.832 N/A TYR 606.A N LEU 602.A O no hydrogen 3.019 N/A ARG 607.A N ARG 603.A O no hydrogen 3.276 N/A ARG 607.A NE TYR 606.A OH no hydrogen 3.540 N/A GLU 608.A N ASP 604.A O no hydrogen 3.076 N/A ALA 609.A N ALA 605.A O no hydrogen 2.815 N/A GLN 610.A N TYR 606.A O no hydrogen 2.929 N/A GLN 610.A NE2 MET 558.A O no hydrogen 2.699 N/A GLN 610.A NE2 ILE 561.A O no hydrogen 2.574 N/A GLN 611.A N ARG 607.A O no hydrogen 3.038 N/A LEU 612.A N GLU 608.A O no hydrogen 3.201 N/A VAL 613.A N ALA 609.A O no hydrogen 2.837 N/A ARG 615.A N LEU 612.A O no hydrogen 2.851 N/A VAL 616.A N VAL 613.A O no hydrogen 3.286 N/A MET 619.A N VAL 616.A O no hydrogen 2.991 N/A LYS 620.A N VAL 616.A O no hydrogen 3.010 N/A