Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 2xhu_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): SER 1.A N ASP 55.A OD1 no hydrogen 2.756 N/A SER 1.A OG GLU 229.A OE1 no hydrogen 3.461 N/A SER 3.A N PHE 54.A O no hydrogen 2.960 N/A SER 3.A OG VAL 52.A O no hydrogen 2.815 N/A SER 3.A OG PHE 54.A O no hydrogen 3.485 N/A THR 5.A N TYR 275.A O no hydrogen 2.971 N/A TRP 6.A NE1 THR 53.A OG1 no hydrogen 2.918 N/A THR 7.A N CYS 273.A O no hydrogen 2.941 N/A THR 7.A OG1 ASN 272.A O no hydrogen 2.658 N/A ALA 9.A N THR 7.A OG1 no hydrogen 3.272 N/A THR 12.A OG1 SER 268.A OG no hydrogen 2.719 N/A LEU 30.A N SER 27.A O no hydrogen 3.235 N/A ARG 32.A N GLY 492.A O no hydrogen 3.017 N/A HIS 33.A N LEU 491.A O no hydrogen 3.032 N/A HIS 33.A ND1 LYS 490.A O no hydrogen 2.966 N/A MET 36.A N HIS 33.A O no hydrogen 2.643 N/A VAL 37.A N HIS 34.A O no hydrogen 3.046 N/A TYR 38.A N PHE 145.A O no hydrogen 3.195 N/A ALA 39.A N SER 19.A O no hydrogen 3.122 N/A THR 40.A N GLU 143.A O no hydrogen 2.829 N/A THR 40.A OG1 LYS 141.A O no hydrogen 2.747 N/A SER 42.A N GLU 17.A OE1 no hydrogen 2.774 N/A SER 42.A N GLU 17.A OE2 no hydrogen 3.142 N/A SER 42.A OG GLU 17.A OE1 no hydrogen 3.261 N/A SER 42.A OG GLU 17.A OE2 no hydrogen 2.517 N/A ARG 43.A N THR 41.A OG1 no hydrogen 3.013 N/A SER 44.A N THR 41.A O no hydrogen 3.204 N/A SER 44.A OG THR 41.A O no hydrogen 3.151 N/A ALA 45.A N SER 42.A O no hydrogen 3.151 N/A LEU 47.A N SER 44.A O no hydrogen 3.086 N/A ARG 48.A N SER 44.A O no hydrogen 3.426 N/A ARG 48.A NE ALA 156.A O no hydrogen 3.384 N/A GLN 49.A N ALA 45.A O no hydrogen 2.818 N/A LYS 50.A N SER 46.A O no hydrogen 3.130 N/A LYS 51.A N LEU 47.A O no hydrogen 3.347 N/A VAL 52.A N ARG 48.A O no hydrogen 2.885 N/A VAL 52.A N GLN 49.A O no hydrogen 3.287 N/A THR 53.A OG1 GLN 49.A O no hydrogen 2.668 N/A PHE 54.A N SER 3.A OG no hydrogen 3.067 N/A ARG 56.A N SER 1.A O no hydrogen 3.127 N/A ARG 56.A NE SER 1.A O no hydrogen 3.106 N/A ARG 56.A NH1 SER 225.A O no hydrogen 2.799 N/A ARG 56.A NH1 VAL 227.A O no hydrogen 2.989 N/A ARG 56.A NH1 ARG 277.A O no hydrogen 3.463 N/A ARG 56.A NH2 SER 1.A OG no hydrogen 3.317 N/A ARG 56.A NH2 ARG 277.A O no hydrogen 2.856 N/A GLN 58.A NE2 ASP 231.A OD1 no hydrogen 3.464 N/A GLN 58.A NE2 ASP 231.A OD2 no hydrogen 2.779 N/A GLN 58.A NE2 TYR 345.A O no hydrogen 2.998 N/A VAL 59.A N ARG 344.A O no hydrogen 2.827 N/A TYR 64.A N ASP 61.A OD2 no hydrogen 3.009 N/A ARG 65.A N ASP 61.A O no hydrogen 3.189 N/A ASP 66.A N ASP 62.A O no hydrogen 2.827 N/A VAL 67.A N HIS 63.A O no hydrogen 3.011 N/A LEU 68.A N TYR 64.A O no hydrogen 2.874 N/A LYS 69.A N ARG 65.A O no hydrogen 2.992 N/A GLU 70.A N ASP 66.A O no hydrogen 3.064 N/A MET 71.A N VAL 67.A O no hydrogen 2.817 N/A LYS 72.A N LEU 68.A O no hydrogen 2.847 N/A ALA 73.A N LYS 69.A O no hydrogen 3.039 N/A LYS 74.A N GLU 70.A O no hydrogen 3.402 N/A ALA 75.A N MET 71.A O no hydrogen 3.032 N/A SER 76.A N LYS 72.A O no hydrogen 2.961 N/A SER 76.A OG.A LYS 72.A O no hydrogen 2.883 N/A SER 76.A OG.B ALA 73.A O no hydrogen 2.504 N/A THR 77.A N LYS 74.A O no hydrogen 3.187 N/A THR 77.A OG1 LYS 74.A O no hydrogen 2.754 N/A VAL 78.A N ALA 75.A O no hydrogen 2.918 N/A ALA 80.A N ASP 243.A O no hydrogen 3.046 N/A LYS 81.A N ASP 176.A OD1 no hydrogen 2.760 N/A LEU 83.A N MET 172.A O no hydrogen 2.952 N/A SER 84.A N GLU 87.A OE2 no hydrogen 2.968 N/A SER 84.A OG GLU 87.A OE2 no hydrogen 2.990 N/A GLU 87.A N SER 84.A OG no hydrogen 3.147 N/A ALA 88.A N SER 84.A O no hydrogen 3.064 N/A CYS 89.A N ILE 85.A O no hydrogen 2.790 N/A CYS 89.A SG ILE 85.A O no hydrogen 3.277 N/A CYS 89.A SG VAL 108.A O no hydrogen 3.482 N/A LYS 90.A N GLU 86.A O no hydrogen 3.006 N/A LYS 90.A NZ ARG 109.A O no hydrogen 2.649 N/A LEU 91.A N ALA 88.A O no hydrogen 3.092 N/A THR 92.A N CYS 89.A O no hydrogen 3.087 N/A THR 92.A OG1 CYS 89.A O no hydrogen 3.363 N/A SER 96.A N PRO 93.A O no hydrogen 2.967 N/A SER 96.A OG ASP 558.A OD1 no hydrogen 2.710 N/A SER 96.A OG ASP 558.A OD2 no hydrogen 2.729 N/A SER 99.A N TYR 103.A O no hydrogen 2.865 N/A SER 99.A OG ASP 163.A OD1 no hydrogen 2.752 N/A SER 99.A OG ASP 163.A OD2 no hydrogen 3.399 N/A LYS 100.A N ASP 163.A OD2 no hydrogen 2.899 N/A PHE 101.A N SER 99.A OG no hydrogen 2.836 N/A TYR 103.A OH HIS 118.A ND1 no hydrogen 2.733 N/A GLY 104.A N ASP 107.A OD1 no hydrogen 2.705 N/A LYS 106.A NZ ASP 107.A OD2 no hydrogen 3.513 N/A VAL 108.A N GLY 104.A O no hydrogen 3.106 N/A ARG 109.A N ALA 105.A O no hydrogen 2.980 N/A ARG 109.A NH1 LYS 90.A O no hydrogen 2.943 N/A ARG 109.A NH1 THR 92.A O no hydrogen 2.875 N/A ASN 110.A N LYS 106.A O no hydrogen 2.917 N/A LEU 111.A N VAL 108.A O no hydrogen 2.906 N/A SER 112.A N ASP 107.A O no hydrogen 2.898 N/A ARG 114.A NE PHE 101.A O no hydrogen 2.886 N/A ARG 114.A NH2 PHE 101.A O no hydrogen 3.181 N/A VAL 116.A N SER 112.A O no hydrogen 3.020 N/A ASN 117.A N SER 113.A O no hydrogen 2.899 N/A HIS 118.A N ARG 114.A O no hydrogen 3.116 N/A HIS 118.A ND1 TYR 103.A OH no hydrogen 2.733 N/A ILE 119.A N ALA 115.A O no hydrogen 2.873 N/A ARG 120.A N VAL 116.A O no hydrogen 3.002 N/A SER 121.A N ASN 117.A O no hydrogen 3.098 N/A SER 121.A OG HIS 118.A O no hydrogen 2.835 N/A VAL 122.A N HIS 118.A O no hydrogen 2.719 N/A TRP 123.A N ILE 119.A O no hydrogen 2.852 N/A TRP 123.A NE1 GLU 247.A OE1 no hydrogen 2.939 N/A GLU 124.A N ARG 120.A O no hydrogen 2.940 N/A ASP 125.A N SER 121.A O no hydrogen 3.049 N/A LEU 126.A N VAL 122.A O no hydrogen 3.216 N/A LEU 126.A N TRP 123.A O no hydrogen 3.042 N/A LEU 127.A N GLU 124.A O no hydrogen 2.910 N/A GLU 128.A N GLU 124.A O no hydrogen 2.844 N/A ASP 129.A N ASP 125.A O no hydrogen 2.898 N/A GLU 131.A N ASP 129.A OD2 no hydrogen 2.981 N/A THR 132.A N ASP 129.A OD2 no hydrogen 3.034 N/A THR 132.A OG1 ASP 129.A OD1 no hydrogen 2.812 N/A THR 132.A OG1 ASP 129.A OD2 no hydrogen 3.280 N/A ILE 134.A N ARG 258.A O no hydrogen 2.708 N/A THR 136.A N PRO 264.A O no hydrogen 3.408 N/A THR 136.A OG1 PRO 264.A O no hydrogen 2.816 N/A THR 137.A N PHE 161.A O no hydrogen 2.902 N/A ILE 138.A N THR 266.A O no hydrogen 2.971 N/A MET 139.A N ILE 159.A O no hydrogen 2.858 N/A LYS 141.A N ARG 157.A O no hydrogen 2.833 N/A LYS 141.A NZ GLU 143.A OE1 no hydrogen 2.946 N/A GLU 143.A N THR 40.A OG1 no hydrogen 3.042 N/A PHE 145.A N TYR 38.A O no hydrogen 2.892 N/A CYS 146.A SG MET 36.A O no hydrogen 3.933 N/A CYS 146.A SG VAL 147.A O no hydrogen 3.647 N/A VAL 147.A N MET 36.A O no hydrogen 2.927 N/A GLN 148.A N GLY 152.A O no hydrogen 2.902 N/A LYS 154.A N TYR 38.A OH no hydrogen 2.822 N/A ALA 156.A N SER 44.A OG no hydrogen 2.811 N/A ARG 157.A NH1 GLU 143.A OE2 no hydrogen 3.083 N/A ILE 159.A N MET 139.A O no hydrogen 2.888 N/A VAL 160.A N SER 281.A OG no hydrogen 3.045 N/A PHE 161.A N THR 137.A O no hydrogen 3.104 N/A GLY 165.A N ASP 163.A OD1 no hydrogen 3.133 N/A ARG 167.A N ASP 163.A O no hydrogen 3.099 N/A ARG 167.A NE ASP 558.A OD2 no hydrogen 2.755 N/A ARG 167.A NH1 SER 96.A OG no hydrogen 2.543 N/A ARG 167.A NH1 ALA 97.A O no hydrogen 2.876 N/A ARG 167.A NH1 ASP 558.A OD2 no hydrogen 3.547 N/A ARG 167.A NH2 PRO 162.A O no hydrogen 2.901 N/A VAL 168.A N LEU 164.A O no hydrogen 3.100 N/A CYS 169.A N GLY 165.A O no hydrogen 3.277 N/A CYS 169.A SG ILE 119.A O no hydrogen 3.566 N/A CYS 169.A SG GLY 165.A O no hydrogen 3.629 N/A GLU 170.A N VAL 166.A O no hydrogen 2.861 N/A LYS 171.A N ARG 167.A O no hydrogen 3.256 N/A LYS 171.A NZ ASP 558.A O no hydrogen 2.652 N/A MET 172.A N VAL 168.A O no hydrogen 3.158 N/A ALA 173.A N CYS 169.A O no hydrogen 3.072 N/A LEU 174.A N GLU 170.A O no hydrogen 2.787 N/A TYR 175.A N LYS 171.A O no hydrogen 2.939 N/A TYR 175.A OH HIS 561.A NE2 no hydrogen 2.779 N/A VAL 178.A N LEU 174.A O no hydrogen 2.855 N/A SER 179.A N TYR 175.A O no hydrogen 3.076 N/A SER 179.A OG TYR 175.A O no hydrogen 2.737 N/A SER 179.A OG TYR 554.A OH no hydrogen 2.590 N/A THR 180.A N VAL 177.A O no hydrogen 3.201 N/A THR 180.A OG1 ASP 176.A O no hydrogen 3.227 N/A THR 180.A OG1 ASP 176.A OD2 no hydrogen 3.404 N/A LEU 181.A N VAL 177.A O no hydrogen 2.962 N/A ALA 184.A N THR 180.A O no hydrogen 3.304 N/A VAL 185.A N LEU 181.A O no hydrogen 2.790 N/A VAL 185.A N PRO 182.A O no hydrogen 3.262 N/A MET 186.A N PRO 182.A O no hydrogen 2.879 N/A GLY 187.A N GLN 183.A O no hydrogen 3.029 N/A SER 189.A N MET 186.A O no hydrogen 3.045 N/A SER 189.A OG MET 312.A O no hydrogen 2.767 N/A TYR 190.A N GLY 187.A O no hydrogen 3.135 N/A GLY 191.A N VAL 314.A O no hydrogen 2.818 N/A GLN 193.A N TYR 190.A O no hydrogen 3.503 N/A GLN 193.A NE2 GLY 187.A O no hydrogen 2.730 N/A GLN 193.A NE2 TYR 190.A O no hydrogen 2.901 N/A TYR 194.A N GLY 191.A O no hydrogen 2.961 N/A TYR 194.A OH SER 188.A O no hydrogen 2.671 N/A SER 195.A N GLN 198.A OE1 no hydrogen 2.852 N/A LYS 197.A NZ HIS 466.A O no hydrogen 3.433 N/A GLN 198.A N SER 195.A OG no hydrogen 3.140 N/A ARG 199.A N SER 195.A O no hydrogen 2.776 N/A ARG 199.A NH1 ASN 315.A OD1 no hydrogen 2.951 N/A ARG 199.A NH2 SER 364.A OG no hydrogen 3.093 N/A VAL 200.A N PRO 196.A O no hydrogen 3.085 N/A GLU 201.A N LYS 197.A O no hydrogen 3.225 N/A PHE 202.A N GLN 198.A O no hydrogen 2.897 N/A LEU 203.A N ARG 199.A O no hydrogen 2.915 N/A VAL 204.A N VAL 200.A O no hydrogen 2.793 N/A ASN 205.A N GLU 201.A O no hydrogen 2.859 N/A THR 206.A N PHE 202.A O no hydrogen 2.907 N/A THR 206.A OG1 PHE 202.A O no hydrogen 2.818 N/A TRP 207.A N LEU 203.A O no hydrogen 2.867 N/A LYS 208.A N VAL 204.A O no hydrogen 3.101 N/A SER 209.A N ASN 205.A O no hydrogen 3.161 N/A SER 209.A N THR 206.A O no hydrogen 3.103 N/A SER 209.A OG THR 206.A O no hydrogen 2.625 N/A LYS 210.A N TRP 207.A O no hydrogen 3.258 N/A LYS 210.A NZ SER 209.A OG no hydrogen 3.423 N/A LYS 210.A NZ ASP 309.A O no hydrogen 3.331 N/A LYS 210.A NZ THR 311.A OG1 no hydrogen 2.931 N/A LYS 211.A N GLU 324.A OE2 no hydrogen 2.497 N/A CYS 212.A N GLU 324.A OE1 no hydrogen 3.104 N/A MET 214.A N CYS 323.A O no hydrogen 2.963 N/A GLY 215.A N GLU 356.A O no hydrogen 2.961 N/A PHE 216.A N VAL 321.A O no hydrogen 2.970 N/A TYR 218.A N LEU 319.A O no hydrogen 2.948 N/A TYR 218.A OH ALA 347.A O no hydrogen 2.674 N/A ARG 221.A N PRO 348.A O no hydrogen 3.097 N/A CYS 222.A SG LYS 51.A O no hydrogen 3.859 N/A SER 225.A N CYS 222.A O no hydrogen 2.904 N/A SER 225.A OG VAL 52.A O no hydrogen 2.803 N/A THR 226.A N CYS 222.A O no hydrogen 3.262 N/A THR 226.A N PHE 223.A O no hydrogen 2.735 N/A THR 226.A OG1 PHE 223.A O no hydrogen 2.771 N/A THR 226.A OG1 SER 346.A O.A no hydrogen 3.346 N/A VAL 227.A N PHE 223.A O no hydrogen 3.262 N/A THR 228.A N ASP 231.A OD1 no hydrogen 3.064 N/A THR 228.A OG1 GLN 58.A OE1 no hydrogen 2.675 N/A GLU 229.A N GLU 229.A OE1 no hydrogen 2.838 N/A ASP 231.A N THR 228.A OG1 no hydrogen 3.006 N/A ILE 232.A N THR 228.A O no hydrogen 2.931 N/A ARG 233.A N GLU 229.A O no hydrogen 2.918 N/A ARG 233.A NE GLU 257.A OE1 no hydrogen 2.957 N/A ARG 233.A NH2 GLU 257.A OE1 no hydrogen 3.293 N/A ARG 233.A NH2 GLU 257.A OE2 no hydrogen 3.112 N/A VAL 234.A N SER 230.A O no hydrogen 2.845 N/A GLU 235.A N ASP 231.A O no hydrogen 2.987 N/A GLU 236.A N ILE 232.A O no hydrogen 3.137 N/A SER 237.A N ARG 233.A O no hydrogen 2.937 N/A SER 237.A OG VAL 234.A O no hydrogen 2.714 N/A ILE 238.A N VAL 234.A O no hydrogen 3.048 N/A TYR 239.A N GLU 235.A O no hydrogen 3.026 N/A TYR 239.A OH GLU 235.A OE2.B no hydrogen 2.241 N/A GLN 240.A N GLU 236.A O no hydrogen 2.651 N/A GLN 240.A NE2 GLU 236.A OE2 no hydrogen 3.004 N/A GLN 240.A NE2 ARG 249.A O no hydrogen 3.397 N/A CYS 241.A N ILE 238.A O no hydrogen 3.020 N/A CYS 241.A SG LYS 72.A O no hydrogen 3.900 N/A CYS 241.A SG SER 237.A O no hydrogen 3.323 N/A CYS 242.A N TYR 239.A O no hydrogen 3.021 N/A CYS 242.A SG TYR 239.A O no hydrogen 3.402 N/A ASP 243.A N VAL 78.A O no hydrogen 2.873 N/A ARG 249.A N ALA 245.A O no hydrogen 2.967 N/A ARG 249.A NH1 GLN 240.A O no hydrogen 2.926 N/A ARG 249.A NH1 GLN 240.A OE1 no hydrogen 2.823 N/A ARG 249.A NH2 CYS 242.A O no hydrogen 3.156 N/A GLN 250.A N PRO 246.A O no hydrogen 3.068 N/A GLN 250.A NE2 GLN 250.A O no hydrogen 3.151 N/A GLN 250.A NE2 SER 254.A OG no hydrogen 3.042 N/A ALA 251.A N GLU 247.A O no hydrogen 2.777 N/A ILE 252.A N ALA 248.A O no hydrogen 2.832 N/A ARG 253.A N ARG 249.A O no hydrogen 2.969 N/A ARG 253.A NE GLU 236.A OE1 no hydrogen 3.371 N/A ARG 253.A NE GLU 236.A OE2 no hydrogen 2.826 N/A ARG 253.A NH2 GLU 236.A OE1 no hydrogen 2.889 N/A ARG 253.A NH2 GLU 257.A OE1 no hydrogen 2.951 N/A SER 254.A N GLN 250.A O no hydrogen 2.747 N/A SER 254.A OG LEU 126.A O no hydrogen 2.602 N/A SER 254.A OG ASP 129.A O no hydrogen 3.544 N/A SER 254.A OG GLN 250.A O no hydrogen 3.339 N/A LEU 255.A N ALA 251.A O no hydrogen 2.856 N/A THR 256.A N ILE 252.A O no hydrogen 2.945 N/A THR 256.A OG1 ILE 252.A O no hydrogen 2.860 N/A GLU 257.A N ARG 253.A O no hydrogen 3.302 N/A ARG 258.A N SER 254.A O no hydrogen 2.831 N/A ARG 258.A NE THR 132.A O no hydrogen 2.641 N/A ARG 258.A NH1 ASP 125.A O no hydrogen 3.077 N/A ARG 258.A NH1 ASP 125.A OD1 no hydrogen 2.919 N/A ARG 258.A NH1 ASP 129.A O no hydrogen 2.842 N/A ARG 258.A NH2 ASP 125.A OD1 no hydrogen 2.823 N/A ARG 258.A NH2 THR 132.A O no hydrogen 3.539 N/A LEU 259.A N LEU 255.A O no hydrogen 2.940 N/A TYR 260.A N LEU 255.A O no hydrogen 2.913 N/A TYR 260.A OH GLU 170.A OE2 no hydrogen 2.627 N/A ILE 261.A N THR 256.A O no hydrogen 3.105 N/A GLY 263.A N ARG 276.A O no hydrogen 3.051 N/A LEU 265.A N GLY 274.A O no hydrogen 2.838 N/A THR 266.A N THR 136.A O no hydrogen 2.809 N/A THR 266.A OG1 ASP 135.A OD1 no hydrogen 3.385 N/A THR 266.A OG1 ASP 135.A OD2 no hydrogen 2.708 N/A ASN 267.A N GLN 271.A O no hydrogen 2.883 N/A ASN 267.A ND2 LEU 10.A O no hydrogen 2.902 N/A SER 268.A OG THR 12.A O no hydrogen 3.459 N/A SER 268.A OG THR 12.A OG1 no hydrogen 2.719 N/A SER 268.A OG PRO 13.A O no hydrogen 3.018 N/A GLY 270.A N ASN 267.A O no hydrogen 3.027 N/A GLN 271.A N ASN 267.A OD1 no hydrogen 2.744 N/A CYS 273.A N LEU 265.A O no hydrogen 2.767 N/A CYS 273.A SG ALA 9.A O no hydrogen 3.703 N/A CYS 273.A SG LEU 10.A O no hydrogen 3.414 N/A CYS 273.A SG GLN 271.A O no hydrogen 3.938 N/A GLY 274.A N ASN 272.A OD1 no hydrogen 3.173 N/A TYR 275.A N THR 5.A O no hydrogen 2.863 N/A ARG 276.A N GLY 263.A O no hydrogen 2.939 N/A ARG 276.A NH1 LEU 259.A O no hydrogen 3.253 N/A ARG 276.A NH1 TYR 260.A O no hydrogen 3.225 N/A ARG 276.A NH1 CYS 278.A O no hydrogen 2.936 N/A ARG 276.A NH2 LEU 259.A O no hydrogen 2.677 N/A ARG 277.A N SER 3.A O no hydrogen 2.903 N/A ARG 277.A NH1 MET 2.A O no hydrogen 3.142 N/A ARG 277.A NH1 THR 5.A OG1 no hydrogen 3.424 N/A ARG 277.A NH2 THR 5.A OG1 no hydrogen 3.265 N/A CYS 278.A SG SER 3.A O no hydrogen 3.732 N/A CYS 278.A SG TYR 4.A OH no hydrogen 3.359 N/A CYS 278.A SG ARG 279.A O no hydrogen 3.815 N/A ARG 279.A N ASP 224.A O no hydrogen 3.155 N/A ARG 279.A NE ASN 290.A OD1 no hydrogen 2.849 N/A ARG 279.A NH1 GLU 235.A OE1.A no hydrogen 2.832 N/A ARG 279.A NH1 GLU 235.A OE1.B no hydrogen 2.830 N/A ARG 279.A NH2 GLU 235.A OE1.B no hydrogen 2.982 N/A ARG 279.A NH2 GLU 235.A OE2.A no hydrogen 2.264 N/A ARG 279.A NH2 ASN 290.A OD1 no hydrogen 3.317 N/A SER 281.A OG LEU 158.A O no hydrogen 3.523 N/A GLY 282.A N VAL 160.A O no hydrogen 2.795 N/A LEU 284.A N GLU 170.A OE2 no hydrogen 2.846 N/A THR 286.A N VAL 283.A O no hydrogen 3.192 N/A THR 286.A OG1 ALA 280.A O no hydrogen 2.530 N/A THR 286.A OG1 VAL 283.A O no hydrogen 3.299 N/A CYS 288.A SG TYR 239.A OH no hydrogen 3.816 N/A GLY 289.A N THR 285.A O no hydrogen 2.675 N/A ASN 290.A N THR 286.A O no hydrogen 2.903 N/A ASN 290.A ND2 ASP 224.A OD1 no hydrogen 2.962 N/A THR 291.A N SER 287.A O no hydrogen 2.903 N/A THR 291.A OG1 SER 287.A O no hydrogen 2.757 N/A LEU 292.A N CYS 288.A O no hydrogen 2.979 N/A THR 293.A N GLY 289.A O no hydrogen 2.957 N/A THR 293.A OG1 GLU 235.A OE2.A no hydrogen 2.680 N/A THR 293.A OG1 GLY 289.A O no hydrogen 3.059 N/A CYS 294.A N ASN 290.A O no hydrogen 2.874 N/A TYR 295.A N THR 291.A O no hydrogen 2.844 N/A LEU 296.A N LEU 292.A O no hydrogen 2.810 N/A LYS 297.A N THR 293.A O no hydrogen 2.969 N/A LYS 297.A NZ ASP 231.A OD1 no hydrogen 2.712 N/A LYS 297.A NZ TYR 345.A O no hydrogen 2.792 N/A LYS 297.A NZ SER 346.A O.A no hydrogen 3.093 N/A LYS 297.A NZ SER 346.A OG.B no hydrogen 2.865 N/A ALA 298.A N CYS 294.A O no hydrogen 2.765 N/A THR 299.A N TYR 295.A O no hydrogen 2.843 N/A THR 299.A OG1 TYR 295.A O no hydrogen 2.759 N/A ALA 300.A N LEU 296.A O no hydrogen 3.103 N/A ALA 301.A N LYS 297.A O no hydrogen 2.882 N/A CYS 302.A N ALA 298.A O no hydrogen 2.869 N/A CYS 302.A SG ALA 298.A O no hydrogen 3.463 N/A ARG 303.A N THR 299.A O no hydrogen 3.332 N/A ARG 303.A NH1 GLU 70.A OE1 no hydrogen 3.409 N/A ARG 303.A NH2 GLU 70.A OE2 no hydrogen 2.836 N/A ALA 304.A N ALA 300.A O no hydrogen 2.945 N/A ALA 305.A N ALA 301.A O no hydrogen 2.861 N/A LYS 306.A N ARG 303.A O no hydrogen 3.204 N/A THR 311.A N ILE 322.A O no hydrogen 2.749 N/A LEU 313.A N VAL 320.A O no hydrogen 2.859 N/A VAL 314.A N SER 189.A O no hydrogen 2.840 N/A ASN 315.A N ASP 318.A O no hydrogen 2.993 N/A GLY 316.A N THR 291.A OG1 no hydrogen 2.860 N/A ASP 318.A N ASN 315.A O no hydrogen 2.902 N/A VAL 320.A N LEU 313.A O no hydrogen 3.108 N/A VAL 321.A N PHE 216.A O no hydrogen 2.992 N/A ILE 322.A N THR 311.A O no hydrogen 2.875 N/A CYS 323.A N MET 214.A O no hydrogen 2.778 N/A CYS 323.A SG MET 214.A O no hydrogen 3.676 N/A GLU 324.A N GLN 308.A O no hydrogen 2.947 N/A SER 325.A N CYS 212.A O no hydrogen 2.935 N/A SER 325.A OG ASP 331.A OD1 no hydrogen 2.548 N/A SER 325.A OG ASP 331.A OD2 no hydrogen 3.313 N/A ALA 326.A N ASP 331.A OD2 no hydrogen 3.028 N/A GLY 327.A N SER 325.A OG no hydrogen 3.220 N/A ASP 331.A N GLY 327.A O no hydrogen 2.924 N/A ALA 332.A N THR 328.A O no hydrogen 3.108 N/A ALA 333.A N GLN 329.A O no hydrogen 3.275 N/A ALA 334.A N GLU 330.A O no hydrogen 2.861 N/A LEU 335.A N ASP 331.A O no hydrogen 2.931 N/A ARG 336.A N ALA 332.A O no hydrogen 3.101 N/A ALA 337.A N ALA 333.A O no hydrogen 3.036 N/A PHE 338.A N ALA 334.A O no hydrogen 2.815 N/A THR 339.A N LEU 335.A O no hydrogen 2.983 N/A THR 339.A OG1 LEU 335.A O no hydrogen 3.270 N/A GLU 340.A N ARG 336.A O no hydrogen 3.031 N/A ALA 341.A N ALA 337.A O no hydrogen 3.087 N/A MET 342.A N PHE 338.A O no hydrogen 2.973 N/A THR 343.A N THR 339.A O no hydrogen 2.889 N/A THR 343.A OG1 THR 339.A O no hydrogen 2.676 N/A ARG 344.A N GLU 340.A O no hydrogen 3.079 N/A TYR 345.A N ALA 341.A O no hydrogen 3.002 N/A TYR 345.A OH ASP 61.A OD1 no hydrogen 2.937 N/A TYR 345.A OH ASP 61.A OD2 no hydrogen 2.580 N/A SER 346.A N.A THR 343.A O no hydrogen 2.949 N/A SER 346.A N.B THR 343.A O no hydrogen 2.919 N/A SER 346.A OG.A THR 226.A O no hydrogen 2.885 N/A SER 346.A OG.B THR 226.A O no hydrogen 2.666 N/A SER 346.A OG.B TYR 345.A O no hydrogen 2.757 N/A ALA 347.A N MET 342.A O no hydrogen 2.839 N/A GLY 350.A N ASP 219.A O no hydrogen 2.588 N/A GLU 356.A N GLY 215.A O no hydrogen 2.755 N/A TYR 357.A OH ASP 331.A OD1 no hydrogen 2.423 N/A GLU 360.A N ASP 358.A OD1 no hydrogen 3.006 N/A LEU 361.A N ASP 358.A O no hydrogen 2.673 N/A ILE 362.A N LEU 359.A O no hydrogen 3.249 N/A SER 364.A N SER 367.A O no hydrogen 2.811 N/A CYS 365.A N ASP 318.A OD2 no hydrogen 2.691 N/A SER 367.A N SER 364.A O no hydrogen 3.033 N/A SER 367.A OG CYS 365.A O no hydrogen 2.940 N/A SER 367.A OG TYR 414.A OH no hydrogen 2.540 N/A ASN 368.A N THR 384.A O no hydrogen 2.760 N/A ASN 368.A ND2 GLU 360.A O no hydrogen 3.287 N/A ASN 368.A ND2 VAL 369.A O no hydrogen 2.872 N/A SER 370.A N TYR 382.A O no hydrogen 2.916 N/A SER 370.A OG GLU 360.A OE1 no hydrogen 3.241 N/A ALA 372.A N VAL 380.A O no hydrogen 2.896 N/A HIS 373.A N HIS 474.A O no hydrogen 3.037 N/A HIS 373.A ND1 GLY 377.A O no hydrogen 2.998 N/A ASP 374.A N LYS 378.A O no hydrogen 3.146 N/A ALA 375.A N THR 472.A OG1 no hydrogen 2.898 N/A SER 376.A OG ASP 374.A OD1 no hydrogen 2.610 N/A SER 376.A OG ASP 374.A OD2 no hydrogen 3.321 N/A GLY 377.A N ASP 374.A O no hydrogen 2.883 N/A VAL 380.A N ALA 372.A O no hydrogen 2.701 N/A TYR 382.A N SER 370.A O no hydrogen 3.118 N/A THR 384.A N ASN 368.A O no hydrogen 2.911 N/A THR 384.A OG1 ARG 385.A O no hydrogen 3.475 N/A THR 384.A OG1 GLU 480.A OE2 no hydrogen 2.705 N/A ARG 385.A NE ASP 386.A O no hydrogen 3.069 N/A THR 388.A N ASP 386.A OD2 no hydrogen 2.920 N/A THR 388.A OG1 ASP 386.A OD2 no hydrogen 2.522 N/A LEU 391.A N PRO 387.A O no hydrogen 2.867 N/A ALA 392.A N THR 388.A O no hydrogen 2.973 N/A ARG 393.A N THR 389.A O no hydrogen 3.015 N/A ARG 393.A NE VAL 144.A O no hydrogen 2.790 N/A ARG 393.A NH2 VAL 144.A O no hydrogen 3.460 N/A ALA 394.A N PRO 390.A O no hydrogen 3.022 N/A ALA 395.A N LEU 391.A O no hydrogen 2.992 N/A TRP 396.A N ALA 392.A O no hydrogen 2.995 N/A GLU 397.A N ARG 393.A O no hydrogen 2.907 N/A THR 398.A N ALA 395.A O no hydrogen 3.240 N/A THR 398.A OG1 ALA 394.A O no hydrogen 2.861 N/A THR 398.A OG1 HIS 427.A NE2 no hydrogen 2.907 N/A ALA 399.A N ALA 395.A O no hydrogen 3.170 N/A ALA 399.A N TRP 396.A O no hydrogen 3.158 N/A ARG 400.A N TRP 396.A O no hydrogen 2.884 N/A ARG 400.A NE LYS 20.A O no hydrogen 3.258 N/A ARG 400.A NH2 LYS 20.A O no hydrogen 2.931 N/A THR 402.A OG1 ILE 404.A O no hydrogen 2.996 N/A ASN 405.A N ASP 443.A O no hydrogen 2.890 N/A ASN 405.A ND2 ASP 443.A O no hydrogen 3.437 N/A SER 406.A N GLU 397.A OE1 no hydrogen 2.846 N/A SER 406.A OG GLU 397.A OE1 no hydrogen 2.781 N/A SER 406.A OG GLU 397.A OE2 no hydrogen 3.402 N/A TRP 407.A N GLU 397.A OE2 no hydrogen 3.154 N/A LEU 408.A N ASN 405.A O no hydrogen 3.035 N/A GLY 409.A N ASN 405.A O no hydrogen 3.506 N/A ASN 410.A N SER 406.A O no hydrogen 2.856 N/A ILE 411.A N TRP 407.A O no hydrogen 2.978 N/A ILE 412.A N LEU 408.A O no hydrogen 3.128 N/A MET 413.A N GLY 409.A O no hydrogen 2.853 N/A TYR 414.A N ASN 410.A O no hydrogen 2.806 N/A TYR 414.A OH SER 367.A OG no hydrogen 2.540 N/A THR 417.A N TYR 414.A O no hydrogen 2.975 N/A THR 417.A OG1 TYR 414.A O no hydrogen 2.888 N/A TRP 419.A NE1 THR 384.A OG1 no hydrogen 3.017 N/A ALA 420.A N THR 417.A OG1 no hydrogen 3.028 N/A ARG 421.A N THR 417.A O no hydrogen 3.190 N/A ARG 421.A NH1 LEU 473.A O no hydrogen 3.029 N/A ARG 421.A NH1 TYR 476.A OH no hydrogen 3.061 N/A MET 422.A N LEU 418.A O no hydrogen 3.180 N/A ILE 423.A N TRP 419.A O no hydrogen 3.213 N/A LEU 424.A N TRP 419.A O no hydrogen 3.414 N/A MET 425.A N ALA 420.A O no hydrogen 2.887 N/A THR 426.A OG1 MET 422.A O no hydrogen 2.697 N/A HIS 427.A N ILE 423.A O no hydrogen 2.725 N/A HIS 427.A NE2 THR 398.A OG1 no hydrogen 2.907 N/A PHE 428.A N LEU 424.A O no hydrogen 3.108 N/A PHE 429.A N MET 425.A O no hydrogen 3.123 N/A SER 430.A N THR 426.A O no hydrogen 3.180 N/A ILE 431.A N HIS 427.A O no hydrogen 3.192 N/A LEU 432.A N PHE 428.A O no hydrogen 2.991 N/A LEU 433.A N PHE 429.A O no hydrogen 2.892 N/A ALA 434.A N SER 430.A O no hydrogen 3.082 N/A GLN 435.A N ILE 431.A O no hydrogen 3.126 N/A GLU 436.A N LEU 433.A O no hydrogen 3.063 N/A GLN 437.A N LEU 432.A O no hydrogen 3.001 N/A LYS 440.A N GLN 437.A O no hydrogen 3.099 N/A LEU 442.A N ILE 453.A O no hydrogen 2.825 N/A CYS 444.A N TYR 451.A O no hydrogen 2.914 N/A ILE 446.A N ALA 449.A O no hydrogen 2.954 N/A TYR 447.A OH TYR 194.A O no hydrogen 2.617 N/A ALA 449.A N ILE 446.A O no hydrogen 3.247 N/A CYS 450.A N ILE 559.A O no hydrogen 2.921 N/A TYR 451.A N CYS 444.A O no hydrogen 2.770 N/A TYR 451.A OH GLY 548.A O no hydrogen 3.306 N/A ILE 453.A N LEU 442.A O no hydrogen 2.911 N/A ASP 457.A N GLU 454.A O no hydrogen 2.770 N/A LEU 458.A N PRO 455.A O no hydrogen 3.007 N/A GLN 460.A N GLN 460.A OE1 no hydrogen 2.688 N/A ILE 461.A N ASP 457.A O no hydrogen 3.183 N/A ILE 462.A N LEU 458.A O no hydrogen 2.779 N/A GLU 463.A N PRO 459.A O no hydrogen 3.044 N/A ARG 464.A N GLN 460.A O no hydrogen 3.004 N/A ARG 464.A NH1 LEU 544.A O no hydrogen 2.728 N/A LEU 465.A N ILE 461.A O no hydrogen 2.930 N/A HIS 466.A N ILE 462.A O no hydrogen 2.698 N/A HIS 466.A NE2 ILE 412.A O no hydrogen 2.721 N/A GLY 467.A N GLU 463.A O no hydrogen 2.618 N/A ALA 470.A N GLY 467.A O no hydrogen 2.851 N/A PHE 471.A N LEU 468.A O no hydrogen 3.113 N/A THR 472.A N SER 469.A O no hydrogen 3.057 N/A LEU 473.A N SER 469.A O no hydrogen 3.219 N/A HIS 474.A N HIS 373.A O no hydrogen 2.882 N/A HIS 474.A NE2 ASP 374.A O no hydrogen 2.890 N/A SER 475.A OG HIS 474.A ND1 no hydrogen 2.796 N/A TYR 476.A OH PRO 416.A O no hydrogen 2.706 N/A SER 477.A OG SER 370.A OG no hydrogen 3.173 N/A GLU 480.A N SER 477.A OG no hydrogen 3.315 N/A ILE 481.A N SER 477.A O no hydrogen 3.070 N/A ASN 482.A N PRO 478.A O no hydrogen 2.864 N/A ARG 483.A N GLY 479.A O no hydrogen 2.870 N/A ARG 483.A NH1 ASN 368.A OD1 no hydrogen 3.227 N/A ARG 483.A NH2 ASN 368.A OD1 no hydrogen 2.798 N/A ARG 483.A NH2 GLU 480.A OE1 no hydrogen 2.950 N/A VAL 484.A N GLU 480.A O no hydrogen 2.929 N/A ALA 485.A N ILE 481.A O no hydrogen 2.993 N/A SER 486.A N ASN 482.A O no hydrogen 2.851 N/A CYS 487.A N ARG 483.A O no hydrogen 3.124 N/A CYS 487.A SG THR 388.A OG1 no hydrogen 3.492 N/A LEU 488.A N VAL 484.A O no hydrogen 2.953 N/A ARG 489.A N ALA 485.A O no hydrogen 3.092 N/A LYS 490.A N SER 486.A O no hydrogen 2.998 N/A LYS 490.A NZ THR 388.A OG1 no hydrogen 2.745 N/A LEU 491.A N CYS 487.A O no hydrogen 3.113 N/A VAL 493.A N LEU 488.A O no hydrogen 2.796 N/A THR 498.A N PRO 495.A O no hydrogen 2.841 N/A TRP 499.A NE1 PRO 494.A O no hydrogen 2.947 N/A ARG 500.A N LEU 496.A O no hydrogen 3.043 N/A HIS 501.A N ARG 497.A O no hydrogen 3.279 N/A HIS 501.A N THR 498.A O no hydrogen 3.060 N/A ARG 502.A N THR 498.A O no hydrogen 3.174 N/A ARG 502.A NH1 SER 29.A O no hydrogen 2.791 N/A ARG 502.A NH2 SER 29.A O no hydrogen 3.524 N/A ALA 503.A N TRP 499.A O no hydrogen 2.782 N/A ARG 504.A N ARG 500.A O no hydrogen 3.287 N/A ARG 504.A NE ALA 528.A O no hydrogen 3.307 N/A SER 505.A N HIS 501.A O no hydrogen 3.486 N/A VAL 506.A N ARG 502.A O no hydrogen 3.043 N/A ARG 507.A N ALA 503.A O no hydrogen 2.733 N/A ARG 507.A NH1 GLY 521.A O no hydrogen 3.487 N/A ARG 507.A NH1 ASN 526.A OD1 no hydrogen 3.178 N/A ALA 508.A N ARG 504.A O no hydrogen 2.939 N/A LYS 509.A N SER 505.A O no hydrogen 2.871 N/A LEU 510.A N VAL 506.A O no hydrogen 2.836 N/A LEU 511.A N ARG 507.A O no hydrogen 2.979 N/A SER 512.A N ALA 508.A O no hydrogen 3.275 N/A SER 512.A OG LYS 509.A O no hydrogen 2.899 N/A GLN 513.A N LEU 510.A O no hydrogen 2.819 N/A GLY 514.A N LEU 511.A O no hydrogen 3.311 N/A ARG 516.A NH1 GLU 454.A OE1 no hydrogen 3.042 N/A THR 519.A N GLY 515.A O no hydrogen 3.172 N/A THR 519.A OG1 GLY 515.A O no hydrogen 3.553 N/A CYS 520.A N ARG 516.A O no hydrogen 3.088 N/A CYS 520.A SG ARG 516.A O no hydrogen 3.602 N/A GLY 521.A N ALA 517.A O no hydrogen 3.217 N/A ARG 522.A N ALA 518.A O no hydrogen 3.017 N/A TYR 523.A N THR 519.A O no hydrogen 2.999 N/A TYR 523.A OH THR 536.A O no hydrogen 2.548 N/A LEU 524.A N CYS 520.A O no hydrogen 3.037 N/A ASN 526.A ND2 LEU 533.A O no hydrogen 2.921 N/A ALA 528.A N PHE 525.A O no hydrogen 3.203 N/A LYS 532.A NZ VAL 529.A O no hydrogen 3.199 N/A LEU 533.A N ASN 526.A OD1 no hydrogen 3.111 N/A ILE 538.A N GLU 463.A OE1 no hydrogen 2.878 N/A ALA 541.A N ILE 538.A O no hydrogen 3.232 N/A GLN 543.A N ALA 540.A O no hydrogen 3.107 N/A SER 547.A OG ASP 545.A OD1 no hydrogen 3.045 N/A GLY 553.A N TYR 190.A OH no hydrogen 3.013 N/A TYR 554.A N TYR 447.A O no hydrogen 2.910 N/A TYR 554.A OH SER 179.A OG no hydrogen 2.590 N/A GLY 557.A N TYR 554.A O no hydrogen 2.680 N/A TYR 560.A N LEU 91.A O no hydrogen 2.818 N/A HIS 561.A N CYS 450.A O no hydrogen 2.874 N/A HIS 561.A ND1 TYR 451.A OH no hydrogen 3.034 N/A HIS 561.A NE2 TYR 175.A OH no hydrogen 2.779 N/A