Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4q86_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLN 2.A NE2 ASP 14.A OD2 no hydrogen 3.250 N/A THR 3.A N GLU 13.A OE1 no hydrogen 2.757 N/A THR 3.A OG1 GLU 13.A OE1 no hydrogen 3.539 N/A THR 3.A OG1 GLU 13.A OE2 no hydrogen 2.502 N/A LYS 8.A N ILE 5.A O no hydrogen 3.312 N/A ASP 9.A N GLU 190.A OE1 no hydrogen 2.780 N/A LEU 12.A N THR 3.A O no hydrogen 2.918 N/A GLU 13.A N GLU 13.A OE1 no hydrogen 2.665 N/A SER 15.A N ALA 11.A O no hydrogen 3.047 N/A SER 15.A OG ALA 11.A O no hydrogen 3.229 N/A SER 15.A OG ASN 186.A OD1 no hydrogen 2.591 N/A ILE 16.A N LEU 12.A O no hydrogen 2.963 N/A ALA 17.A N GLU 13.A O no hydrogen 3.054 N/A ARG 18.A N ASP 14.A O no hydrogen 2.910 N/A ARG 18.A NH1 ASN 186.A O no hydrogen 3.483 N/A ARG 18.A NH2 GLY 378.A O no hydrogen 2.703 N/A PHE 19.A N SER 15.A O no hydrogen 2.829 N/A GLN 20.A N ILE 16.A O no hydrogen 2.871 N/A GLN 21.A N ALA 17.A O no hydrogen 2.930 N/A GLN 21.A NE2 ASP 25.A OD1 no hydrogen 2.783 N/A LYS 22.A N ARG 18.A O no hydrogen 2.957 N/A LEU 23.A N PHE 19.A O no hydrogen 3.003 N/A SER 24.A N GLN 20.A O no hydrogen 3.158 N/A ASP 25.A N GLN 21.A O no hydrogen 2.909 N/A LEU 26.A N LYS 22.A O no hydrogen 2.948 N/A GLY 27.A N SER 24.A O no hydrogen 2.982 N/A PHE 28.A N LEU 23.A O no hydrogen 2.874 N/A GLU 31.A N ARG 48.A O no hydrogen 2.911 N/A ALA 33.A N HIS 46.A O no hydrogen 2.775 N/A TRP 35.A NE1 GLU 32.A OE1 no hydrogen 2.989 N/A LEU 36.A N SER 44.A O no hydrogen 2.915 N/A ASN 41.A ND2 ALA 228.A O no hydrogen 2.776 N/A ASN 41.A ND2 GLU 231.A OE1 no hydrogen 3.105 N/A VAL 42.A N VAL 39.A O no hydrogen 3.284 N/A TRP 43.A N GLY 61.A O no hydrogen 2.834 N/A SER 44.A N LEU 36.A O no hydrogen 3.015 N/A VAL 45.A N GLY 59.A O no hydrogen 3.244 N/A HIS 46.A N SER 34.A O no hydrogen 2.989 N/A HIS 46.A ND1 ASN 58.A OD1 no hydrogen 2.721 N/A ILE 47.A N THR 57.A O no hydrogen 2.976 N/A ARG 48.A N GLU 31.A O no hydrogen 3.007 N/A ARG 48.A NE GLU 31.A OE1 no hydrogen 2.697 N/A ARG 48.A NH2 GLU 31.A OE1 no hydrogen 3.098 N/A ASP 49.A N CYS 55.A O no hydrogen 2.963 N/A LYS 50.A N GLN 29.A O no hydrogen 2.936 N/A GLU 51.A N ASP 49.A OD1 no hydrogen 2.773 N/A CYS 52.A N ASP 49.A O no hydrogen 3.061 N/A CYS 52.A SG SER 567.A OG no hydrogen 3.622 N/A CYS 55.A N CYS 52.A O no hydrogen 3.177 N/A THR 57.A N ILE 47.A O no hydrogen 2.979 N/A THR 57.A OG1 ALA 71.A O no hydrogen 2.875 N/A ASN 58.A N GLU 74.A OE2 no hydrogen 3.317 N/A GLY 59.A N VAL 45.A O no hydrogen 2.793 N/A LYS 60.A N SER 70.A OG no hydrogen 3.015 N/A LYS 60.A NZ ARG 285.A O no hydrogen 3.345 N/A LYS 60.A NZ GLU 289.A OE1 no hydrogen 2.966 N/A GLY 61.A N TRP 43.A O no hydrogen 3.258 N/A LYS 65.A NZ GLU 13.A OE2 no hydrogen 2.945 N/A ALA 66.A N THR 63.A OG1 no hydrogen 3.128 N/A ALA 67.A N THR 63.A O no hydrogen 2.994 N/A LEU 68.A N LYS 64.A O no hydrogen 2.990 N/A ALA 69.A N LYS 65.A O no hydrogen 2.867 N/A SER 70.A N ALA 66.A O no hydrogen 2.994 N/A SER 70.A OG LYS 60.A O no hydrogen 3.401 N/A ALA 71.A N ALA 67.A O no hydrogen 2.950 N/A LEU 72.A N LEU 68.A O no hydrogen 3.041 N/A GLY 73.A N ALA 69.A O no hydrogen 2.803 N/A GLU 74.A N SER 70.A O no hydrogen 2.915 N/A TYR 75.A N ALA 71.A O no hydrogen 2.871 N/A PHE 76.A N LEU 72.A O no hydrogen 2.983 N/A GLU 77.A N GLY 73.A O no hydrogen 2.906 N/A ARG 78.A N GLU 74.A O no hydrogen 2.925 N/A ARG 78.A NE GLU 77.A OE2 no hydrogen 2.921 N/A ARG 78.A NH2 GLU 77.A OE2 no hydrogen 3.346 N/A LEU 79.A N TYR 75.A O no hydrogen 2.858 N/A SER 80.A N PHE 76.A O no hydrogen 2.835 N/A SER 80.A OG PHE 76.A O no hydrogen 2.717 N/A THR 81.A N GLU 77.A O no hydrogen 3.287 N/A THR 81.A OG1 GLU 77.A O no hydrogen 2.802 N/A THR 81.A OG1 ARG 78.A O no hydrogen 3.426 N/A ASN 82.A N LEU 79.A O no hydrogen 3.056 N/A ASN 82.A ND2 HIS 101.A O no hydrogen 3.317 N/A TYR 83.A N ARG 78.A O no hydrogen 2.861 N/A PHE 85.A N ASN 82.A O no hydrogen 3.082 N/A ALA 86.A N TYR 83.A O no hydrogen 3.053 N/A PHE 88.A N PHE 85.A O no hydrogen 3.068 N/A TRP 89.A N GLY 449.A O no hydrogen 2.792 N/A TRP 89.A NE1 SER 145.A O no hydrogen 2.952 N/A LEU 90.A N GLN 144.A O no hydrogen 2.883 N/A GLU 92.A N SER 557.A O no hydrogen 3.006 N/A THR 93.A N ASP 558.A OD1 no hydrogen 3.100 N/A THR 93.A OG1 ASP 558.A OD1 no hydrogen 3.155 N/A THR 93.A OG1 ASP 558.A OD2 no hydrogen 2.579 N/A ALA 95.A N GLY 91.A O no hydrogen 2.952 N/A ASN 96.A N GLU 92.A O no hydrogen 3.075 N/A ASN 96.A N THR 93.A O no hydrogen 3.069 N/A ASN 96.A ND2 GLU 92.A O no hydrogen 2.775 N/A GLY 97.A N ILE 94.A O no hydrogen 3.292 N/A VAL 100.A N GLU 105.A OE2 no hydrogen 2.934 N/A HIS 101.A N GLU 105.A OE1 no hydrogen 2.679 N/A HIS 101.A NE2 ASP 142.A OD2 no hydrogen 2.728 N/A TYR 102.A N GLU 105.A OE1 no hydrogen 2.847 N/A TYR 102.A OH SER 80.A O no hydrogen 2.541 N/A GLU 105.A N TYR 102.A O no hydrogen 3.049 N/A LYS 106.A N GLY 154.A O no hydrogen 3.041 N/A TRP 107.A NE1 GLU 105.A OE2 no hydrogen 2.826 N/A PHE 108.A N ILE 152.A O no hydrogen 2.923 N/A THR 111.A OG1 ASN 113.A OD1 no hydrogen 3.010 N/A THR 111.A OG1 ASP 115.A O no hydrogen 3.093 N/A ASP 114.A N THR 111.A O no hydrogen 3.008 N/A ASP 115.A N ASN 113.A OD1 no hydrogen 3.368 N/A LEU 120.A N PRO 117.A O no hydrogen 3.440 N/A LEU 121.A N TYR 167.A O no hydrogen 2.739 N/A ARG 124.A NH2 ASP 366.A O no hydrogen 2.780 N/A LEU 125.A N ASP 122.A OD1 no hydrogen 2.910 N/A ARG 126.A N ASP 122.A O no hydrogen 2.933 N/A ALA 127.A N ASP 123.A O no hydrogen 3.049 N/A PHE 128.A N ARG 124.A O no hydrogen 2.947 N/A TYR 129.A N LEU 125.A O no hydrogen 2.928 N/A TYR 129.A OH TYR 177.A OH no hydrogen 2.669 N/A ASP 130.A N ARG 126.A O no hydrogen 2.879 N/A ASN 133.A N ASP 130.A O no hydrogen 3.009 N/A GLU 134.A N ASP 130.A OD1 no hydrogen 2.721 N/A LEU 135.A N ASP 130.A OD2 no hydrogen 3.061 N/A GLY 137.A N ASP 114.A O no hydrogen 3.154 N/A SER 138.A N ASP 114.A OD1 no hydrogen 3.063 N/A SER 138.A OG ASP 114.A OD1 no hydrogen 3.505 N/A SER 138.A OG ASP 114.A OD2 no hydrogen 2.524 N/A LEU 140.A N GLY 137.A O no hydrogen 3.000 N/A GLN 144.A NE2 PHE 85.A O no hydrogen 3.140 N/A GLN 144.A NE2 ALA 86.A O no hydrogen 2.886 N/A GLN 144.A NE2 PHE 88.A O no hydrogen 3.067 N/A SER 145.A N ASP 142.A OD2 no hydrogen 2.971 N/A SER 145.A OG ASP 142.A OD1 no hydrogen 2.489 N/A GLY 146.A N ASP 142.A O no hydrogen 2.935 N/A ASN 147.A N SER 145.A OG no hydrogen 2.830 N/A ASN 147.A ND2 ALA 95.A O no hydrogen 3.080 N/A ASN 147.A ND2 ASN 96.A OD1 no hydrogen 3.196 N/A GLU 148.A N GLY 146.A O no hydrogen 3.227 N/A ARG 150.A N ASN 147.A OD1 no hydrogen 3.165 N/A ARG 150.A NH1 ALA 95.A O no hydrogen 2.905 N/A ARG 150.A NH1 GLY 97.A O no hydrogen 2.876 N/A ARG 150.A NH2 GLY 97.A O no hydrogen 2.946 N/A ARG 150.A NH2 PRO 98.A O no hydrogen 2.906 N/A GLY 151.A N ASN 147.A O no hydrogen 3.023 N/A ILE 152.A N PHE 108.A O no hydrogen 2.970 N/A GLY 154.A N LYS 106.A O no hydrogen 2.806 N/A LEU 155.A N ILE 168.A O no hydrogen 2.831 N/A PHE 157.A N VAL 166.A O no hydrogen 2.789 N/A THR 158.A N ILE 371.A O no hydrogen 2.830 N/A ARG 159.A N GLN 164.A O no hydrogen 2.838 N/A ARG 159.A NE ASP 122.A OD2 no hydrogen 3.333 N/A ARG 159.A NH1 ASP 162.A OD1 no hydrogen 3.397 N/A ARG 159.A NH1 ASP 162.A OD2 no hydrogen 2.772 N/A ARG 159.A NH2 ASP 122.A OD2 no hydrogen 2.928 N/A GLN 160.A N VAL 369.A O no hydrogen 2.907 N/A GLN 160.A NE2 THR 158.A O no hydrogen 2.830 N/A SER 161.A N GLU 368.A OE2 no hydrogen 3.082 N/A SER 161.A OG GLU 368.A OE1 no hydrogen 2.590 N/A SER 161.A OG GLU 368.A OE2 no hydrogen 3.264 N/A GLN 164.A N ASP 162.A OD1 no hydrogen 3.139 N/A GLN 164.A NE2 ASP 162.A O no hydrogen 3.467 N/A VAL 166.A N PHE 157.A O no hydrogen 2.753 N/A ILE 168.A N LEU 155.A O no hydrogen 2.917 N/A MET 170.A N CYS 153.A O no hydrogen 2.863 N/A ASN 171.A ND2 ILE 141.A O no hydrogen 3.162 N/A ASN 171.A ND2 ASN 402.A OD1 no hydrogen 2.979 N/A ILE 172.A N PRO 169.A O no hydrogen 2.980 N/A ILE 173.A N PRO 169.A O no hydrogen 3.167 N/A GLY 174.A N MET 170.A O no hydrogen 2.780 N/A ASN 175.A N ASN 171.A O no hydrogen 3.148 N/A ASN 175.A ND2 ASN 171.A O no hydrogen 2.790 N/A ASN 175.A ND2 ASN 402.A OD1 no hydrogen 3.085 N/A ASN 175.A ND2 ASN 403.A OD1 no hydrogen 3.104 N/A LEU 176.A N ILE 172.A O no hydrogen 3.010 N/A TYR 177.A N ILE 173.A O no hydrogen 2.975 N/A TYR 177.A OH TYR 129.A OH no hydrogen 2.669 N/A ASN 180.A N TYR 177.A O no hydrogen 2.788 N/A ASN 180.A ND2 SER 390.A O no hydrogen 2.763 N/A GLY 181.A N GLU 198.A OE1 no hydrogen 2.800 N/A SER 183.A N CYS 382.A O no hydrogen 3.039 N/A SER 183.A OG ALA 184.A O no hydrogen 3.402 N/A SER 183.A OG ALA 191.A O no hydrogen 2.686 N/A GLY 185.A N TYR 380.A O no hydrogen 3.090 N/A ASN 186.A N GLU 190.A OE2 no hydrogen 2.902 N/A ASN 186.A ND2 GLU 190.A OE1 no hydrogen 2.627 N/A THR 187.A OG1 ASP 9.A OD2 no hydrogen 2.768 N/A GLU 190.A N THR 187.A OG1 no hydrogen 3.207 N/A ALA 191.A N THR 187.A O no hydrogen 3.063 N/A ARG 192.A N ARG 188.A O no hydrogen 2.997 N/A ARG 192.A NE TYR 380.A OH no hydrogen 3.024 N/A ARG 192.A NH2 ASP 373.A OD1 no hydrogen 2.883 N/A ARG 192.A NH2 ASP 373.A OD2 no hydrogen 3.379 N/A VAL 193.A N ASN 189.A O no hydrogen 2.868 N/A GLN 194.A N GLU 190.A O no hydrogen 3.103 N/A GLN 194.A NE2 SER 183.A OG no hydrogen 2.908 N/A GLY 195.A N ALA 191.A O no hydrogen 2.962 N/A LEU 196.A N ARG 192.A O no hydrogen 2.856 N/A SER 197.A N VAL 193.A O no hydrogen 2.904 N/A SER 197.A OG VAL 193.A O no hydrogen 2.792 N/A GLU 198.A N GLN 194.A O no hydrogen 2.900 N/A VAL 199.A N GLY 195.A O no hydrogen 3.156 N/A PHE 200.A N LEU 196.A O no hydrogen 3.103 N/A GLU 201.A N SER 197.A O no hydrogen 2.779 N/A ARG 202.A N GLU 198.A O no hydrogen 3.105 N/A ARG 202.A NE ASN 180.A OD1 no hydrogen 2.862 N/A ARG 202.A NH1 GLU 201.A OE2 no hydrogen 3.518 N/A ARG 202.A NH2 ASN 180.A OD1 no hydrogen 3.324 N/A TYR 203.A N VAL 199.A O no hydrogen 2.966 N/A VAL 204.A N PHE 200.A O no hydrogen 2.831 N/A LYS 205.A N GLU 201.A O no hydrogen 2.842 N/A LYS 205.A NZ HIS 321.A O no hydrogen 3.323 N/A ASN 206.A N ARG 202.A O no hydrogen 3.006 N/A ARG 207.A N TYR 203.A O no hydrogen 3.198 N/A ARG 207.A NE GLU 211.A OE2 no hydrogen 2.810 N/A ARG 207.A NH2 GLU 211.A OE1 no hydrogen 2.952 N/A ARG 207.A NH2 GLU 211.A OE2 no hydrogen 3.533 N/A ILE 208.A N VAL 204.A O no hydrogen 2.856 N/A ILE 209.A N LYS 205.A O no hydrogen 2.939 N/A ALA 210.A N ASN 206.A O no hydrogen 2.789 N/A GLU 211.A N ARG 207.A O no hydrogen 2.920 N/A SER 212.A N ILE 209.A O no hydrogen 3.217 N/A ILE 213.A N ILE 208.A O no hydrogen 3.176 N/A SER 214.A N ASP 339.A OD2 no hydrogen 3.003 N/A SER 214.A OG LYS 335.A O no hydrogen 3.360 N/A SER 214.A OG ASP 337.A O no hydrogen 2.890 N/A ILE 218.A N ALA 245.A O no hydrogen 2.930 N/A VAL 222.A N PRO 219.A O no hydrogen 3.086 N/A LEU 223.A N PRO 219.A O no hydrogen 3.200 N/A ALA 224.A N ALA 220.A O no hydrogen 2.960 N/A ARG 225.A N VAL 222.A O no hydrogen 3.081 N/A ARG 225.A NE TYR 226.A OH no hydrogen 3.466 N/A ARG 225.A NH1 ASP 344.A OD2 no hydrogen 2.674 N/A ARG 225.A NH2 TYR 226.A OH no hydrogen 3.213 N/A ARG 225.A NH2 ASP 344.A OD1 no hydrogen 2.773 N/A ARG 225.A NH2 ASP 344.A OD2 no hydrogen 3.457 N/A TYR 226.A N LEU 223.A O no hydrogen 2.815 N/A VAL 230.A N TYR 226.A O no hydrogen 3.088 N/A GLU 231.A N PRO 227.A O no hydrogen 2.915 N/A ALA 232.A N ALA 228.A O no hydrogen 3.267 N/A ILE 233.A N VAL 229.A O no hydrogen 2.988 N/A GLU 234.A N VAL 230.A O no hydrogen 2.895 N/A THR 235.A N GLU 231.A O no hydrogen 3.034 N/A THR 235.A OG1 GLU 231.A O no hydrogen 2.841 N/A LEU 236.A N ALA 232.A O no hydrogen 3.022 N/A GLU 237.A N ILE 233.A O no hydrogen 2.903 N/A ALA 238.A N GLU 234.A O no hydrogen 2.842 N/A GLU 239.A N THR 235.A O no hydrogen 2.880 N/A GLY 240.A N GLU 237.A O no hydrogen 3.089 N/A PHE 241.A N LEU 236.A O no hydrogen 2.987 N/A ILE 243.A N GLU 237.A OE2 no hydrogen 3.006 N/A PHE 244.A N VAL 260.A O no hydrogen 2.808 N/A TYR 246.A N CYS 258.A O no hydrogen 2.769 N/A ASP 247.A N PRO 216.A O no hydrogen 2.897 N/A GLY 248.A N VAL 256.A O no hydrogen 2.883 N/A SER 249.A N ASP 247.A OD1 no hydrogen 2.923 N/A SER 249.A OG ASP 247.A OD1 no hydrogen 2.814 N/A SER 249.A OG ASP 247.A OD2 no hydrogen 3.020 N/A GLY 252.A N SER 249.A OG no hydrogen 2.890 N/A GLN 253.A N SER 249.A O no hydrogen 2.975 N/A GLN 253.A NE2 LEU 250.A O no hydrogen 2.725 N/A TYR 254.A N SER 249.A O no hydrogen 3.136 N/A TYR 254.A OH GLU 365.A OE2 no hydrogen 2.678 N/A VAL 256.A N TYR 254.A O no hydrogen 2.895 N/A ILE 257.A N GLY 274.A O no hydrogen 2.844 N/A CYS 258.A N TYR 246.A O no hydrogen 3.131 N/A CYS 258.A SG SER 272.A O no hydrogen 3.716 N/A VAL 259.A N SER 272.A O no hydrogen 2.848 N/A VAL 260.A N PHE 244.A O no hydrogen 2.860 N/A LEU 261.A N PHE 270.A O no hydrogen 2.874 N/A PHE 262.A N PRO 242.A O no hydrogen 2.891 N/A ASN 263.A N THR 268.A O no hydrogen 2.887 N/A ASN 263.A ND2 LEU 299.A O no hydrogen 3.018 N/A ALA 265.A N ASN 263.A OD1 no hydrogen 3.091 N/A ASN 266.A N ASN 263.A O no hydrogen 3.024 N/A ASN 266.A ND2 THR 268.A OG1 no hydrogen 2.901 N/A ASN 266.A ND2 ASP 300.A O no hydrogen 3.647 N/A THR 268.A N ASN 263.A O no hydrogen 3.430 N/A CYS 269.A N THR 303.A O no hydrogen 3.001 N/A CYS 269.A SG THR 303.A O no hydrogen 3.901 N/A PHE 270.A N LEU 261.A O no hydrogen 2.872 N/A SER 272.A N VAL 259.A O no hydrogen 2.802 N/A SER 272.A OG THR 286.A O no hydrogen 2.715 N/A GLY 274.A N ILE 257.A O no hydrogen 2.970 N/A HIS 276.A N PRO 255.A O no hydrogen 3.130 N/A ASP 278.A N HIS 276.A ND1 no hydrogen 3.132 N/A VAL 281.A N ASP 278.A OD1 no hydrogen 3.257 N/A ALA 282.A N ASP 278.A O no hydrogen 3.015 N/A LEU 283.A N PHE 279.A O no hydrogen 3.012 N/A GLU 284.A N GLY 280.A O no hydrogen 2.962 N/A ARG 285.A N VAL 281.A O no hydrogen 2.929 N/A THR 286.A N ALA 282.A O no hydrogen 3.139 N/A THR 286.A OG1 ILE 257.A O no hydrogen 3.517 N/A THR 286.A OG1 ALA 282.A O no hydrogen 2.704 N/A VAL 287.A N LEU 283.A O no hydrogen 3.312 N/A THR 288.A N GLU 284.A O no hydrogen 2.922 N/A GLU 289.A N ARG 285.A O no hydrogen 2.984 N/A LEU 290.A N THR 286.A O no hydrogen 3.210 N/A GLN 292.A N GLU 289.A O no hydrogen 3.098 N/A GLY 293.A N SER 44.A OG no hydrogen 3.029 N/A ARG 294.A N LEU 291.A O no hydrogen 2.979 N/A GLY 295.A N ASP 298.A OD2 no hydrogen 2.871 N/A ASP 298.A N GLY 295.A O no hydrogen 3.047 N/A THR 303.A OG1 PRO 304.A O no hydrogen 3.399 N/A THR 303.A OG1 GLY 327.A O no hydrogen 3.330 N/A THR 306.A N ILE 329.A O no hydrogen 2.989 N/A ASP 308.A N THR 306.A OG1 no hydrogen 2.924 N/A GLU 311.A N ASP 308.A OD1 no hydrogen 3.041 N/A VAL 312.A N ASP 308.A O no hydrogen 3.414 N/A ALA 313.A N ASP 309.A O no hydrogen 3.255 N/A ALA 313.A N GLU 310.A O no hydrogen 3.164 N/A GLU 314.A N GLU 310.A O no hydrogen 3.004 N/A HIS 315.A ND1 GLU 319.A OE2 no hydrogen 2.844 N/A ASN 317.A ND2 VAL 312.A O no hydrogen 2.895 N/A ASN 317.A ND2 LEU 328.A O no hydrogen 3.117 N/A LEU 318.A N GLU 314.A O no hydrogen 3.309 N/A GLU 319.A N HIS 315.A O no hydrogen 2.816 N/A THR 320.A N THR 316.A O no hydrogen 2.885 N/A THR 320.A OG1 THR 316.A O no hydrogen 3.085 N/A HIS 321.A N ASN 317.A O no hydrogen 3.006 N/A HIS 321.A NE2 LEU 328.A O no hydrogen 2.772 N/A PHE 322.A N LEU 318.A O no hydrogen 3.025 N/A ILE 323.A N GLU 319.A O no hydrogen 2.917 N/A ASP 324.A N THR 320.A O no hydrogen 2.848 N/A SER 325.A N HIS 321.A O no hydrogen 2.997 N/A SER 326.A N ASP 324.A OD1 no hydrogen 2.941 N/A SER 326.A OG ASP 324.A OD1 no hydrogen 2.681 N/A LEU 328.A N ASN 317.A OD1 no hydrogen 2.692 N/A TRP 331.A N THR 306.A O no hydrogen 2.904 N/A ASP 332.A N SER 330.A OG no hydrogen 3.117 N/A LEU 333.A N SER 330.A O no hydrogen 3.175 N/A PHE 334.A N TRP 331.A O no hydrogen 2.877 N/A LYS 335.A N ASP 332.A O no hydrogen 3.207 N/A ASP 339.A N SER 214.A O no hydrogen 2.748 N/A VAL 343.A N ASP 247.A OD2 no hydrogen 3.111 N/A TRP 345.A NE1 ASP 247.A OD1 no hydrogen 2.862 N/A PHE 347.A N PRO 277.A O no hydrogen 2.937 N/A SER 348.A N ASN 346.A OD1 no hydrogen 2.686 N/A SER 348.A OG ASN 346.A OD1 no hydrogen 2.370 N/A GLY 349.A N GLU 354.A OE2 no hydrogen 3.342 N/A THR 350.A N GLU 353.A OE1 no hydrogen 3.003 N/A THR 351.A OG1 ASP 9.A OD1 no hydrogen 3.466 N/A THR 351.A OG1 ASP 9.A OD2 no hydrogen 2.541 N/A GLU 353.A N THR 350.A OG1 no hydrogen 3.078 N/A GLU 354.A N THR 350.A O no hydrogen 2.734 N/A PHE 355.A N THR 351.A O no hydrogen 2.906 N/A ALA 356.A N GLU 352.A O no hydrogen 3.281 N/A THR 357.A N GLU 353.A O no hydrogen 2.779 N/A THR 357.A OG1 GLU 353.A O no hydrogen 2.840 N/A LEU 358.A N GLU 354.A O no hydrogen 2.932 N/A MET 359.A N PHE 355.A O no hydrogen 2.958 N/A ALA 360.A N ALA 356.A O no hydrogen 2.975 N/A PHE 362.A N LEU 358.A O no hydrogen 3.224 N/A ASN 363.A N MET 359.A O no hydrogen 2.788 N/A LYS 364.A N ALA 360.A O no hydrogen 2.901 N/A GLU 365.A N ILE 361.A O no hydrogen 2.936 N/A ASP 366.A N ASN 363.A O no hydrogen 2.855 N/A LYS 367.A N PHE 362.A O no hydrogen 3.068 N/A VAL 369.A N GLU 368.A OE2 no hydrogen 3.304 N/A TYR 370.A N ILE 385.A O no hydrogen 2.857 N/A TYR 370.A OH ASP 122.A OD2 no hydrogen 2.696 N/A ILE 371.A N THR 158.A O no hydrogen 3.020 N/A ALA 372.A N ARG 383.A O no hydrogen 2.936 N/A TYR 374.A N ALA 381.A O no hydrogen 2.809 N/A GLY 378.A N GLU 375.A O no hydrogen 2.973 N/A TYR 380.A OH ASP 373.A OD1 no hydrogen 2.199 N/A ALA 381.A N TYR 374.A O no hydrogen 2.854 N/A CYS 382.A N SER 183.A O no hydrogen 2.828 N/A ARG 383.A N ALA 372.A O no hydrogen 2.970 N/A ARG 383.A NH2 VAL 178.A O no hydrogen 3.101 N/A ILE 384.A N GLY 181.A O no hydrogen 2.935 N/A ILE 385.A N TYR 370.A O no hydrogen 2.880 N/A VAL 386.A N SER 390.A OG no hydrogen 2.942 N/A GLY 388.A N ASP 391.A OD1 no hydrogen 2.712 N/A MET 389.A N VAL 386.A O no hydrogen 2.788 N/A SER 390.A N VAL 386.A O no hydrogen 2.897 N/A ILE 392.A N LEU 176.A O no hydrogen 2.764 N/A TYR 393.A N LEU 176.A O no hydrogen 3.221 N/A ASP 397.A N PRO 394.A O no hydrogen 2.928 N/A LEU 398.A N ALA 395.A O no hydrogen 2.930 N/A TRP 399.A N GLU 396.A O no hydrogen 2.963 N/A LEU 400.A N GLU 396.A O no hydrogen 2.982 N/A ALA 401.A N ASP 397.A O no hydrogen 2.835 N/A ASN 402.A ND2 ASN 171.A OD1 no hydrogen 3.067 N/A ASN 402.A ND2 LEU 398.A O no hydrogen 2.943 N/A ASN 403.A N ASN 175.A OD1 no hydrogen 2.865 N/A SER 404.A N ASN 402.A OD1 no hydrogen 3.072 N/A SER 404.A OG ILE 141.A O no hydrogen 3.019 N/A SER 404.A OG ASN 402.A OD1 no hydrogen 3.140 N/A MET 405.A N ASN 402.A O no hydrogen 2.953 N/A SER 407.A N SER 404.A O no hydrogen 3.106 N/A HIS 408.A NE2 GLU 436.A OE1 no hydrogen 2.670 N/A LEU 409.A N GLY 406.A O no hydrogen 3.092 N/A ARG 410.A N SER 407.A O no hydrogen 3.033 N/A ARG 410.A NE LEU 448.A O no hydrogen 3.000 N/A ARG 410.A NH1 SER 407.A OG no hydrogen 3.050 N/A ARG 410.A NH2 LEU 448.A O no hydrogen 3.191 N/A ILE 413.A N LEU 409.A O no hydrogen 2.978 N/A LEU 414.A N ARG 410.A O no hydrogen 2.891 N/A SER 415.A N GLU 411.A O no hydrogen 3.114 N/A SER 415.A N THR 412.A O no hydrogen 3.215 N/A SER 415.A OG THR 412.A O no hydrogen 2.723 N/A LEU 416.A N ILE 413.A O no hydrogen 3.089 N/A SER 419.A N LEU 416.A O no hydrogen 2.929 N/A SER 419.A OG LEU 416.A O no hydrogen 2.714 N/A SER 419.A OG TYR 426.A OH no hydrogen 2.479 N/A TRP 421.A N TYR 426.A OH no hydrogen 3.190 N/A ASP 425.A N GLU 422.A O no hydrogen 2.886 N/A TYR 426.A OH SER 419.A OG no hydrogen 2.479 N/A LEU 427.A N LYS 423.A O no hydrogen 3.230 N/A ASN 428.A N GLU 424.A O no hydrogen 2.815 N/A LEU 429.A N ASP 425.A O no hydrogen 3.058 N/A ILE 430.A N TYR 426.A O no hydrogen 3.353 N/A GLU 431.A N LEU 427.A O no hydrogen 3.305 N/A GLN 432.A N ASN 428.A O no hydrogen 2.906 N/A GLN 432.A NE2 GLU 436.A OE2 no hydrogen 2.956 N/A LEU 433.A N LEU 429.A O no hydrogen 2.981 N/A ASP 434.A N ILE 430.A O no hydrogen 3.096 N/A GLU 435.A N GLU 431.A O no hydrogen 2.792 N/A GLU 436.A N GLN 432.A O no hydrogen 2.844 N/A GLY 437.A N ASP 434.A O no hydrogen 2.889 N/A PHE 438.A N LEU 433.A O no hydrogen 3.363 N/A PHE 441.A N ASP 439.A OD1 no hydrogen 2.795 N/A THR 442.A N ASP 439.A O no hydrogen 3.052 N/A THR 442.A OG1 ASP 439.A O no hydrogen 3.084 N/A ARG 443.A NH1 GLU 446.A OE1 no hydrogen 3.552 N/A ARG 443.A NH1 GLU 446.A OE2 no hydrogen 3.123 N/A VAL 444.A N LEU 461.A O no hydrogen 2.922 N/A ARG 445.A NE TYR 459.A O no hydrogen 2.909 N/A GLU 446.A N ARG 443.A O no hydrogen 3.049 N/A LEU 447.A N ARG 443.A O no hydrogen 2.937 N/A LEU 448.A N VAL 444.A O no hydrogen 2.929 N/A GLY 449.A N GLU 446.A O no hydrogen 3.298 N/A LEU 450.A N ARG 445.A O no hydrogen 2.766 N/A ALA 451.A N HIS 565.A ND1 no hydrogen 3.167 N/A THR 452.A OG1 GLY 453.A O no hydrogen 2.761 N/A ASN 456.A ND2 THR 452.A O no hydrogen 2.904 N/A GLY 457.A N GLY 551.A O no hydrogen 3.041 N/A TRP 458.A N ASN 456.A OD1 no hydrogen 2.750 N/A TRP 458.A NE1 GLN 553.A O no hydrogen 2.986 N/A TYR 459.A N ASN 456.A O no hydrogen 3.290 N/A TYR 459.A N ASN 456.A OD1 no hydrogen 3.298 N/A ARG 462.A NE ASN 491.A OD1 no hydrogen 2.964 N/A ARG 462.A NH1 PHE 441.A O no hydrogen 2.754 N/A ILE 463.A N THR 442.A O no hydrogen 3.000 N/A GLY 464.A N ASP 440.A O no hydrogen 2.924 N/A LEU 466.A N ARG 462.A O no hydrogen 2.922 N/A LYS 467.A N ILE 463.A O no hydrogen 2.879 N/A LYS 467.A NZ ASP 434.A OD1 no hydrogen 2.655 N/A LYS 467.A NZ ASP 440.A OD1 no hydrogen 2.703 N/A ALA 468.A N GLY 464.A O no hydrogen 3.212 N/A MET 469.A N GLU 465.A O no hydrogen 3.040 N/A LEU 470.A N LEU 466.A O no hydrogen 2.862 N/A ALA 471.A N LYS 467.A O no hydrogen 2.882 N/A LEU 472.A N ALA 468.A O no hydrogen 3.078 N/A ALA 473.A N MET 469.A O no hydrogen 2.967 N/A GLY 474.A N LEU 470.A O no hydrogen 2.795 N/A GLY 475.A N LEU 472.A O no hydrogen 3.019 N/A ASP 476.A N ALA 471.A O no hydrogen 2.827 N/A GLN 479.A N ASP 476.A OD1 no hydrogen 3.061 N/A GLN 479.A NE2 ASP 476.A OD2 no hydrogen 2.974 N/A ALA 480.A N ASP 476.A O no hydrogen 2.866 N/A LEU 481.A N LEU 477.A O no hydrogen 3.057 N/A VAL 482.A N GLU 478.A O no hydrogen 3.149 N/A TRP 483.A N GLN 479.A O no hydrogen 3.087 N/A THR 484.A N ALA 480.A O no hydrogen 2.825 N/A THR 484.A OG1 ALA 480.A O no hydrogen 2.569 N/A GLU 485.A N LEU 481.A O no hydrogen 2.913 N/A TRP 486.A N VAL 482.A O no hydrogen 3.087 N/A THR 487.A N TRP 483.A O no hydrogen 2.930 N/A THR 487.A OG1 TRP 483.A O no hydrogen 2.659 N/A MET 488.A N THR 484.A O no hydrogen 3.127 N/A GLU 489.A N GLU 485.A O no hydrogen 2.838 N/A PHE 490.A N TRP 486.A O no hydrogen 2.974 N/A ASN 491.A ND2 THR 487.A O no hydrogen 3.008 N/A SER 492.A N MET 488.A O no hydrogen 3.255 N/A SER 492.A OG MET 488.A O no hydrogen 2.924 N/A VAL 494.A N ASN 491.A O no hydrogen 2.877 N/A PHE 495.A N ASN 491.A O no hydrogen 3.289 N/A PHE 495.A N SER 492.A O no hydrogen 3.233 N/A SER 496.A OG GLU 498.A OE1 no hydrogen 3.451 N/A ARG 499.A N SER 496.A OG no hydrogen 3.249 N/A ARG 499.A NH1 TYR 550.A O no hydrogen 2.871 N/A ARG 499.A NH2 GLU 465.A OE2 no hydrogen 2.661 N/A ARG 499.A NH2 TYR 550.A O no hydrogen 3.100 N/A ALA 500.A N SER 496.A O no hydrogen 2.922 N/A ASN 501.A N PRO 497.A O no hydrogen 2.909 N/A ASN 501.A ND2 TYR 531.A O no hydrogen 2.893 N/A TYR 502.A N GLU 498.A O no hydrogen 3.064 N/A TYR 503.A N ARG 499.A O no hydrogen 3.122 N/A TYR 503.A OH GLU 465.A OE2 no hydrogen 2.737 N/A ARG 504.A N ALA 500.A O no hydrogen 2.963 N/A CYS 505.A N ASN 501.A O no hydrogen 3.024 N/A CYS 505.A SG ALA 535.A O no hydrogen 3.684 N/A LEU 506.A N TYR 502.A O no hydrogen 2.881 N/A GLN 507.A N TYR 503.A O no hydrogen 2.950 N/A THR 508.A N ARG 504.A O no hydrogen 2.900 N/A THR 508.A OG1 ARG 504.A O no hydrogen 3.071 N/A THR 508.A OG1 TYR 531.A OH no hydrogen 2.536 N/A LEU 509.A N CYS 505.A O no hydrogen 2.977 N/A LEU 510.A N LEU 506.A O no hydrogen 2.892 N/A LEU 511.A N GLN 507.A O no hydrogen 2.863 N/A LEU 512.A N THR 508.A O no hydrogen 2.914 N/A ALA 513.A N LEU 509.A O no hydrogen 2.970 N/A GLN 514.A N LEU 511.A O no hydrogen 3.022 N/A GLU 515.A N LEU 512.A O no hydrogen 2.866 N/A GLU 516.A N GLU 516.A OE2 no hydrogen 2.582 N/A ARG 518.A N GLU 515.A O no hydrogen 3.188 N/A ARG 518.A NE GLU 515.A OE1 no hydrogen 3.211 N/A ARG 518.A NH2 GLU 515.A OE1 no hydrogen 3.333 N/A GLN 522.A N GLN 519.A O no hydrogen 2.936 N/A TYR 523.A N PRO 520.A O no hydrogen 3.092 N/A PHE 527.A N TYR 523.A O no hydrogen 2.857 N/A VAL 528.A N LEU 524.A O no hydrogen 2.863 N/A ARG 529.A N ASN 525.A O no hydrogen 3.023 N/A MET 530.A N ALA 526.A O no hydrogen 2.858 N/A TYR 531.A N PHE 527.A O no hydrogen 2.834 N/A TYR 531.A OH THR 508.A OG1 no hydrogen 2.536 N/A GLY 532.A N VAL 528.A O no hydrogen 2.917 N/A VAL 536.A N GLY 532.A O no hydrogen 3.193 N/A GLU 537.A N ALA 533.A O no hydrogen 2.861 N/A ALA 538.A N ASP 534.A O no hydrogen 2.774 N/A ALA 539.A N ALA 535.A O no hydrogen 2.873 N/A SER 540.A N VAL 536.A O no hydrogen 3.033 N/A SER 540.A OG VAL 536.A O no hydrogen 2.580 N/A ALA 541.A N GLU 537.A O no hydrogen 2.945 N/A ALA 542.A N ALA 538.A O no hydrogen 2.903 N/A MET 543.A N ALA 539.A O no hydrogen 3.028 N/A SER 544.A N SER 540.A O no hydrogen 2.945 N/A SER 544.A OG SER 540.A O no hydrogen 3.449 N/A SER 544.A OG ALA 541.A O no hydrogen 2.822 N/A GLY 545.A N ALA 542.A O no hydrogen 3.182 N/A GLU 546.A N ALA 541.A O no hydrogen 3.089 N/A ALA 547.A N ALA 541.A O no hydrogen 3.127 N/A LEU 552.A N PHE 549.A O no hydrogen 3.005 N/A GLN 553.A N GLN 553.A OE1 no hydrogen 2.862 N/A GLN 553.A NE2 ALA 561.A O no hydrogen 3.225 N/A SER 557.A OG GLU 92.A OE1 no hydrogen 3.275 N/A ASP 558.A N ASP 556.A OD2 no hydrogen 3.196 N/A LEU 559.A N ASP 556.A O no hydrogen 3.106 N/A HIS 560.A N ASP 556.A OD2 no hydrogen 2.997 N/A ALA 561.A N ASP 556.A OD1 no hydrogen 3.186 N/A PHE 562.A N LEU 559.A O no hydrogen 3.115 N/A GLN 566.A N PHE 562.A O no hydrogen 2.996 N/A SER 567.A N ALA 563.A O no hydrogen 2.949 N/A SER 567.A OG ALA 564.A O no hydrogen 2.633 N/A LEU 568.A N ALA 564.A O no hydrogen 3.056 N/A LEU 569.A N HIS 565.A O no hydrogen 2.910 N/A LYS 570.A N GLN 566.A O no hydrogen 2.966 N/A ALA 571.A N SER 567.A O no hydrogen 3.173 N/A TYR 572.A N LEU 568.A O no hydrogen 2.920 N/A TYR 572.A OH VAL 100.A O no hydrogen 2.563 N/A GLU 573.A N LEU 569.A O no hydrogen 2.821 N/A LYS 574.A N LYS 570.A O no hydrogen 3.340 N/A LYS 574.A NZ GLY 27.A O no hydrogen 2.798 N/A LYS 574.A NZ GLU 51.A OE1 no hydrogen 3.031 N/A GLN 576.A N TYR 572.A O no hydrogen 2.799 N/A GLN 576.A NE2 PHE 99.A O no hydrogen 3.029 N/A GLN 576.A NE2 VAL 100.A O no hydrogen 3.413 N/A ARG 577.A N GLU 573.A O no hydrogen 2.946 N/A ALA 578.A N LYS 574.A O no hydrogen 3.315 N/A LYS 579.A N LEU 575.A O no hydrogen 2.892 N/A LYS 579.A NZ ASN 82.A OD1 no hydrogen 2.952 N/A LYS 579.A NZ HIS 101.A O no hydrogen 2.661 N/A LYS 579.A NZ GLN 576.A OE1 no hydrogen 2.826 N/A ALA 580.A N GLN 576.A O no hydrogen 2.963 N/A ALA 581.A N ARG 577.A O no hydrogen 2.993 N/A PHE 582.A N ALA 578.A O no hydrogen 2.987 N/A