Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3p1u_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ARG 5.A NH1.A SER 66.A OG no hydrogen 3.324 N/A LEU 6.A N ASN 2.A O no hydrogen 3.009 N/A ALA 7.A N GLU 3.A O no hydrogen 2.909 N/A SER 8.A N PRO 4.A O no hydrogen 3.334 N/A SER 8.A OG ARG 5.A O no hydrogen 2.665 N/A THR 9.A OG1 LEU 6.A O no hydrogen 2.655 N/A LEU 10.A N ALA 7.A O no hydrogen 3.420 N/A ARG 11.A NE PRO 212.A O no hydrogen 2.781 N/A ARG 11.A NH2 PRO 212.A O no hydrogen 3.034 N/A GLY 12.A N SER 8.A O no hydrogen 2.992 N/A GLY 13.A N THR 9.A O no hydrogen 2.763 N/A ILE 15.A N ARG 11.A O no hydrogen 3.071 N/A ILE 15.A N GLY 12.A O no hydrogen 3.068 N/A GLY 18.A N GLU 21.A OE1 no hydrogen 3.088 N/A ASN 19.A N GLU 17.A OE1 no hydrogen 2.995 N/A VAL 20.A N GLU 17.A OE2 no hydrogen 2.806 N/A GLU 21.A N GLU 17.A OE1 no hydrogen 2.831 N/A ARG 23.A NH1 ASN 19.A O no hydrogen 2.956 N/A LEU 24.A N GLU 21.A O no hydrogen 3.265 N/A LYS 25.A N GLU 21.A O no hydrogen 2.834 N/A LYS 25.A NZ ASP 30.A OD1 no hydrogen 2.753 N/A LYS 25.A NZ TYR 225.A OH no hydrogen 2.794 N/A LYS 25.A NZ PRO 418.A O no hydrogen 2.731 N/A LEU 27.A N GLN 22.A O no hydrogen 3.155 N/A GLN 28.A N LYS 25.A O no hydrogen 3.338 N/A GLN 28.A NE2 ARG 23.A O no hydrogen 2.751 N/A GLN 28.A NE2 ASN 53.A OD1 no hydrogen 3.169 N/A ILE 29.A N LEU 24.A O no hydrogen 3.022 N/A ASP 30.A N LYS 25.A O no hydrogen 2.870 N/A TYR 32.A N GLN 28.A O no hydrogen 2.923 N/A TYR 32.A OH GLN 28.A OE1 no hydrogen 2.734 N/A SER 33.A N ILE 29.A O no hydrogen 3.039 N/A SER 33.A OG ILE 29.A O no hydrogen 2.782 N/A SER 33.A OG ASP 30.A O no hydrogen 3.476 N/A GLN 34.A NE2 ASP 437.A O no hydrogen 3.013 N/A THR 35.A OG1 ASP 30.A OD2 no hydrogen 2.595 N/A VAL 36.A N CYS 236.A O no hydrogen 2.667 N/A GLY 38.A N PRO 234.A O no hydrogen 2.993 N/A GLY 39.A N ASP 37.A OD1 no hydrogen 2.795 N/A THR 43.A OG1 LEU 27.A O no hydrogen 2.556 N/A LYS 44.A N TRP 41.A O no hydrogen 3.185 N/A LYS 44.A NZ ASP 37.A O no hydrogen 2.798 N/A LYS 44.A NZ GLY 39.A O no hydrogen 2.792 N/A ASN 45.A N GLY 42.A O no hydrogen 2.880 N/A ASN 45.A ND2 PRO 297.A O no hydrogen 2.756 N/A ASN 45.A ND2 TYR 441.A O no hydrogen 2.924 N/A TYR 46.A N THR 43.A O no hydrogen 2.954 N/A ILE 47.A N GLY 42.A O no hydrogen 2.982 N/A GLN 48.A NE2 TYR 32.A OH no hydrogen 3.141 N/A TRP 52.A N ASP 49.A OD1 no hydrogen 2.963 N/A ASN 53.A N ASP 49.A O no hydrogen 3.080 N/A ASN 53.A ND2 GLN 48.A OE1 no hydrogen 2.796 N/A ASN 53.A ND2 ARG 464.A O no hydrogen 3.030 N/A ASN 54.A N ASP 50.A O no hydrogen 3.000 N/A LEU 55.A N GLU 51.A O no hydrogen 3.377 N/A VAL 56.A N TRP 52.A O no hydrogen 2.983 N/A TRP 57.A N ASN 53.A O no hydrogen 2.864 N/A GLU 58.A N ASN 54.A O no hydrogen 2.889 N/A GLU 59.A N LEU 55.A O no hydrogen 2.979 N/A TYR 60.A N VAL 56.A O no hydrogen 3.142 N/A LEU 61.A N TRP 57.A O no hydrogen 3.269 N/A LYS 62.A N GLU 58.A O no hydrogen 2.893 N/A GLN 63.A N GLU 59.A O no hydrogen 2.979 N/A GLN 63.A NE2 GLU 59.A OE2 no hydrogen 2.800 N/A ILE 64.A N TYR 60.A O no hydrogen 2.875 N/A ALA 65.A N LEU 61.A O no hydrogen 2.902 N/A SER 66.A N LYS 62.A O no hydrogen 3.074 N/A ILE 67.A N GLN 63.A O no hydrogen 3.019 N/A ASN 68.A N ILE 64.A O no hydrogen 2.888 N/A ASN 68.A ND2 PRO 109.A O no hydrogen 2.702 N/A ILE 69.A N ALA 65.A O no hydrogen 2.965 N/A VAL 70.A N SER 66.A O no hydrogen 3.435 N/A ILE 71.A N ILE 67.A O no hydrogen 2.999 N/A ARG 72.A N ASN 68.A O no hydrogen 2.972 N/A ARG 72.A NH1 TYR 111.A O no hydrogen 3.309 N/A SER 73.A N ILE 69.A O no hydrogen 3.138 N/A SER 73.A OG ILE 69.A O no hydrogen 2.966 N/A SER 73.A OG VAL 70.A O no hydrogen 3.025 N/A LEU 74.A N VAL 70.A O no hydrogen 2.964 N/A THR 75.A N ILE 71.A O no hydrogen 3.054 N/A THR 75.A OG1 ILE 71.A O no hydrogen 2.694 N/A THR 75.A OG1 ARG 72.A O no hydrogen 2.924 N/A GLU 76.A N ARG 72.A O no hydrogen 3.297 N/A LYS 77.A N SER 73.A O no hydrogen 2.881 N/A ASP 78.A N LEU 74.A O no hydrogen 2.810 N/A ALA 81.A N ASP 80.A OD1.B no hydrogen 2.818 N/A TYR 82.A N ASP 78.A O no hydrogen 3.103 N/A ASN 84.A ND2 ASN 142.A O no hydrogen 2.850 N/A ASN 84.A ND2 GLN 146.A O no hydrogen 2.910 N/A THR 85.A OG1 ILE 148.A O no hydrogen 2.714 N/A ILE 86.A N TYR 82.A O no hydrogen 2.951 N/A ALA 87.A N ALA 83.A O no hydrogen 2.870 N/A PHE 88.A N ASN 84.A O no hydrogen 3.212 N/A ALA 89.A N THR 85.A O no hydrogen 2.952 N/A ARG 90.A N ILE 86.A O no hydrogen 2.917 N/A ARG 90.A NE GLU 133.A OE1 no hydrogen 3.169 N/A ARG 90.A NH2 GLU 133.A OE2 no hydrogen 3.221 N/A ILE 91.A N ALA 87.A O no hydrogen 3.210 N/A TRP 92.A N PHE 88.A O no hydrogen 2.966 N/A TRP 92.A NE1 THR 9.A O no hydrogen 2.851 N/A ARG 93.A N ALA 89.A O no hydrogen 2.948 N/A ARG 93.A NE ASN 68.A OD1 no hydrogen 2.831 N/A ARG 93.A NH1 GLU 129.A OE2 no hydrogen 3.204 N/A ARG 93.A NH2 PRO 109.A O no hydrogen 2.788 N/A ARG 93.A NH2 GLU 129.A OE2 no hydrogen 3.207 N/A VAL 94.A N ARG 90.A O no hydrogen 3.238 N/A TYR 95.A N ILE 91.A O no hydrogen 2.984 N/A VAL 96.A N TRP 92.A O no hydrogen 2.995 N/A HIS 97.A N ARG 93.A O no hydrogen 3.301 N/A HIS 97.A ND1 TYR 130.A OH no hydrogen 2.637 N/A HIS 97.A NE2 PRO 107.A O no hydrogen 2.985 N/A THR 98.A N VAL 94.A O no hydrogen 3.079 N/A THR 98.A OG1 TYR 95.A O no hydrogen 2.544 N/A ALA 100.A N HIS 97.A O no hydrogen 3.077 N/A ALA 101.A N HIS 97.A O no hydrogen 2.778 N/A ASP 102.A N THR 98.A O no hydrogen 2.865 N/A LYS 103.A N ALA 100.A O no hydrogen 3.176 N/A LYS 103.A NZ TYR 60.A OH no hydrogen 3.255 N/A LYS 103.A NZ LEU 99.A O no hydrogen 2.815 N/A LYS 103.A NZ GLN 422.A OE1 no hydrogen 2.799 N/A PHE 104.A N ALA 100.A O no hydrogen 3.094 N/A GLY 105.A N ALA 101.A O no hydrogen 2.948 N/A ALA 110.A N GLU 115.A OE1 no hydrogen 2.962 N/A TYR 111.A OH GLU 133.A OE1 no hydrogen 3.051 N/A TYR 111.A OH GLU 133.A OE2 no hydrogen 3.020 N/A GLU 112.A N GLU 112.A OE1 no hydrogen 2.801 N/A ASN 117.A ND2 ASN 473.A OD1 no hydrogen 2.812 N/A TYR 120.A N GLU 476.A OE1 no hydrogen 3.163 N/A TYR 120.A OH GLU 469.A OE1 no hydrogen 2.680 N/A LYS 124.A NZ ASP 128.A OD2 no hydrogen 2.937 N/A ASP 125.A N SER 122.A OG no hydrogen 3.256 N/A ILE 126.A N SER 122.A O no hydrogen 2.841 N/A TYR 127.A N LEU 123.A O no hydrogen 2.797 N/A TYR 127.A OH ASP 102.A OD1 no hydrogen 2.743 N/A ASP 128.A N LYS 124.A O no hydrogen 2.829 N/A GLU 129.A N ASP 125.A O no hydrogen 3.024 N/A TYR 130.A N ILE 126.A O no hydrogen 3.070 N/A TYR 130.A OH HIS 97.A ND1 no hydrogen 2.637 N/A PHE 131.A N TYR 127.A O no hydrogen 3.388 N/A ARG 132.A N ASP 128.A O no hydrogen 3.381 N/A GLU 133.A N GLU 129.A O no hydrogen 2.801 N/A LEU 134.A N TYR 130.A O no hydrogen 2.860 N/A ASP 135.A N PHE 131.A O no hydrogen 2.863 N/A ALA 136.A N ARG 132.A O no hydrogen 3.192 N/A ALA 137.A N GLU 133.A O no hydrogen 2.951 N/A ILE 138.A N LEU 134.A O no hydrogen 3.068 N/A ASN 139.A N ASP 135.A O no hydrogen 3.248 N/A GLY 140.A N ALA 137.A O no hydrogen 3.200 N/A ASN 142.A N ASN 84.A OD1 no hydrogen 2.868 N/A SER 144.A N ASN 142.A OD1 no hydrogen 3.285 N/A ALA 145.A N ASN 142.A O no hydrogen 3.115 N/A GLN 146.A N ALA 81.A O no hydrogen 2.771 N/A PHE 149.A N ASN 160.A OD1 no hydrogen 2.941 N/A SER 150.A N GLU 3.A OE2 no hydrogen 2.641 N/A SER 150.A OG GLU 3.A OE1 no hydrogen 2.716 N/A SER 150.A OG GLU 3.A OE2 no hydrogen 3.145 N/A ILE 154.A N ASP 151.A O no hydrogen 3.157 N/A ASP 155.A N ALA 152.A O no hydrogen 3.218 N/A ILE 157.A N ASP 155.A OD1 no hydrogen 3.278 N/A TYR 158.A N ASP 155.A OD1 no hydrogen 3.321 N/A TYR 158.A OH ASP 208.A O no hydrogen 2.714 N/A LYS 159.A N ASP 155.A O no hydrogen 3.027 N/A ASN 160.A N ASP 155.A OD2 no hydrogen 2.787 N/A ASN 160.A ND2 PHE 149.A O no hydrogen 2.967 N/A ASP 161.A N TYR 158.A O no hydrogen 3.109 N/A SER 163.A OG ASP 161.A OD1 no hydrogen 2.568 N/A LYS 164.A N ASP 161.A OD1 no hydrogen 3.282 N/A LYS 164.A NZ ALA 207.A O no hydrogen 3.236 N/A TRP 165.A N ASP 161.A O no hydrogen 3.274 N/A TRP 165.A NE1 ASP 155.A OD2 no hydrogen 2.769 N/A LYS 166.A N VAL 162.A O no hydrogen 2.932 N/A ARG 167.A N SER 163.A O no hydrogen 3.089 N/A ARG 167.A NH1 LEU 202.A O no hydrogen 2.827 N/A PHE 168.A N LYS 164.A O no hydrogen 3.030 N/A ALA 169.A N TRP 165.A O no hydrogen 2.940 N/A ASN 170.A N LYS 166.A O no hydrogen 2.898 N/A ASN 170.A ND2 ALA 195.A O no hydrogen 2.530 N/A ASN 170.A ND2 GLY 201.A O no hydrogen 3.083 N/A SER 171.A N ARG 167.A O no hydrogen 2.787 N/A SER 171.A OG ARG 167.A O no hydrogen 2.779 N/A LEU 172.A N PHE 168.A O no hydrogen 2.863 N/A ARG 173.A N ALA 169.A O no hydrogen 3.017 N/A ARG 173.A NE ASN 170.A OD1 no hydrogen 3.219 N/A ARG 173.A NH2 ASN 170.A OD1 no hydrogen 3.281 N/A LEU 174.A N ASN 170.A O no hydrogen 3.024 N/A ARG 175.A N SER 171.A O no hydrogen 2.863 N/A ARG 175.A NE GLU 337.A OE2 no hydrogen 2.732 N/A ARG 175.A NH2 LEU 332.A O no hydrogen 3.224 N/A ARG 175.A NH2 GLU 337.A OE1 no hydrogen 3.018 N/A ARG 175.A NH2 GLU 337.A OE2 no hydrogen 3.354 N/A LEU 176.A N LEU 172.A O no hydrogen 2.869 N/A ALA 177.A N ARG 173.A O no hydrogen 2.913 N/A VAL 178.A N LEU 174.A O no hydrogen 3.128 N/A ARG 179.A N ARG 175.A O no hydrogen 3.311 N/A ARG 179.A NE TYR 127.A OH no hydrogen 2.941 N/A ARG 179.A NH1 GLU 423.A OE1 no hydrogen 3.092 N/A ARG 179.A NH2 ASP 102.A OD2 no hydrogen 3.175 N/A LEU 180.A N ALA 177.A O no hydrogen 2.999 N/A THR 181.A N VAL 178.A O no hydrogen 3.268 N/A THR 181.A OG1 VAL 178.A O no hydrogen 3.373 N/A THR 181.A OG1 GLU 182.A OE2 no hydrogen 2.874 N/A ASP 184.A N LEU 180.A O no hydrogen 3.028 N/A GLN 185.A NE2 GLU 182.A O no hydrogen 3.654 N/A LYS 187.A N ASP 184.A OD1 no hydrogen 3.100 N/A LYS 187.A NZ ASP 128.A OD1 no hydrogen 2.867 N/A LYS 187.A NZ ASP 128.A OD2 no hydrogen 3.168 N/A CYS 188.A N ASP 184.A O no hydrogen 2.920 N/A CYS 188.A SG ALA 177.A O no hydrogen 3.382 N/A ILE 189.A N GLN 185.A O no hydrogen 2.963 N/A ALA 190.A N GLU 186.A O no hydrogen 3.040 N/A GLU 191.A N LYS 187.A O no hydrogen 2.857 N/A ALA 192.A N CYS 188.A O no hydrogen 2.960 N/A ASN 193.A N ILE 189.A O no hydrogen 2.833 N/A ALA 194.A N ALA 190.A O no hydrogen 3.150 N/A ALA 195.A N GLU 191.A O no hydrogen 3.025 N/A ILE 196.A N ALA 192.A O no hydrogen 2.879 N/A SER 197.A N ASN 193.A O no hydrogen 2.890 N/A SER 197.A OG ASN 193.A O no hydrogen 2.835 N/A ALA 200.A N SER 198.A OG no hydrogen 3.328 N/A GLY 201.A N SER 198.A O no hydrogen 3.273 N/A ILE 203.A N SER 171.A OG no hydrogen 3.002 N/A SER 204.A OG ASP 208.A OD2 no hydrogen 3.520 N/A ASP 208.A N ASP 205.A O no hydrogen 2.939 N/A ASN 209.A N LYS 206.A O no hydrogen 3.343 N/A ASN 209.A ND2 TYR 211.A OH no hydrogen 3.069 N/A ALA 210.A N PHE 333.A O no hydrogen 2.809 N/A ALA 215.A N GLN 221.A O no hydrogen 2.932 N/A SER 218.A N ASP 216.A OD1 no hydrogen 3.266 N/A SER 218.A OG ASP 216.A OD1 no hydrogen 3.068 N/A SER 218.A OG ASP 216.A OD2 no hydrogen 3.403 N/A GLN 221.A N SER 218.A O no hydrogen 3.355 N/A TYR 223.A N LYS 326.A O no hydrogen 2.753 N/A TYR 223.A OH ASP 419.A OD1 no hydrogen 2.745 N/A ASN 224.A N TYR 330.A OH no hydrogen 2.909 N/A ASN 224.A ND2 ILE 16.A O no hydrogen 2.985 N/A ASN 224.A ND2 GLU 21.A OE1 no hydrogen 2.619 N/A ASN 224.A ND2 GLY 220.A O no hydrogen 3.066 N/A TYR 225.A OH ASP 30.A OD2 no hydrogen 2.637 N/A THR 226.A N TYR 223.A O no hydrogen 3.013 N/A THR 226.A OG1 TYR 223.A O no hydrogen 2.732 N/A GLN 228.A N TYR 225.A O no hydrogen 2.997 N/A GLN 228.A NE2 LEU 315.A O no hydrogen 2.830 N/A ILE 229.A N THR 226.A O no hydrogen 3.032 N/A THR 230.A N THR 226.A O no hydrogen 3.118 N/A THR 230.A OG1 THR 226.A O no hydrogen 3.442 N/A SER 232.A N ILE 229.A O no hydrogen 3.225 N/A GLY 233.A N PHE 227.A O no hydrogen 3.341 N/A ILE 235.A N GLN 228.A OE1 no hydrogen 3.076 N/A CYS 236.A N VAL 36.A O no hydrogen 2.766 N/A CYS 236.A SG SER 309.A O no hydrogen 3.340 N/A SER 237.A OG GLN 34.A O no hydrogen 2.713 N/A LYS 238.A N LEU 293.A O no hydrogen 3.062 N/A LYS 238.A NZ.A GLU 241.A OE1 no hydrogen 3.289 N/A LYS 238.A NZ.B GLU 241.A OE1 no hydrogen 3.439 N/A SER 239.A OG GLN 34.A OE1 no hydrogen 2.676 N/A VAL 240.A N SER 237.A OG no hydrogen 3.163 N/A GLU 241.A N SER 237.A O no hydrogen 3.092 N/A LYS 242.A N LYS 238.A O no hydrogen 3.001 N/A LYS 242.A NZ ASP 437.A OD1 no hydrogen 2.823 N/A LYS 242.A NZ ASP 437.A OD2 no hydrogen 3.150 N/A LEU 243.A N SER 239.A O no hydrogen 3.113 N/A VAL 244.A N VAL 240.A O no hydrogen 2.865 N/A THR 245.A N GLU 241.A O no hydrogen 2.959 N/A THR 245.A OG1 GLU 241.A O no hydrogen 2.578 N/A ASN 246.A N LYS 272.A O no hydrogen 2.768 N/A ASN 246.A ND2 GLU 384.A OE1 no hydrogen 3.140 N/A ASN 246.A ND2 LYS 385.A O no hydrogen 2.781 N/A ILE 247.A N THR 245.A O no hydrogen 2.667 N/A GLY 249.A N ASN 246.A O no hydrogen 3.066 N/A TRP 252.A N GLU 271.A O no hydrogen 2.753 N/A ASN 258.A N VAL 263.A O no hydrogen 2.821 N/A ASN 258.A ND2 PRO 283.A O no hydrogen 2.793 N/A ASN 258.A ND2 GLU 314.A OE2 no hydrogen 2.888 N/A GLN 259.A N GLN 282.A OE1 no hydrogen 2.904 N/A THR 260.A N ASN 258.A OD1 no hydrogen 2.937 N/A SER 261.A N ASN 258.A OD1 no hydrogen 2.948 N/A SER 261.A OG ASN 258.A OD1 no hydrogen 3.196 N/A SER 261.A OG ILE 285.A O no hydrogen 2.835 N/A GLY 262.A N ASN 258.A O no hydrogen 2.875 N/A VAL 265.A N VAL 256.A O no hydrogen 2.924 N/A SER 266.A N GLY 288.A O no hydrogen 2.805 N/A SER 266.A OG ASP 289.A OD1 no hydrogen 2.589 N/A VAL 268.A N SER 266.A OG no hydrogen 3.206 N/A HIS 269.A ND1 PRO 270.A O no hydrogen 2.989 N/A LYS 272.A NZ GLU 271.A OE2 no hydrogen 2.796 N/A VAL 273.A N VAL 250.A O no hydrogen 2.957 N/A ASP 274.A N VAL 244.A O no hydrogen 2.897 N/A ARG 276.A N ASP 274.A OD1 no hydrogen 2.978 N/A ARG 276.A NE ASP 274.A OD1 no hydrogen 2.949 N/A ARG 276.A NH1 SER 366.A OG no hydrogen 2.813 N/A ARG 276.A NH2 ASP 274.A OD2 no hydrogen 2.776 N/A ARG 276.A NH2 GLN 411.A OE1 no hydrogen 2.771 N/A ALA 277.A N ASP 274.A O no hydrogen 3.035 N/A LYS 279.A N ARG 276.A O no hydrogen 2.956 N/A LYS 279.A NZ TRP 370.A O no hydrogen 3.527 N/A LYS 279.A NZ GLY 371.A O no hydrogen 2.925 N/A ILE 280.A N ARG 276.A O no hydrogen 2.878 N/A ILE 280.A N ALA 277.A O no hydrogen 3.158 N/A PHE 281.A N ALA 277.A O no hydrogen 2.813 N/A GLN 282.A N GLU 314.A O no hydrogen 2.621 N/A GLN 282.A NE2 GLU 314.A OE2 no hydrogen 2.853 N/A GLY 284.A N ASP 289.A O no hydrogen 2.813 N/A GLU 286.A N LYS 310.A O no hydrogen 2.921 N/A ASN 287.A ND2 ASP 289.A OD2 no hydrogen 2.918 N/A GLY 288.A N GLY 284.A O no hydrogen 3.084 N/A ASP 289.A N ASN 287.A OD1 no hydrogen 3.155 N/A TRP 290.A N VAL 268.A O no hydrogen 2.929 N/A TRP 290.A NE1 PHE 281.A O no hydrogen 2.917 N/A LYS 291.A NZ ASP 289.A OD2 no hydrogen 2.999 N/A LYS 291.A NZ GLN 311.A O no hydrogen 2.786 N/A GLY 292.A N GLU 241.A OE1 no hydrogen 2.716 N/A GLU 300.A N GLU 300.A OE1 no hydrogen 2.817 N/A GLU 301.A N LYS 298.A O no hydrogen 2.794 N/A ALA 302.A N ALA 299.A O no hydrogen 3.223 N/A ASN 303.A N TYR 307.A O no hydrogen 3.121 N/A THR 304.A N GLU 301.A O no hydrogen 3.335 N/A THR 304.A OG1 GLU 301.A O no hydrogen 2.542 N/A TYR 307.A N THR 304.A O no hydrogen 2.927 N/A GLN 308.A NE2 GLY 305.A O no hydrogen 2.835 N/A SER 309.A N ASN 303.A OD1 no hydrogen 3.414 N/A SER 309.A OG ASN 303.A OD1 no hydrogen 2.739 N/A GLN 311.A N GLN 308.A O no hydrogen 2.972 N/A GLN 311.A NE2 GLU 286.A OE1 no hydrogen 3.219 N/A CYS 312.A N SER 309.A O no hydrogen 3.423 N/A CYS 312.A SG GLN 308.A O no hydrogen 3.531 N/A ALA 313.A N LYS 291.A O no hydrogen 2.842 N/A GLU 314.A N GLN 282.A O no hydrogen 2.863 N/A LEU 315.A N GLN 228.A OE1 no hydrogen 3.102 N/A LEU 315.A N ILE 235.A O no hydrogen 3.140 N/A GLY 316.A N ILE 280.A O no hydrogen 2.796 N/A PHE 317.A N ILE 280.A O no hydrogen 3.299 N/A ILE 319.A N GLY 316.A O no hydrogen 3.278 N/A LYS 320.A N TYR 323.A O no hydrogen 2.774 N/A LYS 320.A NZ TYR 325.A OH no hydrogen 3.451 N/A TYR 323.A N LYS 320.A O no hydrogen 3.101 N/A TYR 325.A N ILE 318.A O no hydrogen 2.600 N/A LYS 326.A N PRO 324.A O no hydrogen 2.879 N/A ARG 328.A N TYR 325.A O no hydrogen 3.383 N/A ARG 328.A NH1 ASP 419.A OD2 no hydrogen 2.876 N/A ARG 328.A NH2 ASP 331.A OD2 no hydrogen 2.937 N/A TYR 330.A OH GLU 21.A OE2 no hydrogen 2.839 N/A TYR 330.A OH ASP 222.A O no hydrogen 3.340 N/A ASP 331.A N ASP 419.A OD2 no hydrogen 2.831 N/A LEU 332.A N ALA 210.A O no hydrogen 2.888 N/A PHE 333.A N ALA 210.A O no hydrogen 3.263 N/A SER 335.A N ASN 209.A OD1 no hydrogen 2.835 N/A SER 335.A OG GLU 336.A OE1 no hydrogen 3.233 N/A GLU 336.A N GLU 336.A OE1 no hydrogen 2.689 N/A GLU 337.A N LEU 334.A O no hydrogen 3.089 N/A HIS 339.A N SER 335.A O no hydrogen 3.311 N/A HIS 339.A ND1 GLU 358.A OE1 no hydrogen 2.772 N/A PHE 340.A N GLU 336.A O no hydrogen 3.080 N/A LEU 341.A N GLU 337.A O no hydrogen 2.722 N/A LYS 342.A N VAL 338.A O no hydrogen 3.104 N/A LYS 342.A NZ GLU 358.A OE2 no hydrogen 3.251 N/A ALA 343.A N HIS 339.A O no hydrogen 2.788 N/A GLU 344.A N PHE 340.A O no hydrogen 3.072 N/A LEU 345.A N LEU 341.A O no hydrogen 3.348 N/A TYR 346.A N LYS 342.A O no hydrogen 2.972 N/A ALA 347.A N ALA 343.A O no hydrogen 2.897 N/A ARG 348.A N GLU 344.A O no hydrogen 3.035 N/A ARG 348.A NH1 THR 181.A OG1 no hydrogen 3.299 N/A ARG 348.A NH1 GLU 182.A OE2 no hydrogen 3.102 N/A ARG 348.A NH1 GLU 344.A OE2 no hydrogen 3.101 N/A ARG 348.A NH2 GLU 182.A OE2 no hydrogen 2.899 N/A GLY 349.A N TYR 346.A O no hydrogen 3.466 N/A PHE 350.A N LEU 345.A O no hydrogen 3.024 N/A ILE 351.A N LEU 345.A O no hydrogen 3.242 N/A LYS 356.A NZ ASP 395.A OD2 no hydrogen 2.954 N/A SER 357.A N ASP 354.A OD1 no hydrogen 3.219 N/A GLU 358.A N ASP 354.A O no hydrogen 3.327 N/A TYR 359.A N ALA 355.A O no hydrogen 2.864 N/A TYR 359.A OH ALA 392.A O no hydrogen 2.667 N/A GLU 360.A N LYS 356.A O no hydrogen 2.928 N/A ALA 361.A N SER 357.A O no hydrogen 3.028 N/A GLY 362.A N GLU 358.A O no hydrogen 3.027 N/A VAL 363.A N TYR 359.A O no hydrogen 3.095 N/A ARG 364.A N GLU 360.A O no hydrogen 2.905 N/A ARG 364.A NH1 ASP 377.A OD1 no hydrogen 2.760 N/A ARG 364.A NH2 ASP 377.A OD1 no hydrogen 2.814 N/A ALA 365.A N ALA 361.A O no hydrogen 3.137 N/A SER 366.A N GLY 362.A O no hydrogen 3.161 N/A PHE 367.A N VAL 363.A O no hydrogen 2.970 N/A ALA 368.A N ARG 364.A O no hydrogen 3.071 N/A THR 369.A N ALA 365.A O no hydrogen 2.990 N/A THR 369.A OG1 GLU 336.A OE2 no hydrogen 2.742 N/A THR 369.A OG1 ALA 365.A O no hydrogen 2.869 N/A TRP 370.A N SER 366.A O no hydrogen 2.979 N/A GLY 371.A N ALA 368.A O no hydrogen 3.223 N/A VAL 372.A N PHE 367.A O no hydrogen 2.707 N/A GLU 375.A N VAL 372.A O no hydrogen 3.025 N/A VAL 376.A N THR 373.A O no hydrogen 3.164 N/A TYR 379.A N GLU 375.A O no hydrogen 3.072 N/A TYR 379.A OH ASP 274.A OD2 no hydrogen 2.602 N/A LEU 380.A N VAL 376.A O no hydrogen 2.925 N/A THR 381.A OG1 ASP 377.A O no hydrogen 3.112 N/A THR 381.A OG1 ASP 378.A O no hydrogen 3.267 N/A SER 382.A N TYR 379.A O no hydrogen 3.243 N/A GLU 384.A N SER 382.A OG no hydrogen 3.215 N/A LYS 385.A NZ GLN 398.A O no hydrogen 3.292 N/A ASN 386.A N THR 390.A O no hydrogen 2.807 N/A ASN 386.A ND2 LEU 243.A O no hydrogen 3.011 N/A GLU 387.A N LYS 242.A O no hydrogen 2.822 N/A ALA 388.A N ASN 386.A OD1 no hydrogen 3.013 N/A GLY 389.A N ASN 386.A O no hydrogen 2.980 N/A THR 390.A N ASN 386.A OD1 no hydrogen 2.753 N/A THR 390.A OG1 GLY 401.A O no hydrogen 2.549 N/A SER 391.A N ASN 402.A OD1 no hydrogen 2.963 N/A SER 391.A OG ASP 396.A OD2 no hydrogen 2.767 N/A SER 391.A OG ASN 402.A OD1 no hydrogen 3.186 N/A ARG 393.A N SER 382.A O no hydrogen 3.243 N/A ARG 393.A NH1 THR 381.A O no hydrogen 3.014 N/A ASP 396.A N ARG 393.A O no hydrogen 3.219 N/A GLN 397.A N ASP 395.A O no hydrogen 3.040 N/A GLN 397.A NE2 TYR 394.A O no hydrogen 3.009 N/A GLY 401.A N THR 504.A OG1 no hydrogen 3.008 N/A ASN 402.A N GLY 399.A O no hydrogen 3.231 N/A ASN 402.A ND2 SER 391.A OG no hydrogen 3.379 N/A ASN 402.A ND2 ASP 396.A OD2 no hydrogen 3.437 N/A ASN 402.A ND2 GLN 398.A O no hydrogen 2.815 N/A THR 403.A N GLU 406.A OE1 no hydrogen 3.165 N/A THR 403.A OG1 GLU 406.A OE1 no hydrogen 2.660 N/A LYS 407.A N THR 403.A O no hydrogen 3.082 N/A LYS 407.A NZ SER 391.A O no hydrogen 2.926 N/A LYS 407.A NZ ARG 393.A O no hydrogen 2.809 N/A LYS 407.A NZ ASP 396.A O no hydrogen 2.741 N/A LYS 407.A NZ ASN 402.A OD1 no hydrogen 2.778 N/A ILE 408.A N ALA 404.A O no hydrogen 3.173 N/A ILE 409.A N LEU 405.A O no hydrogen 3.029 N/A THR 410.A N GLU 406.A O no hydrogen 2.938 N/A THR 410.A OG1 GLU 406.A O no hydrogen 2.611 N/A GLN 411.A N LYS 407.A O no hydrogen 2.997 N/A GLN 411.A NE2 TYR 379.A OH no hydrogen 2.803 N/A LYS 412.A N ILE 408.A O no hydrogen 2.767 N/A LYS 412.A NZ ASP 427.A OD1 no hydrogen 3.570 N/A LYS 412.A NZ ASP 427.A OD2 no hydrogen 2.809 N/A TYR 413.A N ILE 409.A O no hydrogen 2.775 N/A TYR 413.A OH SER 33.A O no hydrogen 2.603 N/A ILE 414.A N THR 410.A O no hydrogen 3.131 N/A ALA 415.A N GLN 411.A O no hydrogen 3.094 N/A GLY 416.A N TYR 413.A O no hydrogen 2.899 N/A ILE 417.A N ILE 414.A O no hydrogen 3.277 N/A LEU 420.A N GLY 416.A O no hydrogen 2.899 N/A ALA 421.A N PRO 418.A O no hydrogen 3.186 N/A GLN 422.A NE2 ASN 426.A OD1 no hydrogen 3.236 N/A GLY 424.A N LEU 420.A O no hydrogen 2.893 N/A TRP 425.A N ALA 421.A O no hydrogen 2.739 N/A TRP 425.A NE1 ILE 461.A O no hydrogen 3.106 N/A ASN 426.A N GLN 422.A O no hydrogen 2.819 N/A ASN 426.A ND2 ASP 102.A OD2 no hydrogen 3.053 N/A ASN 426.A ND2 GLU 423.A OE2 no hydrogen 2.991 N/A ASP 427.A N GLU 423.A O no hydrogen 2.991 N/A LYS 428.A N GLY 424.A O no hydrogen 3.157 N/A LYS 428.A NZ ASN 432.A O no hydrogen 2.953 N/A LYS 428.A NZ ASN 432.A OD1 no hydrogen 2.931 N/A LYS 428.A NZ PRO 434.A O no hydrogen 2.958 N/A ARG 429.A N TRP 425.A O no hydrogen 3.059 N/A ARG 429.A NE TRP 425.A O no hydrogen 3.256 N/A ARG 429.A NH1 ASP 102.A O no hydrogen 2.700 N/A ARG 429.A NH1 LYS 462.A O no hydrogen 2.986 N/A ARG 429.A NH2 ASP 102.A O no hydrogen 2.930 N/A ARG 430.A N ASN 426.A O no hydrogen 2.898 N/A ARG 430.A NH1 THR 181.A OG1 no hydrogen 2.777 N/A ARG 430.A NH1 GLU 344.A OE2 no hydrogen 2.686 N/A ARG 430.A NH2 GLU 344.A OE1 no hydrogen 2.907 N/A ARG 430.A NH2 GLU 344.A OE2 no hydrogen 3.485 N/A ARG 430.A NH2 ASP 427.A OD1 no hydrogen 2.795 N/A LEU 431.A N ASP 427.A O no hydrogen 2.906 N/A ASN 432.A ND2 ILE 454.A O no hydrogen 3.154 N/A ASN 432.A ND2 ASN 501.A OD1 no hydrogen 2.752 N/A ARG 435.A NE LYS 507.A O no hydrogen 2.727 N/A ARG 435.A NH1 ASP 437.A OD1 no hydrogen 2.640 N/A ARG 435.A NH2 ASP 437.A OD1 no hydrogen 3.019 N/A ARG 435.A NH2 LYS 507.A OXT no hydrogen 2.968 N/A ASP 437.A N SER 239.A OG no hydrogen 2.688 N/A VAL 440.A N TYR 295.A O no hydrogen 3.112 N/A TYR 441.A N GLY 296.A O no hydrogen 2.621 N/A ARG 442.A N ASN 449.A OD1 no hydrogen 2.913 N/A ARG 442.A NH1 ASN 459.A O no hydrogen 3.164 N/A ARG 442.A NH1 ASN 459.A OD1 no hydrogen 3.064 N/A ARG 442.A NH2 ASP 451.A O no hydrogen 2.683 N/A ASP 443.A N ASN 45.A O no hydrogen 2.880 N/A ALA 445.A N ASP 443.A OD1 no hydrogen 3.230 N/A VAL 446.A N ASP 443.A O no hydrogen 2.871 N/A TYR 447.A N ASP 443.A O no hydrogen 2.670 N/A ASN 449.A ND2 ARG 442.A O no hydrogen 3.527 N/A ASN 450.A N ASN 448.A OD1 no hydrogen 3.231 N/A ASP 451.A N ASN 448.A O no hydrogen 3.029 N/A LYS 452.A NZ VAL 440.A O no hydrogen 3.545 N/A LYS 452.A NZ ASN 449.A O no hydrogen 2.688 N/A ASP 453.A N ASP 451.A OD1 no hydrogen 3.486 N/A LEU 455.A N ASP 453.A OD1 no hydrogen 2.963 N/A LYS 456.A N ASP 453.A O no hydrogen 3.182 N/A LYS 456.A NZ ASP 451.A OD2 no hydrogen 2.762 N/A ASN 459.A N LYS 456.A O no hydrogen 3.138 N/A ASN 459.A ND2 ASP 451.A OD1 no hydrogen 3.288 N/A ASN 459.A ND2 ASP 453.A O no hydrogen 2.694 N/A PHE 460.A N SER 457.A O no hydrogen 3.191 N/A LYS 462.A N VAL 490.A O no hydrogen 2.849 N/A LYS 462.A NZ SER 457.A O no hydrogen 3.455 N/A LYS 462.A NZ SER 457.A OG no hydrogen 2.802 N/A LYS 462.A NZ ASP 497.A OD1 no hydrogen 3.401 N/A LYS 462.A NZ ASP 497.A OD2 no hydrogen 2.781 N/A LYS 462.A NZ ASN 499.A OD1 no hydrogen 3.065 N/A ARG 463.A N VAL 490.A O no hydrogen 3.191 N/A ARG 463.A NE PHE 104.A O no hydrogen 3.143 N/A ARG 463.A NH1 ASP 488.A OD1 no hydrogen 2.804 N/A ARG 463.A NH1 ILE 489.A O no hydrogen 2.983 N/A ARG 463.A NH2 PHE 104.A O no hydrogen 3.110 N/A ARG 463.A NH2 ASP 488.A OD1 no hydrogen 3.024 N/A ARG 464.A N GLN 48.A OE1 no hydrogen 3.271 N/A TYR 465.A N ASP 488.A OD1 no hydrogen 3.028 N/A TYR 465.A OH PRO 106.A O no hydrogen 2.460 N/A THR 467.A N ASP 50.A OD1 no hydrogen 2.762 N/A THR 467.A OG1 ASP 50.A OD2 no hydrogen 2.624 N/A LYS 468.A NZ ASN 54.A OD1 no hydrogen 3.165 N/A LYS 468.A NZ GLU 58.A OE2 no hydrogen 3.418 N/A LYS 468.A NZ GLU 469.A OE2 no hydrogen 2.761 N/A GLU 469.A N PRO 466.A O no hydrogen 3.064 N/A SER 470.A N THR 467.A O no hydrogen 3.224 N/A SER 470.A OG THR 467.A O no hydrogen 2.589 N/A LEU 471.A N LYS 468.A O no hydrogen 3.188 N/A ILE 472.A N LYS 468.A O no hydrogen 3.019 N/A ASN 473.A N GLU 469.A O no hydrogen 3.188 N/A ASN 473.A ND2 GLU 469.A OE1 no hydrogen 2.816 N/A TYR 477.A N ASN 473.A O no hydrogen 2.898 N/A TYR 477.A OH ASP 488.A OD2 no hydrogen 2.704 N/A GLU 478.A N ALA 474.A O no hydrogen 2.931 N/A LYS 479.A N THR 475.A O no hydrogen 3.307 N/A GLY 480.A N GLU 476.A O no hydrogen 3.063 N/A LYS 481.A N TYR 477.A O no hydrogen 2.900 N/A SER 482.A N GLU 478.A O no hydrogen 2.845 N/A SER 482.A OG GLU 478.A O no hydrogen 2.888 N/A GLY 484.A N LYS 481.A O no hydrogen 3.075 N/A LYS 486.A NZ.B SER 491.A OG no hydrogen 2.765 N/A GLY 487.A N GLY 484.A O no hydrogen 3.214 N/A ILE 489.A N GLY 487.A O no hydrogen 3.044 N/A THR 492.A OG1 GLY 487.A O no hydrogen 2.751 N/A ASP 497.A N LEU 494.A O no hydrogen 2.849 N/A ASN 499.A N ASP 497.A OD1 no hydrogen 2.773 N/A SER 500.A OG GLU 182.A OE1 no hydrogen 2.772 N/A ASN 501.A ND2 CYS 503.A O no hydrogen 3.253 N/A TYR 502.A N LEU 431.A O no hydrogen 2.997 N/A CYS 503.A N ASN 501.A OD1 no hydrogen 3.061 N/A CYS 503.A SG SER 505.A OG no hydrogen 3.735 N/A THR 504.A N GLU 406.A OE2 no hydrogen 2.769 N/A THR 504.A OG1 GLU 406.A OE1 no hydrogen 2.642 N/A THR 504.A OG1 GLU 406.A OE2 no hydrogen 3.314 N/A SER 505.A OG ALA 388.A O no hydrogen 2.856 N/A