Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3vgg_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): TYR 1.A OH ILE 82.A O no hydrogen 2.962 N/A LYS 2.A N ILE 9.A O no hydrogen 3.073 N/A ILE 3.A N GLU 84.A OE2 no hydrogen 3.184 N/A ASP 4.A N GLU 7.A O no hydrogen 3.060 N/A VAL 8.A N LEU 44.A O no hydrogen 2.670 N/A ILE 9.A N LYS 2.A O no hydrogen 2.992 N/A PHE 10.A N ILE 42.A O no hydrogen 2.873 N/A LEU 12.A N PHE 40.A O no hydrogen 3.017 N/A TRP 13.A NE1 LYS 37.A O no hydrogen 3.294 N/A ALA 14.A N GLY 38.A O no hydrogen 2.792 N/A TYR 16.A N LEU 200.A O no hydrogen 2.827 N/A GLN 17.A N ALA 14.A O no hydrogen 2.878 N/A GLN 17.A NE2 LYS 199.A O no hydrogen 2.995 N/A LYS 18.A N ASP 58.A OD1 no hydrogen 3.140 N/A LYS 18.A N ASP 58.A OD2 no hydrogen 2.940 N/A SER 19.A N ASP 58.A OD1 no hydrogen 2.886 N/A SER 19.A OG LYS 18.A O no hydrogen 2.895 N/A SER 19.A OG GLU 31.A OE2 no hydrogen 3.309 N/A LYS 21.A N VAL 56.A O no hydrogen 2.851 N/A LYS 21.A NZ SER 19.A O no hydrogen 3.565 N/A LYS 21.A NZ GLU 31.A OE1 no hydrogen 3.430 N/A LEU 22.A N TYR 30.A O no hydrogen 2.678 N/A LYS 23.A N LYS 54.A O no hydrogen 3.060 N/A LYS 23.A NZ GLU 62.A OE1 no hydrogen 2.945 N/A LYS 23.A NZ GLU 62.A OE2 no hydrogen 3.213 N/A VAL 24.A N GLY 28.A O no hydrogen 3.083 N/A LEU 25.A N ARG 52.A O no hydrogen 3.117 N/A LYS 27.A N VAL 24.A O no hydrogen 2.849 N/A LYS 27.A NZ ASP 51.A OD1 no hydrogen 2.940 N/A LYS 27.A NZ ASP 51.A OD2 no hydrogen 3.148 N/A GLY 28.A N VAL 24.A O no hydrogen 3.169 N/A TYR 30.A N LEU 22.A O no hydrogen 2.556 N/A MET 32.A N VAL 20.A O no hydrogen 3.231 N/A GLU 33.A N THR 41.A O no hydrogen 2.830 N/A ARG 34.A NE GLN 17.A O no hydrogen 3.116 N/A ARG 34.A NH2 GLN 17.A O no hydrogen 3.120 N/A ASP 35.A N TYR 39.A O no hydrogen 2.989 N/A LYS 37.A N ASP 35.A OD1 no hydrogen 3.028 N/A GLY 38.A N ASP 35.A O no hydrogen 2.857 N/A TYR 39.A OH GLU 225.A OE2 no hydrogen 2.970 N/A PHE 40.A N LEU 12.A O no hydrogen 2.798 N/A THR 41.A N GLU 33.A O no hydrogen 2.677 N/A THR 41.A OG1 GLU 33.A O no hydrogen 3.566 N/A ILE 42.A N PHE 10.A O no hydrogen 3.129 N/A LEU 44.A N VAL 8.A O no hydrogen 2.871 N/A ASN 46.A ND2 TYR 30.A OH no hydrogen 3.492 N/A LYS 48.A N ASP 51.A OD1 no hydrogen 2.729 N/A ARG 50.A N ILE 81.A O no hydrogen 2.845 N/A ASP 51.A N LYS 48.A O no hydrogen 3.112 N/A ARG 52.A NE GLN 80.A OE1 no hydrogen 3.110 N/A ARG 52.A NH2 GLN 80.A OE1 no hydrogen 3.473 N/A TYR 53.A N SER 79.A O no hydrogen 2.905 N/A TYR 53.A OH ASP 65.A OD2 no hydrogen 2.717 N/A LYS 54.A N LYS 23.A O no hydrogen 3.081 N/A LYS 54.A NZ HIS 76.A O no hydrogen 3.199 N/A TYR 55.A N ILE 63.A O no hydrogen 2.895 N/A VAL 56.A N LYS 21.A O no hydrogen 2.773 N/A LEU 57.A N SER 61.A O no hydrogen 2.820 N/A ALA 60.A N LEU 57.A O no hydrogen 2.801 N/A SER 61.A OG ASP 59.A OD2 no hydrogen 3.307 N/A ILE 63.A N TYR 55.A O no hydrogen 2.950 N/A ASP 65.A N SER 79.A OG no hydrogen 2.711 N/A ALA 67.A N ASP 65.A OD1 no hydrogen 2.844 N/A SER 68.A N ASP 65.A O no hydrogen 2.701 N/A ARG 69.A NE ALA 67.A O no hydrogen 2.913 N/A TYR 70.A N SER 68.A OG no hydrogen 3.220 N/A GLY 74.A N GLN 71.A O no hydrogen 2.983 N/A HIS 76.A ND1 TYR 196.A OH no hydrogen 2.652 N/A HIS 76.A NE2 GLU 193.A OE2 no hydrogen 2.818 N/A GLY 77.A N GLY 74.A O no hydrogen 3.182 N/A SER 79.A N TYR 53.A O no hydrogen 2.932 N/A SER 79.A OG SER 68.A OG no hydrogen 3.385 N/A SER 79.A OG GLN 71.A OE1 no hydrogen 3.490 N/A GLN 80.A N TYR 70.A O no hydrogen 2.949 N/A ILE 81.A N ASP 51.A O no hydrogen 2.832 N/A ILE 82.A N TYR 1.A OH no hydrogen 2.818 N/A SER 85.A OG GLU 87.A OE2 no hydrogen 3.510 N/A THR 92.A OG1 ASP 244.A OD1 no hydrogen 2.862 N/A LEU 94.A N THR 92.A OG1 no hydrogen 3.088 N/A LYS 95.A NZ GLU 97.A OE1 no hydrogen 3.286 N/A LYS 95.A NZ ASP 98.A OD2 no hydrogen 3.316 N/A LYS 96.A NZ ASP 300.A O no hydrogen 3.064 N/A LYS 96.A NZ CYS 364.A O no hydrogen 3.277 N/A ASP 98.A N LYS 95.A O no hydrogen 2.840 N/A LEU 99.A N LYS 96.A O no hydrogen 3.145 N/A ILE 100.A N THR 131.A OG1 no hydrogen 2.791 N/A ILE 101.A N PRO 408.A O no hydrogen 3.070 N/A TYR 102.A N ALA 132.A O no hydrogen 2.904 N/A TYR 102.A OH GLU 415.A OE1 no hydrogen 3.109 N/A TYR 102.A OH GLU 415.A OE2 no hydrogen 2.807 N/A GLU 103.A N ILE 410.A O no hydrogen 2.766 N/A ILE 104.A N GLU 134.A O no hydrogen 2.755 N/A HIS 105.A ND1 THR 108.A OG1 no hydrogen 2.898 N/A HIS 105.A NE2 ASP 146.A O no hydrogen 2.816 N/A THR 108.A N HIS 105.A ND1 no hydrogen 3.139 N/A THR 108.A N HIS 105.A O no hydrogen 2.984 N/A THR 108.A OG1 HIS 105.A ND1 no hydrogen 2.898 N/A THR 108.A OG1 HIS 105.A O no hydrogen 3.559 N/A PHE 109.A N HIS 105.A O no hydrogen 2.924 N/A GLU 112.A N GLU 112.A OE2 no hydrogen 2.790 N/A GLY 113.A N THR 110.A O no hydrogen 2.801 N/A PHE 115.A N TYR 161.A O no hydrogen 2.999 N/A GLY 117.A N THR 114.A O no hydrogen 2.832 N/A VAL 118.A N THR 114.A O no hydrogen 3.288 N/A ILE 119.A N PHE 115.A O no hydrogen 2.863 N/A ARG 120.A N GLU 116.A O no hydrogen 3.107 N/A ARG 120.A NE GLU 112.A OE1 no hydrogen 2.809 N/A ARG 120.A NH2 GLU 112.A OE2 no hydrogen 2.904 N/A LYS 121.A N VAL 118.A O no hydrogen 2.870 N/A LEU 122.A N ILE 119.A O no hydrogen 3.145 N/A TYR 124.A OH GLU 415.A OE1 no hydrogen 2.458 N/A LEU 125.A N LYS 121.A O no hydrogen 2.895 N/A LYS 126.A N LEU 122.A O no hydrogen 2.810 N/A LYS 126.A NZ GLY 178.A O no hydrogen 3.345 N/A ASP 127.A N ASP 123.A O no hydrogen 2.913 N/A LEU 128.A N TYR 124.A O no hydrogen 2.839 N/A GLY 129.A N LEU 125.A O no hydrogen 3.163 N/A GLY 129.A N LYS 126.A O no hydrogen 3.120 N/A THR 131.A N ILE 100.A O no hydrogen 2.959 N/A THR 131.A OG1 ASP 98.A O no hydrogen 3.163 N/A THR 131.A OG1 ILE 100.A O no hydrogen 3.408 N/A ALA 132.A N ILE 100.A O no hydrogen 3.170 N/A ILE 133.A N GLY 180.A O no hydrogen 2.823 N/A GLU 134.A N TYR 102.A O no hydrogen 2.706 N/A ILE 135.A N ILE 182.A O no hydrogen 2.889 N/A MET 136.A N ILE 104.A O no hydrogen 2.951 N/A GLN 140.A N ALA 156.A O no hydrogen 2.783 N/A PHE 141.A N GLN 158.A OE1 no hydrogen 2.817 N/A LYS 144.A N ASP 427.A OD2 no hydrogen 2.526 N/A ARG 145.A N ASP 427.A OD2 no hydrogen 3.319 N/A TRP 147.A NE1 TYR 423.A O no hydrogen 2.924 N/A GLY 148.A N ASP 146.A OD1 no hydrogen 2.850 N/A TYR 149.A OH ASP 184.A OD2 no hydrogen 2.782 N/A ASP 150.A N ASP 146.A OD1 no hydrogen 3.228 N/A GLY 151.A N GLY 148.A O no hydrogen 2.945 N/A VAL 152.A N GLN 140.A O no hydrogen 2.817 N/A TYR 153.A N GLN 140.A O no hydrogen 3.422 N/A TYR 153.A OH VAL 75.A O no hydrogen 2.989 N/A TYR 153.A OH GLY 194.A O no hydrogen 3.342 N/A TYR 155.A OH PHE 229.A O no hydrogen 2.728 N/A ALA 156.A N TYR 153.A O no hydrogen 3.087 N/A GLN 158.A N ILE 138.A O no hydrogen 2.732 N/A GLN 158.A NE2 GLY 143.A O no hydrogen 3.039 N/A GLN 158.A NE2 SER 160.A OG no hydrogen 3.018 N/A TYR 161.A N GLN 158.A O no hydrogen 3.317 N/A GLY 162.A N ASN 159.A O no hydrogen 2.938 N/A GLY 163.A N GLN 158.A O no hydrogen 3.151 N/A GLY 166.A N GLY 162.A O no hydrogen 3.133 N/A PHE 167.A N GLY 163.A O no hydrogen 3.097 N/A ARG 168.A N PRO 164.A O no hydrogen 2.988 N/A ARG 168.A NE ASP 172.A OD2 no hydrogen 2.979 N/A ARG 168.A NH1 GLU 87.A O no hydrogen 3.285 N/A ARG 168.A NH1 GLU 240.A O no hydrogen 3.358 N/A ARG 168.A NH2 ASP 172.A OD2 no hydrogen 2.961 N/A LYS 169.A N GLU 165.A O no hydrogen 2.963 N/A LEU 170.A N GLY 166.A O no hydrogen 2.826 N/A VAL 171.A N PHE 167.A O no hydrogen 2.965 N/A ASP 172.A N ARG 168.A O no hydrogen 2.904 N/A GLU 173.A N LYS 169.A O no hydrogen 2.881 N/A ALA 174.A N LEU 170.A O no hydrogen 3.004 N/A HIS 175.A N VAL 171.A O no hydrogen 3.089 N/A HIS 175.A NE2 ASP 244.A OD2 no hydrogen 2.827 N/A LYS 176.A N ASP 172.A O no hydrogen 3.027 N/A LYS 177.A N GLU 173.A O no hydrogen 3.175 N/A LYS 177.A NZ ASP 123.A OD1 no hydrogen 2.864 N/A GLY 178.A N HIS 175.A O no hydrogen 2.881 N/A LEU 179.A N ALA 174.A O no hydrogen 2.573 N/A GLY 180.A N THR 131.A O no hydrogen 3.026 N/A VAL 181.A N ASP 244.A OD2 no hydrogen 2.670 N/A ILE 182.A N ILE 133.A O no hydrogen 2.822 N/A LEU 183.A N GLY 245.A O no hydrogen 2.898 N/A ASP 184.A N ILE 135.A O no hydrogen 3.016 N/A VAL 185.A N ARG 247.A O no hydrogen 2.928 N/A TYR 187.A OH ASN 233.A OD1 no hydrogen 2.719 N/A ASN 188.A ND2 ASP 249.A O no hydrogen 2.989 N/A ASN 188.A ND2 ASP 249.A OD2 no hydrogen 2.867 N/A HIS 189.A ND1 ASN 188.A OD1 no hydrogen 2.781 N/A GLY 191.A N GLY 151.A O no hydrogen 3.223 N/A TYR 196.A OH HIS 76.A ND1 no hydrogen 2.652 N/A MET 197.A N ASN 195.A OD1 no hydrogen 3.478 N/A LYS 199.A N TYR 196.A O no hydrogen 3.192 N/A LEU 200.A N MET 197.A O no hydrogen 2.785 N/A TYR 203.A N GLY 201.A O no hydrogen 2.746 N/A SER 205.A N THR 215.A O no hydrogen 3.044 N/A LYS 207.A NZ ASP 219.A OD1 no hydrogen 3.258 N/A TYR 208.A N SER 205.A OG no hydrogen 3.347 N/A TYR 208.A OH ASP 219.A OD1 no hydrogen 3.367 N/A TYR 208.A OH ASP 219.A OD2 no hydrogen 2.879 N/A THR 210.A OG1 GLY 213.A O no hydrogen 3.013 N/A TRP 212.A N THR 210.A OG1 no hydrogen 3.384 N/A GLY 213.A N THR 210.A O no hydrogen 3.276 N/A THR 215.A OG1 ASN 188.A O no hydrogen 2.736 N/A ASN 217.A N TYR 203.A O no hydrogen 2.867 N/A ASN 217.A ND2 PRO 202.A O no hydrogen 3.168 N/A ASN 217.A ND2 ALA 221.A O no hydrogen 3.134 N/A ASP 220.A N ASN 217.A OD1 no hydrogen 3.061 N/A SER 223.A N ASP 220.A O no hydrogen 3.204 N/A SER 223.A OG ASP 220.A O no hydrogen 2.602 N/A ARG 227.A N SER 223.A O no hydrogen 2.767 N/A ARG 227.A NH1 PHE 218.A O no hydrogen 3.033 N/A ARG 227.A NH1 ASP 256.A OD1 no hydrogen 3.502 N/A ARG 227.A NH1 ASP 256.A OD2 no hydrogen 2.795 N/A ARG 227.A NH2 LYS 260.A O no hydrogen 2.854 N/A ARG 227.A NH2 GLU 265.A OE2 no hydrogen 2.603 N/A LYS 228.A N ASP 224.A O no hydrogen 3.006 N/A PHE 229.A N GLU 225.A O no hydrogen 2.982 N/A ILE 230.A N VAL 226.A O no hydrogen 3.097 N/A LEU 231.A N ARG 227.A O no hydrogen 2.820 N/A GLU 232.A N LYS 228.A O no hydrogen 2.695 N/A ASN 233.A N PHE 229.A O no hydrogen 3.251 N/A ASN 233.A N ILE 230.A O no hydrogen 2.955 N/A ASN 233.A ND2 LEU 154.A O no hydrogen 2.941 N/A VAL 234.A N ILE 230.A O no hydrogen 3.330 N/A GLU 235.A N LEU 231.A O no hydrogen 3.227 N/A TYR 236.A N GLU 232.A O no hydrogen 2.830 N/A TYR 236.A OH TYR 155.A O no hydrogen 3.013 N/A TRP 237.A N ASN 233.A O no hydrogen 2.983 N/A ILE 238.A N VAL 234.A O no hydrogen 3.227 N/A LYS 239.A N GLU 235.A O no hydrogen 2.953 N/A LYS 239.A NZ GLU 235.A OE2 no hydrogen 2.949 N/A LYS 239.A NZ TYR 273.A OH no hydrogen 3.452 N/A GLU 240.A N TYR 236.A O no hydrogen 2.837 N/A TYR 241.A N TRP 237.A O no hydrogen 3.269 N/A ASN 242.A N ILE 238.A O no hydrogen 2.812 N/A ASP 244.A N VAL 181.A O no hydrogen 2.905 N/A PHE 246.A N ILE 276.A O no hydrogen 2.855 N/A ARG 247.A N LEU 183.A O no hydrogen 2.882 N/A ARG 247.A NH1 ASP 184.A OD1 no hydrogen 2.659 N/A ARG 247.A NH1 ASP 249.A OD1 no hydrogen 2.750 N/A LEU 248.A N ILE 278.A O no hydrogen 2.833 N/A ASP 249.A N VAL 185.A O no hydrogen 2.988 N/A ALA 250.A N GLN 280.A OE1 no hydrogen 2.789 N/A VAL 251.A N GLN 280.A O no hydrogen 2.926 N/A ALA 253.A N ALA 250.A O no hydrogen 2.969 N/A ILE 254.A N VAL 251.A O no hydrogen 2.820 N/A THR 257.A N ASP 219.A OD2 no hydrogen 2.746 N/A THR 257.A OG1 ASP 219.A OD2 no hydrogen 2.720 N/A SER 258.A N ASP 256.A OD1 no hydrogen 2.853 N/A SER 258.A OG PHE 218.A O no hydrogen 3.433 N/A SER 258.A OG ASP 256.A OD1 no hydrogen 2.655 N/A ILE 262.A N ASP 256.A OD2 no hydrogen 2.813 N/A LEU 263.A N HIS 261.A ND1 no hydrogen 3.113 N/A GLU 265.A N HIS 261.A O no hydrogen 3.188 N/A ILE 266.A N ILE 262.A O no hydrogen 2.772 N/A ALA 267.A N LEU 263.A O no hydrogen 3.127 N/A ASP 268.A N GLU 264.A O no hydrogen 3.069 N/A VAL 269.A N GLU 265.A O no hydrogen 2.932 N/A VAL 270.A N ILE 266.A O no hydrogen 3.049 N/A HIS 271.A N ALA 267.A O no hydrogen 2.879 N/A HIS 271.A NE2 ASP 300.A OD2 no hydrogen 2.816 N/A LYS 272.A N ASP 268.A O no hydrogen 2.781 N/A TYR 273.A N VAL 269.A O no hydrogen 3.225 N/A ASN 274.A N HIS 271.A O no hydrogen 2.986 N/A ASN 274.A ND2 ASN 90.A O no hydrogen 3.307 N/A ARG 275.A N VAL 270.A O no hydrogen 2.756 N/A ARG 275.A NE TYR 273.A O no hydrogen 2.981 N/A ARG 275.A NH1 VAL 243.A O no hydrogen 2.858 N/A ARG 275.A NH2 ASN 89.A O no hydrogen 2.400 N/A ILE 276.A N ASP 244.A O no hydrogen 3.374 N/A VAL 277.A N ASP 300.A OD2 no hydrogen 2.728 N/A ILE 278.A N PHE 246.A O no hydrogen 2.739 N/A ALA 279.A N ALA 301.A O no hydrogen 2.855 N/A GLN 280.A N LEU 248.A O no hydrogen 2.880 N/A GLN 280.A NE2 ASP 374.A OD1 no hydrogen 3.452 N/A ASP 282.A N HIS 252.A ND1 no hydrogen 3.035 N/A LEU 283.A N SER 281.A OG no hydrogen 2.905 N/A ASN 284.A ND2 ASP 306.A OD2 no hydrogen 2.899 N/A ASN 284.A ND2 TYR 342.A O no hydrogen 2.582 N/A ARG 287.A N ASP 285.A OD1 no hydrogen 3.158 N/A VAL 288.A N ASP 285.A O no hydrogen 3.212 N/A VAL 289.A N PRO 286.A O no hydrogen 2.842 N/A ASN 290.A N PRO 286.A O no hydrogen 2.665 N/A LYS 292.A NZ ASP 268.A OD1 no hydrogen 2.926 N/A GLU 293.A N GLU 293.A OE1 no hydrogen 3.024 N/A LYS 294.A N PRO 291.A O no hydrogen 2.715 N/A CYS 295.A N LYS 292.A O no hydrogen 2.651 N/A GLY 296.A N PRO 291.A O no hydrogen 3.005 N/A TYR 297.A N ARG 287.A O no hydrogen 2.820 N/A ILE 299.A N VAL 288.A O no hydrogen 3.260 N/A ASP 300.A N VAL 277.A O no hydrogen 2.806 N/A GLN 302.A N ASN 365.A O no hydrogen 2.963 N/A GLN 302.A NE2 TRP 303.A O no hydrogen 2.938 N/A TRP 303.A N ALA 279.A O no hydrogen 2.955 N/A VAL 304.A N VAL 367.A O no hydrogen 2.923 N/A HIS 308.A NE2 TYR 323.A OH no hydrogen 3.321 N/A HIS 309.A N ASP 305.A O no hydrogen 2.710 N/A SER 310.A N ASP 306.A O no hydrogen 2.968 N/A SER 310.A OG ASP 306.A O no hydrogen 3.221 N/A ILE 311.A N PHE 307.A O no hydrogen 3.303 N/A HIS 312.A N HIS 308.A O no hydrogen 2.907 N/A HIS 312.A NE2 GLU 318.A OE1 no hydrogen 2.490 N/A ALA 313.A N HIS 309.A O no hydrogen 2.762 N/A TYR 314.A N SER 310.A O no hydrogen 3.320 N/A LEU 315.A N ILE 311.A O no hydrogen 2.927 N/A THR 316.A N HIS 312.A O no hydrogen 2.831 N/A THR 316.A OG1 HIS 312.A O no hydrogen 2.562 N/A GLY 317.A N ALA 313.A O no hydrogen 2.762 N/A GLU 318.A N THR 316.A OG1 no hydrogen 3.184 N/A ARG 319.A NH1 ALA 313.A O no hydrogen 2.805 N/A ARG 319.A NH1 GLU 318.A O no hydrogen 2.767 N/A GLN 320.A NE2 GLU 318.A OE1 no hydrogen 3.349 N/A TYR 322.A OH GLN 375.A OE1 no hydrogen 2.437 N/A TYR 323.A N GLN 320.A O no hydrogen 3.203 N/A TYR 323.A OH HIS 308.A NE2 no hydrogen 3.321 N/A THR 324.A N GLY 321.A O no hydrogen 3.087 N/A ASP 325.A N TYR 322.A O no hydrogen 3.102 N/A PHE 326.A N TYR 323.A O no hydrogen 2.798 N/A ASN 328.A N ASP 331.A OD2 no hydrogen 2.876 N/A ASP 331.A N ASN 328.A O no hydrogen 3.115 N/A VAL 333.A N LEU 329.A O no hydrogen 3.143 N/A LYS 334.A N ASP 330.A O no hydrogen 2.694 N/A LYS 334.A NZ ASP 338.A OD2 no hydrogen 2.624 N/A LYS 334.A NZ ASP 343.A OD2 no hydrogen 2.950 N/A SER 335.A N ASP 331.A O no hydrogen 2.907 N/A SER 335.A OG VAL 339.A O no hydrogen 2.989 N/A TYR 336.A N ILE 332.A O no hydrogen 2.838 N/A TYR 336.A OH LEU 400.A O no hydrogen 2.694 N/A LYS 337.A N VAL 333.A O no hydrogen 2.982 N/A LYS 337.A N LYS 334.A O no hydrogen 2.947 N/A ASP 338.A N LYS 334.A O no hydrogen 2.834 N/A PHE 340.A N ASP 338.A O no hydrogen 2.560 N/A TYR 342.A N ASP 306.A OD2 no hydrogen 2.902 N/A TYR 342.A OH ASP 325.A O no hydrogen 2.615 N/A GLY 344.A N HIS 354.A O no hydrogen 2.775 N/A LYS 345.A N HIS 354.A O no hydrogen 3.212 N/A SER 347.A N LYS 352.A O no hydrogen 2.899 N/A SER 347.A OG ASP 325.A OD1 no hydrogen 3.504 N/A SER 347.A OG ASP 325.A OD2 no hydrogen 2.742 N/A PHE 349.A N ASP 325.A OD1 no hydrogen 3.065 N/A ARG 350.A N SER 347.A OG no hydrogen 2.675 N/A ARG 350.A NH1 ASP 282.A OD2 no hydrogen 2.776 N/A ARG 350.A NH2 ASP 282.A OD1 no hydrogen 2.632 N/A ARG 350.A NH2 ASP 282.A OD2 no hydrogen 3.067 N/A ARG 351.A N SER 347.A O no hydrogen 2.572 N/A ARG 351.A NE PHE 349.A O no hydrogen 3.604 N/A LYS 352.A NZ THR 353.A O no hydrogen 3.154 N/A HIS 354.A N LYS 345.A O no hydrogen 2.875 N/A HIS 354.A NE2 ASP 282.A O no hydrogen 3.131 N/A GLY 363.A N CYS 488.A O no hydrogen 2.841 N/A CYS 364.A N ASP 362.A OD1 no hydrogen 2.783 N/A ASN 365.A N ASP 362.A O no hydrogen 3.288 N/A ASN 365.A ND2 ASP 300.A O no hydrogen 3.077 N/A PHE 366.A N GLY 363.A O no hydrogen 3.163 N/A VAL 367.A N GLN 302.A O no hydrogen 2.924 N/A VAL 368.A N ILE 407.A O no hydrogen 2.764 N/A TYR 369.A OH ASP 305.A OD1 no hydrogen 2.466 N/A GLN 371.A NE2 ILE 370.A O no hydrogen 2.985 N/A HIS 373.A N GLU 103.A OE1 no hydrogen 2.784 N/A HIS 373.A ND1 GLU 103.A OE2 no hydrogen 2.522 N/A GLN 375.A N ASN 372.A OD1 no hydrogen 2.817 N/A VAL 376.A N ASN 372.A O no hydrogen 3.058 N/A GLY 377.A N HIS 373.A O no hydrogen 2.794 N/A ASN 378.A N ASP 374.A O no hydrogen 2.899 N/A ARG 379.A N VAL 376.A O no hydrogen 3.082 N/A ARG 379.A NH1 GLU 318.A OE1 no hydrogen 2.975 N/A ARG 379.A NH1 GLU 318.A OE2 no hydrogen 3.409 N/A ARG 379.A NH2 GLU 318.A OE2 no hydrogen 2.609 N/A GLY 382.A N ARG 379.A O no hydrogen 2.822 N/A ARG 384.A NH2 MET 412.A O no hydrogen 2.477 N/A ILE 385.A N GLN 371.A OE1 no hydrogen 2.710 N/A LYS 387.A N ARG 384.A O no hydrogen 3.058 N/A LYS 387.A NZ GLU 419.A OE2 no hydrogen 2.984 N/A LEU 388.A N ILE 385.A O no hydrogen 2.736 N/A ARG 391.A NH1 ASP 467.A OD2 no hydrogen 3.001 N/A ARG 391.A NH2 ASP 467.A OD1 no hydrogen 3.344 N/A ARG 391.A NH2 ASP 467.A OD2 no hydrogen 3.325 N/A ARG 391.A NH2 GLU 469.A OE1 no hydrogen 2.743 N/A SER 393.A N ASP 390.A OD2 no hydrogen 2.617 N/A TYR 394.A N ASP 390.A O no hydrogen 2.907 N/A TYR 394.A OH GLU 414.A O no hydrogen 2.738 N/A LYS 395.A N ARG 391.A O no hydrogen 3.219 N/A LYS 395.A NZ GLU 469.A OE1 no hydrogen 3.112 N/A LYS 395.A NZ SER 531.A O no hydrogen 2.748 N/A ILE 396.A N GLU 392.A O no hydrogen 2.920 N/A ALA 397.A N SER 393.A O no hydrogen 2.908 N/A ALA 398.A N TYR 394.A O no hydrogen 3.024 N/A ALA 399.A N LYS 395.A O no hydrogen 2.915 N/A LEU 400.A N ILE 396.A O no hydrogen 2.863 N/A TYR 401.A N ALA 397.A O no hydrogen 3.341 N/A TYR 401.A OH GLU 414.A OE2 no hydrogen 2.687 N/A LEU 402.A N ALA 398.A O no hydrogen 2.972 N/A LEU 403.A N ALA 399.A O no hydrogen 2.988 N/A SER 404.A N TYR 401.A O no hydrogen 3.232 N/A SER 404.A OG TYR 401.A O no hydrogen 2.784 N/A TYR 406.A N SER 404.A OG no hydrogen 3.402 N/A TYR 406.A OH SER 335.A O no hydrogen 2.643 N/A ILE 407.A N PHE 366.A O no hydrogen 2.929 N/A MET 409.A N VAL 368.A O no hydrogen 2.850 N/A ILE 410.A N ILE 101.A O no hydrogen 2.815 N/A PHE 411.A N GLU 414.A OE1 no hydrogen 3.002 N/A MET 412.A N GLU 103.A O no hydrogen 3.031 N/A GLY 413.A N TYR 102.A OH no hydrogen 3.319 N/A GLY 413.A N GLU 415.A OE2 no hydrogen 2.508 N/A GLU 414.A N PHE 411.A O no hydrogen 2.832 N/A TYR 416.A N GLY 413.A O no hydrogen 3.208 N/A TYR 416.A OH GLU 418.A OE1 no hydrogen 2.683 N/A GLY 417.A N GLU 414.A O no hydrogen 3.137 N/A GLU 418.A N GLY 413.A O no hydrogen 2.973 N/A ASN 420.A N GLU 418.A OE2 no hydrogen 2.745 N/A ASN 420.A ND2 LYS 461.A O no hydrogen 2.994 N/A PHE 422.A N GLY 382.A O no hydrogen 3.076 N/A TYR 423.A N SER 460.A OG no hydrogen 3.035 N/A SER 426.A N PRO 451.A O no hydrogen 3.030 N/A SER 426.A OG GLN 452.A OE1 no hydrogen 2.659 N/A PHE 428.A N GLN 452.A OE1 no hydrogen 2.846 N/A SER 429.A N GLU 193.A OE1 no hydrogen 3.008 N/A SER 429.A OG GLU 193.A OE2 no hydrogen 2.488 N/A ASP 430.A N GLU 193.A OE1 no hydrogen 3.378 N/A LEU 433.A N ASP 430.A OD2 no hydrogen 3.272 N/A ILE 434.A N ASP 430.A O no hydrogen 2.972 N/A GLN 435.A N SER 431.A O no hydrogen 3.179 N/A GLY 436.A N LYS 432.A O no hydrogen 3.013 N/A VAL 437.A N LEU 433.A O no hydrogen 3.332 N/A ARG 438.A N ILE 434.A O no hydrogen 3.346 N/A ARG 438.A NE ASP 450.A OD1 no hydrogen 2.955 N/A ARG 438.A NE ASP 450.A OD2 no hydrogen 2.952 N/A ARG 438.A NH2 ASP 450.A OD2 no hydrogen 3.306 N/A GLU 439.A N GLN 435.A O no hydrogen 3.293 N/A GLY 440.A N GLY 436.A O no hydrogen 3.093 N/A ARG 441.A N VAL 437.A O no hydrogen 2.930 N/A ARG 441.A NH2 GLY 377.A O no hydrogen 3.365 N/A LYS 442.A N ARG 438.A O no hydrogen 2.952 N/A LYS 443.A N GLY 440.A O no hydrogen 3.300 N/A LYS 443.A NZ GLU 439.A O no hydrogen 3.440 N/A GLU 444.A N GLY 440.A O no hydrogen 2.964 N/A ASN 445.A N ARG 441.A O no hydrogen 3.333 N/A ASN 445.A ND2 ASN 378.A O no hydrogen 3.059 N/A GLN 447.A N ARG 441.A O no hydrogen 3.370 N/A THR 449.A OG1 GLN 447.A OE1 no hydrogen 3.539 N/A GLN 452.A N ASP 450.A OD1 no hydrogen 2.651 N/A GLN 452.A NE2 PHE 428.A O no hydrogen 3.041 N/A ASP 453.A N ASP 450.A O no hydrogen 2.949 N/A SER 455.A OG ASP 453.A OD2 no hydrogen 3.298 N/A THR 456.A N ASP 453.A O no hydrogen 2.928 N/A THR 456.A OG1 ASP 450.A O no hydrogen 2.648 N/A PHE 457.A N GLU 454.A O no hydrogen 3.216 N/A ASN 458.A N GLU 454.A O no hydrogen 3.005 N/A ALA 459.A N SER 455.A O no hydrogen 2.737 N/A SER 460.A N PHE 457.A O no hydrogen 2.923 N/A SER 460.A OG THR 456.A O no hydrogen 2.784 N/A LYS 461.A N ASN 458.A O no hydrogen 2.978 N/A LYS 461.A NZ ASN 458.A OD1 no hydrogen 3.025 N/A LEU 462.A N THR 108.A O no hydrogen 3.038 N/A SER 463.A N GLU 418.A OE1 no hydrogen 2.642 N/A SER 463.A OG GLU 418.A OE1 no hydrogen 2.590 N/A TRP 464.A N TYR 416.A OH no hydrogen 3.071 N/A TRP 464.A NE1 PHE 109.A O no hydrogen 2.869 N/A LYS 465.A N SER 463.A OG no hydrogen 2.880 N/A ASP 467.A N TYR 416.A O no hydrogen 3.056 N/A GLU 469.A N ASP 467.A OD1 no hydrogen 3.222 N/A ILE 470.A N ASP 467.A OD1 no hydrogen 3.029 N/A PHE 471.A N ASP 467.A O no hydrogen 2.850 N/A SER 472.A N GLU 468.A O no hydrogen 2.915 N/A PHE 473.A N GLU 469.A O no hydrogen 3.207 N/A TYR 474.A N ILE 470.A O no hydrogen 3.104 N/A TYR 474.A OH GLU 414.A OE2 no hydrogen 2.691 N/A LYS 475.A N PHE 471.A O no hydrogen 3.063 N/A LYS 475.A NZ ASP 127.A OD1 no hydrogen 3.388 N/A LYS 475.A NZ ASP 127.A OD2 no hydrogen 3.027 N/A ILE 476.A N SER 472.A O no hydrogen 3.050 N/A LEU 477.A N PHE 473.A O no hydrogen 2.830 N/A ILE 478.A N TYR 474.A O no hydrogen 2.899 N/A LYS 479.A N LYS 475.A O no hydrogen 3.028 N/A LYS 479.A NZ GLU 483.A OE2 no hydrogen 3.458 N/A MET 480.A N ILE 476.A O no hydrogen 2.779 N/A ARG 481.A N LEU 477.A O no hydrogen 2.916 N/A ARG 481.A NH1 LEU 402.A O no hydrogen 2.732 N/A ARG 481.A NH1 SER 404.A O no hydrogen 2.920 N/A ARG 481.A NH1 TYR 406.A O no hydrogen 3.451 N/A ARG 481.A NH2 TYR 406.A O no hydrogen 2.986 N/A LYS 482.A N ILE 478.A O no hydrogen 3.323 N/A LYS 482.A NZ GLY 129.A O no hydrogen 2.679 N/A GLU 483.A N LYS 479.A O no hydrogen 3.052 N/A LEU 484.A N MET 480.A O no hydrogen 2.832 N/A SER 485.A N LYS 482.A O no hydrogen 3.309 N/A ILE 486.A N ARG 481.A O no hydrogen 3.283 N/A CYS 488.A N PRO 405.A O no hydrogen 2.645 N/A CYS 488.A SG GLU 97.A O no hydrogen 4.029 N/A ASP 489.A N ILE 486.A O no hydrogen 3.319 N/A ARG 490.A NE LEU 361.A O no hydrogen 2.890 N/A ARG 490.A NH2 LEU 361.A O no hydrogen 3.295 N/A ARG 491.A N ASP 489.A OD2 no hydrogen 3.210 N/A ARG 491.A NE ASP 489.A OD2 no hydrogen 2.858 N/A ARG 491.A NH2 ASP 489.A OD1 no hydrogen 3.102 N/A ARG 491.A NH2 ASP 489.A OD2 no hydrogen 3.531 N/A ASN 493.A N LYS 504.A O no hydrogen 2.954 N/A ASN 493.A ND2 TYR 523.A OH no hydrogen 3.114 N/A VAL 495.A N ILE 502.A O no hydrogen 3.186 N/A GLY 497.A N TRP 500.A O no hydrogen 2.933 N/A ASN 499.A ND2 GLU 498.A OE1 no hydrogen 3.326 N/A LEU 501.A N TYR 512.A O no hydrogen 2.923 N/A ILE 502.A N VAL 495.A O no hydrogen 3.010 N/A ILE 503.A N SER 510.A O no hydrogen 2.965 N/A LYS 504.A N ASN 493.A O no hydrogen 2.956 N/A LYS 504.A NZ GLY 505.A O no hydrogen 3.248 N/A GLY 505.A N TYR 508.A O no hydrogen 2.682 N/A PHE 509.A N TYR 553.A O no hydrogen 3.054 N/A SER 510.A N ILE 503.A O no hydrogen 2.632 N/A LEU 511.A N ALA 551.A O no hydrogen 2.868 N/A TYR 512.A N LEU 501.A O no hydrogen 2.777 N/A VAL 513.A N GLY 549.A O no hydrogen 2.775 N/A PHE 514.A N ASN 499.A O no hydrogen 2.913 N/A SER 515.A N ASN 499.A O no hydrogen 3.372 N/A SER 517.A N PHE 546.A O no hydrogen 3.065 N/A SER 517.A OG SER 515.A O no hydrogen 3.236 N/A ILE 519.A N TYR 544.A O no hydrogen 2.715 N/A VAL 521.A N GLY 542.A O no hydrogen 2.970 N/A GLY 525.A N ILE 539.A O no hydrogen 3.065 N/A LEU 527.A N GLN 537.A O no hydrogen 2.662 N/A LEU 528.A N LEU 552.A O no hydrogen 2.748 N/A SER 530.A OG ASN 532.A O no hydrogen 2.532 N/A SER 531.A N PHE 550.A O no hydrogen 2.937 N/A SER 531.A OG GLU 392.A OE2 no hydrogen 2.811 N/A SER 531.A OG PHE 550.A O no hydrogen 3.442 N/A ASN 532.A N SER 530.A OG no hydrogen 3.266 N/A ASN 532.A ND2 GLU 392.A OE1 no hydrogen 2.450 N/A SER 534.A OG ASN 532.A OD1 no hydrogen 3.134 N/A ILE 539.A N GLY 525.A O no hydrogen 2.923 N/A GLY 542.A N VAL 521.A O no hydrogen 3.075 N/A TYR 544.A N ILE 519.A O no hydrogen 2.816 N/A TYR 544.A OH GLU 540.A O no hydrogen 2.697 N/A PHE 546.A N SER 517.A O no hydrogen 2.972 N/A LYS 548.A NZ ASP 390.A OD1 no hydrogen 2.729 N/A LYS 548.A NZ ASP 390.A OD2 no hydrogen 2.792 N/A LYS 548.A NZ SER 393.A OG no hydrogen 2.602 N/A GLY 549.A N VAL 513.A O no hydrogen 2.767 N/A PHE 550.A N SER 531.A OG no hydrogen 2.802 N/A ALA 551.A N LEU 511.A O no hydrogen 3.088 N/A LEU 552.A N LEU 529.A O no hydrogen 2.910 N/A TYR 553.A N PHE 509.A O no hydrogen 2.928 N/A TYR 553.A OH PRO 536.A O no hydrogen 2.925 N/A LYS 554.A N THR 526.A O no hydrogen 3.010 N/A