Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1pca_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): THR 97.A OG1 SER 99.A OG no hydrogen 2.794 N/A THR 97.A OG1 THR 100.A OG1 no hydrogen 2.745 N/A THR 98.A N GLU 122.A OE2 no hydrogen 3.276 N/A THR 98.A OG1 GLU 122.A OE1 no hydrogen 2.925 N/A SER 99.A OG THR 97.A OG1 no hydrogen 2.794 N/A THR 100.A N THR 97.A O no hydrogen 2.999 N/A THR 100.A OG1 THR 97.A O no hydrogen 2.880 N/A THR 100.A OG1 THR 97.A OG1 no hydrogen 2.745 N/A PHE 101.A N THR 98.A O no hydrogen 3.451 N/A TYR 103.A OH THR 98.A O no hydrogen 2.842 N/A ALA 104.A N ASN 102.A OD1 no hydrogen 2.710 N/A THR 105.A OG1 TYR 106.A O no hydrogen 3.538 N/A TYR 106.A OH LEU 375.A O no hydrogen 2.725 N/A HIS 107.A ND1 GLU 111.A OE1 no hydrogen 2.735 N/A HIS 107.A NE2 ASN 102.A O no hydrogen 2.767 N/A THR 108.A N GLU 111.A OE1 no hydrogen 2.739 N/A GLU 111.A N THR 108.A OG1 no hydrogen 3.261 N/A ILE 112.A N THR 108.A O no hydrogen 3.182 N/A TYR 113.A N LEU 109.A O no hydrogen 3.030 N/A TYR 113.A OH PRO 140.A O no hydrogen 2.919 N/A ASP 114.A N GLU 110.A O no hydrogen 2.860 N/A PHE 115.A N GLU 111.A O no hydrogen 3.139 N/A MET 116.A N ILE 112.A O no hydrogen 3.052 N/A ASP 117.A N TYR 113.A O no hydrogen 3.380 N/A ILE 118.A N ASP 114.A O no hydrogen 2.992 N/A LEU 119.A N PHE 115.A O no hydrogen 2.861 N/A VAL 120.A N MET 116.A O no hydrogen 3.006 N/A ALA 121.A N ASP 117.A O no hydrogen 3.106 N/A GLU 122.A N ILE 118.A O no hydrogen 3.074 N/A HIS 123.A N LEU 119.A O no hydrogen 3.061 N/A LEU 126.A N HIS 123.A O no hydrogen 3.358 N/A VAL 127.A N HIS 123.A O no hydrogen 3.155 N/A SER 128.A N LYS 145.A O no hydrogen 2.947 N/A SER 128.A OG LYS 145.A O no hydrogen 3.466 N/A LYS 129.A NZ ASP 117.A OD1 no hydrogen 2.701 N/A LYS 129.A NZ ASP 117.A OD2 no hydrogen 3.289 N/A LEU 130.A N VAL 143.A O no hydrogen 2.833 N/A ILE 132.A N ILE 141.A O no hydrogen 2.834 N/A ARG 134.A NE GLY 138.A O no hydrogen 3.185 N/A SER 135.A N ARG 139.A O no hydrogen 2.718 N/A SER 135.A OG ARG 139.A O no hydrogen 3.187 N/A TYR 136.A N GLU 269.A OE2 no hydrogen 3.224 N/A GLU 137.A N ASN 208.A OD1 no hydrogen 2.870 N/A GLY 138.A N SER 135.A O no hydrogen 2.958 N/A ARG 139.A N SER 135.A OG no hydrogen 2.773 N/A ARG 139.A NH1 GLU 137.A OE1 no hydrogen 2.852 N/A ILE 141.A N GLY 133.A O no hydrogen 2.626 N/A VAL 143.A N LEU 130.A O no hydrogen 2.820 N/A LEU 144.A N LEU 201.A O no hydrogen 2.844 N/A LYS 145.A N SER 128.A O no hydrogen 2.803 N/A PHE 146.A N ILE 199.A O no hydrogen 2.794 N/A SER 147.A N LEU 126.A O no hydrogen 2.905 N/A SER 147.A OG ASP 198.A OD1 no hydrogen 2.771 N/A THR 148.A OG1 LEU 194.A O no hydrogen 2.849 N/A GLY 149.A N SER 147.A OG no hydrogen 2.971 N/A ARG 153.A NH2 LEU 194.A O no hydrogen 2.989 N/A ALA 155.A N ASN 282.A O no hydrogen 2.795 N/A ILE 156.A N ASP 198.A O no hydrogen 2.818 N/A TRP 157.A N ALA 285.A O no hydrogen 3.090 N/A TRP 157.A NE1 ASP 159.A OD2 no hydrogen 2.986 N/A ILE 158.A N PHE 200.A O no hydrogen 2.878 N/A ASP 159.A N ILE 287.A O no hydrogen 3.033 N/A SER 160.A N GLU 202.A O no hydrogen 2.924 N/A SER 160.A OG THR 169.A O no hydrogen 3.335 N/A SER 160.A OG ILE 203.A O no hydrogen 2.845 N/A HIS 163.A NE2 ASP 236.A OD1 no hydrogen 2.654 N/A SER 164.A OG TRP 220.A O no hydrogen 2.867 N/A ARG 165.A NE LEU 219.A O no hydrogen 3.016 N/A ARG 165.A NH2 LEU 219.A O no hydrogen 3.035 N/A ARG 165.A NH2 ASP 35A.A OD1 no hydrogen 2.915 N/A GLU 166.A N HIS 163.A O no hydrogen 3.263 N/A TRP 167.A NE1 THR 213.A OG1 no hydrogen 3.023 N/A THR 169.A N GLU 166.A O no hydrogen 2.803 N/A THR 169.A OG1 GLU 166.A O no hydrogen 2.861 N/A GLN 170.A N GLN 170.A OE1 no hydrogen 2.870 N/A GLN 170.A NE2 SER 164.A O no hydrogen 3.573 N/A ALA 171.A N TRP 167.A O no hydrogen 3.330 N/A SER 172.A N ILE 168.A O no hydrogen 3.031 N/A SER 172.A OG ILE 168.A O no hydrogen 2.816 N/A GLY 173.A N THR 169.A O no hydrogen 2.882 N/A VAL 174.A N GLN 170.A O no hydrogen 3.055 N/A TRP 175.A N ALA 171.A O no hydrogen 3.222 N/A PHE 176.A N SER 172.A O no hydrogen 2.922 N/A ALA 177.A N GLY 173.A O no hydrogen 3.250 N/A LYS 178.A N VAL 174.A O no hydrogen 3.354 N/A LYS 178.A NZ THR 98.A OG1 no hydrogen 2.849 N/A LYS 179.A N TRP 175.A O no hydrogen 2.942 N/A LYS 179.A NZ ASN 183.A OD1 no hydrogen 2.925 N/A ILE 180.A N PHE 176.A O no hydrogen 2.937 N/A THR 181.A OG1 LYS 178.A O no hydrogen 2.845 N/A GLU 182.A N LYS 179.A O no hydrogen 3.036 N/A ASN 183.A N LYS 179.A O no hydrogen 2.856 N/A TYR 184.A N ILE 180.A O no hydrogen 2.955 N/A TYR 184.A OH ASP 195.A OD1 no hydrogen 2.728 N/A GLY 185.A N THR 191.A OG1 no hydrogen 2.648 N/A GLN 186.A N ASN 183.A O no hydrogen 3.005 N/A ASN 187.A N ASN 183.A O no hydrogen 2.708 N/A SER 189.A OG GLU 396.A OE2 no hydrogen 2.726 N/A PHE 190.A N ASN 187.A OD1 no hydrogen 2.838 N/A THR 191.A N ASN 187.A O no hydrogen 2.722 N/A THR 191.A OG1 ASN 187.A O no hydrogen 2.753 N/A ALA 192.A N SER 188.A O no hydrogen 3.254 N/A ILE 193.A N PHE 190.A O no hydrogen 2.827 N/A LEU 194.A N PHE 190.A O no hydrogen 3.226 N/A ASP 195.A N THR 191.A O no hydrogen 2.903 N/A SER 196.A N ILE 193.A O no hydrogen 3.044 N/A MET 197.A N ILE 193.A O no hydrogen 2.824 N/A ASP 198.A N PRO 154.A O no hydrogen 3.028 N/A ILE 199.A N PHE 146.A O no hydrogen 2.964 N/A PHE 200.A N ILE 156.A O no hydrogen 2.761 N/A LEU 201.A N LEU 144.A O no hydrogen 2.956 N/A GLU 202.A N ILE 158.A O no hydrogen 2.932 N/A THR 205.A N SER 160.A O no hydrogen 3.303 N/A THR 205.A OG1 SER 160.A O no hydrogen 2.717 N/A THR 205.A OG1 GLU 202.A O no hydrogen 3.327 N/A ASN 208.A ND2 SER 135.A OG no hydrogen 2.647 N/A PHE 210.A N ASN 206.A O no hydrogen 3.027 N/A ALA 211.A N PRO 207.A O no hydrogen 3.033 N/A PHE 212.A N ASN 208.A O no hydrogen 2.930 N/A THR 213.A N GLY 209.A O no hydrogen 2.940 N/A THR 213.A OG1 PHE 210.A O no hydrogen 2.736 N/A HIS 214.A N ALA 211.A O no hydrogen 3.039 N/A SER 215.A N ALA 211.A O no hydrogen 2.840 N/A SER 215.A OG ALA 211.A O no hydrogen 3.106 N/A ASP 216.A N PHE 212.A O no hydrogen 2.759 N/A ASN 217.A N PHE 212.A O no hydrogen 2.921 N/A ARG 218.A NE GLU 84A.A OE1 no hydrogen 2.835 N/A ARG 218.A NH1 ARG 165.A O no hydrogen 2.760 N/A ARG 218.A NH1 ARG 218.A O no hydrogen 3.067 N/A ARG 218.A NH2 PHE 373.A O no hydrogen 3.058 N/A ARG 218.A NH2 GLU 84A.A OE2 no hydrogen 3.026 N/A TRP 220.A N ASN 217.A O no hydrogen 3.263 N/A TRP 220.A NE1 THR 223.A O no hydrogen 3.129 N/A ARG 221.A NH1 GLU 257.A O no hydrogen 3.554 N/A LYS 222.A NZ VAL 233.A O no hydrogen 2.801 N/A LYS 222.A NZ GLY 234.A O no hydrogen 2.850 N/A LYS 222.A NZ ALA 256.A O no hydrogen 3.342 N/A THR 223.A N SER 235.A O no hydrogen 3.173 N/A THR 223.A OG1 SER 225.A OG no hydrogen 3.422 N/A THR 223.A OG1 SER 235.A O no hydrogen 3.365 N/A THR 223.A OG1 GLU 267.A OE1 no hydrogen 2.735 N/A SER 225.A OG THR 223.A OG1 no hydrogen 3.422 N/A SER 225.A OG GLU 267.A OE1 no hydrogen 2.723 N/A GLY 234.A N SER 225.A O no hydrogen 2.753 N/A SER 235.A N THR 223.A OG1 no hydrogen 2.921 N/A ASP 236.A N TYR 259.A O no hydrogen 2.807 N/A SER 237.A OG ILE 162.A O no hydrogen 3.143 N/A ASN 238.A N ASP 236.A OD1 no hydrogen 3.028 N/A ARG 239.A N ASP 236.A O no hydrogen 3.057 N/A ARG 239.A NE GLY 249.A O no hydrogen 2.757 N/A ARG 239.A NH1 ASN 238.A O no hydrogen 2.855 N/A ASN 240.A ND2 HIS 260.A O no hydrogen 3.016 N/A ASN 240.A ND2 TYR 263.A O no hydrogen 3.160 N/A ASN 240.A ND2 SER 266.A OG no hydrogen 3.043 N/A TRP 241.A N GLY 346.A O no hydrogen 2.984 N/A TRP 241.A NE1 SER 237.A O no hydrogen 2.936 N/A GLY 247.A N GLY 244.A O no hydrogen 2.874 N/A SER 251.A N THR 258.A O no hydrogen 2.838 N/A SER 253.A N SER 251.A OG no hydrogen 3.100 N/A CYS 255.A N SER 253.A OG no hydrogen 3.335 N/A ALA 256.A N SER 253.A O no hydrogen 2.822 N/A TYR 259.A N ALA 256.A O no hydrogen 3.379 N/A HIS 260.A N SER 251.A O no hydrogen 3.082 N/A HIS 260.A ND1 GLY 261.A O no hydrogen 2.741 N/A ASN 265.A N ASN 240.A O no hydrogen 2.864 N/A ASN 265.A ND2 THR 274.A OG1 no hydrogen 2.859 N/A SER 266.A N TYR 263.A O no hydrogen 3.124 N/A SER 266.A OG TYR 263.A O no hydrogen 3.086 N/A SER 266.A OG GLU 267.A OE2 no hydrogen 3.030 N/A GLU 267.A N ASN 240.A OD1 no hydrogen 3.049 N/A GLU 269.A N GLU 269.A OE1 no hydrogen 2.751 N/A VAL 270.A N GLU 267.A O no hydrogen 3.099 N/A LYS 271.A N GLU 267.A O no hydrogen 2.790 N/A LYS 271.A NZ ASP 275.A OD1 no hydrogen 2.897 N/A LYS 271.A NZ ASP 275.A OD2 no hydrogen 2.692 N/A SER 272.A N VAL 268.A O no hydrogen 2.924 N/A SER 272.A OG ILE 132.A O no hydrogen 3.191 N/A SER 272.A OG VAL 268.A O no hydrogen 2.906 N/A ILE 273.A N VAL 270.A O no hydrogen 2.999 N/A THR 274.A N VAL 270.A O no hydrogen 2.989 N/A THR 274.A OG1 VAL 270.A O no hydrogen 3.169 N/A ASP 275.A N LYS 271.A O no hydrogen 2.893 N/A PHE 276.A N SER 272.A O no hydrogen 3.036 N/A VAL 277.A N ILE 273.A O no hydrogen 2.856 N/A LYS 278.A N THR 274.A O no hydrogen 2.890 N/A LYS 278.A NZ ASP 275.A OD1 no hydrogen 2.892 N/A ASN 279.A N ASP 275.A O no hydrogen 2.897 N/A ASN 279.A N PHE 276.A O no hydrogen 3.246 N/A ASN 280.A N VAL 277.A O no hydrogen 2.940 N/A ASN 282.A N ASN 280.A OD1 no hydrogen 3.260 N/A LYS 284.A N ALA 155.A O no hydrogen 2.799 N/A PHE 286.A N TYR 359.A O no hydrogen 2.957 N/A ILE 287.A N TRP 157.A O no hydrogen 2.855 N/A SER 288.A N PHE 361.A O no hydrogen 2.988 N/A SER 288.A OG ASP 159.A OD1 no hydrogen 2.771 N/A SER 288.A OG ASP 159.A OD2 no hydrogen 3.553 N/A ILE 289.A N ASP 159.A O no hydrogen 3.136 N/A HIS 290.A N PHE 363.A O no hydrogen 2.816 N/A SER 291.A N GLU 166.A OE1 no hydrogen 3.216 N/A TYR 292.A OH ASP 48A.A OD2 no hydrogen 2.766 N/A SER 293.A N LEU 365.A O no hydrogen 3.044 N/A SER 293.A OG TYR 292.A O no hydrogen 2.892 N/A GLN 294.A N LEU 365.A O no hydrogen 3.016 N/A GLN 294.A NE2 SER 331.A O no hydrogen 2.892 N/A LEU 295.A N GLU 364.A O no hydrogen 2.932 N/A LEU 296.A N LYS 333.A O no hydrogen 2.817 N/A LEU 297.A N SER 362.A O no hydrogen 2.826 N/A TYR 298.A N GLY 335.A O no hydrogen 3.244 N/A TYR 300.A OH ASN 354.A OD1 no hydrogen 2.863 N/A GLY 301.A N ASP 350.A OD1 no hydrogen 3.176 N/A GLY 301.A N ASP 350.A OD2 no hydrogen 2.714 N/A TYR 302.A N ASP 350.A OD2 no hydrogen 3.273 N/A LYS 303.A NZ TYR 302.A OH no hydrogen 3.365 N/A ASP 309.A N TYR 353.A OH no hydrogen 2.990 N/A LEU 313.A N ASP 309.A O no hydrogen 2.962 N/A ASN 314.A N LYS 310.A O no hydrogen 2.875 N/A GLN 315.A N SER 311.A O no hydrogen 3.040 N/A GLN 315.A NE2 SER 319.A OG no hydrogen 3.078 N/A ILE 316.A N GLU 312.A O no hydrogen 2.879 N/A ALA 317.A N LEU 313.A O no hydrogen 2.950 N/A LYS 318.A N ASN 314.A O no hydrogen 2.910 N/A LYS 318.A NZ GLN 315.A OE1 no hydrogen 2.815 N/A SER 319.A N GLN 315.A O no hydrogen 2.874 N/A SER 319.A OG GLN 315.A O no hydrogen 3.042 N/A ALA 320.A N ILE 316.A O no hydrogen 2.765 N/A VAL 321.A N ALA 317.A O no hydrogen 3.023 N/A ALA 322.A N LYS 318.A O no hydrogen 3.303 N/A ALA 323.A N SER 319.A O no hydrogen 3.091 N/A LEU 324.A N ALA 320.A O no hydrogen 2.920 N/A LYS 325.A N VAL 321.A O no hydrogen 2.870 N/A SER 326.A N ALA 323.A O no hydrogen 3.260 N/A SER 326.A OG ALA 323.A O no hydrogen 2.730 N/A LEU 327.A N LEU 324.A O no hydrogen 3.381 N/A TYR 328.A OH GLN 385.A OE1 no hydrogen 2.562 N/A GLY 329.A N LYS 325.A O no hydrogen 2.991 N/A THR 330.A OG1 GLU 386.A OE1 no hydrogen 2.778 N/A THR 330.A OG1 GLU 386.A OE2 no hydrogen 3.455 N/A LYS 333.A N GLN 294.A O no hydrogen 3.067 N/A GLY 335.A N LEU 296.A O no hydrogen 3.313 N/A SER 336.A OG THR 339.A OG1 no hydrogen 2.702 N/A ILE 337.A N TYR 298.A O no hydrogen 2.846 N/A ILE 338.A N TYR 300.A O no hydrogen 3.098 N/A THR 339.A N SER 336.A O no hydrogen 3.150 N/A THR 339.A OG1 SER 336.A O no hydrogen 3.000 N/A THR 339.A OG1 SER 336.A OG no hydrogen 2.702 N/A VAL 340.A N SER 336.A O no hydrogen 2.900 N/A VAL 340.A N ILE 337.A O no hydrogen 3.178 N/A ILE 341.A N ILE 337.A O no hydrogen 2.866 N/A ALA 344.A N GLY 301.A O no hydrogen 2.998 N/A SER 345.A OG GLY 247.A O no hydrogen 2.732 N/A GLY 346.A N ALA 243.A O no hydrogen 2.878 N/A VAL 348.A N ASN 238.A OD1 no hydrogen 2.897 N/A TRP 351.A N VAL 348.A O no hydrogen 3.126 N/A THR 352.A N VAL 348.A O no hydrogen 3.006 N/A THR 352.A OG1 VAL 348.A O no hydrogen 3.528 N/A THR 352.A OG1 ILE 349.A O no hydrogen 3.127 N/A THR 352.A OG1 SER 360.A OG no hydrogen 2.716 N/A TYR 353.A N ILE 349.A O no hydrogen 2.997 N/A TYR 353.A OH ASP 309.A OD2 no hydrogen 2.642 N/A ASN 354.A N ASP 350.A O no hydrogen 3.294 N/A ASN 354.A ND2 TYR 302.A OH no hydrogen 3.039 N/A GLN 355.A N THR 352.A O no hydrogen 3.000 N/A GLY 356.A N TYR 353.A O no hydrogen 2.899 N/A ILE 357.A N THR 352.A O no hydrogen 2.910 N/A TYR 359.A OH GLU 312.A OE2 no hydrogen 2.881 N/A SER 360.A OG THR 352.A OG1 no hydrogen 2.716 N/A SER 360.A OG ILE 357.A O no hydrogen 2.747 N/A PHE 361.A N PHE 286.A O no hydrogen 2.819 N/A SER 362.A N LEU 297.A O no hydrogen 2.870 N/A SER 362.A OG SER 288.A O no hydrogen 3.529 N/A PHE 363.A N SER 288.A O no hydrogen 2.922 N/A GLU 364.A N LEU 295.A O no hydrogen 2.828 N/A LEU 365.A N HIS 290.A O no hydrogen 2.852 N/A ARG 366.A NE GLU 386.A OE2 no hydrogen 2.745 N/A ARG 366.A NH1 GLN 379.A OE1 no hydrogen 3.182 N/A ARG 366.A NH2 GLU 386.A OE1 no hydrogen 2.974 N/A ARG 366.A NH2 GLU 386.A OE2 no hydrogen 3.294 N/A GLY 369.A N ASP 367.A OD1 no hydrogen 2.852 N/A ARG 371.A N ASP 367.A OD2 no hydrogen 2.865 N/A GLY 372.A N ASP 367.A OD1 no hydrogen 2.974 N/A LEU 374.A N ARG 371.A O no hydrogen 3.094 N/A GLN 379.A N PRO 376.A O no hydrogen 2.720 N/A ILE 380.A N ALA 377.A O no hydrogen 3.188 N/A THR 383.A N GLN 379.A O no hydrogen 3.065 N/A THR 383.A OG1 GLN 379.A O no hydrogen 2.713 N/A ALA 384.A N ILE 380.A O no hydrogen 2.981 N/A GLN 385.A N ILE 381.A O no hydrogen 2.827 N/A GLU 386.A N PRO 382.A O no hydrogen 2.973 N/A THR 387.A N THR 383.A O no hydrogen 3.001 N/A TRP 388.A N ALA 384.A O no hydrogen 2.923 N/A LEU 391.A N THR 387.A O no hydrogen 2.833 N/A LEU 392.A N TRP 388.A O no hydrogen 2.826 N/A THR 393.A N LEU 389.A O no hydrogen 3.253 N/A THR 393.A OG1 LEU 389.A O no hydrogen 3.076 N/A ILE 394.A N ALA 390.A O no hydrogen 3.210 N/A MET 395.A N LEU 391.A O no hydrogen 3.124 N/A GLU 396.A N LEU 392.A O no hydrogen 2.782 N/A HIS 397.A N THR 393.A O no hydrogen 3.122 N/A HIS 397.A NE2 GLU 312.A OE2 no hydrogen 2.823 N/A THR 398.A N ILE 394.A O no hydrogen 3.030 N/A THR 398.A OG1 ILE 394.A O no hydrogen 2.664 N/A LEU 399.A N MET 395.A O no hydrogen 2.966 N/A ASN 400.A N GLU 396.A O no hydrogen 2.927 N/A ASN 401.A N THR 398.A O no hydrogen 3.390 N/A ASN 401.A ND2 HIS 397.A O no hydrogen 3.463 N/A LYS 1A.A N ASP 216.A OD1 no hydrogen 3.121 N/A GLU 2A.A N ASP 216.A O no hydrogen 2.814 N/A PHE 4A.A N GLN 78A.A OE1 no hydrogen 2.776 N/A VAL 5A.A N ASP 3A.A OD2 no hydrogen 3.367 N/A GLY 6A.A N ASP 76A.A OD1 no hydrogen 2.889 N/A HIS 7A.A N PHE 4A.A O no hydrogen 3.222 N/A GLN 8A.A N VAL 51A.A O no hydrogen 3.134 N/A VAL 9A.A N ILE 74A.A O no hydrogen 2.868 N/A LEU 10A.A N VAL 49A.A O no hydrogen 2.890 N/A ARG 11A.A N THR 71A.A O no hydrogen 2.791 N/A ARG 11A.A NE ASP 48A.A OD1 no hydrogen 2.784 N/A ARG 11A.A NH2 THR 368.A O no hydrogen 2.869 N/A ARG 11A.A NH2 ASP 48A.A OD1 no hydrogen 3.208 N/A ARG 11A.A NH2 ASP 48A.A OD2 no hydrogen 2.761 N/A ILE 12A.A N ILE 47A.A O no hydrogen 2.711 N/A SER 13A.A N ARG 69A.A O no hydrogen 2.875 N/A ASP 15A.A N GLN 19A.A OE1 no hydrogen 2.916 N/A GLN 19A.A N ASP 16A.A OD1 no hydrogen 3.006 N/A GLN 19A.A NE2 GLY 67A.A O no hydrogen 3.497 N/A VAL 20A.A N ASP 16A.A O no hydrogen 3.241 N/A GLN 21A.A N GLU 17A.A O no hydrogen 2.967 N/A LYS 22A.A N ALA 18A.A O no hydrogen 2.977 N/A VAL 23A.A N GLN 19A.A O no hydrogen 3.046 N/A LYS 24A.A N VAL 20A.A O no hydrogen 3.100 N/A GLU 25A.A N LYS 22A.A O no hydrogen 2.775 N/A LEU 26A.A N LYS 22A.A O no hydrogen 3.161 N/A GLU 27A.A N VAL 23A.A O no hydrogen 3.000 N/A ASP 28A.A N GLU 25A.A O no hydrogen 2.821 N/A LEU 29A.A N LEU 26A.A O no hydrogen 3.075 N/A ASP 35A.A N ARG 50A.A O no hydrogen 3.025 N/A TRP 37A.A NE1 ASP 35A.A OD2 no hydrogen 2.987 N/A ARG 38A.A N ASP 48A.A O no hydrogen 3.027 N/A ARG 42A.A NH2 ILE 338.A O no hydrogen 2.567 N/A GLY 44A.A N VAL 14A.A O no hydrogen 2.974 N/A PHE 45A.A N ARG 42A.A O no hydrogen 3.055 N/A ILE 47A.A N ILE 12A.A O no hydrogen 3.061 N/A ASP 48A.A N ARG 38A.A O no hydrogen 2.880 N/A VAL 49A.A N LEU 10A.A O no hydrogen 2.941 N/A ARG 50A.A N ASP 35A.A O no hydrogen 2.826 N/A ARG 50A.A NE HIS 7A.A ND1 no hydrogen 3.383 N/A ARG 50A.A NH1 ASP 35A.A OD2 no hydrogen 2.870 N/A VAL 51A.A N GLN 8A.A O no hydrogen 2.854 N/A SER 55A.A N PRO 52A.A O no hydrogen 2.770 N/A SER 55A.A OG LEU 32B.A O no hydrogen 2.720 N/A ILE 56A.A N PHE 53A.A O no hydrogen 3.374 N/A VAL 59A.A N SER 55A.A O no hydrogen 2.962 N/A LYS 60A.A N ILE 56A.A O no hydrogen 2.964 N/A VAL 61A.A N GLN 57A.A O no hydrogen 2.900 N/A PHE 62A.A N ALA 58A.A O no hydrogen 3.214 N/A LEU 63A.A N VAL 59A.A O no hydrogen 3.002 N/A GLU 64A.A N LYS 60A.A O no hydrogen 2.920 N/A ALA 65A.A N VAL 61A.A O no hydrogen 2.864 N/A HIS 66A.A N LEU 63A.A O no hydrogen 3.158 N/A HIS 66A.A ND1 PHE 62A.A O no hydrogen 2.619 N/A GLY 67A.A N GLU 64A.A O no hydrogen 2.846 N/A ILE 68A.A N LEU 63A.A O no hydrogen 3.002 N/A TYR 70A.A OH GLU 64A.A OE2 no hydrogen 3.134 N/A THR 71A.A N ARG 11A.A O no hydrogen 2.828 N/A MET 73A.A N VAL 9A.A O no hydrogen 2.879 N/A ILE 74A.A N VAL 9A.A O no hydrogen 3.319 N/A VAL 77A.A N HIS 7A.A O no hydrogen 3.102 N/A GLN 78A.A N ASP 76A.A OD1 no hydrogen 3.140 N/A GLN 78A.A NE2 ASP 82A.A OD1 no hydrogen 2.974 N/A LEU 79A.A N ASP 76A.A O no hydrogen 3.397 N/A LEU 80A.A N VAL 77A.A O no hydrogen 3.103 N/A LEU 81A.A N VAL 77A.A O no hydrogen 3.056 N/A ASP 82A.A N GLN 78A.A O no hydrogen 2.861 N/A GLU 83A.A N LEU 79A.A O no hydrogen 3.029 N/A GLU 84A.A N LEU 80A.A O no hydrogen 3.084 N/A GLN 85A.A N LEU 81A.A O no hydrogen 3.001 N/A GLU 86A.A N ASP 82A.A O no hydrogen 2.883 N/A GLN 87A.A N GLU 83A.A O no hydrogen 3.059 N/A GLN 87A.A NE2 THR 105.A OG1 no hydrogen 2.721 N/A MET 88A.A N GLU 84A.A O no hydrogen 3.051 N/A PHE 89A.A N GLN 85A.A O no hydrogen 3.084 N/A ALA 90A.A N GLU 86A.A O no hydrogen 3.154 N/A SER 91A.A N MET 88A.A O no hydrogen 3.215 N/A SER 91A.A OG GLN 87A.A O no hydrogen 2.710 N/A GLN 92A.A N PHE 89A.A O no hydrogen 3.370 N/A LEU 32B.A N LEU 29A.A O no hydrogen 2.833 N/A GLN 33C.A N GLU 30A.A O no hydrogen 3.000 N/A