Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3i3r_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): TYR 1.A OH GLU 120.A OE2 no hydrogen 2.403 N/A CYS 4.A N TYR 1.A O no hydrogen 3.131 N/A CYS 4.A SG GLU 2.A O no hydrogen 3.663 N/A CYS 4.A SG SER 94.A O no hydrogen 3.812 N/A LEU 7.A N LEU 126.A O no hydrogen 2.661 N/A THR 8.A N ILE 109.A O no hydrogen 3.393 N/A ILE 9.A N LYS 129.A O no hydrogen 3.069 N/A PHE 10.A N ILE 111.A O no hydrogen 3.259 N/A VAL 11.A N TYR 131.A O no hydrogen 3.018 N/A VAL 13.A N THR 133.A O no hydrogen 3.012 N/A ALA 14.A N VAL 18.A O no hydrogen 3.147 N/A LEU 15.A N LYS 137.A O no hydrogen 2.920 N/A ASN 16.A ND2 TYR 139.A O no hydrogen 2.868 N/A LYS 17.A N ALA 14.A O no hydrogen 2.869 N/A LYS 17.A NZ ASP 147.A OD1 no hydrogen 2.795 N/A ILE 19.A N THR 143.A O no hydrogen 2.734 N/A GLY 20.A N THR 143.A O no hydrogen 3.028 N/A HIS 21.A N GLN 24.A O no hydrogen 2.892 N/A LYS 22.A N ASP 142.A OD2 no hydrogen 3.027 N/A GLN 24.A N HIS 21.A O no hydrogen 2.853 N/A HIS 32.A ND1 TYR 168.A OH no hydrogen 2.666 N/A PHE 34.A N ILE 30.A O no hydrogen 3.400 N/A ARG 35.A N THR 31.A O no hydrogen 3.015 N/A PHE 36.A N HIS 32.A O no hydrogen 2.924 N/A LEU 37.A N ASP 33.A O no hydrogen 2.946 N/A ARG 38.A N PHE 34.A O no hydrogen 2.804 N/A ASN 39.A N ARG 35.A O no hydrogen 2.939 N/A GLY 40.A N PHE 36.A O no hydrogen 2.935 N/A THR 41.A N LEU 37.A O no hydrogen 2.850 N/A THR 41.A OG1 LEU 37.A O no hydrogen 2.783 N/A THR 41.A OG1 ARG 38.A O no hydrogen 3.386 N/A THR 42.A N ARG 38.A O no hydrogen 2.856 N/A THR 42.A OG1 ARG 38.A O no hydrogen 2.668 N/A THR 42.A OG1 THR 42.A O no hydrogen 2.406 N/A LEU 49.A N PRO 45.A O no hydrogen 2.796 N/A SER 50.A N PRO 46.A O no hydrogen 3.133 N/A SER 50.A OG PRO 46.A O no hydrogen 3.469 N/A SER 50.A OG GLU 47.A O no hydrogen 3.263 N/A ILE 55.A N ASN 52.A O no hydrogen 3.409 N/A ASN 57.A ND2 THR 41.A O no hydrogen 2.602 N/A ASN 57.A ND2 TYR 43.A O no hydrogen 3.161 N/A VAL 58.A N LYS 108.A O no hydrogen 2.782 N/A VAL 59.A N ILE 73.A O no hydrogen 2.926 N/A ILE 60.A N PHE 110.A O no hydrogen 2.876 N/A PHE 61.A N VAL 75.A O no hydrogen 3.078 N/A GLY 62.A N GLY 113.A O no hydrogen 3.377 N/A LEU 69.A N ASN 74.A OD1 no hydrogen 2.868 N/A ARG 72.A NE LYS 70.A O no hydrogen 2.891 N/A ARG 72.A NH2 LYS 70.A O no hydrogen 2.845 N/A ILE 73.A N ASN 57.A O no hydrogen 2.947 N/A ASN 74.A ND2 LEU 69.A O no hydrogen 2.912 N/A ASN 74.A ND2 ARG 72.A O no hydrogen 2.749 N/A VAL 75.A N VAL 59.A O no hydrogen 2.734 N/A ILE 76.A N LEU 88.A O no hydrogen 2.863 N/A LEU 77.A N PHE 61.A O no hydrogen 2.761 N/A SER 78.A N TYR 90.A O no hydrogen 2.829 N/A THR 80.A N SER 78.A OG no hydrogen 3.066 N/A THR 80.A OG1 SER 78.A OG no hydrogen 3.423 N/A CYS 87.A N VAL 84.A O no hydrogen 2.983 N/A LEU 88.A N ASN 74.A O no hydrogen 3.110 N/A TYR 90.A N ILE 76.A O no hydrogen 3.184 N/A TYR 90.A OH ASP 99.A OD2 no hydrogen 2.527 N/A THR 95.A N ASP 92.A OD1 no hydrogen 3.101 N/A ALA 96.A N ASP 92.A O no hydrogen 3.245 N/A ILE 97.A N LEU 93.A O no hydrogen 3.096 N/A ARG 98.A N SER 94.A O no hydrogen 3.406 N/A ASP 99.A N THR 95.A O no hydrogen 2.768 N/A LEU 100.A N ALA 96.A O no hydrogen 2.814 N/A ARG 101.A N ILE 97.A O no hydrogen 2.887 N/A ARG 101.A NH1 GLY 3.A O no hydrogen 2.771 N/A ARG 101.A NH1 GLY 5.A O no hydrogen 3.177 N/A ARG 101.A NH2 GLY 5.A O no hydrogen 2.916 N/A ALA 102.A N ARG 98.A O no hydrogen 3.022 N/A ASN 103.A N ASP 99.A O no hydrogen 2.716 N/A ASN 103.A ND2 ASP 99.A OD1 no hydrogen 2.694 N/A VAL 104.A N LEU 100.A O no hydrogen 3.094 N/A ASN 107.A N GLN 56.A O no hydrogen 2.941 N/A ASN 107.A ND2 ASN 57.A OD1 no hydrogen 2.660 N/A LYS 108.A NZ ASP 6.A OD1 no hydrogen 3.525 N/A LYS 108.A NZ THR 8.A OG1 no hydrogen 3.087 N/A PHE 110.A N VAL 58.A O no hydrogen 2.781 N/A ILE 111.A N THR 8.A O no hydrogen 2.846 N/A LEU 112.A N ILE 60.A O no hydrogen 2.917 N/A SER 115.A OG TYR 144.A O no hydrogen 2.839 N/A TYR 118.A N GLY 114.A O no hydrogen 2.986 N/A TYR 118.A OH PHE 10.A O no hydrogen 2.975 N/A LYS 119.A N SER 115.A O no hydrogen 2.718 N/A LYS 119.A NZ ASP 123.A OD1 no hydrogen 3.489 N/A LYS 119.A NZ ASP 123.A OD2 no hydrogen 3.200 N/A GLU 120.A N PHE 116.A O no hydrogen 2.910 N/A VAL 121.A N LEU 117.A O no hydrogen 3.014 N/A LEU 122.A N TYR 118.A O no hydrogen 2.961 N/A ASP 123.A N LYS 119.A O no hydrogen 2.806 N/A ASN 124.A N GLU 120.A O no hydrogen 3.258 N/A ASN 124.A ND2 GLU 120.A O no hydrogen 2.965 N/A GLY 125.A N LEU 122.A O no hydrogen 2.964 N/A LEU 126.A N VAL 121.A O no hydrogen 2.920 N/A CYS 127.A SG LEU 7.A O no hydrogen 3.492 N/A CYS 127.A SG LYS 129.A O no hydrogen 3.141 N/A ASP 128.A N LEU 7.A O no hydrogen 3.333 N/A LYS 129.A NZ TYR 131.A OH no hydrogen 3.064 N/A ILE 130.A N TYR 173.A O no hydrogen 2.932 N/A TYR 131.A N ILE 9.A O no hydrogen 2.843 N/A LEU 132.A N VAL 171.A O no hydrogen 2.940 N/A THR 133.A N VAL 11.A O no hydrogen 2.894 N/A THR 133.A OG1 ASP 33.A OD1 no hydrogen 2.477 N/A ARG 134.A N ASP 169.A O no hydrogen 2.790 N/A ARG 134.A NE ASP 169.A OD1 no hydrogen 2.932 N/A ARG 134.A NH1 PRO 450.A O no hydrogen 3.417 N/A ARG 134.A NH2 ASP 169.A OD2 no hydrogen 2.931 N/A ARG 134.A NH2 PRO 450.A O no hydrogen 2.768 N/A LEU 135.A N VAL 13.A O no hydrogen 2.975 N/A ASN 136.A N SER 167.A O no hydrogen 3.008 N/A ASN 136.A ND2 PRO 452.A O no hydrogen 2.874 N/A ASN 136.A ND2 ASP 477.A O no hydrogen 3.024 N/A LYS 137.A NZ PHE 165.A O no hydrogen 3.565 N/A LYS 137.A NZ ASP 477.A OD1 no hydrogen 2.805 N/A TYR 139.A N ASN 16.A OD1 no hydrogen 3.347 N/A ASP 142.A N GLY 20.A O no hydrogen 2.899 N/A THR 143.A N GLY 20.A O no hydrogen 3.159 N/A THR 143.A OG1 ASP 142.A OD1 no hydrogen 3.064 N/A PHE 145.A N LYS 17.A O no hydrogen 2.878 N/A PHE 152.A N PRO 149.A O no hydrogen 2.932 N/A GLU 153.A N GLU 174.A O no hydrogen 2.908 N/A THR 155.A N ILE 172.A O no hydrogen 2.769 N/A THR 155.A OG1 ILE 172.A O no hydrogen 3.509 N/A THR 155.A OG1 GLU 174.A OE1 no hydrogen 2.572 N/A ALA 156.A N ILE 172.A O no hydrogen 3.376 N/A ILE 157.A N ILE 202.A O no hydrogen 3.052 N/A SER 158.A N PHE 170.A O no hydrogen 2.880 N/A SER 158.A OG PRO 159.A O no hydrogen 2.680 N/A SER 158.A OG PHE 170.A O no hydrogen 3.420 N/A PHE 161.A N TYR 168.A O no hydrogen 2.822 N/A SER 162.A OG ARG 246.A O no hydrogen 2.735 N/A THR 163.A N VAL 166.A O no hydrogen 2.820 N/A PHE 165.A N THR 163.A OG1 no hydrogen 3.154 N/A VAL 166.A N THR 163.A OG1 no hydrogen 3.272 N/A SER 167.A OG PHE 453.A O no hydrogen 2.909 N/A TYR 168.A N PHE 161.A O no hydrogen 2.977 N/A TYR 168.A OH HIS 32.A ND1 no hydrogen 2.666 N/A ASP 169.A N ARG 134.A O no hydrogen 3.121 N/A PHE 170.A N SER 158.A OG no hydrogen 2.894 N/A VAL 171.A N LEU 132.A O no hydrogen 2.846 N/A ILE 172.A N ALA 156.A O no hydrogen 2.991 N/A TYR 173.A N ILE 130.A O no hydrogen 2.869 N/A GLU 174.A N GLU 153.A O no hydrogen 2.869 N/A ARG 175.A N ASP 128.A O no hydrogen 3.378 N/A ARG 175.A NH1 ASP 128.A OD1 no hydrogen 2.717 N/A LYS 176.A N THR 151.A O no hydrogen 2.862 N/A GLN 181.A N PRO 178.A O no hydrogen 3.091 N/A LEU 182.A N PHE 179.A O no hydrogen 3.099 N/A LEU 183.A N PHE 179.A O no hydrogen 2.920 N/A MET 184.A N ASP 180.A O no hydrogen 2.993 N/A THR 185.A N LEU 182.A O no hydrogen 3.382 N/A THR 185.A OG1 LEU 182.A O no hydrogen 2.843 N/A THR 185.A OG1 THR 187.A O no hydrogen 3.495 N/A THR 185.A OG1 THR 187.A OG1 no hydrogen 3.070 N/A GLY 186.A N LEU 183.A O no hydrogen 3.079 N/A THR 187.A N THR 185.A OG1 no hydrogen 3.194 N/A THR 187.A OG1 THR 185.A OG1 no hydrogen 3.070 N/A TYR 194.A N SER 219.A OG no hydrogen 2.912 N/A CYS 197.A N ILE 446.A O no hydrogen 2.795 N/A CYS 197.A SG ILE 446.A O no hydrogen 3.531 N/A CYS 197.A SG ARG 448.A O no hydrogen 3.010 N/A VAL 200.A N CYS 197.A O no hydrogen 2.932 N/A ARG 201.A N THR 155.A O no hydrogen 2.897 N/A ILE 202.A N THR 155.A O no hydrogen 3.171 N/A ARG 203.A NH1 ALA 196.A O no hydrogen 2.808 N/A ARG 203.A NH1 ASP 212.A OD1 no hydrogen 2.852 N/A ARG 203.A NH2 ALA 196.A O no hydrogen 3.123 N/A ARG 203.A NH2 CYS 197.A O no hydrogen 3.056 N/A ARG 203.A NH2 VAL 200.A O no hydrogen 2.851 N/A ASN 204.A N ILE 157.A O no hydrogen 2.885 N/A HIS 205.A NE2 HIS 451.A O no hydrogen 2.635 N/A GLU 207.A N HIS 205.A ND1 no hydrogen 3.008 N/A PHE 208.A N HIS 205.A O no hydrogen 3.091 N/A GLN 209.A N GLU 206.A O no hydrogen 2.953 N/A GLN 209.A NE2 GLU 206.A O no hydrogen 2.943 N/A GLN 209.A NE2 ARG 241.A O no hydrogen 2.969 N/A TYR 210.A OH LEU 396.A O no hydrogen 2.407 N/A LEU 211.A N GLU 207.A O no hydrogen 2.971 N/A ASP 212.A N PHE 208.A O no hydrogen 2.771 N/A ILE 213.A N GLN 209.A O no hydrogen 3.064 N/A LEU 214.A N TYR 210.A O no hydrogen 2.997 N/A ALA 215.A N LEU 211.A O no hydrogen 3.095 N/A ASP 216.A N ASP 212.A O no hydrogen 2.875 N/A VAL 217.A N ILE 213.A O no hydrogen 2.942 N/A LEU 218.A N LEU 214.A O no hydrogen 3.007 N/A SER 219.A N ALA 215.A O no hydrogen 2.773 N/A SER 219.A OG TYR 194.A O no hydrogen 3.246 N/A SER 219.A OG ALA 215.A O no hydrogen 2.832 N/A HIS 220.A N ASP 216.A O no hydrogen 2.860 N/A HIS 220.A ND1 ASP 216.A OD1 no hydrogen 3.326 N/A GLY 221.A N VAL 217.A O no hydrogen 2.761 N/A VAL 222.A N SER 234.A O no hydrogen 2.870 N/A LYS 224.A N ALA 232.A O no hydrogen 2.940 N/A ASN 226.A ND2 THR 230.A O no hydrogen 2.927 N/A THR 228.A N ASN 226.A OD1 no hydrogen 2.958 N/A THR 228.A OG1 ASN 226.A OD1 no hydrogen 2.675 N/A GLY 229.A N ASN 226.A O no hydrogen 3.414 N/A THR 230.A N THR 228.A OG1 no hydrogen 3.220 N/A ALA 232.A N LYS 224.A O no hydrogen 3.160 N/A TYR 233.A N ILE 434.A O no hydrogen 2.735 N/A SER 234.A N VAL 222.A O no hydrogen 2.821 N/A SER 234.A OG ASP 431.A OD2 no hydrogen 2.951 N/A LYS 235.A N ALA 432.A O no hydrogen 2.848 N/A LYS 235.A NZ ASP 216.A OD2 no hydrogen 2.712 N/A GLY 237.A N ALA 430.A O no hydrogen 2.953 N/A TYR 238.A N LEU 429.A O no hydrogen 2.882 N/A TYR 238.A OH ASP 216.A OD2 no hydrogen 2.562 N/A GLN 239.A NE2 ASN 428.A OD1 no hydrogen 2.765 N/A MET 240.A N HIS 427.A O no hydrogen 2.929 N/A ARG 241.A N GLN 209.A OE1 no hydrogen 3.012 N/A ARG 241.A NE GLU 424.A OE2 no hydrogen 3.363 N/A ARG 241.A NH2 GLU 424.A OE1 no hydrogen 2.995 N/A PHE 242.A N PHE 425.A O no hydrogen 2.832 N/A ASP 243.A N GLU 206.A OE2 no hydrogen 2.813 N/A LEU 244.A N GLY 423.A O no hydrogen 2.978 N/A SER 245.A N ASP 243.A OD1 no hydrogen 3.000 N/A SER 245.A OG ASP 243.A OD1 no hydrogen 2.781 N/A ARG 246.A N ASP 243.A O no hydrogen 3.280 N/A SER 247.A N ASP 243.A O no hydrogen 3.370 N/A PHE 248.A N PRO 454.A O no hydrogen 2.972 N/A LEU 250.A N PHE 248.A O no hydrogen 2.885 N/A THR 252.A N GLU 207.A OE1 no hydrogen 2.793 N/A THR 252.A N GLU 207.A OE2 no hydrogen 3.266 N/A THR 252.A OG1 GLU 207.A OE1 no hydrogen 2.615 N/A THR 252.A OG1 HIS 451.A O no hydrogen 3.392 N/A THR 253.A N GLU 207.A OE2 no hydrogen 2.884 N/A THR 253.A OG1 GLU 207.A OE2 no hydrogen 2.526 N/A LYS 254.A NZ GLY 397.A O no hydrogen 2.769 N/A VAL 256.A N TYR 478.A OH no hydrogen 3.054 N/A ARG 259.A NH1 LYS 281.A O no hydrogen 3.561 N/A ARG 259.A NH1 ASN 282.A O no hydrogen 3.042 N/A ARG 259.A NH2 LYS 281.A O no hydrogen 2.658 N/A SER 260.A N ALA 257.A O no hydrogen 3.255 N/A ILE 262.A N LEU 258.A O no hydrogen 3.062 N/A GLU 263.A N ARG 259.A O no hydrogen 3.081 N/A GLU 264.A N SER 260.A O no hydrogen 3.186 N/A LEU 265.A N ILE 261.A O no hydrogen 3.078 N/A LEU 266.A N ILE 262.A O no hydrogen 2.981 N/A TRP 267.A N GLU 263.A O no hydrogen 2.974 N/A TRP 267.A NE1 ASN 274.A O no hydrogen 3.043 N/A PHE 268.A N GLU 264.A O no hydrogen 2.855 N/A ILE 269.A N LEU 265.A O no hydrogen 2.852 N/A LYS 270.A N LEU 266.A O no hydrogen 3.109 N/A GLY 271.A N PHE 268.A O no hydrogen 2.829 N/A SER 272.A N TRP 267.A O no hydrogen 3.231 N/A SER 272.A OG ASP 277.A OD2 no hydrogen 2.765 N/A THR 273.A OG1 TYR 323.A OH no hydrogen 2.774 N/A ASN 274.A N SER 272.A OG no hydrogen 3.264 N/A GLY 275.A N HIS 306.A O no hydrogen 2.893 N/A ASN 276.A N ASN 274.A OD1 no hydrogen 3.108 N/A ASN 276.A ND2 ASN 274.A OD1 no hydrogen 2.960 N/A ASP 277.A N ASN 274.A O no hydrogen 3.084 N/A LEU 278.A N GLY 275.A O no hydrogen 3.135 N/A LEU 279.A N GLY 275.A O no hydrogen 3.023 N/A ALA 280.A N ASN 276.A O no hydrogen 2.759 N/A LYS 281.A N LEU 278.A O no hydrogen 2.914 N/A LYS 281.A NZ GLU 263.A OE2 no hydrogen 3.537 N/A ASN 282.A N LEU 279.A O no hydrogen 2.722 N/A VAL 283.A N LEU 278.A O no hydrogen 3.083 N/A TRP 286.A NE1 GLU 264.A OE2 no hydrogen 2.791 N/A GLU 287.A N ARG 284.A O no hydrogen 3.204 N/A ASN 289.A N TRP 286.A O no hydrogen 3.212 N/A GLY 290.A N GLU 287.A O no hydrogen 3.163 N/A ARG 291.A NE GLU 287.A OE2 no hydrogen 3.060 N/A ARG 291.A NH2 GLU 287.A OE2 no hydrogen 2.882 N/A ARG 292.A N GLU 305.A OE2 no hydrogen 3.378 N/A ARG 292.A NE ASP 296.A OD1 no hydrogen 3.260 N/A ARG 292.A NE ASP 296.A OD2 no hydrogen 3.491 N/A ARG 292.A NH1 ASP 296.A OD1 no hydrogen 3.251 N/A ARG 292.A NH1 ARG 303.A O no hydrogen 2.739 N/A ARG 292.A NH2 ARG 303.A O no hydrogen 2.860 N/A LEU 295.A N ARG 291.A O no hydrogen 2.924 N/A ASP 296.A N ARG 292.A O no hydrogen 2.958 N/A LYS 297.A N ASP 293.A O no hydrogen 3.056 N/A ASN 298.A N PHE 294.A O no hydrogen 3.260 N/A ASN 298.A N LEU 295.A O no hydrogen 3.083 N/A ASN 298.A ND2 PHE 294.A O no hydrogen 2.770 N/A GLY 299.A N ASP 296.A O no hydrogen 2.937 N/A PHE 300.A N LEU 295.A O no hydrogen 2.775 N/A ARG 303.A NE ASP 307.A O no hydrogen 3.226 N/A ARG 303.A NH1 LYS 366.A O no hydrogen 2.563 N/A ARG 303.A NH2 LYS 366.A O no hydrogen 3.014 N/A HIS 306.A N GLY 290.A O no hydrogen 2.650 N/A ASP 307.A N GLU 304.A O no hydrogen 3.093 N/A LEU 308.A N THR 273.A O no hydrogen 3.296 N/A GLY 309.A N ASP 307.A OD2 no hydrogen 3.019 N/A ILE 311.A N GLY 309.A O no hydrogen 2.915 N/A GLN 315.A N ILE 311.A O no hydrogen 3.282 N/A GLN 315.A NE2 PRO 310.A O no hydrogen 2.806 N/A GLN 315.A NE2 ASP 363.A OD2 no hydrogen 3.211 N/A TRP 316.A N TYR 312.A O no hydrogen 2.836 N/A TRP 316.A NE1 SER 358.A OG no hydrogen 3.061 N/A ARG 317.A N GLY 313.A O no hydrogen 3.128 N/A ARG 317.A N PHE 314.A O no hydrogen 3.298 N/A ARG 317.A NE ASP 336.A OD1 no hydrogen 2.868 N/A ARG 317.A NE ASP 336.A OD2 no hydrogen 3.331 N/A ARG 317.A NH1 ILE 269.A O no hydrogen 2.669 N/A ARG 317.A NH2 ASP 336.A OD2 no hydrogen 2.731 N/A ARG 317.A NH2 GLU 466.A OE2 no hydrogen 3.198 N/A HIS 318.A N PHE 314.A O no hydrogen 2.671 N/A HIS 318.A ND1 LYS 333.A O no hydrogen 3.198 N/A PHE 319.A N ILE 335.A O no hydrogen 3.150 N/A ALA 321.A N HIS 318.A O no hydrogen 2.918 N/A TYR 323.A OH THR 273.A OG1 no hydrogen 2.774 N/A TYR 323.A OH ASP 307.A OD2 no hydrogen 2.661 N/A LEU 324.A N TYR 330.A OH no hydrogen 3.028 N/A MET 326.A N ASP 307.A OD1 no hydrogen 2.847 N/A HIS 327.A NE2 GLU 304.A OE1 no hydrogen 2.585 N/A ALA 328.A N ASP 325.A O no hydrogen 3.228 N/A TYR 330.A OH ASP 325.A O no hydrogen 2.575 N/A THR 331.A N ASP 329.A OD1 no hydrogen 3.136 N/A THR 331.A OG1 ASP 329.A OD1 no hydrogen 3.458 N/A LYS 333.A N TYR 330.A O no hydrogen 2.753 N/A ILE 335.A N PHE 319.A O no hydrogen 2.737 N/A GLN 337.A N ILE 335.A O no hydrogen 3.001 N/A GLN 337.A NE2 GLN 315.A O no hydrogen 2.860 N/A GLN 337.A NE2 CYS 357.A O no hydrogen 2.994 N/A LEU 338.A N TRP 316.A O no hydrogen 3.062 N/A ALA 339.A N ASP 336.A OD1 no hydrogen 3.064 N/A GLU 340.A N ASP 336.A O no hydrogen 2.939 N/A ILE 341.A N GLN 337.A O no hydrogen 2.969 N/A ILE 342.A N LEU 338.A O no hydrogen 3.047 N/A ASN 343.A N ALA 339.A O no hydrogen 2.860 N/A ARG 344.A N GLU 340.A O no hydrogen 2.685 N/A ILE 345.A N ILE 341.A O no hydrogen 2.898 N/A LYS 346.A N ILE 342.A O no hydrogen 3.380 N/A THR 347.A N ASN 343.A O no hydrogen 3.046 N/A THR 347.A OG1 ASN 343.A O no hydrogen 2.934 N/A ASN 348.A N ARG 344.A O no hydrogen 2.731 N/A ASP 351.A N ASN 348.A O no hydrogen 3.123 N/A VAL 356.A N PHE 376.A O no hydrogen 3.154 N/A CYS 357.A N GLN 337.A OE1 no hydrogen 2.904 N/A CYS 357.A SG TRP 359.A O no hydrogen 3.881 N/A SER 358.A N CYS 374.A O no hydrogen 2.756 N/A ASN 360.A N SER 358.A O no hydrogen 2.926 N/A ASN 360.A ND2 GLN 315.A OE1 no hydrogen 3.014 N/A SER 362.A N ASN 360.A OD1 no hydrogen 3.247 N/A ASP 363.A N ASN 360.A O no hydrogen 2.924 N/A LYS 366.A N ASP 363.A O no hydrogen 3.001 N/A LYS 366.A NZ SER 362.A O no hydrogen 3.095 N/A LYS 366.A NZ ASP 363.A OD1 no hydrogen 2.777 N/A MET 367.A N LEU 364.A O no hydrogen 3.206 N/A ALA 368.A N LEU 308.A O no hydrogen 3.051 N/A CYS 372.A N TYR 312.A OH no hydrogen 2.660 N/A HIS 373.A N TYR 312.A OH no hydrogen 3.274 N/A HIS 373.A ND1 TYR 407.A OH no hydrogen 2.365 N/A CYS 374.A N HIS 390.A O no hydrogen 2.981 N/A CYS 374.A SG PRO 371.A O no hydrogen 3.950 N/A CYS 374.A SG CYS 372.A O no hydrogen 3.709 N/A PHE 376.A N VAL 356.A O no hydrogen 3.052 N/A GLN 377.A N MET 388.A O no hydrogen 2.657 N/A PHE 378.A N LEU 354.A O no hydrogen 2.902 N/A TYR 379.A N SER 386.A O no hydrogen 2.945 N/A SER 381.A N LYS 384.A O no hydrogen 3.221 N/A LYS 384.A N SER 381.A O no hydrogen 3.021 N/A LEU 385.A N GLY 421.A O no hydrogen 2.939 N/A SER 386.A N TYR 379.A O no hydrogen 2.692 N/A CYS 387.A N GLU 424.A O no hydrogen 2.938 N/A CYS 387.A SG GLN 377.A O no hydrogen 3.982 N/A MET 388.A N GLN 377.A O no hydrogen 2.743 N/A MET 389.A N VAL 426.A O no hydrogen 2.998 N/A HIS 390.A N PHE 375.A O no hydrogen 2.893 N/A GLN 391.A N ASN 428.A O no hydrogen 3.008 N/A GLN 391.A NE2 SER 393.A O no hydrogen 3.069 N/A ARG 392.A N CYS 372.A O no hydrogen 2.931 N/A ARG 392.A NE PRO 371.A O no hydrogen 2.712 N/A ARG 392.A NH2 PRO 370.A O no hydrogen 2.943 N/A CYS 394.A N ASP 431.A O no hydrogen 2.798 N/A CYS 394.A SG GLN 391.A O no hydrogen 3.329 N/A CYS 394.A SG ASP 431.A O no hydrogen 3.824 N/A LEU 396.A N HIS 433.A O no hydrogen 3.000 N/A LEU 398.A N ASP 395.A OD1 no hydrogen 3.097 N/A VAL 400.A N ASP 395.A O no hydrogen 2.937 N/A ASN 403.A N GLY 399.A O no hydrogen 3.068 N/A ILE 404.A N VAL 400.A O no hydrogen 2.937 N/A ALA 405.A N PRO 401.A O no hydrogen 3.447 N/A SER 406.A N PHE 402.A O no hydrogen 2.825 N/A TYR 407.A N ASN 403.A O no hydrogen 3.063 N/A TYR 407.A OH HIS 373.A ND1 no hydrogen 2.365 N/A SER 408.A N ILE 404.A O no hydrogen 3.164 N/A SER 408.A OG ILE 404.A O no hydrogen 2.959 N/A ILE 409.A N ALA 405.A O no hydrogen 2.941 N/A LEU 410.A N SER 406.A O no hydrogen 2.960 N/A THR 411.A N TYR 407.A O no hydrogen 2.936 N/A THR 411.A OG1 TYR 407.A O no hydrogen 2.794 N/A ALA 412.A N SER 408.A O no hydrogen 3.139 N/A MET 413.A N ILE 409.A O no hydrogen 2.868 N/A VAL 414.A N LEU 410.A O no hydrogen 2.927 N/A ALA 415.A N THR 411.A O no hydrogen 2.854 N/A GLN 416.A N ALA 412.A O no hydrogen 2.962 N/A GLN 416.A NE2 ASN 459.A O no hydrogen 2.724 N/A GLN 416.A NE2 ILE 462.A O no hydrogen 2.840 N/A VAL 417.A N MET 413.A O no hydrogen 3.083 N/A CYS 418.A N VAL 414.A O no hydrogen 3.094 N/A CYS 418.A N ALA 415.A O no hydrogen 3.121 N/A CYS 418.A SG ILE 342.A O no hydrogen 3.863 N/A CYS 418.A SG VAL 414.A O no hydrogen 3.197 N/A GLY 419.A N GLN 416.A O no hydrogen 3.256 N/A LEU 420.A N ALA 415.A O no hydrogen 2.876 N/A GLY 421.A N ASN 383.A O no hydrogen 2.828 N/A GLY 423.A N LEU 385.A O no hydrogen 2.776 N/A GLU 424.A N SER 386.A OG no hydrogen 2.941 N/A PHE 425.A N PHE 242.A O no hydrogen 2.854 N/A VAL 426.A N CYS 387.A O no hydrogen 2.713 N/A HIS 427.A N MET 240.A O no hydrogen 2.720 N/A HIS 427.A NE2 GLN 391.A OE1 no hydrogen 2.855 N/A ASN 428.A N MET 389.A O no hydrogen 2.910 N/A LEU 429.A N TYR 238.A O no hydrogen 2.889 N/A ALA 430.A N GLN 391.A O no hydrogen 3.028 N/A ASP 431.A N ARG 392.A O no hydrogen 3.087 N/A ALA 432.A N LYS 235.A O no hydrogen 2.870 N/A HIS 433.A N CYS 394.A O no hydrogen 2.928 N/A HIS 433.A ND1 ASP 431.A OD2 no hydrogen 3.119 N/A ILE 434.A N TYR 233.A O no hydrogen 2.857 N/A VAL 436.A N ASP 231.A O no hydrogen 2.964 N/A HIS 438.A N TYR 435.A O no hydrogen 2.900 N/A HIS 438.A NE2 ALA 487.A O no hydrogen 2.722 N/A VAL 439.A N VAL 436.A O no hydrogen 3.432 N/A VAL 442.A N HIS 438.A O no hydrogen 2.979 N/A THR 443.A N VAL 439.A O no hydrogen 3.106 N/A THR 443.A OG1 VAL 439.A O no hydrogen 2.679 N/A THR 444.A N ASP 440.A O no hydrogen 2.941 N/A THR 444.A OG1 ASP 440.A O no hydrogen 3.037 N/A GLN 445.A N ALA 441.A O no hydrogen 2.930 N/A GLN 445.A NE2 THR 253.A OG1 no hydrogen 2.732 N/A ILE 446.A N VAL 442.A O no hydrogen 2.882 N/A ALA 447.A N THR 444.A O no hydrogen 3.303 N/A ARG 448.A N GLN 445.A O no hydrogen 3.044 N/A ARG 448.A NH1 THR 253.A O no hydrogen 3.078 N/A ARG 448.A NH1 PRO 482.A O no hydrogen 2.815 N/A HIS 451.A N THR 252.A OG1 no hydrogen 2.943 N/A PHE 453.A N THR 160.A OG1 no hydrogen 3.073 N/A ARG 455.A N GLU 476.A O no hydrogen 2.943 N/A ARG 455.A NE ASP 477.A OD2 no hydrogen 2.767 N/A ARG 455.A NH2 ASP 477.A OD2 no hydrogen 3.207 N/A ARG 457.A N VAL 474.A O no hydrogen 2.768 N/A ASN 459.A N ASP 472.A O no hydrogen 2.836 N/A ASN 459.A ND2 ASP 472.A OD1 no hydrogen 2.780 N/A ASP 461.A N ASN 459.A OD1 no hydrogen 2.958 N/A ILE 462.A N ASN 459.A O no hydrogen 3.310 N/A ARG 463.A NE PRO 460.A O no hydrogen 3.036 N/A ARG 463.A NH2 PRO 460.A O no hydrogen 3.318 N/A ASP 467.A N ASN 464.A O no hydrogen 2.867 N/A THR 469.A N ASP 472.A OD2 no hydrogen 2.905 N/A THR 469.A OG1 ASP 472.A OD2 no hydrogen 2.765 N/A ASP 472.A N THR 469.A O no hydrogen 2.881 N/A ILE 473.A N ILE 470.A O no hydrogen 3.095 N/A VAL 474.A N ARG 457.A O no hydrogen 2.937 N/A GLU 476.A N ARG 455.A O no hydrogen 2.861 N/A TYR 478.A OH LEU 251.A O no hydrogen 2.624 N/A SER 480.A OG HIS 481.A O no hydrogen 3.321 N/A HIS 481.A N THR 252.A O no hydrogen 2.948 N/A HIS 481.A NE2 ILE 449.A O no hydrogen 2.579 N/A SER 489.A OG ASP 437.A OD1 no hydrogen 3.412 N/A SER 489.A OG ASP 437.A OD2 no hydrogen 3.499 N/A SER 489.A OG ALA 487.A O no hydrogen 3.517 N/A