Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 2pyj_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ARG 2.A NE ASP 53.A OD1 no hydrogen 2.949 N/A ARG 2.A NH2 ALA 52.A O no hydrogen 3.051 N/A ARG 2.A NH2 ASP 53.A OD1 no hydrogen 3.403 N/A ARG 2.A NH2 HIS 112.A O no hydrogen 2.941 N/A LYS 3.A NZ TYR 5.A OH no hydrogen 3.110 N/A LYS 3.A NZ GLU 33.A OE1 no hydrogen 2.849 N/A LYS 3.A NZ GLU 33.A OE2 no hydrogen 3.228 N/A TYR 5.A N ASP 53.A O no hydrogen 2.887 N/A TYR 5.A OH GLU 33.A OE2 no hydrogen 2.400 N/A SER 6.A N MET 26.A O no hydrogen 2.825 N/A SER 6.A OG ILE 166.A O no hydrogen 2.673 N/A CYS 7.A N TYR 55.A O no hydrogen 2.721 N/A ALA 8.A N GLY 24.A O no hydrogen 2.944 N/A GLU 10.A N ALA 22.A O no hydrogen 2.771 N/A THR 11.A OG1 THR 12.A O no hydrogen 3.523 N/A THR 12.A N ARG 19.A O no hydrogen 2.911 N/A THR 12.A OG1 ASP 17.A O no hydrogen 2.552 N/A THR 12.A OG1 ARG 19.A O no hydrogen 3.398 N/A ASP 17.A N LYS 14.A O no hydrogen 3.140 N/A CYS 18.A SG VAL 557.A O no hydrogen 3.736 N/A ARG 19.A N THR 12.A OG1 no hydrogen 2.994 N/A ARG 19.A NE ASP 17.A OD2 no hydrogen 2.839 N/A ARG 19.A NH1 ARG 148.A O no hydrogen 2.961 N/A ARG 19.A NH2 ASP 17.A OD1 no hydrogen 2.819 N/A ARG 19.A NH2 ARG 148.A O no hydrogen 2.930 N/A TRP 21.A N GLU 10.A O no hydrogen 2.854 N/A ALA 22.A N GLU 10.A O no hydrogen 3.241 N/A TYR 23.A N GLY 37.A O no hydrogen 2.836 N/A TYR 23.A OH GLU 42.A OE1 no hydrogen 2.540 N/A GLY 24.A N ALA 8.A O no hydrogen 2.833 N/A TYR 25.A N LYS 35.A O no hydrogen 2.976 N/A MET 26.A N SER 6.A O no hydrogen 2.816 N/A ASN 27.A N GLU 33.A O no hydrogen 2.802 N/A ILE 28.A N MET 4.A O no hydrogen 2.942 N/A ASP 30.A N ASN 27.A O no hydrogen 3.201 N/A SER 32.A N ASP 30.A OD1 no hydrogen 3.309 N/A SER 32.A OG ASP 30.A OD1 no hydrogen 2.644 N/A SER 32.A OG ASP 30.A OD2 no hydrogen 3.240 N/A GLU 33.A N ASP 30.A O no hydrogen 3.013 N/A TYR 34.A OH TYR 159.A OH no hydrogen 2.821 N/A LYS 35.A N TYR 25.A O no hydrogen 2.991 N/A GLY 37.A N TYR 23.A O no hydrogen 3.017 N/A ASN 38.A ND2 TYR 152.A O no hydrogen 3.119 N/A GLU 42.A N SER 39.A OG no hydrogen 3.216 N/A PHE 43.A N SER 39.A O no hydrogen 3.094 N/A MET 44.A N LEU 40.A O no hydrogen 2.823 N/A ALA 45.A N ASP 41.A O no hydrogen 3.021 N/A TRP 46.A N GLU 42.A O no hydrogen 3.468 N/A VAL 47.A N PHE 43.A O no hydrogen 2.929 N/A LEU 48.A N MET 44.A O no hydrogen 3.024 N/A LYS 49.A N ALA 45.A O no hydrogen 3.246 N/A LYS 49.A N TRP 46.A O no hydrogen 3.169 N/A VAL 50.A N TRP 46.A O no hydrogen 2.794 N/A ASP 53.A N LYS 3.A O no hydrogen 2.886 N/A LEU 54.A N VAL 114.A O no hydrogen 2.732 N/A TYR 55.A N TYR 5.A O no hydrogen 2.814 N/A PHE 56.A N TYR 116.A O no hydrogen 3.146 N/A HIS 57.A ND1 SER 118.A OG no hydrogen 2.653 N/A HIS 57.A NE2 PHE 124.A O no hydrogen 2.765 N/A ASN 58.A N ASP 117.A OD1 no hydrogen 2.903 N/A LEU 59.A N ASP 117.A OD1 no hydrogen 2.958 N/A LYS 60.A NZ GLY 94.A O no hydrogen 2.790 N/A PHE 61.A N ASN 58.A O no hydrogen 3.030 N/A ALA 62.A N ASN 58.A O no hydrogen 3.466 N/A GLY 63.A N LEU 59.A O no hydrogen 2.700 N/A ALA 64.A N PHE 61.A O no hydrogen 3.187 N/A ILE 66.A N ALA 62.A O no hydrogen 3.029 N/A ILE 67.A N GLY 63.A O no hydrogen 2.816 N/A ASN 68.A N ALA 64.A O no hydrogen 2.943 N/A ASN 68.A ND2 ALA 64.A O no hydrogen 2.822 N/A TRP 69.A N PHE 65.A O no hydrogen 3.151 N/A TRP 69.A NE1 ASP 41.A OD1 no hydrogen 2.807 N/A LEU 70.A N ILE 66.A O no hydrogen 2.960 N/A GLU 71.A N ILE 67.A O no hydrogen 3.008 N/A ARG 72.A N ASN 68.A O no hydrogen 3.317 N/A ARG 72.A N TRP 69.A O no hydrogen 3.117 N/A ARG 72.A NH1 ASN 68.A O no hydrogen 3.159 N/A ARG 72.A NH1 ASN 68.A OD1 no hydrogen 2.838 N/A ARG 72.A NH2 GLY 406.A O no hydrogen 2.804 N/A ASN 73.A N LEU 70.A O no hydrogen 3.136 N/A ASN 73.A ND2 TRP 69.A O no hydrogen 2.821 N/A PHE 75.A N LEU 70.A O no hydrogen 3.026 N/A TRP 77.A NE1 THR 88.A OG1 no hydrogen 2.779 N/A SER 78.A N TYR 86.A O no hydrogen 2.860 N/A ASP 80.A N SER 78.A OG no hydrogen 3.086 N/A THR 85.A OG1 LEU 82.A O no hydrogen 2.505 N/A TYR 86.A N LYS 76.A O no hydrogen 3.008 N/A TYR 86.A OH GLU 71.A OE2 no hydrogen 2.498 N/A ASN 87.A N ASP 100.A O no hydrogen 2.823 N/A THR 88.A N ASN 87.A OD1 no hydrogen 2.865 N/A ILE 89.A N MET 98.A O no hydrogen 2.989 N/A SER 91.A N GLN 95.A O no hydrogen 2.888 N/A ARG 92.A NH2 ASP 394.A OD1 no hydrogen 2.804 N/A ARG 92.A NH2 ASP 394.A OD2 no hydrogen 3.531 N/A GLY 94.A N SER 91.A O no hydrogen 2.933 N/A GLN 95.A N SER 91.A OG no hydrogen 3.112 N/A GLN 95.A NE2 SER 91.A OG no hydrogen 2.607 N/A TYR 97.A N ILE 89.A O no hydrogen 2.844 N/A ILE 99.A N ILE 115.A O no hydrogen 2.996 N/A ASP 100.A N ASN 87.A O no hydrogen 2.754 N/A ILE 101.A N THR 113.A O no hydrogen 2.872 N/A CYS 102.A N THR 85.A O no hydrogen 2.831 N/A CYS 102.A SG GLY 81.A O no hydrogen 3.372 N/A CYS 102.A SG LEU 82.A O no hydrogen 3.518 N/A CYS 102.A SG GLY 104.A O no hydrogen 3.908 N/A LEU 103.A N ILE 111.A O no hydrogen 2.773 N/A TYR 105.A OH GLY 81.A O no hydrogen 3.124 N/A LYS 106.A N ARG 109.A O no hydrogen 2.970 N/A ARG 109.A N LYS 106.A O no hydrogen 3.200 N/A ARG 109.A NH1 GLN 51.A OE1 no hydrogen 3.178 N/A LYS 110.A NZ ASP 100.A OD1 no hydrogen 3.013 N/A ILE 111.A N GLY 104.A O no hydrogen 2.720 N/A HIS 112.A ND1 ASP 100.A OD2 no hydrogen 2.699 N/A THR 113.A N ILE 101.A O no hydrogen 3.063 N/A THR 113.A OG1 VAL 47.A O no hydrogen 2.683 N/A VAL 114.A N ALA 52.A O no hydrogen 3.065 N/A ILE 115.A N ILE 99.A O no hydrogen 2.795 N/A TYR 116.A N LEU 54.A O no hydrogen 2.714 N/A SER 118.A N PHE 56.A O no hydrogen 2.882 N/A SER 118.A OG HIS 57.A ND1 no hydrogen 2.653 N/A LEU 119.A N ASP 117.A OD1 no hydrogen 3.121 N/A LYS 120.A N ASP 117.A O no hydrogen 3.207 N/A LYS 120.A NZ TRP 96.A O no hydrogen 2.983 N/A LYS 120.A NZ ASP 117.A OD2 no hydrogen 2.799 N/A LYS 121.A N SER 118.A O no hydrogen 3.087 N/A LYS 121.A NZ LEU 181.A O no hydrogen 3.099 N/A LYS 121.A NZ ARG 183.A O no hydrogen 2.597 N/A LYS 121.A NZ ASP 189.A OD2 no hydrogen 2.817 N/A LEU 122.A N SER 118.A O no hydrogen 2.788 N/A PHE 124.A N LEU 122.A O no hydrogen 2.781 N/A LYS 127.A NZ LEU 138.A O no hydrogen 2.836 N/A LYS 127.A NZ GLY 140.A O no hydrogen 2.914 N/A LYS 128.A NZ GLN 376.A OE1 no hydrogen 2.562 N/A ILE 129.A N PRO 125.A O no hydrogen 3.011 N/A ALA 130.A N VAL 126.A O no hydrogen 3.033 N/A LYS 131.A N LYS 127.A O no hydrogen 3.008 N/A ASP 132.A N LYS 128.A O no hydrogen 3.011 N/A PHE 133.A N ILE 129.A O no hydrogen 2.839 N/A LEU 135.A N ALA 130.A O no hydrogen 2.708 N/A LEU 138.A N ASN 164.A OD1 no hydrogen 3.003 N/A TYR 144.A OH GLU 10.A OE1 no hydrogen 2.501 N/A HIS 145.A N ASP 143.A OD1 no hydrogen 2.756 N/A LYS 146.A NZ TYR 152.A OH no hydrogen 2.731 N/A ARG 148.A NH1 ASP 143.A O no hydrogen 3.193 N/A ARG 148.A NH2 ASP 143.A O no hydrogen 2.449 N/A TYR 152.A N PRO 149.A O no hydrogen 2.752 N/A TYR 152.A OH GLU 158.A OE1 no hydrogen 2.656 N/A TYR 152.A OH GLU 158.A OE2 no hydrogen 2.841 N/A LYS 153.A NZ GLY 151.A O no hydrogen 3.432 N/A THR 155.A N GLU 158.A OE1 no hydrogen 3.017 N/A GLU 158.A N THR 155.A OG1 no hydrogen 3.116 N/A TYR 159.A N THR 155.A O no hydrogen 2.960 N/A TYR 159.A OH TYR 34.A OH no hydrogen 2.821 N/A ALA 160.A N PRO 156.A O no hydrogen 3.025 N/A TYR 161.A N GLU 157.A O no hydrogen 3.001 N/A TYR 161.A OH LYS 139.A O no hydrogen 2.827 N/A ILE 162.A N GLU 158.A O no hydrogen 2.951 N/A LYS 163.A N TYR 159.A O no hydrogen 2.963 N/A LYS 163.A NZ TYR 34.A OH no hydrogen 3.349 N/A ASN 164.A N ALA 160.A O no hydrogen 2.926 N/A ASN 164.A ND2 THR 136.A O no hydrogen 3.034 N/A ASP 165.A N TYR 161.A O no hydrogen 2.948 N/A ILE 166.A N ILE 162.A O no hydrogen 3.017 N/A GLN 167.A N LYS 163.A O no hydrogen 2.990 N/A GLN 167.A NE2 GLU 171.A OE2 no hydrogen 3.163 N/A ILE 168.A N ASN 164.A O no hydrogen 2.852 N/A ILE 169.A N ASP 165.A O no hydrogen 3.403 N/A ALA 170.A N ILE 166.A O no hydrogen 2.957 N/A GLU 171.A N GLN 167.A O no hydrogen 2.776 N/A ALA 172.A N ILE 168.A O no hydrogen 2.938 N/A LEU 173.A N ILE 169.A O no hydrogen 2.853 N/A LEU 174.A N ALA 170.A O no hydrogen 3.039 N/A ILE 175.A N GLU 171.A O no hydrogen 3.047 N/A GLN 176.A N ALA 172.A O no hydrogen 3.126 N/A GLN 176.A NE2.B LYS 121.A O no hydrogen 3.417 N/A PHE 177.A N LEU 173.A O no hydrogen 2.766 N/A LYS 178.A N LEU 174.A O no hydrogen 2.940 N/A GLN 179.A N GLN 176.A O no hydrogen 3.038 N/A GLY 180.A N PHE 177.A O no hydrogen 2.911 N/A LEU 181.A N GLN 176.A O no hydrogen 2.953 N/A ARG 183.A N ASP 189.A OD1 no hydrogen 2.949 N/A ARG 183.A NE SER 188.A OG no hydrogen 2.804 N/A ARG 183.A NH2 SER 188.A OG no hydrogen 3.332 N/A ALA 186.A N LYS 120.A O no hydrogen 3.014 N/A SER 188.A N THR 185.A OG1 no hydrogen 2.930 N/A ASP 189.A N THR 185.A O no hydrogen 3.061 N/A SER 190.A N ALA 186.A O no hydrogen 2.874 N/A SER 190.A OG MET 381.A O no hydrogen 2.617 N/A SER 190.A OG SER 384.A OG no hydrogen 3.383 N/A LEU 191.A N GLY 187.A O no hydrogen 3.093 N/A LYS 192.A N SER 188.A O no hydrogen 3.154 N/A GLY 193.A N ASP 189.A O no hydrogen 2.850 N/A PHE 194.A N SER 190.A O no hydrogen 3.001 N/A LYS 195.A N LEU 191.A O no hydrogen 2.956 N/A ASP 196.A N LYS 192.A O no hydrogen 2.788 N/A ILE 197.A N GLY 193.A O no hydrogen 3.225 N/A ILE 198.A N PHE 194.A O no hydrogen 3.093 N/A THR 199.A OG1 ILE 198.A O no hydrogen 2.356 N/A LYS 202.A N THR 199.A OG1 no hydrogen 3.387 N/A PHE 203.A N THR 199.A O no hydrogen 3.028 N/A LYS 204.A N THR 200.A O no hydrogen 2.969 N/A LYS 205.A N LYS 201.A O no hydrogen 3.254 N/A VAL 206.A N LYS 202.A O no hydrogen 2.859 N/A PHE 207.A N PHE 203.A O no hydrogen 2.773 N/A LEU 214.A N SER 211.A OG no hydrogen 3.041 N/A ASP 215.A N SER 211.A O no hydrogen 2.789 N/A LYS 216.A N LEU 212.A O no hydrogen 2.942 N/A GLU 217.A N GLY 213.A O no hydrogen 3.312 N/A VAL 218.A N LEU 214.A O no hydrogen 2.946 N/A ARG 219.A N ASP 215.A O no hydrogen 2.942 N/A ARG 219.A NH1 ALA 390.A O no hydrogen 3.157 N/A ARG 219.A NH2 ALA 390.A O no hydrogen 3.558 N/A ARG 219.A NH2 SER 391.A O no hydrogen 3.175 N/A TYR 220.A N LYS 216.A O no hydrogen 3.274 N/A TYR 220.A N GLU 217.A O no hydrogen 3.257 N/A ALA 221.A N VAL 218.A O no hydrogen 3.035 N/A TYR 222.A N ARG 219.A O no hydrogen 2.991 N/A TYR 222.A OH TYR 386.A OH no hydrogen 2.687 N/A ARG 223.A NH1 TRP 323.A O no hydrogen 2.963 N/A ARG 223.A NH2 TRP 323.A O no hydrogen 3.293 N/A THR 227.A OG1 ASP 452.A OD1 no hydrogen 2.676 N/A TRP 228.A N CYS 451.A O no hydrogen 2.808 N/A ASN 230.A N ILE 449.A O no hydrogen 2.835 N/A ASN 230.A ND2 ILE 448.A O no hydrogen 2.941 N/A ARG 232.A N ASN 230.A OD1 no hydrogen 3.214 N/A PHE 233.A N ASN 230.A O no hydrogen 2.935 N/A LYS 234.A N ASP 231.A O no hydrogen 3.331 N/A LYS 234.A NZ LEU 491.A O no hydrogen 2.738 N/A GLU 235.A N TYR 490.A O no hydrogen 2.637 N/A LYS 236.A N PHE 233.A O no hydrogen 3.307 N/A ILE 238.A N ALA 488.A O no hydrogen 2.870 N/A GLY 241.A N PHE 485.A O no hydrogen 3.066 N/A MET 242.A N LEU 458.A O no hydrogen 2.877 N/A VAL 243.A N SER 483.A O no hydrogen 2.918 N/A PHE 244.A N ILE 456.A O no hydrogen 3.047 N/A ASP 245.A N ALA 480.A O no hydrogen 2.853 N/A VAL 246.A N ASP 454.A O no hydrogen 2.927 N/A ASN 247.A N TYR 478.A O no hydrogen 2.897 N/A ASN 247.A ND2 ASP 472.A O no hydrogen 2.705 N/A ASN 247.A ND2 LYS 475.A O no hydrogen 2.965 N/A ALA 252.A N SER 248.A O no hydrogen 2.935 N/A GLN 253.A N LEU 249.A O no hydrogen 3.086 N/A GLN 253.A NE2 LEU 249.A O no hydrogen 3.538 N/A MET 254.A N TYR 250.A O no hydrogen 2.967 N/A TYR 255.A N PRO 251.A O no hydrogen 2.914 N/A TYR 255.A OH ASP 361.A OD1 no hydrogen 2.763 N/A SER 256.A N ALA 252.A O no hydrogen 3.270 N/A SER 256.A N GLN 253.A O no hydrogen 3.296 N/A SER 256.A OG ALA 252.A O no hydrogen 3.156 N/A ARG 257.A N GLN 253.A O no hydrogen 2.820 N/A ARG 257.A NE GLN 253.A OE1 no hydrogen 2.744 N/A ARG 257.A NH2 THR 436.A OG1 no hydrogen 3.083 N/A LEU 259.A N THR 352.A O no hydrogen 2.910 N/A TYR 261.A N LYS 350.A O no hydrogen 3.060 N/A GLY 262.A N VAL 206.A O no hydrogen 2.716 N/A ILE 265.A N LYS 348.A O no hydrogen 2.871 N/A PHE 267.A N GLY 346.A O no hydrogen 3.087 N/A GLY 269.A N ILE 344.A O no hydrogen 2.712 N/A TYR 271.A N GLN 282.A OE1 no hydrogen 3.080 N/A TYR 271.A OH TYR 277.A O no hydrogen 2.645 N/A ASP 274.A N TYR 271.A OH no hydrogen 3.051 N/A ASP 276.A N ASP 274.A OD1 no hydrogen 2.987 N/A TYR 277.A N ASP 274.A O no hydrogen 2.900 N/A LEU 279.A N PHE 349.A O no hydrogen 3.503 N/A HIS 280.A N ASN 326.A OD1 no hydrogen 2.926 N/A ILE 281.A N LEU 347.A O no hydrogen 2.765 N/A GLN 282.A N LEU 324.A O no hydrogen 2.746 N/A GLN 282.A NE2 GLY 269.A O no hydrogen 2.966 N/A GLN 282.A NE2 HIS 283.A O no hydrogen 3.159 N/A HIS 283.A N SER 345.A O no hydrogen 2.755 N/A HIS 283.A NE2 ASP 321.A OD1 no hydrogen 2.579 N/A ILE 284.A N LEU 322.A O no hydrogen 2.791 N/A ARG 285.A N GLU 342.A O no hydrogen 2.999 N/A ARG 285.A NE GLU 342.A OE1 no hydrogen 3.089 N/A ARG 285.A NH1 ASP 321.A OD2 no hydrogen 3.190 N/A ARG 285.A NH2 GLU 342.A OE2 no hydrogen 3.143 N/A CYS 286.A N ALA 320.A O no hydrogen 2.916 N/A CYS 286.A SG GLU 287.A O no hydrogen 3.956 N/A GLU 287.A N TYR 339.A O no hydrogen 3.076 N/A PHE 288.A N SER 315.A OG no hydrogen 2.841 N/A GLU 289.A N ASP 337.A O no hydrogen 2.944 N/A LEU 290.A N LYS 313.A O no hydrogen 2.700 N/A LYS 291.A N HIS 335.A O no hydrogen 2.834 N/A LYS 291.A NZ LYS 333.A O no hydrogen 2.976 N/A TYR 294.A N LYS 291.A O no hydrogen 3.154 N/A TYR 294.A OH GLU 334.A OE2 no hydrogen 2.973 N/A ILE 295.A N GLN 442.A OE1 no hydrogen 2.791 N/A THR 297.A N TYR 336.A OH no hydrogen 3.072 N/A ILE 298.A N TYR 336.A OH no hydrogen 3.151 N/A LYS 301.A NZ GLN 299.A OE1 no hydrogen 2.986 N/A LYS 301.A NZ GLY 308.A O no hydrogen 2.775 N/A PHE 305.A N SER 303.A OG no hydrogen 3.082 N/A TYR 306.A N SER 303.A O no hydrogen 3.501 N/A TYR 306.A OH SER 315.A O no hydrogen 2.618 N/A GLU 310.A N LYS 307.A O no hydrogen 3.184 N/A LEU 312.A N ILE 298.A O no hydrogen 2.781 N/A LYS 313.A NZ ASP 231.A OD1 no hydrogen 3.272 N/A SER 314.A OG GLU 289.A OE2 no hydrogen 2.647 N/A SER 315.A N PHE 288.A O no hydrogen 3.118 N/A SER 315.A OG PHE 288.A O no hydrogen 3.381 N/A GLY 316.A N SER 314.A OG no hydrogen 2.855 N/A GLU 318.A N SER 315.A O no hydrogen 3.248 N/A ALA 320.A N CYS 286.A O no hydrogen 2.789 N/A LEU 322.A N ILE 284.A O no hydrogen 2.809 N/A LEU 324.A N GLN 282.A O no hydrogen 2.878 N/A SER 325.A OG ASP 328.A OD2 no hydrogen 2.724 N/A ASN 326.A N HIS 280.A O no hydrogen 2.801 N/A ASP 328.A N SER 325.A OG no hydrogen 3.159 N/A LEU 329.A N SER 325.A O no hydrogen 2.944 N/A GLU 330.A N ASN 326.A O no hydrogen 3.044 N/A LEU 331.A N VAL 327.A O no hydrogen 3.111 N/A MET 332.A N ASP 328.A O no hydrogen 2.820 N/A LYS 333.A N LEU 329.A O no hydrogen 2.945 N/A GLU 334.A N GLU 330.A O no hydrogen 3.018 N/A HIS 335.A N LEU 331.A O no hydrogen 3.056 N/A HIS 335.A ND1 ILE 295.A O no hydrogen 2.540 N/A TYR 336.A N MET 332.A O no hydrogen 2.788 N/A TYR 336.A OH LEU 312.A O no hydrogen 2.589 N/A ASP 337.A N GLU 289.A O no hydrogen 2.797 N/A TYR 339.A N GLU 287.A O no hydrogen 2.892 N/A GLU 342.A N ARG 285.A O no hydrogen 2.737 N/A ILE 344.A N HIS 283.A O no hydrogen 2.920 N/A GLY 346.A N PHE 267.A O no hydrogen 2.977 N/A LEU 347.A N ILE 281.A O no hydrogen 2.907 N/A LYS 348.A N ILE 265.A O no hydrogen 2.907 N/A LYS 348.A NZ ASP 274.A OD2 no hydrogen 2.741 N/A PHE 349.A N LEU 279.A O no hydrogen 2.881 N/A THR 352.A N LEU 259.A O no hydrogen 2.949 N/A THR 352.A OG1 THR 353.A O no hydrogen 3.561 N/A LYS 357.A N GLY 354.A O no hydrogen 3.320 N/A LYS 357.A NZ TYR 255.A OH no hydrogen 3.509 N/A LYS 357.A NZ ASP 361.A OD2 no hydrogen 2.785 N/A ILE 360.A N PHE 356.A O no hydrogen 2.922 N/A ASP 361.A N LYS 357.A O no hydrogen 2.775 N/A LYS 362.A N ASP 358.A O no hydrogen 3.049 N/A TRP 363.A N PHE 359.A O no hydrogen 3.222 N/A THR 364.A N ILE 360.A O no hydrogen 2.854 N/A THR 364.A OG1 ILE 360.A O no hydrogen 2.780 N/A TYR 365.A N ASP 361.A O no hydrogen 3.123 N/A ILE 366.A N LYS 362.A O no hydrogen 3.209 N/A LYS 367.A N TRP 363.A O no hydrogen 2.809 N/A LYS 367.A NZ SER 248.A OG no hydrogen 2.939 N/A THR 368.A N THR 364.A O no hydrogen 2.741 N/A THR 368.A OG1 THR 364.A O no hydrogen 2.970 N/A THR 369.A N TYR 365.A O no hydrogen 3.055 N/A THR 369.A N ILE 366.A O no hydrogen 3.231 N/A THR 369.A OG1 TYR 365.A O no hydrogen 2.539 N/A THR 369.A OG1 ILE 366.A O no hydrogen 3.474 N/A SER 370.A OG ILE 366.A O no hydrogen 2.802 N/A ALA 373.A N ASP 132.A OD2 no hydrogen 2.814 N/A LYS 375.A N GLU 371.A O no hydrogen 3.301 N/A GLN 376.A N GLY 372.A O no hydrogen 2.903 N/A LEU 377.A N ALA 373.A O no hydrogen 2.815 N/A ALA 378.A N ILE 374.A O no hydrogen 3.152 N/A LYS 379.A N LYS 375.A O no hydrogen 2.967 N/A LEU 380.A N GLN 376.A O no hydrogen 3.036 N/A MET 381.A N LEU 377.A O no hydrogen 2.901 N/A LEU 382.A N ALA 378.A O no hydrogen 3.179 N/A ASN 383.A N LYS 379.A O no hydrogen 2.962 N/A SER 384.A N LEU 380.A O no hydrogen 2.813 N/A SER 384.A OG LEU 380.A O no hydrogen 2.782 N/A SER 384.A OG MET 381.A O no hydrogen 3.464 N/A LEU 385.A N MET 381.A O no hydrogen 3.329 N/A TYR 386.A OH TYR 222.A OH no hydrogen 2.687 N/A GLY 387.A N ASN 383.A O no hydrogen 3.172 N/A LYS 388.A N SER 384.A O no hydrogen 2.816 N/A PHE 389.A N LEU 385.A O no hydrogen 3.184 N/A ALA 390.A N TYR 386.A O no hydrogen 3.366 N/A ALA 390.A N GLY 387.A O no hydrogen 3.078 N/A SER 391.A N LYS 388.A O no hydrogen 3.100 N/A SER 391.A OG LYS 388.A O no hydrogen 2.528 N/A ASP 394.A N ASN 392.A OD1 no hydrogen 2.854 N/A VAL 395.A N GLU 416.A O no hydrogen 2.996 N/A THR 396.A N ASP 394.A OD2 no hydrogen 3.104 N/A THR 396.A OG1 ASP 394.A OD2 no hydrogen 2.559 N/A THR 396.A OG1 GLU 416.A O no hydrogen 3.358 N/A LYS 398.A N ILE 90.A O no hydrogen 2.926 N/A VAL 399.A N ARG 411.A O no hydrogen 2.719 N/A TYR 401.A N GLY 409.A O no hydrogen 2.904 N/A LYS 403.A N ALA 407.A O no hydrogen 3.009 N/A GLY 406.A N LYS 403.A O no hydrogen 2.851 N/A ALA 407.A N ASN 405.A OD1 no hydrogen 2.939 N/A GLY 409.A N TYR 401.A O no hydrogen 2.729 N/A ARG 411.A N VAL 399.A O no hydrogen 2.928 N/A GLY 413.A N GLY 397.A O no hydrogen 2.689 N/A GLU 416.A N THR 396.A OG1 no hydrogen 3.002 N/A LYS 418.A N PRO 393.A O no hydrogen 2.708 N/A LYS 418.A NZ ASN 392.A O no hydrogen 2.752 N/A TYR 422.A N PHE 389.A O no hydrogen 3.010 N/A TYR 422.A OH GLY 262.A O no hydrogen 2.589 N/A THR 423.A OG1 ASP 215.A OD2 no hydrogen 2.586 N/A MET 425.A N TYR 422.A O no hydrogen 3.193 N/A VAL 427.A N THR 423.A O no hydrogen 3.018 N/A PHE 428.A N PRO 424.A O no hydrogen 3.097 N/A ILE 429.A N MET 425.A O no hydrogen 2.913 N/A THR 430.A N GLY 426.A O no hydrogen 3.322 N/A THR 430.A OG1 ARG 223.A O no hydrogen 2.734 N/A THR 430.A OG1 GLY 426.A O no hydrogen 3.320 N/A THR 430.A OG1 VAL 427.A O no hydrogen 3.162 N/A ALA 431.A N VAL 427.A O no hydrogen 3.150 N/A TRP 432.A N PHE 428.A O no hydrogen 3.043 N/A TRP 432.A NE1 LEU 258.A O no hydrogen 2.979 N/A ALA 433.A N ILE 429.A O no hydrogen 3.087 N/A ARG 434.A N THR 430.A O no hydrogen 2.898 N/A ARG 434.A NE ASP 328.A OD1 no hydrogen 3.102 N/A ARG 434.A NH1 GLY 224.A O no hydrogen 2.817 N/A ARG 434.A NH1 THR 430.A OG1 no hydrogen 3.172 N/A ARG 434.A NH2 ASP 328.A OD1 no hydrogen 3.111 N/A ARG 434.A NH2 ASP 328.A OD2 no hydrogen 2.876 N/A TYR 435.A N ALA 431.A O no hydrogen 2.934 N/A THR 436.A N TRP 432.A O no hydrogen 2.902 N/A THR 436.A OG1 GLN 253.A OE1 no hydrogen 3.024 N/A THR 436.A OG1 TRP 432.A O no hydrogen 2.803 N/A THR 437.A N ALA 433.A O no hydrogen 3.025 N/A THR 437.A OG1 ALA 433.A O no hydrogen 3.286 N/A THR 437.A OG1 THR 453.A O no hydrogen 2.705 N/A ILE 438.A N ARG 434.A O no hydrogen 2.873 N/A THR 439.A N TYR 435.A O no hydrogen 2.884 N/A THR 439.A OG1 TYR 435.A O no hydrogen 2.611 N/A ALA 440.A N THR 436.A O no hydrogen 3.310 N/A ALA 441.A N THR 437.A O no hydrogen 2.934 N/A GLN 442.A N ILE 438.A O no hydrogen 2.839 N/A GLN 442.A NE2 GLY 293.A O no hydrogen 2.883 N/A ALA 443.A N THR 439.A O no hydrogen 3.099 N/A CYS 444.A N ALA 440.A O no hydrogen 3.115 N/A CYS 444.A N ALA 441.A O no hydrogen 3.024 N/A CYS 444.A SG ALA 440.A O no hydrogen 3.359 N/A TYR 445.A N GLN 442.A O no hydrogen 3.213 N/A ARG 447.A N CYS 444.A O no hydrogen 2.870 N/A ARG 447.A NE THR 459.A O no hydrogen 2.792 N/A ARG 447.A NH1 GLU 462.A O no hydrogen 2.881 N/A ARG 447.A NH2 THR 459.A O no hydrogen 3.008 N/A ARG 447.A NH2 GLY 460.A O no hydrogen 3.459 N/A ARG 447.A NH2 GLU 462.A O no hydrogen 2.781 N/A ILE 449.A N HIS 457.A O no hydrogen 2.734 N/A TYR 450.A N HIS 457.A O no hydrogen 3.427 N/A CYS 451.A N TRP 228.A O no hydrogen 2.918 N/A CYS 451.A SG SER 455.A O no hydrogen 3.528 N/A ASP 452.A N SER 455.A OG no hydrogen 3.100 N/A THR 453.A N PHE 226.A O no hydrogen 2.673 N/A THR 453.A OG1 ASP 452.A OD1 no hydrogen 2.837 N/A ASP 454.A N ASP 452.A O no hydrogen 2.797 N/A ILE 456.A N PHE 244.A O no hydrogen 2.983 N/A HIS 457.A N TYR 450.A O no hydrogen 2.805 N/A HIS 457.A ND1 TYR 490.A OH no hydrogen 2.645 N/A LEU 458.A N MET 242.A O no hydrogen 2.837 N/A THR 459.A N ARG 447.A O no hydrogen 2.951 N/A THR 459.A OG1 ARG 447.A O no hydrogen 3.469 N/A GLY 460.A N GLU 240.A O no hydrogen 3.096 N/A LYS 468.A NZ ASP 469.A OD2 no hydrogen 3.540 N/A ILE 470.A N ILE 467.A O no hydrogen 2.858 N/A ASP 472.A N TRP 479.A O no hydrogen 2.953 N/A LYS 474.A N ASP 472.A OD1 no hydrogen 2.804 N/A LYS 474.A NZ THR 368.A O no hydrogen 3.134 N/A LYS 475.A N ASP 472.A OD1 no hydrogen 2.826 N/A GLY 477.A N ASN 247.A O no hydrogen 2.943 N/A TYR 478.A N LYS 475.A O no hydrogen 3.091 N/A TRP 479.A N ILE 470.A O no hydrogen 2.745 N/A ALA 480.A N ASP 245.A O no hydrogen 2.787 N/A GLU 482.A N VAL 243.A O no hydrogen 2.798 N/A SER 483.A N VAL 243.A O no hydrogen 3.335 N/A THR 484.A OG1 HIS 481.A NE2 no hydrogen 2.810 N/A PHE 485.A N GLY 241.A O no hydrogen 2.815 N/A LYS 486.A N ASP 499.A O no hydrogen 2.747 N/A ARG 487.A NE ASP 499.A OD2 no hydrogen 2.928 N/A ARG 487.A NH1 GLU 237.A OE1 no hydrogen 3.438 N/A ARG 487.A NH2 ASP 499.A OD2 no hydrogen 3.543 N/A ALA 488.A N ILE 238.A O no hydrogen 3.061 N/A LYS 489.A N ILE 497.A O no hydrogen 2.939 N/A LYS 489.A NZ PHE 535.A O no hydrogen 3.324 N/A LYS 489.A NZ PHE 538.A O no hydrogen 2.770 N/A TYR 490.A OH HIS 457.A ND1 no hydrogen 2.645 N/A LEU 491.A N THR 495.A O no hydrogen 3.030 N/A ARG 492.A NE THR 495.A OG1 no hydrogen 3.142 N/A GLN 493.A NE2 ASN 309.A O no hydrogen 3.537 N/A LYS 494.A N TYR 450.A OH no hydrogen 2.816 N/A LYS 494.A NZ ASP 452.A OD1 no hydrogen 3.328 N/A LYS 494.A NZ ASP 452.A OD2 no hydrogen 2.891 N/A THR 495.A N ARG 492.A O no hydrogen 3.288 N/A THR 495.A OG1 GLN 493.A O no hydrogen 2.961 N/A TYR 496.A N LYS 521.A O no hydrogen 2.719 N/A ILE 497.A N LYS 489.A O no hydrogen 2.896 N/A GLN 498.A N SER 519.A O no hydrogen 2.995 N/A GLN 498.A NE2 TYR 490.A OH no hydrogen 2.757 N/A ASP 499.A N ARG 487.A O no hydrogen 2.888 N/A ILE 500.A N LYS 517.A O no hydrogen 2.860 N/A TYR 501.A N THR 484.A O no hydrogen 2.963 N/A TYR 501.A OH GLU 240.A OE2 no hydrogen 2.760 N/A MET 502.A N ASP 515.A O no hydrogen 2.744 N/A LYS 503.A N VAL 506.A O no hydrogen 2.907 N/A GLU 504.A N THR 514.A OG1 no hydrogen 3.003 N/A GLY 508.A N TYR 501.A O no hydrogen 2.883 N/A SER 509.A N ASP 512.A O no hydrogen 3.174 N/A SER 509.A OG ASP 511.A OD1 no hydrogen 2.548 N/A THR 514.A N MET 502.A O no hydrogen 2.761 N/A THR 514.A OG1 ASP 515.A OD2 no hydrogen 3.271 N/A ASP 515.A N MET 502.A O no hydrogen 3.016 N/A LYS 517.A N ILE 500.A O no hydrogen 2.841 N/A SER 519.A N GLN 498.A O no hydrogen 2.847 N/A LYS 521.A N TYR 496.A O no hydrogen 2.833 N/A ALA 523.A N LYS 494.A O no hydrogen 2.908 N/A MET 525.A N CYS 522.A O no hydrogen 2.953 N/A LYS 530.A N THR 526.A O no hydrogen 3.116 N/A LYS 530.A NZ VAL 520.A O no hydrogen 3.152 N/A LYS 531.A N ASP 527.A O no hydrogen 3.221 N/A GLU 532.A N ILE 529.A O no hydrogen 3.113 N/A VAL 533.A N LYS 530.A O no hydrogen 3.079 N/A THR 534.A N ASN 537.A OD1 no hydrogen 2.680 N/A ASN 537.A N THR 534.A OG1 no hydrogen 3.002 N/A ASN 537.A ND2 GLU 532.A O no hydrogen 2.850 N/A PHE 538.A N THR 534.A O no hydrogen 2.988 N/A GLY 541.A N ILE 566.A O no hydrogen 2.763 N/A PHE 542.A N LYS 539.A O no hydrogen 3.046 N/A SER 543.A OG THR 565.A OG1 no hydrogen 2.667 N/A ARG 544.A N PHE 564.A O no hydrogen 3.210 N/A ARG 544.A NE GLU 532.A OE1 no hydrogen 3.186 N/A ARG 544.A NH1 SER 543.A O no hydrogen 3.006 N/A LYS 547.A N ASP 562.A O no hydrogen 3.020 N/A LYS 547.A NZ GLY 524.A O no hydrogen 2.578 N/A LYS 549.A N VAL 560.A O no hydrogen 2.703 N/A VAL 551.A N VAL 558.A O no hydrogen 2.738 N/A VAL 553.A N GLY 556.A O no hydrogen 2.906 N/A GLY 555.A N ASN 68.A OD1 no hydrogen 3.086 N/A GLY 556.A N VAL 553.A O no hydrogen 3.136 N/A VAL 558.A N VAL 551.A O no hydrogen 3.070 N/A VAL 560.A N LYS 549.A O no hydrogen 2.941 N/A ASP 562.A N LYS 547.A O no hydrogen 2.743 N/A THR 563.A N ASP 562.A OD1 no hydrogen 2.940 N/A PHE 564.A N ARG 544.A O no hydrogen 3.126 N/A THR 565.A OG1 SER 543.A OG no hydrogen 2.667 N/A ILE 566.A N PHE 542.A O no hydrogen 2.824 N/A