Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 7nyd_B.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): CYS 1.A N ASN 38.A O no hydrogen 2.863 N/A CYS 1.A N ASN 352.A OD1 no hydrogen 2.921 N/A PHE 2.A N TYR 34.A OH no hydrogen 3.111 N/A CYS 3.A SG CYS 1.A O no hydrogen 3.632 N/A HIS 5.A N PHE 2.A O no hydrogen 2.903 N/A TYR 6.A N CYS 3.A O no hydrogen 3.247 N/A TYR 6.A OH VAL 30.A O no hydrogen 2.812 N/A TRP 8.A NE1 ASP 4.A OD1 no hydrogen 2.754 N/A THR 9.A OG1 HIS 26.A O no hydrogen 2.728 N/A THR 12.A N SER 24.A O no hydrogen 3.157 N/A CYS 14.A SG LYS 16.A O no hydrogen 3.365 N/A SER 15.A N THR 22.A O no hydrogen 3.520 N/A SER 15.A OG THR 22.A O no hydrogen 3.525 N/A LYS 16.A NZ ASN 19.A O no hydrogen 2.919 N/A ASN 19.A N GLN 55.A O no hydrogen 2.911 N/A SER 20.A N ASN 53.A O no hydrogen 2.927 N/A THR 22.A N SER 15.A OG no hydrogen 3.311 N/A GLN 23.A N ARG 50.A O no hydrogen 2.922 N/A ARG 25.A N GLU 48.A O no hydrogen 3.165 N/A ARG 25.A NE GLU 48.A OE2 no hydrogen 2.827 N/A ARG 25.A NH1 ALA 7.A O no hydrogen 2.803 N/A ARG 25.A NH1 THR 9.A OG1 no hydrogen 3.158 N/A ARG 25.A NH2 GLU 48.A OE2 no hydrogen 2.876 N/A ARG 27.A N LYS 46.A O no hydrogen 2.880 N/A ARG 27.A NE CYS 3.A O no hydrogen 2.888 N/A ARG 27.A NH1 SER 45.A O no hydrogen 2.905 N/A LYS 33.A N ASP 32.A OD1 no hydrogen 2.791 N/A LYS 33.A NZ GLU 37.A OE1 no hydrogen 2.777 N/A TYR 35.A OH GLU 41.A OE2 no hydrogen 2.587 N/A GLN 36.A N ASP 32.A O no hydrogen 2.916 N/A GLU 37.A N LYS 33.A O no hydrogen 3.049 N/A ASN 38.A N TYR 34.A O no hydrogen 3.021 N/A ASN 38.A ND2 TYR 34.A O no hydrogen 2.882 N/A CYS 40.A SG TYR 35.A O no hydrogen 3.541 N/A GLN 42.A N GLN 42.A OE1 no hydrogen 2.804 N/A ILE 43.A N PHE 39.A O no hydrogen 3.322 N/A CYS 44.A N CYS 40.A O no hydrogen 3.151 N/A SER 45.A OG GLN 47.A O no hydrogen 3.544 N/A LYS 46.A NZ GLU 41.A OE1 no hydrogen 2.801 N/A LYS 46.A NZ GLU 41.A OE2 no hydrogen 3.284 N/A GLU 48.A N ARG 25.A O no hydrogen 2.877 N/A THR 49.A OG1 GLU 48.A O no hydrogen 2.827 N/A ARG 50.A N GLN 23.A O no hydrogen 2.951 N/A CYS 52.A N GLY 21.A O no hydrogen 3.101 N/A ASN 53.A ND2 LYS 16.A O no hydrogen 2.866 N/A GLN 55.A N GLN 55.A OE1 no hydrogen 2.836 N/A GLN 55.A NE2 ASN 53.A OD1 no hydrogen 3.115 N/A ARG 56.A NE ASN 19.A OD1 no hydrogen 2.798 N/A ARG 56.A NH1 PRO 480.A O no hydrogen 3.246 N/A ILE 59.A N GLN 90.A O no hydrogen 2.915 N/A CYS 61.A N GLN 94.A O no hydrogen 3.159 N/A CYS 61.A SG ARG 87.A O no hydrogen 3.800 N/A LEU 62.A N ARG 87.A O no hydrogen 3.282 N/A GLY 64.A N SER 84.A O no hydrogen 2.855 N/A GLY 67.A N VAL 82.A O no hydrogen 2.972 N/A SER 70.A N SER 80.A O no hydrogen 2.870 N/A SER 70.A OG SER 80.A O no hydrogen 2.743 N/A CYS 72.A SG LYS 78.A O no hydrogen 3.767 N/A ASP 73.A N LYS 78.A O no hydrogen 3.201 N/A ILE 76.A N ASP 73.A O no hydrogen 3.106 N/A GLU 77.A N ASP 73.A O no hydrogen 2.875 N/A GLN 79.A N GLN 104.A O no hydrogen 2.933 N/A GLN 79.A NE2 GLN 104.A OE1 no hydrogen 2.793 N/A LYS 81.A N ALA 102.A O no hydrogen 2.879 N/A ARG 83.A N LEU 100.A O no hydrogen 3.221 N/A ARG 83.A NE PRO 99.A O no hydrogen 3.062 N/A ARG 83.A NH2 PRO 99.A O no hydrogen 2.886 N/A LEU 86.A N LEU 62.A O no hydrogen 2.774 N/A ARG 87.A NE ASN 60.A O no hydrogen 3.015 N/A SER 89.A N THR 492.A O no hydrogen 3.296 N/A SER 89.A OG THR 492.A O no hydrogen 3.124 N/A GLN 90.A N ILE 59.A O no hydrogen 3.014 N/A GLN 90.A NE2 ALA 479.A O no hydrogen 2.885 N/A GLY 93.A N GLN 90.A O no hydrogen 3.273 N/A GLN 94.A N ASN 60.A OD1 no hydrogen 2.958 N/A CYS 96.A SG THR 492.A O no hydrogen 3.446 N/A THR 97.A OG1 PRO 95.A O no hydrogen 2.722 N/A ALA 98.A N CYS 96.A O no hydrogen 2.754 N/A ALA 102.A N LYS 81.A O no hydrogen 2.886 N/A GLN 104.A N GLN 79.A O no hydrogen 3.018 N/A CYS 106.A N GLU 77.A O no hydrogen 2.960 N/A LYS 110.A NZ ASN 574.A OD1 no hydrogen 2.907 N/A LYS 120.A N ASP 118.A O no hydrogen 2.867 N/A LYS 120.A NZ ASP 582.A OD2 no hydrogen 2.784 N/A LYS 122.A N CYS 119.A O no hydrogen 3.060 N/A PHE 123.A N ILE 131.A O no hydrogen 2.905 N/A CYS 125.A N ARG 129.A O no hydrogen 2.914 N/A CYS 125.A SG ARG 129.A O no hydrogen 3.304 N/A ASP 126.A N SER 147.A OG no hydrogen 3.086 N/A SER 127.A N ASP 145.A OD2 no hydrogen 2.857 N/A SER 127.A OG ASP 145.A OD1 no hydrogen 3.524 N/A SER 127.A OG ASP 145.A OD2 no hydrogen 2.616 N/A GLY 128.A N CYS 125.A O no hydrogen 2.840 N/A ARG 129.A NH1 ASP 300.A OD1 no hydrogen 2.782 N/A ARG 129.A NH2 LEU 298.A O no hydrogen 2.851 N/A ARG 129.A NH2 ASP 300.A OD1 no hydrogen 2.820 N/A CYS 130.A SG GLY 128.A O no hydrogen 3.703 N/A ILE 131.A N ARG 129.A O no hydrogen 3.177 N/A ARG 133.A NE GLU 136.A OE1 no hydrogen 2.832 N/A ARG 133.A NH1 ASN 121.A O no hydrogen 2.924 N/A LEU 135.A N ALA 132.A O no hydrogen 2.915 N/A GLU 136.A N ARG 133.A O no hydrogen 3.164 N/A CYS 137.A N ASP 148.A O no hydrogen 2.925 N/A CYS 137.A SG ASP 148.A O no hydrogen 4.007 N/A CYS 137.A SG ASP 151.A O no hydrogen 3.772 N/A ASN 138.A N LEU 135.A O no hydrogen 3.438 N/A ASN 138.A ND2 LEU 135.A O no hydrogen 2.733 N/A ASN 138.A ND2 GLU 140.A O no hydrogen 2.765 N/A GLU 140.A N ASN 138.A OD1 no hydrogen 2.838 N/A ASN 141.A ND2 GLY 144.A O no hydrogen 2.831 N/A ASP 142.A N ASP 148.A OD2 no hydrogen 2.873 N/A CYS 143.A N ASP 148.A OD1 no hydrogen 2.943 N/A CYS 143.A SG SER 147.A OG no hydrogen 3.128 N/A ASN 146.A N ASN 141.A OD1 no hydrogen 2.873 N/A GLU 149.A N ASN 146.A O no hydrogen 2.814 N/A ARG 150.A NH2 ASP 126.A OD2 no hydrogen 2.756 N/A CYS 152.A SG ASP 148.A O no hydrogen 3.962 N/A LYS 156.A N CYS 137.A O no hydrogen 3.195 N/A CYS 159.A SG ILE 196.A O no hydrogen 3.551 N/A ARG 161.A NH1 LYS 162.A O no hydrogen 2.796 N/A SER 168.A OG PRO 167.A O no hydrogen 2.675 N/A VAL 169.A N ILE 166.A O no hydrogen 3.244 N/A GLN 170.A NE2 ASN 174.A OD1 no hydrogen 3.641 N/A GLN 170.A NE2 LEU 188.A O no hydrogen 2.858 N/A LEU 171.A N SER 168.A O no hydrogen 2.951 N/A MET 172.A N VAL 169.A O no hydrogen 3.223 N/A GLY 173.A N GLN 170.A O no hydrogen 2.899 N/A ASN 174.A N LEU 171.A O no hydrogen 3.395 N/A GLY 175.A N GLY 185.A O no hydrogen 2.846 N/A PHE 176.A N HIS 328.A O no hydrogen 2.711 N/A HIS 177.A N GLU 182.A O no hydrogen 2.835 N/A GLY 181.A N HIS 177.A O no hydrogen 2.787 N/A ARG 184.A N GLY 175.A O no hydrogen 2.862 N/A ARG 184.A NE GLU 182.A OE1 no hydrogen 2.841 N/A ARG 184.A NH1 ASP 323.A O no hydrogen 2.828 N/A ARG 184.A NH2 GLU 182.A OE1 no hydrogen 2.715 N/A VAL 187.A N GLY 173.A O no hydrogen 2.876 N/A LEU 188.A N GLY 173.A O no hydrogen 2.870 N/A ASP 189.A N HIS 297.A O no hydrogen 2.955 N/A ASN 190.A N GLN 170.A OE1 no hydrogen 2.951 N/A ASN 190.A ND2 VAL 169.A O no hydrogen 2.999 N/A SER 191.A N ASP 189.A OD1 no hydrogen 2.989 N/A PHE 192.A N ASP 189.A O no hydrogen 3.166 N/A THR 193.A OG1 GLU 140.A OE1 no hydrogen 2.661 N/A ILE 196.A N THR 193.A O no hydrogen 3.265 N/A THR 199.A OG1 TYR 209.A O no hydrogen 2.657 N/A VAL 200.A N TYR 209.A O no hydrogen 2.949 N/A LYS 201.A NZ SER 203.A O no hydrogen 2.980 N/A LYS 201.A NZ ARG 204.A O no hydrogen 3.205 N/A LYS 201.A NZ SER 206.A O no hydrogen 2.763 N/A THR 205.A N SER 203.A OG no hydrogen 3.068 N/A SER 206.A N SER 203.A O no hydrogen 3.167 N/A SER 206.A OG SER 203.A O no hydrogen 3.364 N/A SER 206.A OG ASN 207.A O no hydrogen 2.872 N/A TYR 209.A N VAL 200.A O no hydrogen 2.956 N/A ARG 210.A N ASN 164.A O no hydrogen 2.999 N/A ARG 210.A NH1 GLU 140.A OE1 no hydrogen 3.180 N/A ARG 210.A NH1 GLU 140.A OE2 no hydrogen 2.737 N/A ARG 210.A NH2 GLU 140.A OE1 no hydrogen 2.720 N/A ARG 210.A NH2 ILE 196.A O no hydrogen 2.812 N/A VAL 211.A N LYS 198.A O no hydrogen 3.052 N/A ALA 213.A N PHE 192.A O no hydrogen 3.172 N/A ASN 214.A ND2 ASN 190.A OD1 no hydrogen 2.933 N/A ASN 214.A ND2 HIS 297.A O no hydrogen 3.210 N/A LEU 215.A N PRO 212.A O no hydrogen 3.048 N/A GLU 216.A N THR 290.A O no hydrogen 2.775 N/A GLY 219.A N ASN 288.A O no hydrogen 3.207 N/A GLN 223.A N LYS 285.A O no hydrogen 3.273 N/A GLN 223.A NE2 GLU 221.A O no hydrogen 2.839 N/A ASP 228.A N HIS 281.A O no hydrogen 2.858 N/A LYS 230.A N ARG 279.A O no hydrogen 2.943 N/A LYS 230.A NZ ASP 228.A OD1 no hydrogen 2.744 N/A THR 231.A OG1 PHE 277.A O no hydrogen 2.718 N/A ASP 232.A N PHE 277.A O no hydrogen 3.130 N/A TYR 234.A N SER 275.A O no hydrogen 2.837 N/A ASP 236.A N LYS 273.A O no hydrogen 2.871 N/A THR 238.A N HIS 271.A O no hydrogen 2.867 N/A THR 238.A OG1 HIS 271.A O no hydrogen 2.911 N/A LEU 240.A N ALA 269.A O no hydrogen 2.896 N/A HIS 242.A N ILE 267.A O no hydrogen 2.904 N/A HIS 242.A ND1 GLU 37.A OE2 no hydrogen 2.867 N/A GLU 244.A N GLN 265.A O no hydrogen 2.957 N/A GLN 246.A N PHE 263.A O no hydrogen 2.848 N/A GLN 247.A NE2 ASN 245.A OD1 no hydrogen 2.910 N/A GLY 248.A N SER 261.A O no hydrogen 2.852 N/A SER 249.A OG HIS 259.A O no hydrogen 2.785 N/A PHE 250.A N HIS 259.A O no hydrogen 3.038 N/A SER 252.A N ILE 257.A O no hydrogen 2.899 N/A ARG 253.A NE GLU 255.A OE1 no hydrogen 2.833 N/A ARG 253.A NH1 GLU 255.A OE1 no hydrogen 2.766 N/A SER 254.A N GLU 367.A O no hydrogen 2.911 N/A ASN 256.A N ARG 365.A O no hydrogen 2.890 N/A ILE 257.A N SER 252.A O no hydrogen 2.903 N/A ASN 258.A N CYS 363.A O no hydrogen 2.918 N/A HIS 259.A N PHE 250.A O no hydrogen 2.813 N/A ASN 260.A N LYS 361.A O no hydrogen 2.909 N/A SER 261.A N GLY 248.A O no hydrogen 2.862 N/A SER 261.A OG GLU 359.A O no hydrogen 2.715 N/A ALA 262.A N GLU 359.A O no hydrogen 2.916 N/A PHE 263.A N GLN 246.A O no hydrogen 2.951 N/A LYS 264.A N GLU 357.A O no hydrogen 2.870 N/A GLN 265.A N GLU 244.A O no hydrogen 2.935 N/A GLN 265.A NE2 GLU 37.A OE2 no hydrogen 2.796 N/A GLN 265.A NE2 GLU 244.A OE1 no hydrogen 2.765 N/A ALA 266.A N LEU 355.A O no hydrogen 3.050 N/A ILE 267.A N HIS 242.A O no hydrogen 2.828 N/A GLN 268.A N SER 353.A O no hydrogen 2.882 N/A ALA 269.A N LEU 240.A O no hydrogen 2.858 N/A SER 270.A N LYS 351.A O no hydrogen 3.066 N/A SER 270.A OG THR 238.A O no hydrogen 2.669 N/A HIS 271.A N THR 238.A O no hydrogen 3.301 N/A HIS 271.A N THR 238.A OG1 no hydrogen 3.124 N/A LYS 272.A N GLU 349.A O no hydrogen 2.865 N/A LYS 273.A N ASP 236.A O no hydrogen 2.879 N/A ASP 274.A N SER 347.A O no hydrogen 2.838 N/A SER 275.A N TYR 234.A O no hydrogen 2.892 N/A SER 275.A OG ASP 274.A O no hydrogen 2.702 N/A SER 276.A N PHE 345.A O no hydrogen 2.882 N/A PHE 277.A N ASP 232.A O no hydrogen 2.943 N/A ILE 278.A N TYR 343.A O no hydrogen 2.865 N/A ARG 279.A N LYS 230.A O no hydrogen 2.820 N/A ARG 279.A NE ASP 513.A OD1 no hydrogen 2.820 N/A ARG 279.A NE ASP 513.A OD2 no hydrogen 3.361 N/A ARG 279.A NH1 ASP 228.A OD2 no hydrogen 2.754 N/A ARG 279.A NH1 ASP 513.A OD2 no hydrogen 2.722 N/A ARG 279.A NH2 ASP 228.A OD2 no hydrogen 2.889 N/A ILE 280.A N LEU 341.A O no hydrogen 2.807 N/A HIS 281.A N ASP 228.A O no hydrogen 2.930 N/A LYS 282.A N TYR 339.A O no hydrogen 2.884 N/A VAL 283.A N GLU 226.A O no hydrogen 2.895 N/A MET 284.A N GLY 337.A O no hydrogen 2.903 N/A LYS 285.A N GLN 223.A O no hydrogen 2.960 N/A LYS 285.A NZ SER 334.A OG no hydrogen 3.284 N/A LYS 285.A NZ ASP 439.A OD2 no hydrogen 2.772 N/A LEU 287.A N LEU 335.A O no hydrogen 3.081 N/A ASN 288.A N GLY 219.A O no hydrogen 2.999 N/A PHE 289.A N GLY 333.A O no hydrogen 3.210 N/A THR 290.A N ASN 217.A O no hydrogen 3.009 N/A THR 291.A N THR 331.A O no hydrogen 2.834 N/A THR 291.A OG1 PHE 330.A O no hydrogen 2.862 N/A LYS 292.A N ASN 214.A O no hydrogen 2.894 N/A HIS 297.A N ASN 214.A OD1 no hydrogen 2.949 N/A SER 299.A N VAL 187.A O no hydrogen 2.888 N/A SER 299.A OG GLU 186.A O no hydrogen 2.754 N/A LEU 303.A N SER 299.A O no hydrogen 2.889 N/A LYS 304.A N ASP 300.A O no hydrogen 2.982 N/A ALA 305.A N VAL 301.A O no hydrogen 3.283 N/A LEU 306.A N PHE 302.A O no hydrogen 2.978 N/A ASN 307.A N LEU 303.A O no hydrogen 2.983 N/A HIS 308.A N LYS 304.A O no hydrogen 2.983 N/A LEU 309.A N ALA 305.A O no hydrogen 3.158 N/A TYR 313.A N GLU 312.A OE2 no hydrogen 2.869 N/A TYR 313.A OH SER 315.A OG no hydrogen 3.275 N/A TYR 313.A OH GLU 468.A OE1 no hydrogen 2.592 N/A ASN 314.A ND2 ASP 73.A OD2 no hydrogen 2.752 N/A ASN 314.A ND2 SER 80.A OG no hydrogen 2.929 N/A SER 315.A OG TYR 313.A OH no hydrogen 3.275 N/A SER 315.A OG GLU 468.A OE1 no hydrogen 2.586 N/A LEU 317.A N ASN 314.A OD1 no hydrogen 2.980 N/A TYR 318.A N ASN 314.A O no hydrogen 3.113 N/A TYR 318.A OH PRO 310.A O no hydrogen 2.639 N/A SER 319.A N SER 315.A O no hydrogen 2.865 N/A SER 319.A OG SER 315.A O no hydrogen 2.644 N/A ARG 320.A N ALA 316.A O no hydrogen 3.174 N/A ILE 321.A N TYR 318.A O no hydrogen 3.191 N/A PHE 322.A N SER 319.A O no hydrogen 2.911 N/A ASP 323.A N SER 319.A O no hydrogen 3.403 N/A ASP 324.A N ARG 320.A O no hydrogen 3.107 N/A ASP 324.A N ILE 321.A O no hydrogen 3.263 N/A PHE 325.A N ILE 321.A O no hydrogen 2.754 N/A GLY 326.A N PHE 322.A O no hydrogen 2.957 N/A THR 327.A N PHE 176.A O no hydrogen 2.858 N/A HIS 328.A N PHE 176.A O no hydrogen 2.927 N/A TYR 329.A N ALA 443.A O no hydrogen 2.820 N/A THR 331.A N GLU 441.A O no hydrogen 2.861 N/A THR 331.A OG1 GLU 441.A O no hydrogen 3.283 N/A SER 332.A OG PHE 289.A O no hydrogen 2.956 N/A GLY 333.A N PHE 289.A O no hydrogen 3.277 N/A SER 334.A N ASP 439.A O no hydrogen 2.880 N/A SER 334.A OG ASN 288.A OD1 no hydrogen 3.227 N/A SER 334.A OG ASP 439.A OD1 no hydrogen 2.583 N/A LEU 335.A N LEU 287.A O no hydrogen 3.191 N/A GLY 336.A N ALA 436.A O no hydrogen 2.787 N/A GLY 337.A N MET 284.A O no hydrogen 2.965 N/A VAL 338.A N ARG 400.A O no hydrogen 3.012 N/A TYR 339.A N LYS 282.A O no hydrogen 2.941 N/A ASP 340.A N LEU 398.A O no hydrogen 2.929 N/A LEU 341.A N ILE 280.A O no hydrogen 2.901 N/A LEU 342.A N ILE 396.A O no hydrogen 2.817 N/A TYR 343.A N ILE 278.A O no hydrogen 2.793 N/A TYR 343.A OH GLU 393.A OE1 no hydrogen 2.581 N/A GLN 344.A N LYS 394.A O no hydrogen 2.937 N/A PHE 345.A N SER 276.A O no hydrogen 2.812 N/A SER 346.A N ALA 392.A O no hydrogen 2.857 N/A SER 347.A N ASP 274.A O no hydrogen 2.862 N/A GLU 348.A N GLN 390.A O no hydrogen 2.795 N/A GLU 349.A N LYS 272.A O no hydrogen 2.837 N/A LEU 350.A N PHE 388.A O no hydrogen 2.784 N/A LYS 351.A N SER 270.A O no hydrogen 2.881 N/A ASN 352.A N GLY 386.A O no hydrogen 2.920 N/A ASN 352.A ND2 ASN 38.A OD1 no hydrogen 2.853 N/A SER 353.A N GLN 268.A O no hydrogen 2.857 N/A GLY 354.A N HIS 384.A O no hydrogen 2.959 N/A LEU 355.A N ALA 266.A O no hydrogen 2.783 N/A THR 356.A N GLU 382.A O no hydrogen 2.886 N/A THR 356.A OG1 LEU 355.A O no hydrogen 2.802 N/A GLU 357.A N LYS 264.A O no hydrogen 2.901 N/A GLU 358.A N LEU 380.A O no hydrogen 3.039 N/A GLU 359.A N ALA 262.A O no hydrogen 2.856 N/A ALA 360.A N ASN 378.A O no hydrogen 2.931 N/A LYS 361.A N ASN 260.A O no hydrogen 2.849 N/A HIS 362.A N THR 376.A O no hydrogen 2.864 N/A CYS 363.A N ASN 258.A O no hydrogen 2.845 N/A VAL 364.A N ARG 374.A O no hydrogen 2.852 N/A ARG 365.A N ASN 256.A O no hydrogen 2.952 N/A ARG 365.A NE GLU 367.A OE1 no hydrogen 2.851 N/A ARG 365.A NH1 GLU 367.A OE1 no hydrogen 2.763 N/A ILE 366.A N GLU 372.A O no hydrogen 2.880 N/A GLU 367.A N SER 254.A O no hydrogen 2.886 N/A THR 368.A N LYS 370.A O no hydrogen 2.933 N/A LYS 370.A N THR 368.A O no hydrogen 2.921 N/A GLU 372.A N ILE 366.A O no hydrogen 2.848 N/A ARG 374.A N VAL 364.A O no hydrogen 2.900 N/A CYS 375.A SG HIS 362.A O no hydrogen 3.139 N/A THR 376.A N HIS 362.A O no hydrogen 2.962 N/A ASN 378.A N ALA 360.A O no hydrogen 2.926 N/A LYS 379.A NZ GLU 357.A OE1 no hydrogen 2.792 N/A LEU 380.A N GLU 358.A O no hydrogen 2.906 N/A SER 381.A OG THR 356.A O no hydrogen 2.694 N/A GLU 382.A N THR 356.A O no hydrogen 3.095 N/A HIS 384.A N GLY 354.A O no hydrogen 2.960 N/A GLY 386.A N ASN 352.A O no hydrogen 3.023 N/A PHE 388.A N LEU 350.A O no hydrogen 3.029 N/A GLN 390.A N GLU 348.A O no hydrogen 2.905 N/A GLN 390.A NE2 GLU 348.A OE2 no hydrogen 2.788 N/A ALA 392.A N SER 346.A O no hydrogen 2.938 N/A LYS 394.A N GLN 344.A O no hydrogen 2.852 N/A SER 395.A OG LYS 414.A O no hydrogen 2.676 N/A ILE 396.A N LEU 342.A O no hydrogen 2.946 N/A SER 397.A OG ASP 340.A O no hydrogen 2.651 N/A LEU 398.A N ASP 340.A O no hydrogen 2.995 N/A ARG 400.A N VAL 338.A O no hydrogen 2.969 N/A ARG 400.A NH1 VAL 437.A O no hydrogen 2.754 N/A ARG 400.A NH2 VAL 437.A O no hydrogen 2.965 N/A GLY 402.A N ASN 434.A O no hydrogen 2.769 N/A ARG 403.A NE GLU 433.A OE2 no hydrogen 2.742 N/A ARG 403.A NH1 GLU 433.A OE2 no hydrogen 2.818 N/A GLY 407.A N ARG 403.A O no hydrogen 3.013 N/A ALA 408.A N SER 404.A O no hydrogen 2.821 N/A ALA 409.A N GLU 405.A O no hydrogen 3.009 N/A LEU 410.A N TYR 406.A O no hydrogen 2.889 N/A ALA 411.A N GLY 407.A O no hydrogen 2.817 N/A TRP 412.A N ALA 408.A O no hydrogen 2.878 N/A GLU 413.A N LEU 410.A O no hydrogen 3.193 N/A LYS 414.A NZ GLU 393.A OE2 no hydrogen 2.810 N/A SER 416.A OG TYR 343.A OH no hydrogen 2.994 N/A GLY 418.A N GLY 415.A O no hydrogen 2.948 N/A THR 423.A OG1 GLU 413.A OE2 no hydrogen 2.523 N/A PHE 424.A N GLU 420.A O no hydrogen 2.944 N/A SER 425.A N GLU 421.A O no hydrogen 2.878 N/A SER 425.A OG GLU 421.A O no hydrogen 2.684 N/A SER 425.A OG LYS 422.A O no hydrogen 3.052 N/A GLU 426.A N LYS 422.A O no hydrogen 3.060 N/A TRP 427.A N THR 423.A O no hydrogen 3.007 N/A TRP 427.A NE1 GLY 401.A O no hydrogen 2.972 N/A LEU 428.A N PHE 424.A O no hydrogen 2.837 N/A GLU 429.A N SER 425.A O no hydrogen 3.020 N/A SER 430.A N GLU 426.A O no hydrogen 3.074 N/A SER 430.A OG GLU 426.A O no hydrogen 2.867 N/A VAL 431.A N TRP 427.A O no hydrogen 2.916 N/A LYS 432.A N LEU 428.A O no hydrogen 3.227 N/A GLU 433.A N SER 430.A O no hydrogen 2.998 N/A ASN 434.A N SER 430.A O no hydrogen 3.022 N/A ASN 434.A N VAL 431.A O no hydrogen 3.174 N/A ASN 434.A ND2 GLY 402.A O no hydrogen 2.802 N/A ALA 436.A N GLY 336.A O no hydrogen 2.806 N/A ILE 438.A N SER 334.A O no hydrogen 3.007 N/A GLU 441.A N SER 332.A O no hydrogen 2.840 N/A ALA 443.A N TYR 329.A O no hydrogen 3.136 N/A ILE 445.A N THR 327.A O no hydrogen 2.797 N/A ASP 447.A N PRO 444.A O no hydrogen 3.028 N/A LEU 448.A N ILE 445.A O no hydrogen 3.069 N/A ARG 450.A NH1 ASP 581.A OD2 no hydrogen 2.854 N/A ARG 450.A NH2 ASP 447.A O no hydrogen 3.320 N/A CYS 454.A N ASN 580.A OD1 no hydrogen 2.747 N/A VAL 456.A N ILE 579.A O no hydrogen 3.020 N/A THR 457.A OG1 PRO 577.A O no hydrogen 2.836 N/A LYS 458.A N CYS 454.A O no hydrogen 3.058 N/A LYS 458.A NZ LEU 306.A O no hydrogen 2.954 N/A LYS 458.A NZ LEU 309.A O no hydrogen 2.803 N/A ARG 459.A N ALA 455.A O no hydrogen 2.794 N/A ARG 459.A NE VAL 449.A O no hydrogen 3.095 N/A ARG 459.A NH1 ASP 581.A OD1 no hydrogen 3.560 N/A ARG 459.A NH1 ASP 581.A OD2 no hydrogen 2.794 N/A ARG 459.A NH2 VAL 449.A O no hydrogen 2.731 N/A ARG 459.A NH2 ASP 581.A OD1 no hydrogen 2.795 N/A ARG 459.A NH2 ASP 581.A OD2 no hydrogen 2.945 N/A ASN 460.A N VAL 456.A O no hydrogen 3.077 N/A ASN 461.A N THR 457.A O no hydrogen 3.096 N/A ASN 461.A ND2 LEU 311.A O no hydrogen 3.035 N/A ASN 461.A ND2 TYR 318.A OH no hydrogen 3.149 N/A ASN 461.A ND2 GLN 576.A OE1 no hydrogen 2.934 N/A LEU 462.A N LYS 458.A O no hydrogen 2.878 N/A ARG 463.A N ARG 459.A O no hydrogen 2.909 N/A ARG 463.A NH2 ASP 447.A OD1 no hydrogen 2.909 N/A LYS 464.A N ASN 460.A O no hydrogen 3.033 N/A ALA 465.A N ASN 461.A O no hydrogen 2.894 N/A LEU 466.A N LEU 462.A O no hydrogen 2.913 N/A GLN 467.A N ARG 463.A O no hydrogen 3.137 N/A GLU 468.A N LYS 464.A O no hydrogen 3.080 N/A TYR 469.A N ALA 465.A O no hydrogen 2.816 N/A TYR 469.A OH ASP 323.A OD1 no hydrogen 2.605 N/A ALA 470.A N LEU 466.A O no hydrogen 2.785 N/A ALA 471.A N GLN 467.A O no hydrogen 2.880 N/A LYS 472.A N GLU 468.A O no hydrogen 3.185 N/A LYS 472.A N TYR 469.A O no hydrogen 3.137 N/A LYS 472.A NZ ARG 83.A O no hydrogen 3.089 N/A PHE 473.A N TYR 469.A O no hydrogen 2.869 N/A PHE 473.A N ALA 470.A O no hydrogen 3.259 N/A ASP 474.A N ALA 470.A O no hydrogen 2.921 N/A CYS 476.A N ASP 474.A OD1 no hydrogen 2.859 N/A CYS 476.A SG ASP 474.A O no hydrogen 4.018 N/A GLN 477.A NE2 LYS 472.A O no hydrogen 3.020 N/A GLN 477.A NE2 ASP 474.A O no hydrogen 2.900 N/A CYS 478.A N PRO 475.A O no hydrogen 2.997 N/A CYS 478.A SG PRO 475.A O no hydrogen 3.226 N/A ALA 479.A N GLN 90.A OE1 no hydrogen 2.786 N/A ASN 483.A ND2 CYS 507.A O no hydrogen 2.776 N/A ASN 483.A ND2 GLU 508.A O no hydrogen 2.924 N/A ASN 484.A ND2 VAL 519.A O no hydrogen 2.810 N/A GLY 485.A N PRO 482.A O no hydrogen 3.415 N/A ARG 486.A N VAL 497.A O no hydrogen 2.999 N/A ARG 486.A NE PRO 487.A O no hydrogen 3.111 N/A ARG 486.A NH2 PHE 178.A O no hydrogen 2.885 N/A THR 488.A N LEU 495.A O no hydrogen 2.903 N/A THR 488.A OG1 LEU 495.A O no hydrogen 2.718 N/A LEU 489.A N LEU 179.A O no hydrogen 2.873 N/A SER 490.A N GLU 493.A O no hydrogen 2.948 N/A SER 490.A OG GLU 493.A O no hydrogen 3.102 N/A THR 492.A N SER 490.A OG no hydrogen 3.407 N/A GLU 493.A N SER 490.A OG no hydrogen 3.083 N/A CYS 494.A N SER 89.A O no hydrogen 2.850 N/A CYS 494.A SG GLN 90.A OE1 no hydrogen 3.369 N/A LEU 495.A N THR 488.A O no hydrogen 2.820 N/A CYS 496.A SG ASN 506.A O no hydrogen 3.870 N/A VAL 497.A N ARG 486.A O no hydrogen 2.955 N/A CYS 498.A SG CYS 496.A O no hydrogen 3.763 N/A GLN 499.A NE2 ASN 484.A O no hydrogen 2.911 N/A THR 502.A N GLN 499.A O no hydrogen 3.027 N/A THR 502.A OG1 GLN 499.A O no hydrogen 2.689 N/A TYR 503.A N LYS 509.A O no hydrogen 2.856 N/A CYS 507.A SG CYS 496.A O no hydrogen 3.412 N/A LYS 509.A N TYR 503.A O no hydrogen 3.020 N/A GLN 510.A NE2 ASN 483.A OD1 no hydrogen 2.809 N/A GLN 510.A NE2 ASN 517.A OD1 no hydrogen 2.888 N/A SER 511.A N GLY 501.A O no hydrogen 2.897 N/A SER 511.A OG GLY 501.A O no hydrogen 3.081 N/A SER 511.A OG ASP 513.A OD1 no hydrogen 2.530 N/A TYR 514.A N SER 511.A O no hydrogen 3.028 N/A TYR 514.A OH ASN 484.A OD1 no hydrogen 2.927 N/A LYS 515.A N ASP 513.A O no hydrogen 2.758 N/A ASP 520.A N GLN 550.A O no hydrogen 3.121 N/A GLN 522.A N PRO 547.A O no hydrogen 3.009 N/A GLN 522.A NE2 TRP 523.A O no hydrogen 3.100 N/A SER 527.A N THR 541.A O no hydrogen 2.994 N/A TRP 529.A NE1 GLU 564.A OE1 no hydrogen 2.752 N/A TRP 529.A NE1 GLU 564.A OE2 no hydrogen 2.862 N/A SER 530.A N SER 539.A O no hydrogen 2.930 N/A SER 530.A OG SER 539.A O no hydrogen 2.743 N/A SER 530.A OG SER 539.A OG no hydrogen 3.155 N/A ASP 533.A N LYS 537.A O no hydrogen 2.859 N/A THR 535.A N ASP 533.A OD1 no hydrogen 2.778 N/A TYR 536.A N ASP 533.A O no hydrogen 2.886 N/A LYS 537.A N ASP 533.A OD1 no hydrogen 2.911 N/A ARG 538.A N GLU 564.A O no hydrogen 2.842 N/A ARG 538.A NE GLU 564.A OE2 no hydrogen 2.833 N/A ARG 538.A NH2 GLU 564.A OE2 no hydrogen 2.768 N/A SER 539.A OG SER 530.A OG no hydrogen 3.155 N/A ARG 540.A N GLN 562.A O no hydrogen 3.384 N/A ARG 540.A NH1 GLU 564.A OE1 no hydrogen 2.876 N/A ARG 542.A N LYS 560.A O no hydrogen 2.906 N/A ARG 542.A NH1 GLU 557.A O no hydrogen 2.849 N/A ARG 542.A NH2 GLU 557.A O no hydrogen 3.542 N/A ASN 546.A N GLN 522.A O no hydrogen 3.077 N/A ASN 546.A ND2 CYS 476.A O no hydrogen 2.955 N/A ASN 546.A ND2 TRP 523.A O no hydrogen 2.951 N/A GLN 550.A N ASP 520.A O no hydrogen 2.972 N/A GLN 550.A NE2 ALA 548.A O no hydrogen 2.849 N/A GLY 553.A N GLN 550.A O no hydrogen 3.070 N/A ARG 555.A NH1 CYS 556.A O no hydrogen 3.541 N/A ARG 555.A NH1 GLU 557.A OE1 no hydrogen 2.787 N/A ARG 555.A NH2 GLU 557.A OE1 no hydrogen 3.483 N/A ARG 555.A NH2 GLU 557.A OE2 no hydrogen 2.824 N/A GLY 558.A N GLU 557.A OE1 no hydrogen 2.869 N/A ARG 561.A NE GLU 563.A OE1 no hydrogen 2.884 N/A ARG 561.A NH2 GLU 563.A OE1 no hydrogen 2.763 N/A GLN 562.A N ARG 540.A O no hydrogen 2.969 N/A GLU 564.A N ARG 538.A O no hydrogen 3.032 N/A CYS 566.A N TYR 536.A O no hydrogen 2.874 N/A THR 567.A N ASP 565.A OD1 no hydrogen 2.981 N/A THR 567.A OG1 ASP 565.A OD1 no hydrogen 2.553 N/A ASN 573.A N GLU 572.A OE2 no hydrogen 2.976 N/A GLY 575.A N ASN 573.A OD1 no hydrogen 3.049 N/A GLN 576.A N GLU 312.A OE1 no hydrogen 2.781 N/A GLN 576.A NE2 GLU 312.A OE2 no hydrogen 2.752 N/A GLN 576.A NE2 ASN 461.A OD1 no hydrogen 2.984 N/A CYS 578.A SG GLU 115.A OE1 no hydrogen 3.196 N/A CYS 578.A SG ASN 580.A OD1 no hydrogen 3.901 N/A ILE 579.A N THR 457.A OG1 no hydrogen 3.014 N/A ASN 580.A N GLU 583.A OE2 no hydrogen 2.745 N/A ASN 580.A ND2 GLU 115.A OE1 no hydrogen 2.768 N/A ASN 580.A ND2 GLU 583.A OE1 no hydrogen 2.867 N/A ASN 580.A ND2 GLU 583.A OE2 no hydrogen 2.859 N/A GLU 583.A N ASN 580.A O no hydrogen 3.133 N/A LYS 586.A NZ ASP 589.A OD2 no hydrogen 2.761 N/A LEU 590.A N ASP 589.A OD1 no hydrogen 2.738 N/A SER 597.A N GLU 594.A O no hydrogen 3.053 N/A CYS 599.A N TYR 617.A O no hydrogen 3.001 N/A CYS 599.A SG LEU 642.A O no hydrogen 3.892 N/A CYS 599.A SG THR 646.A O no hydrogen 3.261 N/A GLN 601.A N GLN 615.A O no hydrogen 2.980 N/A GLN 601.A NE2 PRO 602.A O no hydrogen 2.850 N/A ARG 611.A N GLU 624.A O no hydrogen 3.012 N/A ARG 611.A NE SER 626.A OG no hydrogen 2.810 N/A LYS 614.A N TYR 617.A OH no hydrogen 3.082 N/A LYS 614.A NZ GLU 621.A OE1 no hydrogen 2.884 N/A LYS 614.A NZ GLU 621.A OE2 no hydrogen 2.940 N/A TYR 617.A N CYS 599.A O no hydrogen 2.861 N/A TYR 617.A OH ASN 612.A O no hydrogen 2.690 N/A LEU 618.A N GLU 621.A OE1 no hydrogen 2.936 N/A GLY 620.A N CYS 641.A O no hydrogen 2.767 N/A GLU 621.A N LEU 618.A O no hydrogen 3.145 N/A VAL 623.A N PHE 639.A O no hydrogen 2.896 N/A ILE 625.A N GLN 637.A O no hydrogen 3.028 N/A SER 626.A N PHE 609.A O no hydrogen 3.377 N/A SER 626.A OG ILE 625.A O no hydrogen 2.720 N/A LEU 628.A N ASN 607.A O no hydrogen 3.183 N/A PHE 631.A N LEU 628.A O no hydrogen 2.856 N/A GLU 632.A N GLN 655.A O no hydrogen 2.815 N/A VAL 634.A N GLU 653.A O no hydrogen 3.018 N/A TYR 636.A N ASP 651.A O no hydrogen 2.879 N/A GLN 637.A N GLN 637.A OE1 no hydrogen 2.793 N/A GLN 637.A NE2 GLU 624.A OE2 no hydrogen 2.882 N/A PHE 639.A N VAL 623.A O no hydrogen 3.034 N/A ARG 640.A N TRP 647.A O no hydrogen 2.921 N/A CYS 641.A N GLU 621.A O no hydrogen 2.823 N/A CYS 641.A SG TYR 617.A O no hydrogen 3.848 N/A CYS 641.A SG LEU 618.A O no hydrogen 3.201 N/A CYS 641.A SG LEU 642.A O no hydrogen 3.664 N/A LEU 642.A N THR 646.A O no hydrogen 2.889 N/A THR 646.A N ASP 644.A OD1 no hydrogen 2.825 N/A THR 646.A OG1 ASP 644.A OD1 no hydrogen 2.610 N/A THR 646.A OG1 ASP 644.A OD2 no hydrogen 3.538 N/A TRP 647.A NE1 PRO 600.A O no hydrogen 2.872 N/A GLU 653.A N VAL 634.A O no hydrogen 2.854 N/A GLN 655.A N GLU 632.A O no hydrogen 2.798 N/A GLN 655.A NE2 GLU 653.A O no hydrogen 2.959 N/A GLN 655.A NE2 GLU 653.A OE1 no hydrogen 2.842 N/A ARG 656.A NE GLY 703.A O no hydrogen 2.792 N/A ARG 656.A NH1 GLU 658.A O no hydrogen 2.944 N/A THR 657.A N GLY 630.A O no hydrogen 2.811 N/A GLU 658.A N GLY 630.A O no hydrogen 2.893 N/A CYS 659.A N TYR 677.A O no hydrogen 2.783 N/A GLN 665.A NE2 ASN 712.A OD1 no hydrogen 2.865 N/A THR 671.A N GLU 684.A O no hydrogen 2.953 N/A PHE 673.A N THR 671.A O no hydrogen 3.060 N/A GLN 674.A N TYR 677.A OH no hydrogen 2.979 N/A GLN 674.A NE2 LEU 676.A O no hydrogen 2.844 N/A GLN 674.A NE2 GLU 681.A OE1 no hydrogen 2.802 N/A TYR 677.A N CYS 659.A O no hydrogen 2.849 N/A TYR 677.A OH GLN 674.A O no hydrogen 2.786 N/A ARG 678.A N GLU 681.A OE1 no hydrogen 2.839 N/A ARG 678.A NE GLU 658.A OE2 no hydrogen 2.804 N/A ARG 678.A NH2 GLU 658.A OE2 no hydrogen 2.782 N/A ILE 679.A N THR 657.A O no hydrogen 2.907 N/A GLU 681.A N ARG 678.A O no hydrogen 2.913 N/A ILE 683.A N TYR 699.A O no hydrogen 2.936 N/A THR 686.A N THR 669.A O no hydrogen 2.912 N/A CYS 687.A SG PHE 691.A O no hydrogen 3.185 N/A ARG 698.A NH2 SER 682.A OG no hydrogen 2.984 N/A TYR 699.A N ILE 683.A O no hydrogen 2.901 N/A TYR 699.A OH THR 707.A O no hydrogen 2.902 N/A THR 700.A OG1 GLU 681.A O no hydrogen 2.656 N/A CYS 701.A SG ASN 704.A O no hydrogen 3.337 N/A GLN 702.A N ASN 704.A O no hydrogen 3.181 N/A GLN 702.A NE2 THR 700.A O no hydrogen 2.846 N/A GLN 702.A NE2 TRP 706.A O no hydrogen 2.872 N/A THR 707.A N SER 705.A O no hydrogen 2.851 N/A THR 707.A OG1 TYR 699.A OH no hydrogen 2.832 N/A THR 707.A OG1 TRP 706.A O no hydrogen 2.629 N/A ASN 712.A ND2 SER 713.A O no hydrogen 2.845 N/A ASN 712.A ND2 THR 715.A OG1 no hydrogen 2.951 N/A SER 713.A N GLN 665.A OE1 no hydrogen 2.812 N/A THR 715.A N SER 713.A O no hydrogen 2.870 N/A CYS 716.A N LEU 714.A O no hydrogen 2.926 N/A