Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 2z3z_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLN 5.A N VAL 12.A O no hydrogen 3.023 N/A GLN 5.A NE2 GLY 3.A O no hydrogen 2.890 N/A TRP 6.A NE1 GLN 362.A O no hydrogen 3.009 N/A MET 7.A N ASN 10.A O no hydrogen 2.803 N/A GLY 8.A N ALA 45.A O no hydrogen 2.751 N/A ASN 10.A N MET 7.A O no hydrogen 3.017 N/A ASN 10.A ND2 MET 7.A O no hydrogen 3.208 N/A TYR 11.A N ASN 22.A O no hydrogen 2.795 N/A VAL 12.A N GLN 5.A O no hydrogen 2.830 N/A PHE 13.A N VAL 20.A O no hydrogen 3.348 N/A ILE 14.A N VAL 2.A O no hydrogen 2.706 N/A GLU 15.A N ASP 18.A O no hydrogen 2.812 N/A ASP 17.A N GLU 15.A O no hydrogen 2.409 N/A ASP 18.A N GLU 15.A O no hydrogen 3.480 N/A LEU 19.A N PHE 27.A O no hydrogen 2.692 N/A VAL 20.A N PHE 13.A O no hydrogen 2.917 N/A PHE 21.A N THR 25.A O no hydrogen 2.740 N/A ASN 22.A N TYR 11.A O no hydrogen 3.035 N/A THR 25.A N PHE 21.A O no hydrogen 2.948 N/A ARG 26.A NH1 GLU 15.A OE1 no hydrogen 2.520 N/A ARG 26.A NH1 ASP 18.A OD2 no hydrogen 2.710 N/A ARG 26.A NH2 GLU 15.A OE1 no hydrogen 3.067 N/A PHE 27.A N LEU 19.A O no hydrogen 2.827 N/A SER 28.A N ASP 31.A OD1 no hydrogen 3.246 N/A ALA 29.A N ASP 17.A O no hydrogen 2.919 N/A ASP 31.A N SER 28.A OG no hydrogen 3.254 N/A LEU 32.A N SER 28.A O no hydrogen 3.082 N/A ASN 33.A N ALA 29.A O no hydrogen 2.856 N/A ALA 34.A N ALA 30.A O no hydrogen 3.028 N/A LEU 35.A N LEU 32.A O no hydrogen 2.840 N/A MET 36.A N ASN 33.A O no hydrogen 3.409 N/A PHE 37.A N GLY 16.A O no hydrogen 2.466 N/A ARG 41.A N VAL 51.A O no hydrogen 2.918 N/A THR 42.A OG1 GLN 5.A OE1 no hydrogen 2.462 N/A LEU 43.A N LEU 49.A O no hydrogen 2.740 N/A ASP 44.A N LEU 49.A O no hydrogen 3.106 N/A ARG 47.A N ASP 44.A O no hydrogen 3.232 N/A ARG 47.A N ASP 44.A OD1 no hydrogen 3.169 N/A GLY 48.A N ALA 45.A O no hydrogen 3.205 N/A LEU 49.A N ASP 44.A O no hydrogen 3.092 N/A VAL 50.A N PHE 61.A O no hydrogen 2.900 N/A VAL 51.A N ARG 41.A O no hydrogen 2.761 N/A LEU 52.A N VAL 59.A O no hydrogen 2.774 N/A THR 54.A N GLY 57.A O no hydrogen 3.198 N/A THR 54.A OG1 GLN 55.A O no hydrogen 3.041 N/A THR 54.A OG1 GLY 57.A O no hydrogen 2.882 N/A LEU 58.A N PHE 72.A O no hydrogen 3.068 N/A VAL 59.A N LEU 52.A O no hydrogen 2.961 N/A GLY 60.A N TYR 70.A O no hydrogen 2.728 N/A PHE 61.A N VAL 50.A O no hydrogen 2.857 N/A ASP 62.A N LYS 67.A O no hydrogen 2.758 N/A MET 63.A N GLY 48.A O no hydrogen 2.860 N/A LEU 64.A N ASP 62.A OD1 no hydrogen 3.001 N/A ALA 65.A N ASP 62.A OD1 no hydrogen 2.883 N/A ARG 66.A NH2 ARG 26.A O no hydrogen 3.389 N/A LYS 67.A N ASP 62.A O no hydrogen 3.141 N/A THR 69.A N GLY 60.A O no hydrogen 2.828 N/A TYR 70.A N THR 69.A OG1 no hydrogen 2.745 N/A LEU 71.A N GLY 104.A O no hydrogen 2.789 N/A PHE 72.A N LEU 58.A O no hydrogen 2.895 N/A THR 74.A OG1 GLU 77.A O no hydrogen 2.757 N/A ASN 75.A N ASP 73.A OD1 no hydrogen 3.117 N/A GLU 77.A N THR 74.A O no hydrogen 2.909 N/A SER 80.A N GLU 77.A OE2 no hydrogen 3.031 N/A SER 80.A OG GLU 77.A OE2 no hydrogen 2.617 N/A SER 80.A OG VAL 93.A O no hydrogen 3.541 N/A LEU 81.A N THR 78.A O no hydrogen 3.489 N/A ASP 82.A N ALA 91.A O no hydrogen 2.932 N/A SER 84.A N ARG 89.A O no hydrogen 2.845 N/A VAL 86.A N SER 84.A OG no hydrogen 3.013 N/A GLY 87.A N SER 84.A O no hydrogen 2.859 N/A VAL 90.A N ALA 101.A O no hydrogen 2.861 N/A ALA 91.A N ASP 82.A O no hydrogen 2.814 N/A TYR 92.A N TYR 99.A O no hydrogen 3.027 N/A VAL 93.A N SER 80.A OG no hydrogen 2.823 N/A ARG 94.A N ASN 97.A O no hydrogen 2.861 N/A ARG 94.A NE ASN 75.A O no hydrogen 3.168 N/A ASN 97.A N ARG 94.A O no hydrogen 3.151 N/A LEU 98.A N THR 117.A OG1 no hydrogen 2.970 N/A TYR 99.A N TYR 92.A O no hydrogen 2.898 N/A ILE 100.A N ILE 114.A O no hydrogen 2.926 N/A ALA 101.A N VAL 90.A O no hydrogen 2.851 N/A GLY 103.A N ASP 88.A O no hydrogen 2.734 N/A GLY 104.A N LEU 71.A O no hydrogen 2.793 N/A GLU 108.A N LYS 105.A O no hydrogen 2.926 N/A ILE 114.A N ILE 100.A O no hydrogen 2.743 N/A VAL 116.A N LEU 98.A O no hydrogen 2.763 N/A THR 117.A N LEU 98.A O no hydrogen 3.377 N/A THR 117.A OG1 ASN 97.A OD1 no hydrogen 2.810 N/A GLY 120.A N ASN 97.A OD1 no hydrogen 2.888 N/A THR 121.A N LEU 124.A O no hydrogen 3.006 N/A LEU 124.A N THR 121.A O no hydrogen 3.009 N/A VAL 125.A N MET 155.A O no hydrogen 2.840 N/A TYR 126.A OH ASP 119.A OD1 no hydrogen 2.601 N/A GLY 127.A N TYR 153.A O no hydrogen 2.956 N/A HIS 131.A ND1 HIS 188.A NE2 no hydrogen 3.049 N/A ARG 133.A N VAL 130.A O no hydrogen 3.106 N/A GLU 134.A N HIS 131.A O no hydrogen 3.065 N/A ILE 137.A N GLU 134.A O no hydrogen 3.050 N/A LYS 139.A NZ ASP 82.A OD2 no hydrogen 2.998 N/A LYS 139.A NZ THR 141.A O no hydrogen 3.050 N/A THR 141.A OG1 ASP 82.A OD2 no hydrogen 2.635 N/A PHE 142.A N ALA 151.A O no hydrogen 2.794 N/A TRP 143.A NE1 ASP 82.A O no hydrogen 2.914 N/A SER 144.A N CYS 149.A O no hydrogen 2.872 N/A SER 144.A OG CYS 149.A O no hydrogen 3.184 N/A SER 144.A OG GLU 224.A OE2 no hydrogen 2.595 N/A LYS 146.A N GLU 224.A OE2 no hydrogen 2.738 N/A GLY 147.A N SER 144.A O no hydrogen 2.945 N/A SER 148.A N GLU 224.A OE2 no hydrogen 3.200 N/A SER 148.A OG GLU 224.A OE1 no hydrogen 2.574 N/A SER 148.A OG GLU 224.A OE2 no hydrogen 3.262 N/A CYS 149.A N SER 144.A OG no hydrogen 2.797 N/A CYS 149.A SG HIS 196.A ND1 no hydrogen 3.376 N/A LEU 150.A N TYR 195.A O no hydrogen 2.912 N/A ALA 151.A N PHE 142.A O no hydrogen 2.877 N/A PHE 152.A N GLY 193.A O no hydrogen 2.855 N/A TYR 153.A N GLY 140.A O no hydrogen 3.114 N/A TYR 153.A OH LEU 215.A O no hydrogen 2.709 N/A ARG 154.A N THR 191.A O no hydrogen 2.855 N/A ARG 154.A NE TYR 126.A OH no hydrogen 3.327 N/A MET 155.A N VAL 125.A O no hydrogen 2.862 N/A ASP 156.A N HIS 189.A O no hydrogen 2.841 N/A GLN 157.A N THR 123.A O no hydrogen 2.817 N/A GLN 157.A NE2 GLU 122.A O no hydrogen 2.844 N/A SER 158.A N ASP 156.A OD1 no hydrogen 2.944 N/A SER 158.A OG ASP 156.A OD1 no hydrogen 2.749 N/A VAL 160.A N GLN 157.A O no hydrogen 3.090 N/A THR 163.A N LEU 178.A O no hydrogen 2.835 N/A ILE 165.A N LYS 176.A O no hydrogen 2.868 N/A ASP 167.A N GLU 174.A O no hydrogen 2.746 N/A HIS 169.A N ASP 167.A OD1 no hydrogen 3.127 N/A HIS 169.A NE2 SER 626.A OG no hydrogen 2.682 N/A GLU 172.A N GLU 172.A OE1 no hydrogen 2.836 N/A GLU 174.A N ASP 167.A O no hydrogen 2.924 N/A LYS 176.A N ILE 165.A O no hydrogen 2.891 N/A LEU 178.A N THR 163.A O no hydrogen 2.738 N/A TYR 180.A N LEU 178.A O no hydrogen 2.860 N/A TYR 180.A OH VAL 599.A O no hydrogen 2.757 N/A ALA 183.A N TYR 554.A O no hydrogen 2.759 N/A GLY 184.A N GLU 560.A OE2 no hydrogen 2.724 N/A THR 185.A N MET 182.A O no hydrogen 3.031 N/A THR 185.A OG1 MET 182.A O no hydrogen 2.636 N/A SER 187.A N GLU 212.A OE2 no hydrogen 2.864 N/A HIS 188.A NE2 HIS 131.A ND1 no hydrogen 3.049 N/A HIS 189.A N ASP 156.A O no hydrogen 2.979 N/A THR 191.A N ARG 154.A O no hydrogen 2.848 N/A GLY 193.A N PHE 152.A O no hydrogen 2.856 N/A ILE 194.A N VAL 203.A O no hydrogen 2.804 N/A TYR 195.A N LEU 150.A O no hydrogen 2.857 N/A HIS 196.A N LYS 201.A O no hydrogen 2.805 N/A HIS 196.A NE2 ALA 246.A O no hydrogen 2.792 N/A LEU 197.A N SER 148.A O no hydrogen 3.065 N/A THR 199.A N HIS 196.A O no hydrogen 3.318 N/A GLY 200.A N HIS 196.A O no hydrogen 2.770 N/A LYS 201.A N THR 199.A OG1 no hydrogen 3.150 N/A VAL 203.A N ILE 194.A O no hydrogen 3.018 N/A LEU 205.A N VAL 192.A O no hydrogen 2.913 N/A GLN 206.A N GLY 249.A O no hydrogen 2.799 N/A LYS 211.A NZ GLU 209.A OE2 no hydrogen 3.465 N/A LYS 213.A N PRO 210.A O no hydrogen 3.090 N/A LYS 213.A NZ THR 207.A O no hydrogen 2.694 N/A LYS 213.A NZ GLU 209.A O no hydrogen 3.233 N/A PHE 214.A N VAL 232.A O no hydrogen 2.956 N/A LEU 215.A N HIS 131.A NE2 no hydrogen 2.971 N/A THR 216.A N ALA 230.A O no hydrogen 2.918 N/A THR 216.A OG1 ASN 217.A OD1 no hydrogen 3.019 N/A THR 216.A OG1 ALA 230.A O no hydrogen 2.763 N/A SER 219.A N TYR 228.A O no hydrogen 2.925 N/A SER 219.A OG ASN 217.A O no hydrogen 2.893 N/A TRP 220.A NE1 PHE 142.A O no hydrogen 2.956 N/A SER 221.A N ILE 226.A O no hydrogen 2.814 N/A SER 221.A OG ASP 223.A OD1 no hydrogen 2.707 N/A SER 221.A OG ILE 226.A O no hydrogen 3.200 N/A ASP 223.A N ASN 277.A OD1 no hydrogen 2.977 N/A GLU 224.A N SER 221.A O no hydrogen 2.939 N/A ASN 225.A N ASP 223.A OD1 no hydrogen 2.968 N/A ASN 225.A ND2 ASP 223.A OD2 no hydrogen 2.954 N/A ILE 226.A N SER 221.A OG no hydrogen 3.089 N/A LEU 227.A N TYR 244.A O no hydrogen 2.969 N/A TYR 228.A N SER 219.A O no hydrogen 2.870 N/A VAL 229.A N ASN 242.A O no hydrogen 2.971 N/A ALA 230.A N THR 216.A O no hydrogen 2.834 N/A GLU 231.A N LYS 240.A O no hydrogen 2.804 N/A VAL 232.A N PHE 214.A O no hydrogen 2.903 N/A ASN 233.A N GLU 238.A O no hydrogen 3.277 N/A ASN 233.A ND2 ASN 237.A OD1 no hydrogen 2.892 N/A ARG 234.A NE GLU 560.A OE1 no hydrogen 2.819 N/A ARG 234.A NH1 THR 185.A O no hydrogen 3.029 N/A ARG 234.A NH1 GLU 212.A OE1 no hydrogen 2.913 N/A ARG 234.A NH2 THR 185.A O no hydrogen 2.814 N/A ARG 234.A NH2 GLU 560.A OE2 no hydrogen 2.847 N/A GLN 236.A N ASN 233.A O no hydrogen 2.931 N/A GLN 236.A NE2 MET 557.A O no hydrogen 2.940 N/A ASN 237.A N ASN 233.A OD1 no hydrogen 3.059 N/A GLU 238.A N ASN 233.A OD1 no hydrogen 3.189 N/A CYS 239.A N GLU 258.A O no hydrogen 2.806 N/A LYS 240.A N GLU 231.A O no hydrogen 2.875 N/A VAL 241.A N PHE 256.A O no hydrogen 2.912 N/A ASN 242.A N VAL 229.A O no hydrogen 2.874 N/A ASN 242.A ND2 GLU 231.A OE2 no hydrogen 3.057 N/A ALA 243.A N ARG 253.A O no hydrogen 2.813 N/A TYR 244.A N LEU 227.A O no hydrogen 3.023 N/A TYR 244.A OH GLU 231.A OE2 no hydrogen 2.532 N/A ASP 245.A N ARG 250.A O no hydrogen 2.782 N/A ALA 246.A N ASN 225.A O no hydrogen 2.921 N/A THR 248.A N ASP 245.A OD2 no hydrogen 2.800 N/A THR 248.A OG1 ASP 245.A OD2 no hydrogen 3.108 N/A GLY 249.A N ASP 245.A O no hydrogen 2.749 N/A ARG 250.A N THR 248.A OG1 no hydrogen 3.079 N/A VAL 252.A N ALA 243.A O no hydrogen 2.810 N/A ARG 253.A N ALA 243.A O no hydrogen 3.393 N/A ARG 253.A NE THR 297.A O no hydrogen 3.489 N/A THR 254.A OG1 ASN 242.A OD1 no hydrogen 2.692 N/A LEU 255.A N VAL 241.A O no hydrogen 2.690 N/A GLU 258.A N CYS 239.A O no hydrogen 2.802 N/A ASP 260.A N ASN 237.A O no hydrogen 3.277 N/A HIS 262.A N ASP 260.A OD2 no hydrogen 2.886 N/A HIS 262.A ND1 HIS 487.A ND1 no hydrogen 3.071 N/A TYR 263.A N ASP 260.A OD2 no hydrogen 2.953 N/A TYR 263.A OH GLU 483.A OE2 no hydrogen 2.616 N/A VAL 264.A N GLN 236.A O no hydrogen 2.869 N/A LEU 270.A N SER 219.A OG no hydrogen 2.920 N/A THR 271.A N ILE 281.A O no hydrogen 3.011 N/A LEU 273.A N GLN 279.A O no hydrogen 2.964 N/A SER 276.A N LEU 273.A O no hydrogen 3.098 N/A ASN 278.A N SER 276.A OG no hydrogen 3.129 N/A GLN 279.A N SER 276.A OG no hydrogen 3.096 N/A PHE 280.A N TYR 295.A O no hydrogen 2.979 N/A ILE 281.A N THR 271.A O no hydrogen 2.805 N/A TRP 282.A N TYR 293.A O no hydrogen 2.880 N/A TRP 282.A NE1 GLU 258.A OE2 no hydrogen 2.617 N/A SER 284.A N HIS 291.A O no hydrogen 3.012 N/A SER 284.A OG GLU 258.A OE1 no hydrogen 3.063 N/A SER 284.A OG GLU 258.A OE2 no hydrogen 2.977 N/A ARG 285.A NE GLU 311.A OE2 no hydrogen 2.878 N/A ARG 285.A NH1 GLU 483.A OE1 no hydrogen 2.821 N/A ARG 285.A NH2 GLU 311.A OE1 no hydrogen 2.855 N/A ARG 285.A NH2 GLU 311.A OE2 no hydrogen 3.481 N/A ARG 286.A N SER 284.A OG no hydrogen 3.024 N/A ARG 286.A NE SER 284.A OG no hydrogen 3.138 N/A ARG 286.A NH1 TYR 295.A OH no hydrogen 2.914 N/A ARG 286.A NH2 GLU 258.A OE2 no hydrogen 2.824 N/A ARG 286.A NH2 TYR 295.A OH no hydrogen 2.957 N/A GLY 288.A N ARG 285.A O no hydrogen 2.852 N/A TRP 289.A N ASP 287.A OD1 no hydrogen 3.026 N/A ASN 290.A N GLU 311.A OE2 no hydrogen 2.925 N/A ASN 290.A ND2 GLN 283.A OE1 no hydrogen 2.945 N/A ASN 290.A ND2 VAL 312.A O no hydrogen 2.990 N/A HIS 291.A N SER 284.A O no hydrogen 2.933 N/A HIS 291.A ND1 THR 306.A OG1 no hydrogen 2.819 N/A HIS 291.A NE2 GLY 308.A O no hydrogen 2.896 N/A LEU 292.A N THR 306.A OG1 no hydrogen 2.866 N/A TYR 293.A N TRP 282.A O no hydrogen 2.853 N/A LEU 294.A N ARG 303.A O no hydrogen 2.869 N/A TYR 295.A N PHE 280.A O no hydrogen 2.976 N/A ASP 296.A N ARG 300.A O no hydrogen 3.058 N/A THR 297.A N ASN 278.A O no hydrogen 3.003 N/A THR 298.A N ASP 296.A OD1 no hydrogen 2.838 N/A THR 298.A OG1 ASP 296.A OD1 no hydrogen 2.614 N/A GLY 299.A N ASP 296.A O no hydrogen 2.882 N/A ARG 300.A N ASP 296.A OD1 no hydrogen 3.307 N/A ARG 300.A N THR 298.A OG1 no hydrogen 3.321 N/A ILE 302.A N LEU 294.A O no hydrogen 2.708 N/A ARG 303.A N LEU 294.A O no hydrogen 3.360 N/A ARG 303.A NH1 ILE 344.A O no hydrogen 2.993 N/A GLN 304.A NE2 ASP 287.A OD2 no hydrogen 3.055 N/A GLN 304.A NE2 THR 306.A O no hydrogen 2.889 N/A VAL 305.A N LEU 292.A O no hydrogen 2.738 N/A THR 306.A N LEU 292.A O no hydrogen 3.438 N/A THR 306.A OG1 HIS 291.A ND1 no hydrogen 2.819 N/A GLU 311.A N THR 330.A OG1 no hydrogen 2.861 N/A VAL 312.A N ASN 290.A O no hydrogen 2.838 N/A THR 313.A N GLU 328.A O no hydrogen 2.789 N/A THR 313.A OG1 GLU 328.A OE2 no hydrogen 2.572 N/A ASN 314.A N GLU 328.A O no hydrogen 3.313 N/A ALA 316.A N TYR 326.A O no hydrogen 2.882 N/A GLY 317.A N TYR 326.A O no hydrogen 3.238 N/A GLY 322.A N ASP 319.A O no hydrogen 2.947 N/A THR 323.A N ASP 319.A OD1 no hydrogen 2.675 N/A THR 323.A OG1 ASP 319.A OD2 no hydrogen 2.624 N/A ARG 324.A N ASP 319.A OD1 no hydrogen 3.059 N/A LEU 325.A N ILE 342.A O no hydrogen 2.832 N/A TYR 326.A N GLY 317.A O no hydrogen 2.788 N/A PHE 327.A N TYR 340.A O no hydrogen 3.095 N/A GLU 328.A N ASN 314.A O no hydrogen 2.798 N/A SER 329.A N HIS 338.A O no hydrogen 2.993 N/A THR 330.A N GLU 311.A O no hydrogen 3.059 N/A THR 330.A OG1 GLU 311.A O no hydrogen 3.507 N/A GLU 331.A N SER 329.A OG no hydrogen 3.088 N/A LEU 335.A N SER 333.A OG no hydrogen 2.982 N/A GLU 336.A N SER 333.A O no hydrogen 2.980 N/A ARG 337.A N GLY 357.A O no hydrogen 3.226 N/A ARG 337.A NH1 PRO 334.A O no hydrogen 2.918 N/A ARG 337.A NH1 GLU 336.A O no hydrogen 2.757 N/A ARG 337.A NH2 GLN 447.A OE1 no hydrogen 2.753 N/A HIS 338.A N SER 329.A O no hydrogen 3.299 N/A HIS 338.A ND1 ASP 351.A OD2 no hydrogen 2.636 N/A HIS 338.A NE2 GLU 336.A OE1 no hydrogen 2.738 N/A PHE 339.A N THR 353.A OG1 no hydrogen 2.897 N/A TYR 340.A N PHE 327.A O no hydrogen 2.716 N/A CYS 341.A N LYS 350.A O no hydrogen 2.915 N/A ILE 342.A N LEU 325.A O no hydrogen 3.012 N/A ILE 344.A N THR 323.A O no hydrogen 2.855 N/A LYS 345.A N ASP 343.A OD1 no hydrogen 2.699 N/A GLY 346.A N ASP 343.A O no hydrogen 2.737 N/A THR 349.A OG1 GLU 331.A OE1 no hydrogen 2.604 N/A THR 349.A OG1 GLU 331.A OE2 no hydrogen 3.323 N/A LYS 350.A N CYS 341.A O no hydrogen 2.812 N/A LEU 352.A N PHE 339.A O no hydrogen 2.729 N/A THR 353.A N ASP 351.A OD1 no hydrogen 2.776 N/A SER 356.A OG GLU 336.A OE1 no hydrogen 3.359 N/A SER 356.A OG GLU 336.A OE2 no hydrogen 2.854 N/A GLY 357.A N GLU 336.A OE1 no hydrogen 3.087 N/A MET 358.A N GLN 375.A O no hydrogen 2.931 N/A HIS 359.A N ARG 337.A O no hydrogen 2.949 N/A HIS 359.A ND1 ASP 372.A OD2 no hydrogen 2.623 N/A HIS 359.A NE2 GLU 355.A O no hydrogen 2.713 N/A ARG 360.A N ILE 373.A O no hydrogen 2.841 N/A THR 361.A OG1 ASP 372.A OD1 no hydrogen 2.662 N/A GLN 362.A N ILE 371.A O no hydrogen 2.767 N/A GLN 362.A NE2 LEU 4.A O no hydrogen 3.055 N/A SER 364.A N ALA 369.A O no hydrogen 2.742 N/A SER 364.A OG ASP 366.A OD1 no hydrogen 2.826 N/A SER 364.A OG ALA 369.A O no hydrogen 3.208 N/A GLY 367.A N SER 364.A O no hydrogen 2.781 N/A SER 368.A N SER 364.A OG no hydrogen 3.076 N/A SER 368.A N ASP 366.A OD1 no hydrogen 2.859 N/A SER 368.A OG ASP 366.A OD1 no hydrogen 2.811 N/A ALA 369.A N SER 364.A OG no hydrogen 3.031 N/A ILE 370.A N THR 386.A O no hydrogen 2.979 N/A ILE 371.A N GLN 362.A O no hydrogen 2.916 N/A ASP 372.A N THR 384.A O no hydrogen 2.864 N/A ILE 373.A N ARG 360.A O no hydrogen 2.865 N/A PHE 374.A N LYS 382.A O no hydrogen 2.820 N/A GLN 375.A N MET 358.A O no hydrogen 3.045 N/A SER 376.A N VAL 379.A O no hydrogen 2.780 N/A SER 376.A OG THR 378.A OG1 no hydrogen 3.227 N/A THR 378.A N SER 376.A OG no hydrogen 3.261 N/A THR 378.A OG1 SER 376.A OG no hydrogen 3.227 N/A VAL 379.A N SER 376.A O no hydrogen 3.122 N/A VAL 379.A N SER 376.A OG no hydrogen 2.931 N/A ARG 381.A NE PRO 380.A O no hydrogen 3.433 N/A LYS 382.A N PHE 374.A O no hydrogen 2.828 N/A VAL 383.A N LEU 396.A O no hydrogen 2.913 N/A THR 384.A N ASP 372.A O no hydrogen 2.832 N/A VAL 385.A N HIS 393.A O no hydrogen 2.908 N/A THR 386.A N ILE 370.A O no hydrogen 2.928 N/A ASN 387.A N GLY 391.A O no hydrogen 3.223 N/A ILE 388.A N SER 368.A O no hydrogen 3.044 N/A HIS 393.A N VAL 385.A O no hydrogen 3.069 N/A LEU 395.A N VAL 383.A O no hydrogen 2.730 N/A LEU 396.A N VAL 383.A O no hydrogen 3.401 N/A ALA 398.A N ARG 381.A O no hydrogen 2.780 N/A ARG 405.A N LEU 422.A O no hydrogen 2.753 N/A ARG 405.A NE GLU 403.A OE2 no hydrogen 2.920 N/A GLY 407.A N TYR 420.A O no hydrogen 3.277 N/A ILE 409.A N LEU 418.A O no hydrogen 2.869 N/A ALA 411.A N THR 416.A O no hydrogen 2.785 N/A ALA 412.A N ASP 497.A OD1 no hydrogen 2.915 N/A GLY 414.A N ALA 411.A O no hydrogen 2.915 N/A GLN 415.A N ASP 413.A OD1 no hydrogen 2.811 N/A THR 416.A N ASP 413.A OD1 no hydrogen 2.786 N/A THR 416.A OG1 ASP 413.A OD1 no hydrogen 3.514 N/A THR 416.A OG1 ASP 413.A OD2 no hydrogen 2.583 N/A LEU 418.A N ILE 409.A O no hydrogen 2.713 N/A TYR 420.A N GLY 407.A O no hydrogen 2.943 N/A LYS 421.A N THR 469.A O no hydrogen 2.868 N/A LYS 421.A NZ LEU 448.A O no hydrogen 2.615 N/A LEU 422.A N ARG 405.A O no hydrogen 2.754 N/A THR 423.A N VAL 467.A O no hydrogen 2.792 N/A THR 423.A OG1 ASP 457.A OD2 no hydrogen 2.783 N/A MET 424.A N GLU 403.A O no hydrogen 2.731 N/A LEU 426.A N ALA 461.A O no hydrogen 2.852 N/A PHE 428.A N PRO 425.A O no hydrogen 3.089 N/A ASP 429.A N TYR 434.A OH no hydrogen 2.793 N/A ALA 431.A N ASP 429.A OD1 no hydrogen 3.039 N/A LYS 432.A N ASP 429.A O no hydrogen 2.850 N/A LYS 433.A NZ SER 509.A O no hydrogen 3.184 N/A LYS 433.A NZ VAL 511.A O no hydrogen 2.921 N/A TYR 434.A N TRP 510.A O no hydrogen 2.805 N/A VAL 436.A N ARG 515.A O no hydrogen 3.106 N/A ILE 437.A N ALA 466.A O no hydrogen 2.788 N/A VAL 438.A N GLY 517.A O no hydrogen 2.807 N/A TYR 439.A N PHE 468.A O no hydrogen 2.893 N/A VAL 440.A N HIS 519.A O no hydrogen 2.867 N/A HIS 445.A NE2 GLU 265.A OE2 no hydrogen 2.658 N/A GLN 447.A NE2 PRO 334.A O no hydrogen 2.856 N/A LEU 448.A N ASP 471.A OD1 no hydrogen 2.775 N/A VAL 449.A N ASP 471.A OD2 no hydrogen 2.778 N/A LYS 451.A N LEU 335.A O no hydrogen 2.768 N/A LYS 451.A NZ SER 356.A OG no hydrogen 2.948 N/A THR 452.A OG1 GLN 375.A OE1 no hydrogen 2.642 N/A TRP 453.A N GLN 375.A OE1 no hydrogen 2.920 N/A TYR 459.A N GLY 455.A O no hydrogen 3.257 N/A TYR 459.A OH GLU 641.A OE1 no hydrogen 2.696 N/A MET 460.A N TRP 456.A O no hydrogen 2.882 N/A ALA 461.A N ASP 457.A O no hydrogen 2.846 N/A GLN 462.A N ILE 458.A O no hydrogen 2.884 N/A LYS 463.A N TYR 459.A O no hydrogen 3.199 N/A LYS 463.A N MET 460.A O no hydrogen 2.925 N/A GLY 464.A N ALA 461.A O no hydrogen 3.049 N/A TYR 465.A N MET 460.A O no hydrogen 3.157 N/A TYR 465.A OH LEU 651.A OXT no hydrogen 2.746 N/A ALA 466.A N PRO 435.A O no hydrogen 3.116 N/A VAL 467.A N THR 423.A O no hydrogen 2.967 N/A PHE 468.A N ILE 437.A O no hydrogen 2.977 N/A THR 469.A N LYS 421.A O no hydrogen 2.883 N/A THR 469.A OG1 TYR 439.A O no hydrogen 2.892 N/A ASP 471.A N TYR 419.A O no hydrogen 3.196 N/A ARG 473.A N ASP 497.A OD2 no hydrogen 2.932 N/A ARG 473.A NE ASP 497.A OD1 no hydrogen 3.440 N/A ARG 473.A NE ASP 497.A OD2 no hydrogen 2.758 N/A ARG 473.A NH2 ASP 497.A OD1 no hydrogen 2.801 N/A GLY 474.A N PHE 482.A O no hydrogen 2.971 N/A SER 475.A N SER 472.A O no hydrogen 3.176 N/A SER 475.A OG SER 472.A O no hydrogen 2.644 N/A ALA 476.A N ALA 446.A O no hydrogen 3.002 N/A ASN 477.A ND2 GLN 447.A OE1 no hydrogen 2.971 N/A ARG 478.A NH1 PRO 417.A O no hydrogen 2.970 N/A ARG 478.A NH2 PRO 417.A O no hydrogen 2.820 N/A GLY 479.A N GLU 311.A OE1 no hydrogen 2.918 N/A ALA 480.A N GLY 288.A O no hydrogen 2.806 N/A GLU 483.A N GLY 479.A O no hydrogen 3.375 N/A GLN 484.A N ALA 480.A O no hydrogen 2.669 N/A GLN 484.A NE2 ASP 260.A OD2 no hydrogen 3.161 N/A GLN 484.A NE2 TYR 263.A O no hydrogen 3.577 N/A ILE 486.A N GLU 483.A O no hydrogen 3.327 N/A HIS 487.A N GLN 484.A O no hydrogen 2.915 N/A HIS 487.A NE2 ASP 564.A OD1 no hydrogen 2.981 N/A ARG 488.A N TYR 562.A O no hydrogen 2.793 N/A ARG 488.A NH1 ASP 564.A OD2 no hydrogen 2.870 N/A ARG 488.A NH1 GLU 568.A O no hydrogen 3.213 N/A ARG 488.A NH2 GLU 568.A O no hydrogen 2.954 N/A ARG 489.A N ILE 486.A O no hydrogen 2.810 N/A ARG 489.A NE VAL 485.A O no hydrogen 3.407 N/A ARG 489.A NH2 VAL 485.A O no hydrogen 3.050 N/A ARG 489.A NH2 THR 493.A OG1 no hydrogen 2.273 N/A GLY 491.A N GLU 494.A OE2 no hydrogen 2.781 N/A GLN 492.A N ARG 489.A O no hydrogen 3.075 N/A GLU 494.A N GLU 494.A OE1 no hydrogen 2.718 N/A MET 495.A N GLY 491.A O no hydrogen 2.925 N/A ALA 496.A N GLN 492.A O no hydrogen 3.148 N/A ASP 497.A N THR 493.A O no hydrogen 2.857 N/A GLN 498.A N GLU 494.A O no hydrogen 2.926 N/A GLN 498.A NE2 VAL 470.A O no hydrogen 2.969 N/A GLN 498.A NE2 SER 472.A OG no hydrogen 2.800 N/A MET 499.A N MET 495.A O no hydrogen 2.802 N/A CYS 500.A N ALA 496.A O no hydrogen 3.241 N/A CYS 500.A SG ALA 496.A O no hydrogen 3.601 N/A GLY 501.A N ASP 497.A O no hydrogen 3.184 N/A VAL 502.A N GLN 498.A O no hydrogen 3.050 N/A ASP 503.A N MET 499.A O no hydrogen 2.837 N/A PHE 504.A N CYS 500.A O no hydrogen 3.000 N/A LEU 505.A N GLY 501.A O no hydrogen 2.886 N/A LYS 506.A N VAL 502.A O no hydrogen 2.821 N/A SER 507.A N ASP 503.A O no hydrogen 3.145 N/A SER 507.A N PHE 504.A O no hydrogen 3.167 N/A SER 507.A OG PHE 504.A O no hydrogen 2.705 N/A SER 507.A OG GLN 508.A OE1 no hydrogen 3.259 N/A GLN 508.A N LEU 505.A O no hydrogen 2.929 N/A VAL 511.A N GLN 508.A O no hydrogen 3.237 N/A ASP 512.A N TYR 434.A O no hydrogen 2.864 N/A ASP 514.A N ASP 512.A OD1 no hydrogen 3.011 N/A ARG 515.A N ASP 512.A O no hydrogen 2.879 N/A ARG 515.A NE LEU 651.A O no hydrogen 2.785 N/A ARG 515.A NH2 LEU 651.A O no hydrogen 3.548 N/A ARG 515.A NH2 LEU 651.A OXT no hydrogen 2.828 N/A GLY 517.A N VAL 436.A O no hydrogen 2.817 N/A VAL 518.A N VAL 541.A O no hydrogen 2.969 N/A HIS 519.A N VAL 438.A O no hydrogen 2.888 N/A HIS 519.A ND1 VAL 543.A O no hydrogen 2.790 N/A GLY 520.A N VAL 543.A O no hydrogen 3.346 N/A TRP 521.A NE1 HIS 629.A O no hydrogen 2.887 N/A SER 522.A N GLY 545.A O no hydrogen 2.822 N/A SER 522.A OG HIS 629.A NE2 no hydrogen 2.711 N/A TYR 523.A OH GLU 494.A OE2 no hydrogen 2.477 N/A GLY 524.A N TRP 521.A O no hydrogen 2.870 N/A GLY 525.A N SER 522.A O no hydrogen 2.830 N/A PHE 526.A N SER 522.A O no hydrogen 2.938 N/A MET 527.A N TYR 523.A O no hydrogen 2.866 N/A THR 528.A N GLY 524.A O no hydrogen 2.871 N/A THR 528.A OG1 GLY 524.A O no hydrogen 2.724 N/A THR 529.A N GLY 525.A O no hydrogen 3.101 N/A THR 529.A OG1 GLY 525.A O no hydrogen 2.970 N/A ASN 530.A N PHE 526.A O no hydrogen 2.867 N/A LEU 531.A N MET 527.A O no hydrogen 2.819 N/A MET 532.A N THR 528.A O no hydrogen 3.024 N/A LEU 533.A N THR 529.A O no hydrogen 2.980 N/A THR 534.A N ASN 530.A O no hydrogen 2.772 N/A THR 534.A OG1 ASN 530.A O no hydrogen 2.692 N/A THR 534.A OG1 ASN 530.A OD1 no hydrogen 3.036 N/A HIS 535.A N LEU 531.A O no hydrogen 2.762 N/A VAL 538.A N HIS 535.A O no hydrogen 2.919 N/A PHE 539.A N HIS 535.A O no hydrogen 3.149 N/A LYS 540.A N ILE 516.A O no hydrogen 3.014 N/A LYS 540.A NZ ASP 537.A O no hydrogen 3.011 N/A GLY 542.A N ARG 588.A O no hydrogen 2.844 N/A VAL 543.A N VAL 518.A O no hydrogen 3.077 N/A ALA 544.A N MET 590.A O no hydrogen 2.804 N/A GLY 545.A N GLY 520.A O no hydrogen 3.112 N/A GLY 546.A N ILE 592.A O no hydrogen 2.779 N/A ILE 549.A N HIS 604.A ND1 no hydrogen 3.109 N/A ASP 550.A N HIS 604.A ND1 no hydrogen 3.381 N/A ASN 552.A N ASP 550.A OD1 no hydrogen 2.985 N/A ARG 553.A N ASP 550.A O no hydrogen 2.896 N/A ARG 553.A NH1 ASP 550.A OD2 no hydrogen 2.816 N/A TYR 554.A N TRP 551.A O no hydrogen 3.147 N/A ILE 556.A N PRO 181.A O no hydrogen 2.866 N/A GLY 559.A N ALA 555.A O no hydrogen 2.919 N/A GLU 560.A N ILE 556.A O no hydrogen 3.088 N/A ARG 561.A N TYR 558.A O no hydrogen 3.183 N/A ARG 561.A NH1 GLU 134.A OE1 no hydrogen 2.735 N/A ARG 561.A NH1 TYR 562.A OH no hydrogen 3.058 N/A ARG 561.A NH2 GLU 134.A OE1 no hydrogen 2.736 N/A ARG 561.A NH2 GLN 236.A OE1 no hydrogen 3.360 N/A PHE 563.A N GLY 559.A O no hydrogen 2.849 N/A ALA 565.A N GLU 568.A OE1 no hydrogen 2.840 N/A GLN 567.A N GLN 567.A OE1 no hydrogen 2.747 N/A GLN 567.A NE2 GLY 184.A O no hydrogen 2.945 N/A GLU 568.A N ALA 565.A O no hydrogen 2.933 N/A ASN 569.A N PRO 566.A O no hydrogen 3.277 N/A ASN 569.A ND2 ARG 488.A O no hydrogen 2.966 N/A ASN 569.A ND2 PHE 563.A O no hydrogen 2.763 N/A GLY 572.A N ASN 569.A OD1 no hydrogen 3.120 N/A TYR 573.A N ASN 569.A O no hydrogen 3.083 N/A TYR 573.A OH ASP 564.A O no hydrogen 2.635 N/A ASP 574.A N PRO 570.A O no hydrogen 2.875 N/A ALA 575.A N GLU 571.A O no hydrogen 3.058 N/A ALA 576.A N GLY 572.A O no hydrogen 3.237 N/A ALA 576.A N TYR 573.A O no hydrogen 3.113 N/A ASN 577.A N ASP 574.A O no hydrogen 3.245 N/A LEU 578.A N ILE 549.A O no hydrogen 2.871 N/A LEU 579.A N ASN 577.A OD1 no hydrogen 3.033 N/A LYS 580.A N ASN 577.A O no hydrogen 3.090 N/A ARG 581.A N LEU 578.A O no hydrogen 3.144 N/A ARG 581.A NH1 ASN 530.A OD1 no hydrogen 3.428 N/A ARG 581.A NH1 THR 534.A OG1 no hydrogen 3.126 N/A ARG 581.A NH2 ASN 530.A OD1 no hydrogen 2.912 N/A ARG 581.A NH2 ALA 575.A O no hydrogen 2.825 N/A ASP 584.A N ARG 581.A O no hydrogen 2.879 N/A LEU 585.A N ALA 582.A O no hydrogen 3.214 N/A LYS 586.A NZ ASP 537.A OD1 no hydrogen 2.769 N/A ARG 588.A N LYS 540.A O no hydrogen 3.116 N/A ARG 588.A NH2 ASP 620.A OD2 no hydrogen 2.823 N/A MET 590.A N GLY 542.A O no hydrogen 3.056 N/A LEU 591.A N ASP 620.A O no hydrogen 3.016 N/A ILE 592.A N ALA 544.A O no hydrogen 2.975 N/A HIS 593.A N TYR 622.A O no hydrogen 3.149 N/A HIS 593.A ND1 SER 605.A OG no hydrogen 2.718 N/A HIS 593.A NE2 VAL 600.A O no hydrogen 2.792 N/A ALA 595.A N TYR 624.A O no hydrogen 2.994 N/A ILE 596.A N HIS 627.A O no hydrogen 3.214 N/A ASP 597.A N GLY 594.A O no hydrogen 3.125 N/A VAL 599.A N ASP 597.A OD1 no hydrogen 2.817 N/A VAL 600.A N ASP 597.A OD1 no hydrogen 2.875 N/A HIS 604.A N VAL 601.A O no hydrogen 2.924 N/A SER 605.A N TRP 602.A O no hydrogen 3.059 N/A SER 605.A OG HIS 593.A ND1 no hydrogen 2.718 N/A SER 605.A OG TRP 602.A O no hydrogen 3.409 N/A SER 605.A OG TYR 621.A OH no hydrogen 2.711 N/A LEU 606.A N TRP 602.A O no hydrogen 3.185 N/A LEU 607.A N GLN 603.A O no hydrogen 2.830 N/A PHE 608.A N HIS 604.A O no hydrogen 3.174 N/A LEU 609.A N SER 605.A O no hydrogen 3.047 N/A ASP 610.A N LEU 606.A O no hydrogen 2.940 N/A ALA 611.A N LEU 607.A O no hydrogen 2.787 N/A CYS 612.A N PHE 608.A O no hydrogen 2.927 N/A CYS 612.A SG PHE 608.A O no hydrogen 3.426 N/A CYS 612.A SG THR 617.A OG1 no hydrogen 3.278 N/A VAL 613.A N LEU 609.A O no hydrogen 2.982 N/A LYS 614.A N ASP 610.A O no hydrogen 3.233 N/A ALA 615.A N ALA 611.A O no hydrogen 2.845 N/A ARG 616.A N VAL 613.A O no hydrogen 3.185 N/A THR 617.A N CYS 612.A O no hydrogen 2.749 N/A THR 617.A OG1 ALA 582.A O no hydrogen 2.859 N/A ASP 620.A N LEU 589.A O no hydrogen 2.757 N/A TYR 621.A OH SER 605.A OG no hydrogen 2.711 N/A TYR 622.A N LEU 591.A O no hydrogen 2.981 N/A TYR 624.A N HIS 593.A O no hydrogen 2.931 N/A TYR 624.A OH HIS 638.A ND1 no hydrogen 2.794 N/A SER 626.A OG HIS 169.A NE2 no hydrogen 2.682 N/A HIS 627.A N TYR 624.A O no hydrogen 3.134 N/A HIS 627.A NE2 ASP 635.A OD2 no hydrogen 2.738 N/A HIS 629.A ND1 ASP 597.A OD2 no hydrogen 2.624 N/A HIS 629.A NE2 SER 522.A OG no hydrogen 2.711 N/A ARG 636.A N GLY 633.A O no hydrogen 2.908 N/A ARG 636.A NE TYR 640.A OH no hydrogen 3.343 N/A ARG 636.A NH1 VAL 631.A O no hydrogen 2.815 N/A ARG 636.A NH2 TYR 640.A OH no hydrogen 3.501 N/A VAL 637.A N PRO 634.A O no hydrogen 3.025 N/A HIS 638.A ND1 TYR 624.A OH no hydrogen 2.794 N/A LEU 639.A N ASP 635.A O no hydrogen 3.070 N/A TYR 640.A N ARG 636.A O no hydrogen 2.924 N/A TYR 640.A OH GLY 454.A O no hydrogen 3.322 N/A GLU 641.A N VAL 637.A O no hydrogen 2.996 N/A THR 642.A N HIS 638.A O no hydrogen 2.885 N/A THR 642.A OG1 HIS 638.A O no hydrogen 2.964 N/A ILE 643.A N LEU 639.A O no hydrogen 2.916 N/A THR 644.A N TYR 640.A O no hydrogen 2.841 N/A THR 644.A OG1 TYR 640.A O no hydrogen 2.907 N/A ARG 645.A N GLU 641.A O no hydrogen 2.974 N/A TYR 646.A N THR 642.A O no hydrogen 3.182 N/A TYR 646.A OH ASP 620.A OD2 no hydrogen 2.687 N/A PHE 647.A N ILE 643.A O no hydrogen 3.305 N/A THR 648.A N THR 644.A O no hydrogen 2.873 N/A THR 648.A OG1 THR 644.A O no hydrogen 3.530 N/A THR 648.A OG1 ARG 645.A O no hydrogen 3.364 N/A ASP 649.A N ARG 645.A O no hydrogen 2.754 N/A HIS 650.A N TYR 646.A O no hydrogen 3.038 N/A LEU 651.A N PHE 647.A O no hydrogen 2.936 N/A