Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 8jal_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): TYR 7.A OH ASP 35.A OD2 no hydrogen 2.400 N/A ASN 8.A N THR 5.A OG1 no hydrogen 3.330 N/A THR 9.A N THR 5.A O no hydrogen 2.846 N/A THR 9.A OG1 THR 5.A O no hydrogen 3.335 N/A ALA 10.A N LEU 6.A O no hydrogen 2.915 N/A ILE 11.A N TYR 7.A O no hydrogen 2.867 N/A SER 12.A N ASN 8.A O no hydrogen 2.915 N/A SER 12.A OG ASN 8.A O no hydrogen 3.196 N/A ALA 13.A N THR 9.A O no hydrogen 2.933 N/A VAL 14.A N ALA 10.A O no hydrogen 2.864 N/A VAL 15.A N ILE 11.A O no hydrogen 3.132 N/A ASP 16.A N SER 12.A O no hydrogen 3.106 N/A ASN 17.A N ALA 13.A O no hydrogen 2.992 N/A SER 21.A N TYR 18.A O no hydrogen 2.858 N/A SER 21.A OG ASN 17.A O no hydrogen 3.036 N/A SER 21.A OG TYR 18.A O no hydrogen 3.506 N/A ARG 22.A N ILE 19.A O no hydrogen 3.454 N/A ASP 24.A N SER 21.A O no hydrogen 3.186 N/A ILE 25.A N SER 21.A O no hydrogen 3.004 N/A ARG 26.A NE GLU 52.A OE2 no hydrogen 3.539 N/A ARG 26.A NH2 GLU 52.A OE1 no hydrogen 2.485 N/A ARG 26.A NH2 GLU 55.A OE2 no hydrogen 3.323 N/A SER 27.A N ASP 24.A O no hydrogen 3.178 N/A SER 27.A OG ASP 24.A O no hydrogen 2.666 N/A LEU 28.A N ILE 25.A O no hydrogen 2.980 N/A GLU 30.A N GLU 30.A OE1 no hydrogen 2.649 N/A GLN 33.A N PRO 29.A O no hydrogen 2.866 N/A PHE 34.A N GLU 30.A O no hydrogen 2.935 N/A ASP 35.A N ASN 31.A O no hydrogen 2.929 N/A VAL 36.A N ILE 32.A O no hydrogen 2.892 N/A TYR 37.A N GLN 33.A O no hydrogen 2.974 N/A TYR 37.A OH GLU 52.A OE2 no hydrogen 2.860 N/A TYR 38.A N PHE 34.A O no hydrogen 2.840 N/A LYS 39.A N ASP 35.A O no hydrogen 2.886 N/A LYS 39.A NZ GLN 43.A OE1 no hydrogen 2.809 N/A LEU 40.A N VAL 36.A O no hydrogen 2.932 N/A TYR 41.A N TYR 37.A O no hydrogen 2.953 N/A TYR 41.A OH HIS 74.A NE2 no hydrogen 2.708 N/A GLN 42.A N TYR 38.A O no hydrogen 2.871 N/A GLN 43.A N LYS 39.A O no hydrogen 3.002 N/A GLY 44.A N TYR 41.A O no hydrogen 3.109 N/A ARG 45.A NH1 VAL 15.A O no hydrogen 2.561 N/A LEU 46.A N GLY 44.A O no hydrogen 2.785 N/A CYS 47.A SG HIS 82.A NE2 no hydrogen 3.354 N/A LEU 49.A N ARG 45.A O no hydrogen 3.147 N/A GLY 50.A N LEU 46.A O no hydrogen 2.878 N/A SER 51.A N CYS 47.A O no hydrogen 2.905 N/A SER 51.A OG CYS 47.A O no hydrogen 2.969 N/A GLU 52.A N GLN 48.A O no hydrogen 2.958 N/A PHE 53.A N LEU 49.A O no hydrogen 2.879 N/A CYS 54.A N GLY 50.A O no hydrogen 3.090 N/A CYS 54.A SG GLY 50.A O no hydrogen 3.141 N/A GLU 55.A N GLU 52.A O no hydrogen 3.330 N/A PHE 59.A N GLU 55.A O no hydrogen 2.929 N/A ALA 60.A N LEU 56.A O no hydrogen 2.832 N/A LYS 61.A NZ ARG 26.A O no hydrogen 2.881 N/A LYS 61.A NZ GLN 33.A OE1 no hydrogen 2.787 N/A VAL 62.A N VAL 58.A O no hydrogen 3.250 N/A LEU 63.A N PHE 59.A O no hydrogen 2.920 N/A ALA 65.A N VAL 62.A O no hydrogen 3.324 N/A LYS 68.A NZ ASP 67.A OD1 no hydrogen 2.807 N/A ARG 69.A N LEU 66.A O no hydrogen 2.925 N/A ARG 69.A NH2 LEU 63.A O no hydrogen 2.738 N/A LEU 71.A N LYS 68.A O no hydrogen 2.939 N/A LEU 72.A N LYS 68.A O no hydrogen 3.208 N/A HIS 73.A N ARG 69.A O no hydrogen 2.903 N/A CYS 75.A N LEU 71.A O no hydrogen 2.823 N/A CYS 75.A SG LEU 71.A O no hydrogen 3.587 N/A PHE 76.A N LEU 72.A O no hydrogen 2.770 N/A GLN 77.A N HIS 73.A O no hydrogen 3.372 N/A GLN 77.A NE2 ASP 81.A OD1 no hydrogen 2.630 N/A GLN 77.A NE2 GLY 317.A O no hydrogen 3.043 N/A ALA 78.A N HIS 74.A O no hydrogen 3.076 N/A LEU 79.A N CYS 75.A O no hydrogen 3.085 N/A MET 80.A N PHE 76.A O no hydrogen 2.901 N/A ASP 81.A N GLN 77.A O no hydrogen 2.726 N/A HIS 82.A N LEU 79.A O no hydrogen 2.934 N/A VAL 84.A N LEU 79.A O no hydrogen 3.329 N/A LYS 85.A NZ GLY 83.A O no hydrogen 3.527 N/A SER 88.A OG ASP 131.A OD1 no hydrogen 3.449 N/A SER 88.A OG ASP 131.A OD2 no hydrogen 3.306 N/A VAL 89.A N LYS 85.A O no hydrogen 3.199 N/A LEU 90.A N VAL 86.A O no hydrogen 2.894 N/A ALA 91.A N ALA 87.A O no hydrogen 2.921 N/A TYR 92.A N SER 88.A O no hydrogen 2.918 N/A SER 93.A N VAL 89.A O no hydrogen 2.856 N/A SER 93.A OG VAL 89.A O no hydrogen 2.858 N/A PHE 94.A N LEU 90.A O no hydrogen 2.911 N/A SER 95.A N ALA 91.A O no hydrogen 2.925 N/A SER 95.A OG ALA 91.A O no hydrogen 3.390 N/A SER 95.A OG TYR 92.A O no hydrogen 2.599 N/A ARG 96.A N TYR 92.A O no hydrogen 2.917 N/A ARG 97.A N SER 93.A O no hydrogen 2.889 N/A CYS 98.A N PHE 94.A O no hydrogen 2.924 N/A CYS 98.A SG PHE 94.A O no hydrogen 3.304 N/A SER 99.A N SER 95.A O no hydrogen 2.910 N/A SER 99.A OG SER 95.A O no hydrogen 2.804 N/A TYR 100.A N ARG 96.A O no hydrogen 2.916 N/A ILE 101.A N ARG 97.A O no hydrogen 2.945 N/A SER 104.A OG GLU 103.A O no hydrogen 2.816 N/A VAL 108.A N ASP 105.A O no hydrogen 3.375 N/A LYS 109.A N ASP 105.A O no hydrogen 3.113 N/A LYS 109.A NZ ALA 102.A O no hydrogen 3.085 N/A GLU 110.A N ALA 106.A O no hydrogen 2.969 N/A ALA 112.A N VAL 108.A O no hydrogen 3.280 N/A ILE 113.A N LYS 109.A O no hydrogen 3.200 N/A GLN 114.A N GLU 110.A O no hydrogen 3.040 N/A VAL 115.A N LYS 111.A O no hydrogen 2.917 N/A GLY 116.A N ALA 112.A O no hydrogen 2.538 N/A PHE 117.A N ILE 113.A O no hydrogen 2.501 N/A VAL 118.A N GLN 114.A O no hydrogen 3.248 N/A LEU 119.A N VAL 115.A O no hydrogen 3.095 N/A GLY 120.A N GLY 116.A O no hydrogen 2.875 N/A GLY 121.A N PHE 117.A O no hydrogen 2.862 N/A PHE 122.A N VAL 118.A O no hydrogen 2.895 N/A LEU 123.A N LEU 119.A O no hydrogen 2.943 N/A SER 124.A N GLY 120.A O no hydrogen 2.873 N/A ASP 125.A N GLY 121.A O no hydrogen 2.872 N/A ALA 126.A N PHE 122.A O no hydrogen 2.734 N/A GLY 127.A N SER 124.A O no hydrogen 3.253 N/A TRP 128.A N LEU 123.A O no hydrogen 2.757 N/A TYR 129.A OH HIS 321.A NE2 no hydrogen 2.599 N/A ASP 131.A N TRP 128.A O no hydrogen 3.103 N/A ALA 132.A N TRP 128.A O no hydrogen 2.605 N/A GLU 133.A N TYR 129.A O no hydrogen 3.037 N/A PHE 136.A N ALA 132.A O no hydrogen 3.167 N/A LEU 137.A N GLU 133.A O no hydrogen 2.863 N/A SER 138.A N LYS 134.A O no hydrogen 2.929 N/A SER 138.A OG LYS 134.A O no hydrogen 3.043 N/A CYS 139.A N VAL 135.A O no hydrogen 2.960 N/A CYS 139.A SG VAL 135.A O no hydrogen 3.229 N/A LEU 140.A N PHE 136.A O no hydrogen 2.850 N/A GLN 141.A N LEU 137.A O no hydrogen 2.892 N/A LEU 142.A N SER 138.A O no hydrogen 2.971 N/A CYS 143.A N CYS 139.A O no hydrogen 2.955 N/A CYS 143.A SG CYS 139.A O no hydrogen 3.128 N/A THR 144.A N GLN 141.A O no hydrogen 2.847 N/A THR 144.A OG1 LEU 140.A O no hydrogen 2.319 N/A THR 144.A OG1 TYR 185.A OH no hydrogen 3.371 N/A LEU 145.A N GLN 141.A O no hydrogen 2.983 N/A TRP 152.A N GLU 148.A O no hydrogen 2.860 N/A PHE 153.A N MET 149.A O no hydrogen 2.954 N/A ARG 154.A N LEU 150.A O no hydrogen 2.943 N/A ARG 154.A NH1 GLU 110.A OE2 no hydrogen 3.560 N/A ALA 155.A N HIS 151.A O no hydrogen 2.836 N/A VAL 156.A N TRP 152.A O no hydrogen 2.911 N/A GLU 157.A N PHE 153.A O no hydrogen 2.948 N/A CYS 158.A N ARG 154.A O no hydrogen 2.852 N/A CYS 158.A SG PHE 136.A O no hydrogen 3.053 N/A CYS 159.A N ALA 155.A O no hydrogen 2.869 N/A VAL 160.A N VAL 156.A O no hydrogen 2.930 N/A ARG 161.A N GLU 157.A O no hydrogen 2.950 N/A ARG 161.A NH2 GLU 157.A OE1 no hydrogen 3.471 N/A LEU 162.A N CYS 158.A O no hydrogen 2.848 N/A LEU 163.A N CYS 159.A O no hydrogen 2.977 N/A HIS 164.A N VAL 160.A O no hydrogen 3.363 N/A VAL 165.A N ARG 161.A O no hydrogen 3.307 N/A ARG 166.A N LEU 162.A O no hydrogen 3.161 N/A ARG 166.A NE GLU 133.A OE2 no hydrogen 2.622 N/A ARG 166.A NH1 THR 178.A OG1 no hydrogen 2.357 N/A ARG 166.A NH2 GLU 133.A OE2 no hydrogen 3.066 N/A ASN 167.A N HIS 164.A O no hydrogen 3.272 N/A ASN 167.A ND2 GLU 204.A O no hydrogen 2.922 N/A GLY 168.A N HIS 164.A O no hydrogen 3.252 N/A CYS 170.A N ASN 167.A O no hydrogen 3.174 N/A CYS 170.A SG TYR 172.A OH no hydrogen 2.652 N/A LYS 171.A N ARG 166.A O no hydrogen 3.065 N/A LYS 171.A NZ GLU 133.A OE1 no hydrogen 2.382 N/A GLY 175.A N LYS 171.A O no hydrogen 3.173 N/A GLU 176.A N TYR 172.A O no hydrogen 2.951 N/A THR 178.A N LEU 174.A O no hydrogen 2.899 N/A THR 178.A OG1 LEU 174.A O no hydrogen 2.743 N/A PHE 179.A N GLY 175.A O no hydrogen 2.932 N/A LYS 180.A N GLU 176.A O no hydrogen 2.930 N/A LEU 181.A N GLU 177.A O no hydrogen 2.911 N/A ALA 182.A N THR 178.A O no hydrogen 2.909 N/A GLN 183.A N PHE 179.A O no hydrogen 2.872 N/A THR 184.A N LYS 180.A O no hydrogen 2.908 N/A THR 184.A OG1 LYS 180.A O no hydrogen 3.267 N/A TYR 185.A N LEU 181.A O no hydrogen 2.984 N/A MET 186.A N ALA 182.A O no hydrogen 2.924 N/A ASP 187.A N GLN 183.A O no hydrogen 2.869 N/A LYS 188.A N THR 184.A O no hydrogen 2.947 N/A LEU 189.A N TYR 185.A O no hydrogen 2.887 N/A SER 190.A N MET 186.A O no hydrogen 2.878 N/A LYS 191.A N ASP 187.A O no hydrogen 2.925 N/A HIS 192.A N LEU 189.A O no hydrogen 3.214 N/A GLY 193.A N SER 190.A O no hydrogen 3.162 N/A GLN 194.A N LEU 189.A O no hydrogen 3.302 N/A GLN 195.A N GLN 194.A OE1 no hydrogen 3.268 N/A ASN 197.A ND2 GLU 228.A O no hydrogen 3.207 N/A LYS 198.A NZ GLU 228.A OE1 no hydrogen 3.429 N/A LYS 198.A NZ GLU 228.A OE2 no hydrogen 3.229 N/A TYR 202.A N LYS 198.A O no hydrogen 3.026 N/A TYR 202.A OH GLN 183.A OE1 no hydrogen 3.379 N/A GLY 203.A N ALA 199.A O no hydrogen 2.887 N/A GLU 204.A N ALA 200.A O no hydrogen 2.933 N/A LEU 205.A N LEU 201.A O no hydrogen 2.913 N/A CYS 206.A N TYR 202.A O no hydrogen 2.855 N/A CYS 206.A SG ALA 218.A O no hydrogen 3.347 N/A CYS 206.A SG GLN 244.A O no hydrogen 3.597 N/A ALA 207.A N GLY 203.A O no hydrogen 2.951 N/A LEU 208.A N GLU 204.A O no hydrogen 2.870 N/A LEU 209.A N LEU 205.A O no hydrogen 2.894 N/A PHE 210.A N CYS 206.A O no hydrogen 2.853 N/A ALA 211.A N ALA 207.A O no hydrogen 2.933 N/A LYS 212.A N LEU 208.A O no hydrogen 3.093 N/A LYS 212.A NZ GLU 176.A OE1 no hydrogen 2.971 N/A SER 213.A N PHE 210.A O no hydrogen 3.169 N/A SER 213.A OG ASN 418.A OD1 no hydrogen 3.067 N/A HIS 214.A N LEU 209.A O no hydrogen 2.762 N/A ALA 218.A N HIS 214.A O no hydrogen 2.817 N/A TYR 219.A N TYR 215.A O no hydrogen 2.883 N/A LYS 220.A N ASP 216.A O no hydrogen 2.973 N/A TRP 221.A N GLU 217.A O no hydrogen 2.877 N/A CYS 222.A N ALA 218.A O no hydrogen 2.878 N/A CYS 222.A SG ALA 218.A O no hydrogen 3.424 N/A CYS 222.A SG TYR 219.A O no hydrogen 3.086 N/A ILE 223.A N TYR 219.A O no hydrogen 3.007 N/A GLU 224.A N LYS 220.A O no hydrogen 2.966 N/A ALA 225.A N TRP 221.A O no hydrogen 2.854 N/A MET 226.A N CYS 222.A O no hydrogen 2.869 N/A LYS 227.A N ILE 223.A O no hydrogen 2.932 N/A GLU 228.A N ALA 225.A O no hydrogen 3.141 N/A VAL 238.A N PRO 234.A O no hydrogen 3.278 N/A VAL 239.A N VAL 235.A O no hydrogen 2.894 N/A ASP 240.A N LYS 236.A O no hydrogen 2.913 N/A VAL 241.A N VAL 237.A O no hydrogen 2.953 N/A LEU 242.A N VAL 238.A O no hydrogen 2.901 N/A ARG 243.A N VAL 239.A O no hydrogen 2.901 N/A ARG 243.A NE ASP 286.A OD2 no hydrogen 2.413 N/A GLN 244.A N ASP 240.A O no hydrogen 2.971 N/A ALA 245.A N VAL 241.A O no hydrogen 2.880 N/A SER 246.A N LEU 242.A O no hydrogen 2.894 N/A SER 246.A OG ALA 258.A O no hydrogen 3.171 N/A LYS 247.A N ARG 243.A O no hydrogen 2.944 N/A LYS 247.A NZ ASP 286.A OD1 no hydrogen 2.921 N/A ALA 248.A N GLN 244.A O no hydrogen 2.937 N/A CYS 249.A N ALA 245.A O no hydrogen 2.878 N/A CYS 249.A SG ALA 245.A O no hydrogen 3.369 N/A VAL 250.A N SER 246.A O no hydrogen 2.882 N/A VAL 251.A N LYS 247.A O no hydrogen 2.996 N/A LYS 252.A N ALA 248.A O no hydrogen 2.883 N/A LYS 252.A NZ ASP 216.A OD1 no hydrogen 2.362 N/A ARG 253.A N VAL 250.A O no hydrogen 3.067 N/A ARG 253.A NH1 ASP 460.A OD1 no hydrogen 2.356 N/A GLU 254.A N CYS 249.A O no hydrogen 2.760 N/A LYS 257.A NZ GLU 254.A OE1 no hydrogen 2.700 N/A GLU 259.A N PHE 255.A O no hydrogen 3.351 N/A LEU 261.A N LYS 257.A O no hydrogen 3.017 N/A ILE 262.A N ALA 258.A O no hydrogen 2.891 N/A LYS 263.A N GLU 259.A O no hydrogen 2.943 N/A HIS 264.A N GLN 260.A O no hydrogen 2.899 N/A ALA 265.A N LEU 261.A O no hydrogen 2.964 N/A VAL 266.A N ILE 262.A O no hydrogen 2.884 N/A TYR 267.A N LYS 263.A O no hydrogen 2.932 N/A LEU 268.A N HIS 264.A O no hydrogen 2.872 N/A ALA 269.A N ALA 265.A O no hydrogen 2.955 N/A ARG 270.A N VAL 266.A O no hydrogen 2.891 N/A ASP 271.A N TYR 267.A O no hydrogen 2.879 N/A HIS 272.A N LEU 268.A O no hydrogen 2.945 N/A PHE 273.A N ALA 269.A O no hydrogen 2.963 N/A GLY 274.A N ALA 269.A O no hydrogen 3.112 N/A LYS 279.A N HIS 277.A ND1 no hydrogen 3.252 N/A LYS 279.A NZ ASP 240.A OD1 no hydrogen 2.400 N/A LYS 279.A NZ ASP 240.A OD2 no hydrogen 3.341 N/A SER 281.A N HIS 277.A O no hydrogen 2.922 N/A SER 281.A OG PRO 278.A O no hydrogen 2.342 N/A ASP 282.A N PRO 278.A O no hydrogen 2.928 N/A THR 283.A N LYS 279.A O no hydrogen 2.946 N/A THR 283.A OG1 TYR 280.A O no hydrogen 2.440 N/A LEU 284.A N TYR 280.A O no hydrogen 2.893 N/A LEU 285.A N SER 281.A O no hydrogen 2.873 N/A ASP 286.A N ASP 282.A O no hydrogen 2.971 N/A TYR 287.A N THR 283.A O no hydrogen 2.834 N/A GLY 288.A N LEU 284.A O no hydrogen 2.859 N/A PHE 289.A N LEU 285.A O no hydrogen 2.952 N/A TYR 290.A N ASP 286.A O no hydrogen 2.926 N/A TYR 290.A OH PHE 255.A O no hydrogen 3.386 N/A LEU 291.A N TYR 287.A O no hydrogen 2.873 N/A LEU 292.A N GLY 288.A O no hydrogen 2.852 N/A ASN 293.A N PHE 289.A O no hydrogen 3.003 N/A VAL 294.A N TYR 290.A O no hydrogen 2.963 N/A CYS 298.A SG HIS 336.A NE2 no hydrogen 3.520 N/A GLN 299.A NE2 GLN 299.A O no hydrogen 3.005 N/A SER 300.A N ILE 297.A O no hydrogen 2.899 N/A SER 300.A OG GLY 288.A O no hydrogen 2.831 N/A ILE 303.A N SER 300.A O no hydrogen 2.920 N/A TYR 304.A N SER 300.A O no hydrogen 2.937 N/A GLN 305.A N VAL 301.A O no hydrogen 3.011 N/A GLN 305.A NE2 GLN 305.A O no hydrogen 3.646 N/A GLN 305.A NE2 ASP 309.A OD1 no hydrogen 2.680 N/A GLN 305.A NE2 ASP 309.A OD2 no hydrogen 3.537 N/A ALA 307.A N ILE 303.A O no hydrogen 2.794 N/A LEU 308.A N TYR 304.A O no hydrogen 2.589 N/A ASP 309.A N GLN 305.A O no hydrogen 2.945 N/A ILE 310.A N ALA 306.A O no hydrogen 3.375 N/A ARG 311.A N ALA 307.A O no hydrogen 3.126 N/A ARG 311.A NE SER 281.A OG no hydrogen 3.398 N/A ARG 311.A NH2 ASP 282.A OD1 no hydrogen 2.362 N/A GLN 312.A N LEU 308.A O no hydrogen 2.706 N/A SER 313.A N ASP 309.A O no hydrogen 3.158 N/A SER 313.A N ILE 310.A O no hydrogen 3.269 N/A SER 313.A OG ASP 309.A O no hydrogen 3.168 N/A SER 313.A OG ILE 310.A O no hydrogen 3.020 N/A VAL 314.A N ILE 310.A O no hydrogen 2.942 N/A PHE 315.A N ARG 311.A O no hydrogen 3.341 N/A ASN 319.A ND2 ALA 126.A O no hydrogen 3.097 N/A HIS 321.A NE2 TYR 129.A OH no hydrogen 2.599 N/A ALA 323.A N ASN 319.A O no hydrogen 2.953 N/A THR 324.A N ILE 320.A O no hydrogen 2.886 N/A THR 324.A OG1 ILE 320.A O no hydrogen 3.011 N/A THR 324.A OG1 HIS 321.A O no hydrogen 2.898 N/A ALA 325.A N HIS 321.A O no hydrogen 3.470 N/A HIS 326.A N VAL 322.A O no hydrogen 3.045 N/A HIS 326.A ND1 HIS 349.A ND1 no hydrogen 3.086 N/A GLU 327.A N ALA 323.A O no hydrogen 2.879 N/A ASP 328.A N THR 324.A O no hydrogen 2.924 N/A LEU 329.A N ALA 325.A O no hydrogen 2.905 N/A ALA 330.A N HIS 326.A O no hydrogen 2.875 N/A TYR 331.A N GLU 327.A O no hydrogen 3.215 N/A SER 332.A N ASP 328.A O no hydrogen 3.069 N/A SER 333.A N LEU 329.A O no hydrogen 2.854 N/A SER 333.A OG LEU 329.A O no hydrogen 2.962 N/A TYR 334.A N ALA 330.A O no hydrogen 3.022 N/A VAL 335.A N TYR 331.A O no hydrogen 2.718 N/A HIS 336.A N SER 332.A O no hydrogen 2.528 N/A GLN 337.A N SER 333.A O no hydrogen 2.977 N/A TYR 338.A N VAL 335.A O no hydrogen 3.444 N/A GLY 341.A N GLN 337.A O no hydrogen 2.796 N/A ASP 344.A N LYS 342.A O no hydrogen 2.789 N/A PHE 348.A N ASP 344.A O no hydrogen 3.398 N/A HIS 349.A N ASN 345.A O no hydrogen 3.280 N/A HIS 349.A ND1 HIS 326.A ND1 no hydrogen 3.086 N/A ALA 350.A N ALA 346.A O no hydrogen 3.046 N/A GLU 351.A N LEU 347.A O no hydrogen 2.885 N/A ARG 352.A N PHE 348.A O no hydrogen 3.062 N/A ALA 353.A N HIS 349.A O no hydrogen 3.197 N/A ILE 354.A N ALA 350.A O no hydrogen 3.248 N/A GLY 355.A N GLU 351.A O no hydrogen 2.919 N/A ILE 356.A N ARG 352.A O no hydrogen 3.173 N/A ILE 356.A N ALA 353.A O no hydrogen 3.242 N/A ILE 357.A N ALA 353.A O no hydrogen 2.910 N/A THR 358.A N ILE 354.A O no hydrogen 2.902 N/A THR 358.A OG1 ILE 354.A O no hydrogen 2.413 N/A HIS 359.A N ILE 356.A O no hydrogen 2.884 N/A ILE 360.A N ILE 356.A O no hydrogen 3.152 N/A LEU 361.A N ILE 357.A O no hydrogen 2.888 N/A HIS 365.A N PRO 362.A O no hydrogen 3.248 N/A HIS 365.A NE2 ASN 169.A O no hydrogen 2.590 N/A HIS 365.A NE2 ASN 169.A OD1 no hydrogen 2.832 N/A LEU 367.A N HIS 365.A ND1 no hydrogen 3.261 N/A LEU 368.A N HIS 365.A O no hydrogen 3.247 N/A ALA 369.A N LEU 366.A O no hydrogen 2.838 N/A SER 370.A OG GLU 327.A OE1 no hydrogen 3.184 N/A SER 370.A OG GLU 327.A OE2 no hydrogen 3.269 N/A SER 370.A OG LEU 367.A O no hydrogen 3.197 N/A SER 371.A N LEU 367.A O no hydrogen 3.250 N/A SER 371.A N LEU 368.A O no hydrogen 3.247 N/A SER 371.A OG LEU 367.A O no hydrogen 3.335 N/A SER 371.A OG LEU 368.A O no hydrogen 3.090 N/A LYS 372.A N LEU 368.A O no hydrogen 2.669 N/A LYS 372.A NZ SER 405.A OG no hydrogen 2.933 N/A ARG 373.A N ALA 369.A O no hydrogen 3.395 N/A LYS 375.A N SER 371.A O no hydrogen 3.347 N/A ALA 376.A N LYS 372.A O no hydrogen 3.006 N/A LEU 377.A N ARG 373.A O no hydrogen 2.893 N/A ILE 378.A N VAL 374.A O no hydrogen 2.948 N/A LEU 379.A N LYS 375.A O no hydrogen 2.856 N/A GLU 380.A N ALA 376.A O no hydrogen 2.978 N/A GLU 381.A N LEU 377.A O no hydrogen 3.207 N/A ILE 382.A N ILE 378.A O no hydrogen 2.906 N/A ALA 383.A N LEU 379.A O no hydrogen 3.108 N/A ILE 384.A N GLU 380.A O no hydrogen 3.422 N/A ASP 385.A N ILE 382.A O no hydrogen 3.008 N/A CYS 386.A N ILE 382.A O no hydrogen 3.350 N/A CYS 386.A SG ILE 382.A O no hydrogen 3.866 N/A CYS 386.A SG ALA 383.A O no hydrogen 3.281 N/A GLU 390.A N GLU 390.A OE1 no hydrogen 2.813 N/A GLU 392.A N ASN 388.A O no hydrogen 2.872 N/A GLN 393.A N LYS 389.A O no hydrogen 2.909 N/A ARG 394.A N THR 391.A O no hydrogen 3.250 N/A LEU 395.A N THR 391.A O no hydrogen 2.897 N/A LEU 396.A N GLU 392.A O no hydrogen 2.910 N/A GLU 398.A N ARG 394.A O no hydrogen 2.921 N/A ALA 399.A N LEU 395.A O no hydrogen 2.883 N/A HIS 400.A N LEU 396.A O no hydrogen 2.837 N/A HIS 400.A NE2 TYR 432.A OH no hydrogen 2.464 N/A ASP 401.A N GLN 397.A O no hydrogen 2.964 N/A LEU 402.A N GLU 398.A O no hydrogen 2.939 N/A HIS 403.A N ALA 399.A O no hydrogen 2.867 N/A HIS 403.A ND1 ALA 399.A O no hydrogen 2.524 N/A LEU 404.A N HIS 400.A O no hydrogen 2.923 N/A SER 405.A N ASP 401.A O no hydrogen 2.934 N/A SER 406.A N LEU 402.A O no hydrogen 2.918 N/A SER 406.A OG ALA 369.A O no hydrogen 3.420 N/A SER 406.A OG LEU 402.A O no hydrogen 2.725 N/A LEU 407.A N HIS 403.A O no hydrogen 2.840 N/A GLN 408.A N LEU 404.A O no hydrogen 2.875 N/A LEU 409.A N SER 405.A O no hydrogen 2.979 N/A ALA 410.A N SER 406.A O no hydrogen 2.914 N/A LYS 411.A N LEU 407.A O no hydrogen 2.859 N/A LYS 411.A NZ TYR 425.A OH no hydrogen 2.794 N/A LYS 412.A N GLN 408.A O no hydrogen 2.893 N/A ALA 413.A N LEU 409.A O no hydrogen 2.964 N/A PHE 414.A N ALA 410.A O no hydrogen 2.870 N/A GLY 415.A N LYS 411.A O no hydrogen 3.234 N/A ASN 418.A ND2 LYS 212.A O no hydrogen 3.059 N/A GLN 420.A N ASN 418.A OD1 no hydrogen 2.923 N/A ALA 422.A N ASN 418.A O no hydrogen 3.128 N/A LYS 423.A N VAL 419.A O no hydrogen 2.883 N/A LYS 423.A NZ GLN 420.A OE1 no hydrogen 3.176 N/A HIS 424.A N GLN 420.A O no hydrogen 2.987 N/A TYR 425.A N THR 421.A O no hydrogen 2.904 N/A TYR 425.A OH GLU 416.A OE2 no hydrogen 3.386 N/A GLY 426.A N ALA 422.A O no hydrogen 2.889 N/A ASN 427.A N LYS 423.A O no hydrogen 2.902 N/A LEU 428.A N HIS 424.A O no hydrogen 2.918 N/A GLY 429.A N TYR 425.A O no hydrogen 2.866 N/A ARG 430.A N GLY 426.A O no hydrogen 2.956 N/A ARG 430.A NH2 TYR 338.A OH no hydrogen 3.271 N/A ARG 430.A NH2 GLU 381.A OE2 no hydrogen 3.375 N/A LEU 431.A N ASN 427.A O no hydrogen 2.924 N/A TYR 432.A N LEU 428.A O no hydrogen 2.834 N/A TYR 432.A OH HIS 400.A NE2 no hydrogen 2.464 N/A GLN 433.A N GLY 429.A O no hydrogen 2.922 N/A SER 434.A N ARG 430.A O no hydrogen 2.958 N/A SER 434.A OG GLU 380.A OE2 no hydrogen 3.237 N/A MET 435.A N TYR 432.A O no hydrogen 3.202 N/A ARG 436.A N GLN 433.A O no hydrogen 3.325 N/A LYS 437.A N TYR 432.A O no hydrogen 3.031 N/A LYS 439.A NZ GLU 443.A OE2 no hydrogen 3.294 N/A GLU 442.A N PHE 438.A O no hydrogen 2.930 N/A GLU 443.A N LYS 439.A O no hydrogen 2.898 N/A MET 444.A N GLU 440.A O no hydrogen 2.936 N/A HIS 445.A N ALA 441.A O no hydrogen 2.911 N/A ILE 446.A N GLU 442.A O no hydrogen 2.887 N/A LYS 447.A N GLU 443.A O no hydrogen 2.949 N/A ALA 448.A N MET 444.A O no hydrogen 2.913 N/A ILE 449.A N HIS 445.A O no hydrogen 2.883 N/A GLN 450.A N ILE 446.A O no hydrogen 2.890 N/A ILE 451.A N LYS 447.A O no hydrogen 2.977 N/A LYS 452.A N ALA 448.A O no hydrogen 2.876 N/A LYS 452.A NZ GLU 462.A O no hydrogen 2.947 N/A LYS 452.A NZ SER 466.A OG no hydrogen 2.363 N/A GLU 453.A N ILE 449.A O no hydrogen 2.892 N/A TYR 461.A N ASP 460.A OD1 no hydrogen 2.480 N/A ALA 464.A N ASP 460.A O no hydrogen 3.118 N/A LEU 465.A N TYR 461.A O no hydrogen 2.943 N/A SER 466.A N GLU 462.A O no hydrogen 2.974 N/A SER 466.A OG GLU 462.A O no hydrogen 3.398 N/A VAL 467.A N VAL 463.A O no hydrogen 2.856 N/A GLY 468.A N ALA 464.A O no hydrogen 2.907 N/A HIS 469.A N LEU 465.A O no hydrogen 2.966 N/A LEU 470.A N SER 466.A O no hydrogen 2.917 N/A ALA 471.A N VAL 467.A O no hydrogen 2.848 N/A SER 472.A N GLY 468.A O no hydrogen 2.922 N/A SER 472.A OG GLY 468.A O no hydrogen 3.481 N/A SER 472.A OG TYR 488.A OH no hydrogen 2.843 N/A LEU 473.A N HIS 469.A O no hydrogen 2.923 N/A TYR 474.A N LEU 470.A O no hydrogen 2.907 N/A ASN 475.A N ALA 471.A O no hydrogen 2.869 N/A TYR 476.A N SER 472.A O no hydrogen 2.934 N/A MET 478.A N LEU 473.A O no hydrogen 2.932 N/A GLN 480.A N TYR 474.A O no hydrogen 2.897 N/A TYR 481.A OH SER 519.A OG no hydrogen 3.093 N/A ASN 483.A N GLN 480.A O no hydrogen 3.088 N/A ALA 484.A N GLN 480.A O no hydrogen 3.122 N/A GLU 485.A N TYR 481.A O no hydrogen 2.914 N/A LEU 487.A N ASN 483.A O no hydrogen 2.953 N/A TYR 488.A N ALA 484.A O no hydrogen 2.874 N/A TYR 488.A OH SER 472.A OG no hydrogen 2.843 N/A LEU 489.A N GLU 485.A O no hydrogen 2.953 N/A ARG 490.A N LYS 486.A O no hydrogen 2.905 N/A ARG 490.A NH2 GLU 453.A OE2 no hydrogen 2.679 N/A SER 491.A N LEU 487.A O no hydrogen 2.914 N/A SER 491.A OG ASP 509.A OD2 no hydrogen 2.546 N/A ILE 492.A N TYR 488.A O no hydrogen 2.918 N/A ALA 493.A N LEU 489.A O no hydrogen 2.893 N/A ILE 494.A N ARG 490.A O no hydrogen 2.947 N/A GLY 495.A N SER 491.A O no hydrogen 2.929 N/A LYS 496.A N ILE 492.A O no hydrogen 2.870 N/A LYS 496.A NZ TYR 510.A OH no hydrogen 2.908 N/A LYS 497.A N ALA 493.A O no hydrogen 2.921 N/A LEU 498.A N ILE 494.A O no hydrogen 2.940 N/A PHE 499.A N GLY 495.A O no hydrogen 2.956 N/A GLY 500.A N GLY 495.A O no hydrogen 3.207 N/A SER 504.A N ASP 295.A OD2 no hydrogen 2.679 N/A SER 504.A OG ASP 295.A OD1 no hydrogen 2.498 N/A SER 504.A OG ASP 295.A OD2 no hydrogen 2.994 N/A LEU 506.A N TYR 503.A O no hydrogen 3.371 N/A ASP 509.A N LEU 506.A O no hydrogen 3.284 N/A TYR 510.A N LEU 506.A O no hydrogen 2.860 N/A ARG 511.A N GLU 507.A O no hydrogen 2.947 N/A LEU 513.A N ASP 509.A O no hydrogen 2.923 N/A ILE 514.A N TYR 510.A O no hydrogen 2.888 N/A LYS 515.A N ARG 511.A O no hydrogen 2.916 N/A LEU 516.A N GLY 512.A O no hydrogen 2.907 N/A TYR 517.A N LEU 513.A O no hydrogen 2.910 N/A ASN 518.A N ILE 514.A O no hydrogen 2.853 N/A SER 519.A N LYS 515.A O no hydrogen 2.984 N/A SER 519.A N LEU 516.A O no hydrogen 3.121 N/A SER 519.A OG TYR 481.A OH no hydrogen 3.093 N/A GLY 521.A N TYR 517.A O no hydrogen 2.972 N/A ASN 522.A ND2 GLU 524.A OE2 no hydrogen 3.471 N/A TYR 523.A OH ASN 518.A O no hydrogen 3.356 N/A GLU 524.A N GLU 524.A OE1 no hydrogen 2.805 N/A LYS 525.A N ASN 522.A O no hydrogen 2.993 N/A LYS 525.A NZ GLU 528.A OE2 no hydrogen 3.359 N/A PHE 527.A N TYR 523.A O no hydrogen 2.964 N/A GLU 528.A N GLU 524.A O no hydrogen 3.478 N/A TYR 529.A N LYS 525.A O no hydrogen 2.893 N/A HIS 530.A N VAL 526.A O no hydrogen 2.908 N/A HIS 530.A ND1 VAL 526.A O no hydrogen 2.742 N/A ASN 531.A N PHE 527.A O no hydrogen 2.967 N/A VAL 532.A N GLU 528.A O no hydrogen 2.847 N/A LEU 533.A N TYR 529.A O no hydrogen 2.851 N/A SER 534.A N HIS 530.A O no hydrogen 2.916 N/A ASN 535.A N ASN 531.A O no hydrogen 2.913 N/A TRP 536.A N VAL 532.A O no hydrogen 2.818 N/A TRP 536.A NE1 TYR 503.A O no hydrogen 2.704 N/A ASN 537.A N LEU 533.A O no hydrogen 2.896 N/A ARG 538.A N SER 534.A O no hydrogen 2.920 N/A LEU 539.A N ASN 535.A O no hydrogen 2.883 N/A ARG 540.A N TRP 536.A O no hydrogen 2.861 N/A ASP 541.A N ASN 537.A O no hydrogen 2.913 N/A ARG 542.A N LEU 539.A O no hydrogen 3.144 N/A GLN 543.A N LEU 539.A O no hydrogen 2.899 N/A SER 545.A N ARG 542.A O no hydrogen 3.360 N/A SER 545.A OG ARG 542.A O no hydrogen 2.830 N/A THR 547.A OG1 GLN 299.A OE1 no hydrogen 3.477 N/A THR 547.A OG1 ASP 552.A OD1 no hydrogen 2.928 N/A GLU 551.A N ASP 548.A O no hydrogen 2.787 N/A ASP 552.A N ASP 548.A O no hydrogen 2.794 N/A VAL 553.A N ALA 549.A O no hydrogen 2.928 N/A SER 554.A OG VAL 553.A O no hydrogen 2.600 N/A SER 556.A OG THR 555.A O no hydrogen 2.642 N/A SER 556.A OG SER 556.A O no hydrogen 2.525 N/A SER 559.A N GLU 562.A OE1 no hydrogen 3.123 N/A SER 559.A OG GLU 561.A OE1 no hydrogen 2.971 N/A GLU 561.A N GLU 561.A OE1 no hydrogen 2.635 N/A VAL 563.A N SER 559.A O no hydrogen 3.379 N/A GLN 565.A N GLU 561.A O no hydrogen 2.902 N/A SER 566.A N GLU 562.A O no hydrogen 2.894 N/A PHE 567.A N VAL 563.A O no hydrogen 2.919 N/A LEU 568.A N VAL 564.A O no hydrogen 2.896 N/A ILE 569.A N GLN 565.A O no hydrogen 2.919 N/A SER 570.A OG SER 566.A O no hydrogen 3.360 N/A SER 570.A OG PHE 567.A O no hydrogen 3.105 N/A GLN 571.A N LEU 568.A O no hydrogen 3.149 N/A