Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3bjf_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLN 3.A N PRO 25.A O no hydrogen 2.701 N/A GLN 4.A N SER 24.A OG no hydrogen 2.732 N/A GLN 4.A NE2 ASP 21.A O no hydrogen 2.932 N/A LEU 5.A N THR 2.A O no hydrogen 3.054 N/A HIS 6.A N GLN 1.A OE1 no hydrogen 2.728 N/A ALA 8.A N GLN 4.A O no hydrogen 2.920 N/A MET 9.A N LEU 5.A O no hydrogen 3.186 N/A MET 9.A N HIS 6.A O no hydrogen 3.007 N/A ALA 10.A N ALA 7.A O no hydrogen 3.103 N/A GLU 15.A N THR 12.A OG1 no hydrogen 3.050 N/A HIS 16.A N THR 12.A O no hydrogen 3.061 N/A HIS 16.A ND1 ALA 7.A O no hydrogen 2.658 N/A HIS 16.A NE2 ALA 375.A O no hydrogen 2.826 N/A MET 17.A N PHE 13.A O no hydrogen 2.914 N/A CYS 18.A N LEU 14.A O no hydrogen 2.914 N/A CYS 18.A SG LEU 14.A O no hydrogen 3.307 N/A ARG 19.A N GLU 15.A O no hydrogen 2.916 N/A ARG 19.A N HIS 16.A O no hydrogen 3.051 N/A ARG 19.A NE GLU 15.A OE2 no hydrogen 2.889 N/A ARG 19.A NH1 HIS 6.A O no hydrogen 3.032 N/A LEU 20.A N MET 17.A O no hydrogen 2.977 N/A ASP 21.A N GLN 4.A OE1 no hydrogen 2.871 N/A ASP 23.A N ASP 21.A OD1 no hydrogen 2.643 N/A SER 24.A N ASP 21.A O no hydrogen 2.852 N/A SER 24.A OG GLN 1.A O no hydrogen 3.327 N/A THR 28.A OG1 GLY 488.A O no hydrogen 2.863 N/A ARG 30.A NE ASN 366.A OD1 no hydrogen 2.823 N/A ARG 30.A NH1 THR 32.A O no hydrogen 2.738 N/A ARG 30.A NH1 ASN 57.A OD1 no hydrogen 2.936 N/A ARG 30.A NH2 GLY 55.A O no hydrogen 2.952 N/A ASN 31.A N GLU 373.A OE1 no hydrogen 2.542 N/A ASN 31.A ND2 ARG 434.A O no hydrogen 3.687 N/A THR 32.A N GLU 373.A OE2 no hydrogen 2.727 N/A THR 32.A OG1 GLU 373.A OE2 no hydrogen 2.767 N/A GLY 33.A N ASP 344.A O no hydrogen 3.048 N/A ILE 34.A N ASN 57.A OD1 no hydrogen 2.891 N/A ILE 35.A N ILE 346.A O no hydrogen 3.023 N/A CYS 36.A N VAL 58.A O no hydrogen 2.849 N/A THR 37.A N LEU 348.A O no hydrogen 3.022 N/A THR 37.A OG1 LEU 348.A O no hydrogen 2.750 N/A ILE 38.A N ARG 60.A O no hydrogen 2.944 N/A GLY 39.A N SER 42.A OG no hydrogen 3.217 N/A ALA 41.A N ALA 353.A O no hydrogen 2.933 N/A SER 42.A N GLY 39.A O no hydrogen 2.947 N/A SER 42.A OG THR 352.A O no hydrogen 2.756 N/A ARG 43.A NE THR 74.A OG1 no hydrogen 2.797 N/A ARG 43.A NH2 TYR 70.A O no hydrogen 2.741 N/A SER 44.A OG THR 47.A OG1 no hydrogen 2.520 N/A THR 47.A N SER 44.A OG no hydrogen 2.777 N/A THR 47.A OG1 SER 44.A O no hydrogen 2.912 N/A THR 47.A OG1 SER 44.A OG no hydrogen 2.520 N/A LEU 48.A N SER 44.A O no hydrogen 2.771 N/A LYS 49.A N VAL 45.A O no hydrogen 3.033 N/A MET 51.A N THR 47.A O no hydrogen 2.911 N/A ILE 52.A N LEU 48.A O no hydrogen 2.966 N/A LYS 53.A N LYS 49.A O no hydrogen 3.012 N/A SER 54.A N GLU 50.A O no hydrogen 2.720 N/A SER 54.A OG GLU 50.A O no hydrogen 3.091 N/A GLY 55.A N MET 51.A O no hydrogen 3.083 N/A GLY 55.A N ILE 52.A O no hydrogen 3.134 N/A MET 56.A N MET 51.A O no hydrogen 2.988 N/A ASN 57.A N ILE 34.A O no hydrogen 2.949 N/A VAL 58.A N ILE 34.A O no hydrogen 3.205 N/A ALA 59.A N ALA 96.A O no hydrogen 2.816 N/A ARG 60.A N CYS 36.A O no hydrogen 2.677 N/A ARG 60.A NE THR 37.A OG1 no hydrogen 2.900 N/A ARG 60.A NH1 ASP 100.A OD1 no hydrogen 2.509 N/A ARG 60.A NH2 THR 37.A OG1 no hydrogen 2.967 N/A LEU 61.A N ALA 98.A O no hydrogen 2.968 N/A PHE 63.A N ASP 100.A O no hydrogen 2.782 N/A SER 64.A N ASN 62.A OD1 no hydrogen 3.314 N/A SER 64.A OG ASN 62.A OD1 no hydrogen 2.924 N/A HIS 65.A N ASN 62.A O no hydrogen 3.429 N/A HIS 68.A NE2 ASP 215.A OD1 no hydrogen 2.380 N/A TYR 70.A N THR 67.A OG1 no hydrogen 3.122 N/A HIS 71.A N THR 67.A O no hydrogen 2.977 N/A ALA 72.A N HIS 68.A O no hydrogen 2.833 N/A GLU 73.A N GLU 69.A O no hydrogen 3.257 N/A THR 74.A N TYR 70.A O no hydrogen 3.067 N/A THR 74.A OG1 TYR 70.A O no hydrogen 3.374 N/A ILE 75.A N HIS 71.A O no hydrogen 2.807 N/A LYS 76.A N ALA 72.A O no hydrogen 2.995 N/A ASN 77.A N GLU 73.A O no hydrogen 2.865 N/A ASN 77.A ND2 ARG 43.A O no hydrogen 3.021 N/A VAL 78.A N THR 74.A O no hydrogen 2.831 N/A ARG 79.A N ILE 75.A O no hydrogen 2.931 N/A ARG 79.A NH1 ASP 223.A O no hydrogen 3.275 N/A THR 80.A N LYS 76.A O no hydrogen 2.895 N/A THR 80.A OG1 LYS 76.A O no hydrogen 2.881 N/A ALA 81.A N ASN 77.A O no hydrogen 2.915 N/A THR 82.A N VAL 78.A O no hydrogen 2.894 N/A THR 82.A OG1 VAL 78.A O no hydrogen 2.780 N/A GLU 83.A N ARG 79.A O no hydrogen 2.825 N/A SER 84.A N THR 80.A O no hydrogen 3.097 N/A SER 84.A N ALA 81.A O no hydrogen 3.191 N/A SER 84.A OG ALA 81.A O no hydrogen 2.526 N/A PHE 85.A N THR 82.A O no hydrogen 3.276 N/A ALA 86.A N GLU 83.A O no hydrogen 2.887 N/A ASP 88.A N PHE 85.A O no hydrogen 3.501 N/A ILE 90.A N ASP 88.A OD1 no hydrogen 3.174 N/A LEU 91.A N ASP 88.A O no hydrogen 2.976 N/A TYR 92.A N ASP 88.A O no hydrogen 2.861 N/A TYR 92.A OH GLU 83.A OE1 no hydrogen 2.576 N/A ALA 96.A N ASN 57.A O no hydrogen 2.889 N/A VAL 97.A N ASP 225.A OD2 no hydrogen 2.929 N/A ALA 98.A N ALA 59.A O no hydrogen 2.800 N/A LEU 99.A N MET 226.A O no hydrogen 2.952 N/A ASP 100.A N LEU 61.A O no hydrogen 3.029 N/A THR 101.A N PHE 228.A O no hydrogen 3.148 N/A LYS 102.A NZ GLU 105.A OE2 no hydrogen 3.232 N/A GLY 103.A N ASP 212.A OD1 no hydrogen 2.939 N/A GLU 105.A N GLY 103.A O no hydrogen 2.770 N/A ARG 107.A N ASP 147.A OD2 no hydrogen 3.197 N/A ARG 107.A NE LYS 193.A O no hydrogen 2.714 N/A ARG 107.A NH1 GLU 105.A OE2 no hydrogen 2.872 N/A ARG 107.A NH2 LYS 193.A O no hydrogen 2.893 N/A THR 108.A N LYS 194.A O no hydrogen 3.064 N/A THR 108.A OG1 GLY 109.A O no hydrogen 3.524 N/A LEU 110.A N MET 136.A O no hydrogen 2.867 N/A ILE 111.A N SER 192.A OG no hydrogen 2.963 N/A LYS 112.A N CYS 139.A O no hydrogen 2.738 N/A THR 116.A N SER 114.A OG no hydrogen 3.426 N/A VAL 119.A N LEU 190.A O no hydrogen 3.009 N/A LEU 121.A N GLY 188.A O no hydrogen 3.047 N/A LYS 123.A NZ GLU 185.A O no hydrogen 3.015 N/A GLY 124.A N VAL 184.A O no hydrogen 2.748 N/A ALA 125.A N LYS 122.A O no hydrogen 3.304 N/A LEU 127.A N THR 182.A O no hydrogen 2.798 N/A LYS 128.A N ASN 142.A O no hydrogen 3.157 N/A ILE 129.A N LEU 180.A O no hydrogen 2.791 N/A THR 130.A N LEU 144.A O no hydrogen 2.831 N/A LEU 131.A N ASP 178.A O no hydrogen 3.222 N/A TYR 135.A N ASP 132.A O no hydrogen 2.888 N/A MET 136.A N ASN 133.A O no hydrogen 3.224 N/A LYS 138.A N TYR 135.A O no hydrogen 2.738 N/A CYS 139.A N LEU 110.A O no hydrogen 2.789 N/A CYS 139.A SG TYR 135.A O no hydrogen 3.981 N/A CYS 139.A SG TRP 145.A O no hydrogen 3.970 N/A ASP 140.A N ILE 143.A O no hydrogen 2.949 N/A GLU 141.A N GLU 141.A OE2 no hydrogen 2.372 N/A ASN 142.A N ASP 140.A OD1 no hydrogen 2.648 N/A ILE 143.A N ASP 140.A OD1 no hydrogen 2.925 N/A LEU 144.A N LYS 128.A O no hydrogen 2.674 N/A TRP 145.A NE1 LEU 131.A O no hydrogen 3.171 N/A LEU 146.A N THR 130.A O no hydrogen 3.270 N/A ASP 147.A N ARG 107.A O no hydrogen 3.073 N/A TYR 148.A OH ASP 204.A OD1 no hydrogen 2.749 N/A ASN 150.A ND2 ASP 204.A OD1 no hydrogen 3.474 N/A ILE 151.A N TYR 148.A O no hydrogen 3.162 N/A CYS 152.A SG GLY 176.A O no hydrogen 3.418 N/A CYS 152.A SG ALA 177.A O no hydrogen 3.561 N/A CYS 152.A SG PHE 179.A O no hydrogen 3.499 N/A LYS 153.A N ASN 150.A O no hydrogen 2.844 N/A VAL 154.A N ILE 151.A O no hydrogen 3.118 N/A VAL 155.A N ILE 151.A O no hydrogen 3.304 N/A GLU 156.A N SER 159.A OG no hydrogen 3.061 N/A GLY 158.A N VAL 172.A O no hydrogen 2.599 N/A SER 159.A N GLU 156.A O no hydrogen 3.067 N/A SER 159.A OG GLU 156.A O no hydrogen 3.198 N/A ILE 161.A N LEU 170.A O no hydrogen 2.494 N/A TYR 162.A N ASN 197.A O no hydrogen 3.121 N/A VAL 163.A N ILE 168.A O no hydrogen 2.687 N/A ASP 164.A N GLY 195.A O no hydrogen 2.803 N/A LEU 167.A N ASP 164.A O no hydrogen 2.860 N/A ILE 168.A N VAL 163.A O no hydrogen 2.935 N/A SER 169.A OG GLU 185.A OE1 no hydrogen 3.437 N/A SER 169.A OG ASN 186.A OD1 no hydrogen 3.302 N/A LEU 170.A N ILE 161.A O no hydrogen 2.488 N/A GLN 171.A N GLU 183.A O no hydrogen 3.024 N/A GLN 171.A NE2 GLY 158.A O no hydrogen 3.400 N/A VAL 172.A N SER 159.A O no hydrogen 2.820 N/A LYS 173.A N VAL 181.A O no hydrogen 2.804 N/A GLN 174.A N VAL 181.A O no hydrogen 3.107 N/A LYS 175.A NZ VAL 155.A O no hydrogen 3.059 N/A GLY 176.A N PHE 179.A O no hydrogen 2.802 N/A LEU 180.A N ILE 129.A O no hydrogen 2.877 N/A VAL 181.A N GLN 174.A O no hydrogen 3.032 N/A THR 182.A N LEU 127.A O no hydrogen 2.718 N/A THR 182.A OG1 LEU 127.A O no hydrogen 2.813 N/A GLU 183.A N GLN 171.A O no hydrogen 2.871 N/A VAL 184.A N ALA 125.A O no hydrogen 2.862 N/A GLU 185.A N SER 169.A O no hydrogen 2.982 N/A GLY 188.A N LEU 121.A O no hydrogen 2.929 N/A SER 189.A OG GLU 120.A OE1 no hydrogen 3.337 N/A LEU 190.A N VAL 119.A O no hydrogen 2.758 N/A LYS 193.A N GLY 109.A O no hydrogen 2.800 N/A LYS 194.A N THR 108.A OG1 no hydrogen 2.936 N/A VAL 196.A N ILE 106.A O no hydrogen 2.840 N/A ASN 197.A N TYR 162.A O no hydrogen 2.830 N/A ASN 197.A ND2 ASP 283.A OD1 no hydrogen 2.814 N/A ASN 197.A ND2 GLU 287.A OE1 no hydrogen 3.002 N/A ALA 201.A N LEU 198.A O no hydrogen 3.150 N/A ASP 204.A N TYR 148.A OH no hydrogen 3.093 N/A SER 209.A N ASP 212.A OD2 no hydrogen 3.170 N/A LYS 211.A NZ ASP 215.A OD1 no hydrogen 3.364 N/A LYS 211.A NZ ASP 215.A OD2 no hydrogen 2.699 N/A ASP 212.A N SER 209.A OG no hydrogen 3.043 N/A ILE 213.A N SER 209.A O no hydrogen 3.037 N/A GLN 214.A N GLU 210.A O no hydrogen 3.144 N/A GLN 214.A NE2 GLU 210.A OE2 no hydrogen 3.461 N/A ASP 215.A N LYS 211.A O no hydrogen 2.926 N/A LEU 216.A N ASP 212.A O no hydrogen 2.832 N/A LYS 217.A N ILE 213.A O no hydrogen 2.968 N/A PHE 218.A N GLN 214.A O no hydrogen 2.960 N/A GLY 219.A N ASP 215.A O no hydrogen 2.846 N/A VAL 220.A N LEU 216.A O no hydrogen 3.080 N/A GLU 221.A N LYS 217.A O no hydrogen 2.897 N/A GLN 222.A N PHE 218.A O no hydrogen 2.719 N/A ASP 223.A N VAL 220.A O no hydrogen 2.959 N/A VAL 224.A N GLY 219.A O no hydrogen 3.119 N/A ASP 225.A N VAL 97.A O no hydrogen 2.934 N/A MET 226.A N VAL 97.A O no hydrogen 3.431 N/A VAL 227.A N LYS 253.A O no hydrogen 2.815 N/A PHE 228.A N LEU 99.A O no hydrogen 2.688 N/A ALA 229.A N ILE 255.A O no hydrogen 2.936 N/A SER 230.A N THR 101.A OG1 no hydrogen 3.082 N/A SER 230.A OG THR 101.A O no hydrogen 2.695 N/A PHE 231.A N GLU 259.A OE1 no hydrogen 2.855 N/A ILE 232.A N LYS 257.A O no hydrogen 3.264 N/A ARG 233.A N ASP 237.A OD2 no hydrogen 2.873 N/A ARG 233.A NH1 PHE 231.A O no hydrogen 3.095 N/A LYS 234.A N ASP 237.A OD2 no hydrogen 3.227 N/A ALA 235.A N GLU 269.A OE2 no hydrogen 2.955 N/A ASP 237.A N LYS 234.A O no hydrogen 2.914 N/A HIS 239.A N ALA 235.A O no hydrogen 3.006 N/A GLU 240.A N SER 236.A O no hydrogen 2.984 N/A VAL 241.A N ASP 237.A O no hydrogen 3.221 N/A ARG 242.A N VAL 238.A O no hydrogen 2.947 N/A ARG 242.A NH1 ALA 273.A O no hydrogen 3.103 N/A ARG 242.A NH1 ASP 275.A OD1 no hydrogen 3.234 N/A ARG 242.A NH2 ASP 275.A OD1 no hydrogen 2.809 N/A LYS 243.A N HIS 239.A O no hydrogen 2.846 N/A VAL 244.A N GLU 240.A O no hydrogen 2.946 N/A LEU 245.A N VAL 241.A O no hydrogen 2.986 N/A GLY 246.A N ARG 242.A O no hydrogen 2.742 N/A GLY 249.A N LEU 245.A O no hydrogen 3.054 N/A LYS 250.A N GLU 247.A O no hydrogen 3.250 N/A ASN 251.A ND2 GLN 445.A OE1 no hydrogen 3.257 N/A ILE 252.A N GLY 249.A O no hydrogen 2.879 N/A LYS 253.A N ASP 225.A O no hydrogen 3.268 N/A ILE 254.A N ASP 275.A OD1 no hydrogen 2.664 N/A ILE 255.A N VAL 227.A O no hydrogen 2.843 N/A SER 256.A N GLY 276.A O no hydrogen 3.085 N/A SER 256.A OG SER 274.A OG no hydrogen 2.681 N/A LYS 257.A N ALA 229.A O no hydrogen 2.888 N/A LYS 257.A NZ ASP 100.A OD1 no hydrogen 3.092 N/A LYS 257.A NZ ASP 100.A OD2 no hydrogen 2.884 N/A LYS 257.A NZ SER 230.A OG no hydrogen 2.775 N/A ILE 258.A N MET 278.A O no hydrogen 3.071 N/A GLY 263.A N ASN 260.A OD1 no hydrogen 3.317 N/A VAL 264.A N ASN 260.A O no hydrogen 3.339 N/A ARG 265.A N HIS 261.A O no hydrogen 2.947 N/A ARG 265.A NE HIS 261.A O no hydrogen 3.567 N/A ARG 266.A N GLU 262.A O no hydrogen 2.772 N/A ARG 266.A NE GLU 269.A OE2 no hydrogen 3.045 N/A ARG 266.A NH1 GLU 262.A OE1 no hydrogen 3.557 N/A ARG 266.A NH2 GLU 269.A OE1 no hydrogen 3.540 N/A ARG 266.A NH2 GLU 269.A OE2 no hydrogen 2.798 N/A PHE 267.A N VAL 264.A O no hydrogen 3.166 N/A ILE 270.A N ARG 266.A O no hydrogen 3.234 N/A LEU 271.A N PHE 267.A O no hydrogen 2.925 N/A GLU 272.A N ASP 268.A O no hydrogen 3.126 N/A ALA 273.A N GLU 269.A O no hydrogen 3.351 N/A SER 274.A N ILE 270.A O no hydrogen 2.985 N/A SER 274.A N LEU 271.A O no hydrogen 3.119 N/A SER 274.A OG SER 256.A OG no hydrogen 2.681 N/A SER 274.A OG ILE 270.A O no hydrogen 2.643 N/A ASP 275.A N ILE 254.A O no hydrogen 2.856 N/A GLY 276.A N ILE 254.A O no hydrogen 3.260 N/A ILE 277.A N PRO 310.A O no hydrogen 2.845 N/A MET 278.A N SER 256.A O no hydrogen 2.972 N/A VAL 279.A N ILE 312.A O no hydrogen 2.694 N/A ALA 280.A N ILE 258.A O no hydrogen 3.303 N/A ARG 281.A NE GLN 297.A OE1 no hydrogen 3.149 N/A ARG 281.A NH1 THR 315.A O no hydrogen 3.038 N/A ARG 281.A NH1 ASP 334.A OD2 no hydrogen 2.878 N/A ARG 281.A NH2 GLN 297.A OE1 no hydrogen 3.114 N/A ARG 281.A NH2 ASP 334.A OD1 no hydrogen 2.395 N/A ARG 281.A NH2 ASP 334.A OD2 no hydrogen 3.229 N/A LEU 284.A N ALA 280.A O no hydrogen 3.141 N/A GLY 285.A N ARG 281.A O no hydrogen 2.872 N/A ILE 286.A N ASP 283.A O no hydrogen 2.956 N/A GLU 287.A N ASP 283.A O no hydrogen 2.780 N/A ILE 288.A N LEU 284.A O no hydrogen 2.849 N/A GLU 291.A N GLU 291.A OE2 no hydrogen 2.695 N/A LYS 292.A N PRO 289.A O no hydrogen 2.930 N/A VAL 293.A N ALA 290.A O no hydrogen 3.272 N/A LEU 295.A N LYS 292.A O no hydrogen 3.020 N/A ALA 296.A N LYS 292.A O no hydrogen 3.326 N/A GLN 297.A N VAL 293.A O no hydrogen 2.912 N/A GLN 297.A NE2 ASP 341.A OD2 no hydrogen 2.942 N/A LYS 298.A N PHE 294.A O no hydrogen 3.029 N/A LYS 298.A NZ ASP 341.A OD1 no hydrogen 2.662 N/A MET 299.A N LEU 295.A O no hydrogen 2.998 N/A MET 300.A N ALA 296.A O no hydrogen 2.993 N/A ILE 301.A N GLN 297.A O no hydrogen 2.938 N/A GLY 302.A N LYS 298.A O no hydrogen 2.999 N/A ARG 303.A N MET 299.A O no hydrogen 2.931 N/A ARG 303.A NH1 ASP 268.A OD1 no hydrogen 2.900 N/A CYS 304.A N MET 300.A O no hydrogen 2.905 N/A CYS 304.A SG MET 300.A O no hydrogen 3.288 N/A ASN 305.A N ILE 301.A O no hydrogen 2.834 N/A ARG 306.A N GLY 302.A O no hydrogen 2.922 N/A ALA 307.A N ARG 303.A O no hydrogen 3.013 N/A GLY 308.A N ASN 305.A O no hydrogen 3.295 N/A LYS 309.A N CYS 304.A O no hydrogen 3.134 N/A LYS 309.A NZ LEU 271.A O no hydrogen 2.770 N/A LYS 309.A NZ SER 274.A O no hydrogen 2.763 N/A VAL 311.A N ASP 344.A OD1 no hydrogen 2.858 N/A ILE 312.A N ILE 277.A O no hydrogen 2.805 N/A CYS 313.A N CYS 345.A O no hydrogen 2.947 N/A CYS 313.A SG GLN 297.A OE1 no hydrogen 3.565 N/A ALA 314.A N VAL 279.A O no hydrogen 3.191 N/A LEU 318.A N GLU 351.A OE1 no hydrogen 2.910 N/A SER 320.A N GLU 331.A OE2 no hydrogen 2.795 N/A SER 320.A OG GLU 331.A OE1 no hydrogen 2.647 N/A MET 321.A N LEU 318.A O no hydrogen 2.833 N/A ILE 322.A N GLU 319.A O no hydrogen 3.011 N/A LYS 323.A N SER 320.A O no hydrogen 3.050 N/A LYS 323.A NZ ASP 356.A OD2 no hydrogen 3.201 N/A LYS 324.A N SER 320.A O no hydrogen 3.000 N/A LYS 324.A NZ SER 320.A O no hydrogen 3.351 N/A THR 328.A N GLU 331.A OE1 no hydrogen 2.998 N/A GLU 331.A N THR 328.A OG1 no hydrogen 3.197 N/A GLY 332.A N THR 328.A O no hydrogen 3.199 N/A SER 333.A N ARG 329.A O no hydrogen 3.119 N/A ASP 334.A N ALA 330.A O no hydrogen 2.862 N/A VAL 335.A N GLU 331.A O no hydrogen 3.116 N/A ALA 336.A N GLY 332.A O no hydrogen 3.215 N/A ASN 337.A N SER 333.A O no hydrogen 2.887 N/A ASN 337.A ND2 SER 333.A O no hydrogen 2.846 N/A ALA 338.A N ASP 334.A O no hydrogen 2.954 N/A VAL 339.A N VAL 335.A O no hydrogen 3.166 N/A LEU 340.A N ALA 336.A O no hydrogen 2.919 N/A ASP 341.A N ASN 337.A O no hydrogen 2.739 N/A GLY 342.A N ALA 338.A O no hydrogen 3.204 N/A GLY 342.A N VAL 339.A O no hydrogen 2.896 N/A ALA 343.A N ALA 338.A O no hydrogen 3.126 N/A ASP 344.A N VAL 311.A O no hydrogen 2.836 N/A CYS 345.A N VAL 311.A O no hydrogen 3.279 N/A CYS 345.A SG HIS 451.A O no hydrogen 3.300 N/A CYS 345.A SG LEU 452.A O no hydrogen 3.714 N/A ILE 346.A N GLY 33.A O no hydrogen 2.944 N/A LEU 348.A N ILE 35.A O no hydrogen 2.915 N/A SER 349.A N GLU 351.A OE2 no hydrogen 2.812 N/A GLU 351.A N GLU 351.A OE2 no hydrogen 2.804 N/A THR 352.A N SER 349.A O no hydrogen 3.143 N/A THR 352.A OG1 THR 37.A O no hydrogen 2.745 N/A THR 352.A OG1 SER 349.A O no hydrogen 3.421 N/A ALA 353.A N SER 349.A O no hydrogen 2.927 N/A LYS 354.A N GLY 350.A O no hydrogen 3.197 N/A GLY 355.A N GLY 350.A O no hydrogen 2.875 N/A ASP 356.A N ILE 322.A O no hydrogen 2.834 N/A GLU 360.A N GLU 360.A OE1 no hydrogen 2.717 N/A ALA 361.A N TYR 357.A O no hydrogen 3.053 N/A VAL 362.A N PRO 358.A O no hydrogen 3.154 N/A ARG 363.A N LEU 359.A O no hydrogen 3.018 N/A ARG 363.A NE SER 54.A OG no hydrogen 3.133 N/A MET 364.A N GLU 360.A O no hydrogen 2.958 N/A GLN 365.A N ALA 361.A O no hydrogen 3.102 N/A GLN 365.A NE2 MET 347.A O no hydrogen 3.215 N/A ASN 366.A N VAL 362.A O no hydrogen 3.082 N/A LEU 367.A N ARG 363.A O no hydrogen 2.878 N/A ILE 368.A N MET 364.A O no hydrogen 2.872 N/A ALA 369.A N GLN 365.A O no hydrogen 2.887 N/A ARG 370.A N ASN 366.A O no hydrogen 3.241 N/A ARG 370.A NH1 THR 28.A O no hydrogen 3.036 N/A GLU 371.A N LEU 367.A O no hydrogen 3.329 N/A ALA 372.A N ILE 368.A O no hydrogen 2.899 N/A GLU 373.A N ALA 369.A O no hydrogen 2.779 N/A ALA 374.A N ARG 370.A O no hydrogen 3.438 N/A ALA 375.A N ALA 372.A O no hydrogen 2.867 N/A ILE 376.A N GLU 373.A O no hydrogen 3.463 N/A TYR 377.A OH ALA 10.A O no hydrogen 2.624 N/A GLN 380.A N TYR 377.A O no hydrogen 3.215 N/A LEU 381.A N TYR 377.A O no hydrogen 3.161 N/A PHE 382.A N HIS 378.A O no hydrogen 2.867 N/A GLU 384.A N GLN 380.A O no hydrogen 2.766 N/A LEU 385.A N LEU 381.A O no hydrogen 2.770 N/A ARG 386.A N PHE 382.A O no hydrogen 2.996 N/A ARG 387.A N GLU 383.A O no hydrogen 2.905 N/A LEU 388.A N GLU 384.A O no hydrogen 3.010 N/A ALA 389.A N ARG 386.A O no hydrogen 2.938 N/A ASP 394.A N THR 392.A OG1 no hydrogen 3.304 N/A THR 396.A N ASP 394.A OD2 no hydrogen 2.962 N/A THR 396.A OG1 ASP 394.A OD2 no hydrogen 2.479 N/A THR 396.A OG1 GLN 427.A OE1 no hydrogen 3.554 N/A ALA 398.A N ASP 394.A O no hydrogen 3.242 N/A THR 399.A N PRO 395.A O no hydrogen 2.941 N/A THR 399.A OG1 PRO 395.A O no hydrogen 2.907 N/A ALA 400.A N THR 396.A O no hydrogen 2.905 N/A VAL 401.A N GLU 397.A O no hydrogen 3.010 N/A GLY 402.A N ALA 398.A O no hydrogen 3.039 N/A ALA 403.A N THR 399.A O no hydrogen 2.877 N/A VAL 404.A N ALA 400.A O no hydrogen 3.078 N/A GLU 405.A N VAL 401.A O no hydrogen 2.980 N/A ALA 406.A N GLY 402.A O no hydrogen 2.977 N/A SER 407.A N ALA 403.A O no hydrogen 2.800 N/A SER 407.A OG VAL 404.A O no hydrogen 2.630 N/A PHE 408.A N VAL 404.A O no hydrogen 3.127 N/A LYS 409.A N GLU 405.A O no hydrogen 3.065 N/A CYS 410.A N ALA 406.A O no hydrogen 3.192 N/A CYS 410.A SG ALA 406.A O no hydrogen 3.251 N/A CYS 411.A N PHE 408.A O no hydrogen 3.345 N/A SER 412.A N SER 407.A O no hydrogen 3.024 N/A SER 412.A OG ALA 414.A O no hydrogen 3.495 N/A GLY 413.A N VAL 495.A O no hydrogen 3.059 N/A ILE 415.A N PRO 436.A O no hydrogen 2.845 N/A ILE 416.A N ILE 497.A O no hydrogen 2.707 N/A VAL 417.A N ILE 438.A O no hydrogen 2.890 N/A LEU 418.A N LEU 499.A O no hydrogen 3.182 N/A THR 419.A N VAL 440.A O no hydrogen 2.999 N/A GLY 422.A N THR 419.A OG1 no hydrogen 2.645 N/A ARG 423.A N SER 421.A OG no hydrogen 3.273 N/A SER 424.A OG THR 509.A OG1 no hydrogen 2.571 N/A HIS 426.A N GLY 422.A O no hydrogen 2.914 N/A GLN 427.A N ARG 423.A O no hydrogen 2.879 N/A GLN 427.A NE2 ASP 394.A OD1 no hydrogen 3.528 N/A GLN 427.A NE2 THR 396.A OG1 no hydrogen 3.388 N/A VAL 428.A N SER 424.A O no hydrogen 3.284 N/A ALA 429.A N ALA 425.A O no hydrogen 3.058 N/A ARG 430.A N HIS 426.A O no hydrogen 3.043 N/A ARG 430.A NH2 ARG 306.A O no hydrogen 2.792 N/A TYR 431.A N VAL 428.A O no hydrogen 3.034 N/A TYR 431.A OH GLU 397.A OE1 no hydrogen 2.837 N/A ARG 432.A N ALA 429.A O no hydrogen 2.845 N/A ARG 432.A NH1 ALA 429.A O no hydrogen 2.936 N/A ARG 432.A NH2 GLY 342.A O no hydrogen 3.043 N/A ARG 432.A NH2 ASP 344.A OD2 no hydrogen 2.997 N/A ILE 437.A N GLY 455.A O no hydrogen 2.772 N/A ILE 438.A N ILE 415.A O no hydrogen 2.937 N/A ALA 439.A N PHE 457.A O no hydrogen 3.126 N/A VAL 440.A N VAL 417.A O no hydrogen 2.859 N/A THR 441.A N VAL 459.A O no hydrogen 2.981 N/A THR 441.A OG1 THR 419.A O no hydrogen 2.752 N/A THR 441.A OG1 LYS 420.A O no hydrogen 3.465 N/A THR 441.A OG1 THR 446.A OG1 no hydrogen 2.884 N/A ARG 442.A NE ASP 463.A O no hydrogen 3.066 N/A ARG 442.A NH1 ASP 472.A OD1 no hydrogen 3.510 N/A ARG 442.A NH1 ASP 472.A OD2 no hydrogen 3.099 N/A ARG 442.A NH2 ASP 463.A O no hydrogen 3.188 N/A ARG 442.A NH2 ASP 472.A OD1 no hydrogen 2.939 N/A ASN 443.A N THR 441.A OG1 no hydrogen 3.107 N/A THR 446.A N ASN 443.A OD1 no hydrogen 3.095 N/A THR 446.A OG1 LYS 420.A O no hydrogen 3.375 N/A THR 446.A OG1 THR 441.A OG1 no hydrogen 2.884 N/A THR 446.A OG1 ASN 443.A O no hydrogen 2.797 N/A ALA 447.A N ASN 443.A O no hydrogen 3.056 N/A ARG 448.A N PRO 444.A O no hydrogen 3.088 N/A ARG 448.A NE ASP 225.A OD1 no hydrogen 2.837 N/A ARG 448.A NE ASP 225.A OD2 no hydrogen 3.329 N/A ARG 448.A NH2 ASP 225.A OD1 no hydrogen 3.278 N/A GLN 449.A N GLN 445.A O no hydrogen 2.806 N/A GLN 449.A NE2 ASP 225.A O no hydrogen 2.895 N/A GLN 449.A NE2 ASN 251.A O no hydrogen 2.997 N/A ALA 450.A N THR 446.A O no hydrogen 2.961 N/A HIS 451.A N ARG 448.A O no hydrogen 3.457 N/A HIS 451.A NE2 PRO 94.A O no hydrogen 2.773 N/A LEU 452.A N GLN 449.A O no hydrogen 3.182 N/A TYR 453.A N ALA 450.A O no hydrogen 3.079 N/A ARG 454.A N ASP 344.A OD2 no hydrogen 3.074 N/A ARG 454.A NH1 VAL 339.A O no hydrogen 3.010 N/A ARG 454.A NH1 ALA 343.A O no hydrogen 2.702 N/A ARG 454.A NH2 VAL 339.A O no hydrogen 3.242 N/A GLY 455.A N ASN 31.A O no hydrogen 2.897 N/A ILE 456.A N TYR 453.A O no hydrogen 3.192 N/A PHE 457.A N ILE 437.A O no hydrogen 2.607 N/A VAL 459.A N ALA 439.A O no hydrogen 2.831 N/A CYS 461.A N THR 441.A O no hydrogen 2.845 N/A CYS 461.A SG ASP 463.A OD2 no hydrogen 3.318 N/A GLN 466.A N ASP 472.A OD1 no hydrogen 2.978 N/A ASP 472.A N ALA 468.A O no hydrogen 3.166 N/A VAL 473.A N TRP 469.A O no hydrogen 2.979 N/A ASP 474.A N ALA 470.A O no hydrogen 3.001 N/A LEU 475.A N GLU 471.A O no hydrogen 2.736 N/A ARG 476.A N ASP 472.A O no hydrogen 3.082 N/A ARG 476.A NE ASP 472.A O no hydrogen 3.208 N/A VAL 477.A N VAL 473.A O no hydrogen 2.862 N/A ASN 478.A N ASP 474.A O no hydrogen 2.858 N/A PHE 479.A N LEU 475.A O no hydrogen 3.019 N/A ALA 480.A N ARG 476.A O no hydrogen 3.238 N/A MET 481.A N VAL 477.A O no hydrogen 3.017 N/A ASN 482.A N ASN 478.A O no hydrogen 2.937 N/A ASN 482.A ND2 ASN 478.A OD1 no hydrogen 3.501 N/A VAL 483.A N PHE 479.A O no hydrogen 2.966 N/A GLY 484.A N ALA 480.A O no hydrogen 2.914 N/A LYS 485.A N MET 481.A O no hydrogen 3.185 N/A LYS 485.A NZ PRO 518.A O no hydrogen 2.856 N/A ALA 486.A N ASN 482.A O no hydrogen 2.869 N/A ARG 487.A N VAL 483.A O no hydrogen 2.966 N/A ARG 487.A NH2 LEU 91.A O no hydrogen 2.719 N/A GLY 488.A N LYS 485.A O no hydrogen 3.222 N/A PHE 489.A N GLY 484.A O no hydrogen 2.730 N/A PHE 490.A N GLY 484.A O no hydrogen 3.489 N/A LYS 491.A N ASP 494.A OD2 no hydrogen 2.609 N/A ASP 494.A N LYS 491.A O no hydrogen 2.829 N/A VAL 496.A N VAL 515.A O no hydrogen 2.881 N/A ILE 497.A N ALA 414.A O no hydrogen 2.959 N/A VAL 498.A N ARG 513.A O no hydrogen 2.854 N/A LEU 499.A N ILE 416.A O no hydrogen 2.765 N/A THR 500.A N THR 511.A O no hydrogen 2.981 N/A THR 509.A OG1 SER 424.A OG no hydrogen 2.571 N/A ASN 510.A N THR 500.A O no hydrogen 3.157 N/A THR 511.A N THR 500.A O no hydrogen 2.961 N/A THR 511.A OG1 ASN 510.A OD1 no hydrogen 2.929 N/A ARG 513.A N VAL 498.A O no hydrogen 2.908 N/A VAL 515.A N VAL 496.A O no hydrogen 3.050 N/A VAL 517.A N ASP 494.A O no hydrogen 2.623 N/A