Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1m51_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ALA 4.A N ASN 1.A O no hydrogen 3.201 N/A LYS 5.A N LEU 2.A O no hydrogen 2.800 N/A LYS 5.A NZ PRO 31.A O no hydrogen 2.954 N/A VAL 6.A N SER 3.A O no hydrogen 3.195 N/A VAL 7.A N ILE 34.A O no hydrogen 2.888 N/A GLN 8.A NE2 ILE 36.A O no hydrogen 3.288 N/A GLN 8.A NE2 GLU 43.A OE2 no hydrogen 2.814 N/A ASP 12.A N SER 10.A OG no hydrogen 3.262 N/A SER 13.A N SER 10.A O no hydrogen 3.132 N/A SER 13.A OG SER 10.A O no hydrogen 3.059 N/A LEU 14.A N LEU 11.A O no hydrogen 3.026 N/A ARG 19.A N PRO 15.A O no hydrogen 2.962 N/A ARG 19.A NE GLU 23.A OE2 no hydrogen 2.904 N/A ARG 19.A NH1 ASP 12.A OD1 no hydrogen 3.497 N/A GLU 20.A N GLN 16.A O no hydrogen 2.891 N/A PHE 21.A N ALA 17.A O no hydrogen 3.163 N/A LEU 22.A N VAL 18.A O no hydrogen 2.964 N/A GLU 23.A N ARG 19.A O no hydrogen 2.777 N/A ASN 24.A N GLU 20.A O no hydrogen 2.906 N/A ASN 25.A N PHE 21.A O no hydrogen 3.254 N/A ASN 25.A ND2 PHE 21.A O no hydrogen 2.998 N/A ALA 26.A N LEU 22.A O no hydrogen 2.859 N/A GLU 27.A N GLU 23.A O no hydrogen 3.041 N/A LEU 28.A N ASN 24.A O no hydrogen 3.162 N/A CYS 29.A N ASN 25.A O no hydrogen 2.764 N/A CYS 29.A SG ASN 25.A O no hydrogen 3.347 N/A CYS 29.A SG PHE 121.A O no hydrogen 3.979 N/A GLN 30.A N ALA 26.A O no hydrogen 2.749 N/A GLN 30.A NE2 GLU 27.A O no hydrogen 2.667 N/A ASP 32.A N ARG 128.A O no hydrogen 2.749 N/A HIS 33.A N ARG 128.A O no hydrogen 3.431 N/A ILE 34.A N LYS 5.A O no hydrogen 2.939 N/A HIS 35.A N MET 130.A O no hydrogen 2.867 N/A HIS 35.A NE2 GLU 43.A OE2 no hydrogen 2.632 N/A ILE 36.A N GLN 8.A O no hydrogen 3.082 N/A CYS 37.A N VAL 132.A O no hydrogen 2.939 N/A ASP 38.A N GLU 43.A OE2 no hydrogen 3.026 N/A GLY 39.A N GLU 43.A OE1 no hydrogen 2.882 N/A SER 40.A N ASP 38.A OD1 no hydrogen 2.906 N/A SER 40.A OG ASP 38.A OD1 no hydrogen 2.906 N/A SER 40.A OG ASP 38.A OD2 no hydrogen 3.310 N/A SER 40.A OG GLU 42.A OE1 no hydrogen 3.546 N/A GLU 43.A N SER 40.A OG no hydrogen 3.077 N/A ASN 44.A N SER 40.A O no hydrogen 3.041 N/A GLY 45.A N GLU 41.A O no hydrogen 2.814 N/A ARG 46.A N GLU 42.A O no hydrogen 2.995 N/A ARG 46.A NH2 GLN 8.A OE1 no hydrogen 2.601 N/A LEU 47.A N GLU 43.A O no hydrogen 2.908 N/A LEU 48.A N ASN 44.A O no hydrogen 2.900 N/A GLY 49.A N GLY 45.A O no hydrogen 2.937 N/A GLN 50.A N ARG 46.A O no hydrogen 2.927 N/A MET 51.A N LEU 47.A O no hydrogen 2.985 N/A GLU 52.A N LEU 48.A O no hydrogen 2.926 N/A GLU 53.A N GLY 49.A O no hydrogen 3.031 N/A GLU 54.A N GLN 50.A O no hydrogen 3.074 N/A GLY 55.A N GLU 52.A O no hydrogen 3.296 N/A LEU 57.A N MET 51.A O no hydrogen 3.285 N/A ARG 58.A N LEU 68.A O no hydrogen 3.005 N/A ARG 58.A NH1 ASN 377.A OD1 no hydrogen 3.335 N/A LEU 60.A N CYS 66.A O no hydrogen 2.824 N/A LYS 62.A N GLY 355.A O no hydrogen 3.122 N/A TYR 63.A N LEU 60.A O no hydrogen 3.173 N/A ASN 65.A ND2 ASN 343.A OD1 no hydrogen 3.154 N/A CYS 66.A SG ASP 64.A O no hydrogen 3.793 N/A CYS 66.A SG ILE 340.A O no hydrogen 3.789 N/A TRP 67.A N THR 344.A O no hydrogen 3.109 N/A TRP 67.A NE1 ASN 65.A OD1 no hydrogen 2.748 N/A LEU 68.A N ARG 58.A O no hydrogen 2.946 N/A ALA 69.A N PHE 346.A O no hydrogen 2.789 N/A THR 71.A N ASN 348.A OD1 no hydrogen 2.925 N/A THR 71.A OG1 ASP 72.A O no hydrogen 3.085 N/A THR 71.A OG1 ASP 75.A O no hydrogen 3.249 N/A ARG 74.A N ASP 72.A OD1 no hydrogen 2.962 N/A ARG 74.A NE ASP 72.A OD1 no hydrogen 3.066 N/A ARG 74.A NE ASP 72.A OD2 no hydrogen 3.322 N/A ARG 74.A NH2 ASP 72.A OD2 no hydrogen 2.702 N/A ASP 75.A N ASP 72.A O no hydrogen 2.890 N/A ARG 78.A NH1 GLU 80.A OE2 no hydrogen 3.114 N/A LYS 82.A N ILE 79.A O no hydrogen 3.147 N/A THR 83.A N GLU 80.A O no hydrogen 3.037 N/A THR 83.A OG1 ILE 79.A O no hydrogen 2.670 N/A VAL 84.A N ILE 208.A O no hydrogen 2.845 N/A ILE 85.A N ARG 106.A O no hydrogen 2.885 N/A VAL 86.A N HIS 210.A O no hydrogen 2.830 N/A THR 87.A OG1 GLU 89.A O no hydrogen 2.831 N/A THR 87.A OG1 THR 93.A OG1 no hydrogen 2.780 N/A ASP 92.A N GLU 89.A O no hydrogen 3.259 N/A THR 93.A N GLN 90.A O no hydrogen 2.967 N/A THR 93.A OG1 THR 87.A OG1 no hydrogen 2.780 N/A VAL 94.A N GLN 90.A O no hydrogen 3.037 N/A LYS 98.A N ASP 579.A O no hydrogen 2.613 N/A LYS 98.A NZ ASN 582.A OD1 no hydrogen 2.788 N/A THR 99.A OG1 ASP 579.A OD2 no hydrogen 3.440 N/A GLN 103.A N GLN 580.A OE1 no hydrogen 2.690 N/A LEU 104.A N SER 102.A OG no hydrogen 2.937 N/A TRP 107.A NE1 THR 87.A O no hydrogen 2.967 N/A MET 108.A N ILE 85.A O no hydrogen 3.130 N/A ASP 112.A N SER 109.A OG no hydrogen 2.961 N/A PHE 113.A N SER 109.A O no hydrogen 2.872 N/A GLU 114.A N GLU 110.A O no hydrogen 2.890 N/A LYS 115.A N GLU 111.A O no hydrogen 3.174 N/A ALA 116.A N ASP 112.A O no hydrogen 2.911 N/A PHE 117.A N PHE 113.A O no hydrogen 2.828 N/A ASN 118.A N GLU 114.A O no hydrogen 3.127 N/A ALA 119.A N LYS 115.A O no hydrogen 3.224 N/A ARG 120.A N PHE 117.A O no hydrogen 3.112 N/A ARG 120.A NE LEU 205.A O no hydrogen 2.790 N/A ARG 120.A NH1 ALA 116.A O no hydrogen 2.881 N/A PHE 121.A N PHE 117.A O no hydrogen 2.928 N/A GLY 123.A N LEU 28.A O no hydrogen 2.938 N/A CYS 124.A N PHE 121.A O no hydrogen 3.110 N/A CYS 124.A SG PHE 121.A O no hydrogen 3.221 N/A CYS 124.A SG SER 184.A OG no hydrogen 3.429 N/A MET 125.A N CYS 29.A O no hydrogen 2.965 N/A LYS 126.A N GLY 123.A O no hydrogen 3.264 N/A GLY 127.A N ASP 32.A OD1 no hydrogen 3.049 N/A ARG 128.A N MET 125.A O no hydrogen 2.820 N/A ARG 128.A NE CYS 187.A O no hydrogen 2.959 N/A ARG 128.A NH2 CYS 187.A O no hydrogen 2.708 N/A MET 130.A N HIS 33.A O no hydrogen 2.693 N/A TYR 131.A N THR 150.A O no hydrogen 2.661 N/A VAL 132.A N HIS 35.A O no hydrogen 2.778 N/A ILE 133.A N GLU 148.A O no hydrogen 2.759 N/A PHE 135.A N GLY 146.A O no hydrogen 3.006 N/A SER 136.A N ARG 164.A O no hydrogen 2.801 N/A SER 136.A OG GLY 138.A O no hydrogen 2.792 N/A MET 137.A N LYS 144.A O no hydrogen 2.695 N/A GLY 138.A N PRO 317.A O no hydrogen 2.761 N/A SER 143.A OG PRO 139.A O no hydrogen 2.648 N/A LYS 144.A N MET 137.A O no hydrogen 3.034 N/A GLY 146.A N PHE 135.A O no hydrogen 2.860 N/A ILE 147.A N VAL 179.A O no hydrogen 3.013 N/A GLU 148.A N ILE 133.A O no hydrogen 2.913 N/A LEU 149.A N CYS 181.A O no hydrogen 2.791 N/A THR 150.A N TYR 131.A O no hydrogen 3.104 N/A THR 150.A OG1 HIS 183.A ND1 no hydrogen 2.773 N/A SER 152.A N THR 150.A OG1 no hydrogen 3.061 N/A TYR 154.A OH THR 347.A OG1 no hydrogen 2.727 N/A VAL 155.A N SER 152.A OG no hydrogen 3.284 N/A VAL 156.A N SER 152.A O no hydrogen 3.124 N/A ALA 157.A N PRO 153.A O no hydrogen 3.081 N/A SER 158.A N TYR 154.A O no hydrogen 3.037 N/A SER 158.A OG TYR 154.A O no hydrogen 2.857 N/A MET 159.A N VAL 155.A O no hydrogen 2.815 N/A ARG 160.A N VAL 156.A O no hydrogen 2.996 N/A ARG 160.A NE GLY 39.A O no hydrogen 3.131 N/A ARG 160.A NH2 GLY 39.A O no hydrogen 3.328 N/A MET 162.A N SER 158.A O no hydrogen 2.828 N/A THR 163.A N MET 159.A O no hydrogen 2.836 N/A THR 163.A OG1 MET 159.A O no hydrogen 2.756 N/A ARG 164.A N SER 136.A O no hydrogen 3.394 N/A ARG 164.A NH2 GLU 410.A OE2 no hydrogen 2.874 N/A GLY 166.A N PRO 134.A O no hydrogen 2.887 N/A THR 167.A N ASP 38.A O no hydrogen 2.793 N/A VAL 169.A N GLY 166.A O no hydrogen 3.084 N/A LEU 170.A N GLY 166.A O no hydrogen 3.426 N/A GLU 171.A N THR 167.A O no hydrogen 2.925 N/A ALA 172.A N PRO 168.A O no hydrogen 2.912 N/A LEU 173.A N VAL 169.A O no hydrogen 2.784 N/A GLY 174.A N LEU 170.A O no hydrogen 3.184 N/A GLY 176.A N LEU 173.A O no hydrogen 2.877 N/A VAL 179.A N ILE 145.A O no hydrogen 3.088 N/A LYS 180.A N ARG 215.A O no hydrogen 2.974 N/A CYS 181.A N ILE 147.A O no hydrogen 2.969 N/A CYS 181.A SG VAL 179.A O no hydrogen 3.897 N/A LEU 182.A N ILE 217.A O no hydrogen 2.704 N/A HIS 183.A N LEU 149.A O no hydrogen 2.841 N/A HIS 183.A ND1 THR 150.A OG1 no hydrogen 2.773 N/A HIS 183.A NE2 SER 222.A O no hydrogen 2.791 N/A SER 184.A N SER 219.A O no hydrogen 2.989 N/A SER 184.A OG ASP 151.A OD2 no hydrogen 2.646 N/A VAL 185.A N ASP 151.A OD1 no hydrogen 3.004 N/A GLY 186.A N SER 184.A OG no hydrogen 3.118 N/A CYS 187.A SG VAL 185.A O no hydrogen 3.924 N/A CYS 187.A SG CYS 201.A O no hydrogen 2.989 N/A LEU 189.A N LYS 126.A O no hydrogen 2.682 N/A GLN 192.A NE2 PRO 190.A O no hydrogen 3.094 N/A ASN 197.A ND2 THR 71.A O no hydrogen 3.150 N/A TRP 199.A N VAL 196.A O no hydrogen 2.860 N/A TRP 199.A NE1 ASP 75.A OD2 no hydrogen 3.011 N/A CYS 201.A SG TRP 199.A O no hydrogen 4.017 N/A ASN 202.A N GLY 221.A O no hydrogen 2.668 N/A ASN 202.A ND2 GLY 186.A O no hydrogen 3.087 N/A GLU 204.A N GLU 204.A OE1 no hydrogen 3.061 N/A LEU 205.A N ASN 202.A O no hydrogen 3.212 N/A LEU 205.A N ASN 202.A OD1 no hydrogen 3.383 N/A THR 206.A N PRO 203.A O no hydrogen 3.204 N/A THR 206.A OG1 ASN 202.A O no hydrogen 2.974 N/A THR 206.A OG1 PRO 203.A O no hydrogen 3.340 N/A LEU 207.A N PHE 220.A O no hydrogen 2.896 N/A ILE 208.A N LYS 82.A O no hydrogen 2.839 N/A ALA 209.A N ILE 218.A O no hydrogen 2.695 N/A HIS 210.A N VAL 84.A O no hydrogen 3.072 N/A HIS 210.A ND1 VAL 84.A O no hydrogen 2.747 N/A LEU 211.A N GLU 216.A O no hydrogen 2.787 N/A ARG 214.A NH1 GLU 114.A OE1 no hydrogen 3.375 N/A ARG 215.A N PRO 212.A O no hydrogen 3.164 N/A ARG 215.A NH1 PHE 178.A O no hydrogen 2.570 N/A GLU 216.A N LEU 211.A O no hydrogen 3.086 N/A ILE 217.A N LYS 180.A O no hydrogen 2.759 N/A ILE 218.A N ALA 209.A O no hydrogen 2.910 N/A SER 219.A N LEU 182.A O no hydrogen 2.725 N/A SER 219.A OG ASN 227.A O no hydrogen 2.636 N/A PHE 220.A N LEU 207.A O no hydrogen 2.731 N/A GLY 221.A N SER 184.A O no hydrogen 2.713 N/A SER 222.A OG ASP 75.A OD1 no hydrogen 2.600 N/A SER 222.A OG ASP 75.A OD2 no hydrogen 3.512 N/A GLY 223.A N ASP 75.A OD2 no hydrogen 2.682 N/A TYR 224.A N SER 222.A OG no hydrogen 3.214 N/A ASN 227.A N TYR 224.A O no hydrogen 2.763 N/A ASN 227.A ND2 ALA 77.A O no hydrogen 3.146 N/A ASN 227.A ND2 SER 222.A OG no hydrogen 2.925 N/A SER 228.A N GLY 225.A O no hydrogen 3.233 N/A SER 228.A OG GLY 223.A O no hydrogen 2.773 N/A SER 228.A OG TYR 224.A O no hydrogen 3.239 N/A LEU 229.A N GLY 225.A O no hydrogen 2.807 N/A LEU 230.A N GLU 148.A OE1 no hydrogen 3.099 N/A LYS 232.A N LEU 229.A O no hydrogen 3.163 N/A LYS 232.A NZ ASP 300.A OD2 no hydrogen 2.617 N/A LYS 232.A NZ GLU 318.A OE1 no hydrogen 3.097 N/A LYS 232.A NZ GLU 318.A OE2 no hydrogen 2.682 N/A LYS 233.A NZ HIS 253.A NE2 no hydrogen 2.937 N/A LYS 233.A NZ ASP 300.A OD2 no hydrogen 2.526 N/A CYS 234.A SG HIS 210.A NE2 no hydrogen 3.523 N/A PHE 235.A N LEU 230.A O no hydrogen 2.968 N/A ALA 236.A N GLY 231.A O no hydrogen 2.875 N/A LEU 237.A N LYS 233.A O no hydrogen 3.317 N/A ARG 238.A N LYS 233.A O no hydrogen 3.033 N/A ARG 238.A NE PRO 465.A O no hydrogen 3.070 N/A ARG 238.A NH1 HIS 210.A NE2 no hydrogen 3.029 N/A ARG 238.A NH2 PRO 465.A O no hydrogen 2.852 N/A MET 239.A N CYS 234.A O no hydrogen 3.184 N/A ALA 240.A N PHE 235.A O no hydrogen 2.909 N/A SER 241.A N LEU 237.A O no hydrogen 2.835 N/A SER 241.A OG LEU 237.A O no hydrogen 3.111 N/A SER 241.A OG ARG 238.A O no hydrogen 2.907 N/A LEU 243.A N MET 239.A O no hydrogen 3.132 N/A ALA 244.A N ALA 240.A O no hydrogen 2.732 N/A LYS 245.A N SER 241.A O no hydrogen 2.999 N/A GLU 246.A N ARG 242.A O no hydrogen 3.177 N/A GLU 247.A N LEU 243.A O no hydrogen 2.812 N/A TRP 249.A N ALA 244.A O no hydrogen 3.009 N/A TRP 249.A NE1 GLU 247.A OE1 no hydrogen 2.935 N/A LEU 250.A N MET 304.A O no hydrogen 2.792 N/A GLU 252.A N ALA 302.A O no hydrogen 2.910 N/A HIS 253.A ND1 ALA 462.A O no hydrogen 2.817 N/A LEU 255.A N ALA 271.A O no hydrogen 2.933 N/A VAL 256.A N GLY 298.A O no hydrogen 2.808 N/A LEU 257.A N LEU 269.A O no hydrogen 2.994 N/A GLY 258.A N GLU 295.A O no hydrogen 2.718 N/A ILE 259.A N LYS 267.A O no hydrogen 2.766 N/A THR 260.A N LYS 293.A O no hydrogen 2.747 N/A ASN 261.A N GLU 265.A O no hydrogen 2.970 N/A GLU 263.A N ASN 261.A OD1 no hydrogen 2.936 N/A GLY 264.A N ASN 261.A O no hydrogen 3.172 N/A GLU 265.A N ASN 261.A OD1 no hydrogen 3.089 N/A LYS 266.A NZ TYR 268.A OH no hydrogen 3.216 N/A LYS 266.A NZ GLU 295.A OE2 no hydrogen 3.020 N/A LYS 266.A NZ ASP 406.A OD2 no hydrogen 2.589 N/A LYS 267.A N ILE 259.A O no hydrogen 2.915 N/A LYS 267.A NZ GLU 265.A OE2 no hydrogen 3.001 N/A LYS 267.A NZ GLU 418.A OE1 no hydrogen 2.760 N/A LYS 267.A NZ ASP 526.A OD1 no hydrogen 2.912 N/A TYR 268.A OH ASP 406.A OD1 no hydrogen 2.654 N/A TYR 268.A OH ASP 406.A OD2 no hydrogen 3.082 N/A LEU 269.A N LEU 257.A O no hydrogen 2.864 N/A ALA 270.A N GLY 419.A O no hydrogen 3.030 N/A ALA 271.A N LEU 255.A O no hydrogen 2.916 N/A ALA 272.A N ILE 421.A O no hydrogen 2.879 N/A CYS 277.A SG PRO 274.A O no hydrogen 3.749 N/A CYS 277.A SG SER 275.A O no hydrogen 3.627 N/A LYS 279.A NZ ASP 300.A O no hydrogen 3.468 N/A LYS 279.A NZ ASP 300.A OD1 no hydrogen 3.004 N/A THR 280.A OG1 ASP 299.A OD2 no hydrogen 2.713 N/A LEU 282.A N GLY 278.A O no hydrogen 3.030 N/A LEU 282.A N LYS 279.A O no hydrogen 3.064 N/A ALA 283.A N LYS 279.A O no hydrogen 2.958 N/A MET 284.A N THR 280.A O no hydrogen 3.147 N/A MET 285.A N LEU 282.A O no hydrogen 3.319 N/A SER 288.A N GLY 512.A O no hydrogen 3.159 N/A SER 288.A OG GLY 512.A O no hydrogen 3.321 N/A SER 288.A OG GLU 513.A OE1 no hydrogen 2.513 N/A TRP 292.A N LEU 289.A O no hydrogen 3.276 N/A LYS 293.A N THR 260.A O no hydrogen 2.971 N/A GLU 295.A N GLY 258.A O no hydrogen 2.714 N/A CYS 296.A N ILE 404.A O no hydrogen 2.852 N/A VAL 297.A N VAL 256.A O no hydrogen 2.800 N/A GLY 298.A N VAL 256.A O no hydrogen 3.070 N/A ALA 302.A N GLU 252.A O no hydrogen 2.871 N/A TRP 303.A N ILE 315.A O no hydrogen 2.882 N/A TRP 303.A NE1 ALA 236.A O no hydrogen 2.924 N/A MET 304.A N LEU 250.A O no hydrogen 2.806 N/A LYS 305.A N ARG 313.A O no hydrogen 2.764 N/A LYS 305.A NZ LYS 305.A O no hydrogen 3.318 N/A ASP 307.A N HIS 311.A O no hydrogen 2.712 N/A GLN 309.A N ASP 307.A OD1 no hydrogen 2.973 N/A GLY 310.A N ASP 307.A O no hydrogen 2.995 N/A HIS 311.A N ASP 307.A OD1 no hydrogen 2.839 N/A ARG 313.A N LYS 305.A O no hydrogen 2.822 N/A ARG 313.A NE ASP 307.A OD2 no hydrogen 3.133 N/A ARG 313.A NH1 GLY 414.A O no hydrogen 3.020 N/A ARG 313.A NH2 ASP 307.A OD2 no hydrogen 3.553 N/A ALA 314.A N VAL 415.A O no hydrogen 2.839 N/A ILE 315.A N TRP 303.A O no hydrogen 2.789 N/A ASN 316.A ND2 VAL 297.A O no hydrogen 2.914 N/A GLU 318.A N ASN 316.A OD1 no hydrogen 2.828 N/A ASN 319.A N MET 162.A O no hydrogen 3.010 N/A ASN 319.A ND2 ILE 161.A O no hydrogen 3.631 N/A ASN 319.A ND2 THR 163.A O no hydrogen 2.979 N/A PHE 321.A N THR 397.A O no hydrogen 2.893 N/A GLY 323.A N PHE 395.A O no hydrogen 3.007 N/A ALA 325.A N SER 393.A O no hydrogen 2.898 N/A GLY 327.A N GLU 360.A O no hydrogen 2.744 N/A THR 328.A N ALA 325.A O no hydrogen 3.056 N/A THR 328.A OG1 VAL 324.A O no hydrogen 3.305 N/A THR 328.A OG1 ALA 325.A O no hydrogen 2.816 N/A SER 329.A N THR 332.A OG1 no hydrogen 3.092 N/A SER 329.A OG THR 332.A OG1 no hydrogen 3.115 N/A THR 332.A N SER 329.A OG no hydrogen 3.088 N/A THR 332.A OG1 GLY 327.A O no hydrogen 2.650 N/A THR 332.A OG1 SER 329.A OG no hydrogen 3.115 N/A ASN 333.A N SER 329.A O no hydrogen 2.988 N/A ASN 333.A ND2 ASN 281.A OD1 no hydrogen 2.512 N/A ASN 335.A ND2 MET 284.A O no hydrogen 2.737 N/A ALA 336.A N ASN 333.A OD1 no hydrogen 2.850 N/A ILE 337.A N ASN 333.A O no hydrogen 3.211 N/A LYS 338.A N PRO 334.A O no hydrogen 3.203 N/A THR 339.A N ASN 335.A O no hydrogen 3.061 N/A THR 339.A OG1 ASN 335.A O no hydrogen 2.714 N/A ILE 340.A N ALA 336.A O no hydrogen 3.054 N/A GLN 341.A N LYS 338.A O no hydrogen 3.446 N/A GLN 341.A NE2 ILE 337.A O no hydrogen 2.662 N/A ASN 343.A N ASP 64.A O no hydrogen 3.022 N/A ASN 343.A ND2 GLN 401.A OE1 no hydrogen 2.775 N/A THR 344.A OG1 LYS 342.A O no hydrogen 2.772 N/A THR 344.A OG1 THR 397.A OG1 no hydrogen 2.773 N/A ILE 345.A N CYS 396.A O no hydrogen 3.106 N/A PHE 346.A N TRP 67.A O no hydrogen 2.870 N/A THR 347.A N ARG 394.A O no hydrogen 2.758 N/A THR 347.A OG1 TYR 154.A OH no hydrogen 2.727 N/A ASN 348.A N ALA 69.A O no hydrogen 2.883 N/A ASN 348.A ND2 THR 71.A OG1 no hydrogen 2.756 N/A ALA 350.A N TYR 358.A O no hydrogen 2.979 N/A GLU 351.A N THR 373.A O no hydrogen 2.833 N/A THR 352.A N GLY 356.A O no hydrogen 2.977 N/A THR 352.A OG1 ASP 354.A OD2 no hydrogen 2.673 N/A SER 353.A N THR 371.A O no hydrogen 2.770 N/A GLY 355.A N THR 352.A O no hydrogen 2.962 N/A GLY 356.A N THR 352.A OG1 no hydrogen 2.839 N/A VAL 357.A N TYR 63.A OH no hydrogen 2.872 N/A TYR 358.A N ALA 350.A O no hydrogen 2.921 N/A TYR 358.A OH GLU 364.A O no hydrogen 2.849 N/A TRP 359.A NE1 THR 328.A O no hydrogen 2.733 N/A ILE 362.A N TRP 359.A O no hydrogen 3.161 N/A VAL 370.A N ALA 367.A O no hydrogen 3.401 N/A THR 371.A N SER 353.A OG no hydrogen 3.055 N/A THR 373.A N GLU 351.A O no hydrogen 2.745 N/A SER 374.A N LYS 378.A O no hydrogen 2.650 N/A SER 374.A OG LYS 378.A O no hydrogen 3.274 N/A TRP 375.A N CYS 388.A O no hydrogen 2.955 N/A LYS 376.A N SER 374.A OG no hydrogen 3.321 N/A ASN 377.A N SER 374.A O no hydrogen 2.947 N/A LYS 378.A N SER 374.A OG no hydrogen 3.346 N/A TRP 380.A N ILE 372.A O no hydrogen 3.039 N/A TRP 380.A NE1 GLU 386.A O no hydrogen 2.633 N/A SER 381.A OG GLU 383.A OE1 no hydrogen 3.321 N/A SER 381.A OG ASP 384.A OD1 no hydrogen 2.760 N/A GLU 383.A N SER 381.A OG no hydrogen 3.306 N/A ASP 384.A N SER 381.A O no hydrogen 3.340 N/A CYS 388.A N GLU 360.A OE2 no hydrogen 2.824 N/A CYS 388.A SG GLU 360.A OE1 no hydrogen 3.862 N/A CYS 388.A SG GLU 360.A OE2 no hydrogen 3.420 N/A ALA 389.A N GLU 360.A OE1 no hydrogen 3.309 N/A HIS 390.A N ASN 348.A O no hydrogen 3.167 N/A ASN 392.A N HIS 390.A ND1 no hydrogen 3.074 N/A ASN 392.A ND2 VAL 76.A O no hydrogen 2.923 N/A ASN 392.A ND2 TYR 224.A OH no hydrogen 3.032 N/A SER 393.A N HIS 390.A O no hydrogen 2.971 N/A SER 393.A OG HIS 390.A O no hydrogen 2.733 N/A ARG 394.A N THR 347.A O no hydrogen 2.960 N/A ARG 394.A NE ASN 392.A O no hydrogen 3.361 N/A ARG 394.A NH1 PHE 322.A O no hydrogen 3.087 N/A ARG 394.A NH2 ASN 392.A OD1 no hydrogen 2.744 N/A PHE 395.A N GLY 323.A O no hydrogen 3.000 N/A CYS 396.A N ILE 345.A O no hydrogen 2.709 N/A CYS 396.A SG SER 158.A O no hydrogen 3.989 N/A THR 397.A N PHE 321.A O no hydrogen 2.957 N/A THR 397.A OG1 THR 339.A O no hydrogen 3.492 N/A THR 397.A OG1 THR 344.A OG1 no hydrogen 2.773 N/A ALA 399.A N ASN 319.A O no hydrogen 3.102 N/A GLN 401.A N PRO 398.A O no hydrogen 3.209 N/A GLN 401.A NE2 THR 339.A O no hydrogen 2.900 N/A GLN 401.A NE2 LYS 342.A O no hydrogen 2.841 N/A CYS 402.A N ALA 399.A O no hydrogen 3.075 N/A ILE 405.A N CYS 402.A O no hydrogen 2.981 N/A ASP 406.A N CYS 296.A O no hydrogen 2.775 N/A ALA 408.A N ASP 406.A OD1 no hydrogen 2.727 N/A TRP 409.A N ASP 406.A O no hydrogen 3.016 N/A SER 411.A N ALA 408.A O no hydrogen 3.096 N/A GLU 413.A N SER 411.A OG no hydrogen 3.277 N/A GLY 414.A N SER 411.A O no hydrogen 3.025 N/A VAL 415.A N ALA 314.A O no hydrogen 2.969 N/A ILE 417.A N LEU 312.A O no hydrogen 2.759 N/A GLU 418.A N TYR 268.A O no hydrogen 3.031 N/A ILE 420.A N LYS 491.A O no hydrogen 2.783 N/A ILE 421.A N ALA 270.A O no hydrogen 2.780 N/A PHE 422.A N PHE 493.A O no hydrogen 2.826 N/A GLY 423.A N ALA 272.A O no hydrogen 3.299 N/A GLY 424.A N VAL 495.A O no hydrogen 3.458 N/A ARG 425.A N SER 451.A OG no hydrogen 2.799 N/A ARG 425.A NE ALA 276.A O no hydrogen 2.813 N/A ARG 425.A NH2 ALA 276.A O no hydrogen 2.656 N/A ARG 426.A N ASN 496.A OD1 no hydrogen 3.081 N/A ARG 426.A NH1 GLU 569.A OE2 no hydrogen 3.172 N/A ARG 426.A NH2 GLU 569.A OE1 no hydrogen 2.775 N/A ARG 426.A NH2 GLU 569.A OE2 no hydrogen 3.411 N/A VAL 430.A N ALA 428.A O no hydrogen 2.928 N/A TYR 434.A N HIS 494.A O no hydrogen 2.806 N/A GLU 435.A N TYR 538.A O no hydrogen 2.732 N/A ALA 436.A N ILE 492.A O no hydrogen 2.860 N/A LEU 437.A N HIS 441.A ND1 no hydrogen 3.007 N/A TRP 439.A NE1 TRP 478.A O no hydrogen 2.940 N/A HIS 441.A N SER 438.A OG no hydrogen 3.227 N/A GLY 442.A N SER 438.A O no hydrogen 2.883 N/A VAL 443.A N TRP 439.A O no hydrogen 2.897 N/A PHE 444.A N GLN 440.A O no hydrogen 3.140 N/A VAL 445.A N HIS 441.A O no hydrogen 2.862 N/A GLY 446.A N GLY 442.A O no hydrogen 3.026 N/A ALA 447.A N VAL 443.A O no hydrogen 2.830 N/A ALA 448.A N PHE 444.A O no hydrogen 2.751 N/A ALA 448.A N VAL 445.A O no hydrogen 3.271 N/A MET 449.A N GLY 446.A O no hydrogen 3.278 N/A ARG 450.A NH1 GLU 569.A OE2 no hydrogen 3.205 N/A SER 451.A N MET 457.A O no hydrogen 2.768 N/A GLU 452.A N ARG 425.A O no hydrogen 2.941 N/A ALA 453.A N ILE 455.A O no hydrogen 2.689 N/A LYS 454.A NZ GLU 452.A OE2 no hydrogen 2.800 N/A ILE 455.A N ALA 453.A O no hydrogen 3.403 N/A MET 457.A N SER 451.A O no hydrogen 2.854 N/A HIS 458.A NE2 ASP 572.A OD1 no hydrogen 2.680 N/A ASP 459.A N MET 449.A O no hydrogen 2.899 N/A PHE 461.A N GLY 446.A O no hydrogen 3.034 N/A ALA 462.A N ASP 459.A O no hydrogen 2.956 N/A MET 463.A N PRO 460.A O no hydrogen 2.792 N/A ARG 464.A N ASP 459.A OD1 no hydrogen 2.964 N/A ARG 464.A NE GLU 80.A OE1 no hydrogen 3.486 N/A ARG 464.A NH1 HIS 458.A O no hydrogen 3.310 N/A ARG 464.A NH2 GLU 80.A OE1 no hydrogen 3.008 N/A PHE 466.A N MET 463.A O no hydrogen 2.629 N/A GLY 468.A N SER 241.A OG no hydrogen 3.056 N/A ASN 470.A N ASP 92.A O no hydrogen 3.129 N/A ASN 470.A ND2 ARG 91.A O no hydrogen 2.765 N/A ASN 470.A ND2 ASP 584.A OD2 no hydrogen 2.738 N/A LYS 473.A N ASN 470.A OD1 no hydrogen 3.148 N/A LYS 473.A NZ ASP 92.A OD1 no hydrogen 3.424 N/A TYR 474.A N ASN 470.A O no hydrogen 2.935 N/A TYR 474.A OH GLU 252.A OE1 no hydrogen 2.461 N/A TYR 474.A OH GLU 252.A OE2 no hydrogen 3.256 N/A LEU 475.A N PHE 471.A O no hydrogen 2.817 N/A ALA 476.A N GLY 472.A O no hydrogen 2.987 N/A HIS 477.A N LYS 473.A O no hydrogen 2.853 N/A HIS 477.A NE2 TRP 249.A O no hydrogen 2.740 N/A TRP 478.A N TYR 474.A O no hydrogen 2.947 N/A TRP 478.A NE1 GLU 252.A OE2 no hydrogen 2.946 N/A LEU 479.A N LEU 475.A O no hydrogen 3.074 N/A SER 480.A N ALA 476.A O no hydrogen 2.886 N/A SER 480.A OG HIS 477.A O no hydrogen 2.648 N/A MET 481.A N TRP 478.A O no hydrogen 3.164 N/A ALA 482.A N LEU 479.A O no hydrogen 3.249 N/A GLN 483.A N SER 480.A O no hydrogen 3.029 N/A HIS 484.A N MET 481.A O no hydrogen 3.294 N/A ALA 487.A N HIS 484.A O no hydrogen 3.162 N/A LYS 488.A N GLY 310.A O no hydrogen 2.784 N/A LYS 488.A NZ GLN 309.A O no hydrogen 2.784 N/A LYS 488.A NZ ALA 486.A O no hydrogen 2.781 N/A LYS 491.A N GLU 418.A O no hydrogen 3.212 N/A LYS 491.A NZ GLU 435.A OE2 no hydrogen 2.771 N/A PHE 493.A N ILE 420.A O no hydrogen 2.843 N/A HIS 494.A N TYR 434.A O no hydrogen 2.681 N/A VAL 495.A N PHE 422.A O no hydrogen 2.854 N/A ASN 496.A N LEU 432.A O no hydrogen 2.890 N/A ASN 496.A ND2 ARG 426.A O no hydrogen 2.746 N/A ASN 496.A ND2 VAL 430.A O no hydrogen 2.839 N/A PHE 498.A N ASN 496.A OD1 no hydrogen 2.992 N/A ARG 499.A NH1 LEU 558.A O no hydrogen 2.924 N/A ARG 499.A NH1 SER 560.A O no hydrogen 2.948 N/A ARG 499.A NH2 SER 560.A O no hydrogen 3.109 N/A LYS 500.A N PRO 427.A O no hydrogen 2.963 N/A ASP 501.A N LYS 505.A O no hydrogen 2.707 N/A GLU 503.A N ASP 501.A OD1 no hydrogen 3.249 N/A GLY 504.A N ASP 501.A O no hydrogen 2.653 N/A LYS 505.A N ASP 501.A OD1 no hydrogen 2.761 N/A LEU 507.A N ARG 499.A O no hydrogen 2.794 N/A TRP 508.A NE1 ASN 514.A OD1 no hydrogen 2.792 N/A GLU 513.A N GLY 510.A O no hydrogen 2.991 N/A ASN 514.A N PHE 511.A O no hydrogen 2.920 N/A SER 515.A N GLY 512.A O no hydrogen 3.215 N/A SER 515.A OG GLY 512.A O no hydrogen 3.020 N/A ARG 516.A N GLU 513.A O no hydrogen 2.926 N/A ARG 516.A NE GLU 513.A OE1 no hydrogen 2.591 N/A ARG 516.A NH1 ASN 546.A O no hydrogen 2.902 N/A ARG 516.A NH1 LYS 548.A O no hydrogen 2.963 N/A ARG 516.A NH2 GLU 513.A OE1 no hydrogen 2.905 N/A ARG 516.A NH2 LYS 548.A O no hydrogen 2.932 N/A VAL 517.A N ASN 514.A O no hydrogen 2.903 N/A LEU 518.A N ASN 514.A O no hydrogen 3.028 N/A GLU 519.A N SER 515.A O no hydrogen 2.881 N/A TRP 520.A N ARG 516.A O no hydrogen 3.311 N/A TRP 520.A NE1 SER 530.A O no hydrogen 3.262 N/A MET 521.A N VAL 517.A O no hydrogen 3.052 N/A PHE 522.A N LEU 518.A O no hydrogen 2.737 N/A ASN 523.A N GLU 519.A O no hydrogen 3.099 N/A ARG 524.A N TRP 520.A O no hydrogen 2.980 N/A ARG 524.A NE GLU 435.A OE1 no hydrogen 2.649 N/A ARG 524.A NH1 LYS 528.A O no hydrogen 2.910 N/A ARG 524.A NH2 GLU 435.A OE1 no hydrogen 3.480 N/A ARG 524.A NH2 GLU 435.A OE2 no hydrogen 2.844 N/A ILE 525.A N MET 521.A O no hydrogen 2.892 N/A ASP 526.A N PHE 522.A O no hydrogen 3.322 N/A ASP 526.A N ASN 523.A O no hydrogen 2.938 N/A GLY 527.A N ARG 524.A O no hydrogen 2.861 N/A LYS 528.A N ASN 523.A O no hydrogen 2.909 N/A SER 530.A N LYS 528.A O no hydrogen 2.709 N/A SER 530.A OG LYS 528.A O no hydrogen 3.363 N/A LYS 532.A N ILE 539.A O no hydrogen 2.947 N/A THR 534.A N GLY 537.A O no hydrogen 3.001 N/A THR 534.A OG1 GLY 537.A O no hydrogen 2.733 N/A ILE 536.A N THR 534.A OG1 no hydrogen 3.286 N/A GLY 537.A N THR 534.A O no hydrogen 3.319 N/A TYR 538.A N GLU 435.A O no hydrogen 2.958 N/A ILE 539.A N LYS 532.A O no hydrogen 3.091 N/A LYS 541.A N SER 530.A O no hydrogen 2.981 N/A LYS 541.A NZ ALA 529.A O no hydrogen 3.251 N/A LYS 541.A NZ THR 531.A O no hydrogen 3.414 N/A ALA 544.A N LYS 541.A O no hydrogen 3.055 N/A ASN 546.A ND2 GLU 519.A OE1 no hydrogen 3.410 N/A LYS 548.A N ASN 546.A OD1 no hydrogen 3.088 N/A LEU 550.A N LEU 547.A O no hydrogen 3.060 N/A MET 555.A N ILE 553.A O no hydrogen 2.815 N/A GLU 557.A N ASN 554.A OD1 no hydrogen 3.085 N/A LEU 558.A N ASN 554.A O no hydrogen 3.039 N/A PHE 559.A N MET 555.A O no hydrogen 3.021 N/A LYS 563.A NZ ILE 600.A O no hydrogen 3.491 N/A LYS 563.A NZ SER 601.A O no hydrogen 3.229 N/A PHE 565.A N SER 562.A OG no hydrogen 3.207 N/A TRP 566.A N SER 562.A O no hydrogen 2.924 N/A TRP 566.A NE1 GLY 429.A O no hydrogen 3.197 N/A ASP 567.A N LYS 563.A O no hydrogen 2.772 N/A LYS 568.A N GLU 564.A O no hydrogen 3.111 N/A GLU 569.A N PHE 565.A O no hydrogen 2.815 N/A VAL 570.A N TRP 566.A O no hydrogen 3.018 N/A GLU 571.A N ASP 567.A O no hydrogen 3.234 N/A ASP 572.A N LYS 568.A O no hydrogen 3.159 N/A ILE 573.A N GLU 569.A O no hydrogen 2.908 N/A GLU 574.A N VAL 570.A O no hydrogen 2.858 N/A LYS 575.A N GLU 571.A O no hydrogen 3.005 N/A LYS 575.A NZ ASP 579.A OD2 no hydrogen 2.490 N/A TYR 576.A N ASP 572.A O no hydrogen 2.968 N/A LEU 577.A N ILE 573.A O no hydrogen 2.941 N/A VAL 578.A N GLU 574.A O no hydrogen 2.890 N/A ASP 579.A N LYS 575.A O no hydrogen 3.094 N/A GLN 580.A N TYR 576.A O no hydrogen 2.912 N/A GLN 580.A NE2 LEU 101.A O no hydrogen 3.375 N/A VAL 581.A N LEU 577.A O no hydrogen 2.849 N/A ASN 582.A ND2 ILE 96.A O no hydrogen 2.923 N/A ASP 584.A N VAL 581.A O no hydrogen 2.956 N/A LEU 585.A N ASN 582.A O no hydrogen 3.355 N/A ILE 589.A N PRO 586.A O no hydrogen 2.955 N/A GLU 590.A N PRO 586.A O no hydrogen 3.310 N/A ARG 591.A N CYS 587.A O no hydrogen 2.864 N/A GLU 592.A N GLU 588.A O no hydrogen 3.005 N/A ILE 593.A N ILE 589.A O no hydrogen 2.898 N/A LEU 594.A N GLU 590.A O no hydrogen 3.028 N/A ALA 595.A N ARG 591.A O no hydrogen 2.803 N/A LEU 596.A N GLU 592.A O no hydrogen 3.104 N/A LYS 597.A N ILE 593.A O no hydrogen 3.276 N/A LYS 597.A NZ GLU 574.A OE1 no hydrogen 2.547 N/A LYS 597.A NZ GLU 574.A OE2 no hydrogen 3.495 N/A GLN 598.A N LEU 594.A O no hydrogen 2.848 N/A ARG 599.A N ALA 595.A O no hydrogen 2.921 N/A ARG 599.A NE PRO 535.A O no hydrogen 2.513 N/A ARG 599.A NH2 PRO 535.A O no hydrogen 2.921 N/A ILE 600.A N LEU 596.A O no hydrogen 2.833 N/A SER 601.A N LYS 597.A O no hydrogen 2.771 N/A SER 601.A OG GLN 598.A O no hydrogen 2.420 N/A GLN 602.A N ARG 599.A O no hydrogen 3.342 N/A MET 603.A N ILE 600.A O no hydrogen 3.188 N/A