Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 5emn_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LYS 6.A N SER 2.A O no hydrogen 3.009 N/A MET 7.A N PHE 3.A O no hydrogen 2.954 N/A LYS 8.A N VAL 4.A O no hydrogen 2.967 N/A LYS 8.A NZ GLU 5.A OE2 no hydrogen 2.931 N/A LYS 8.A NZ GLU 61.A OE2 no hydrogen 2.631 N/A LYS 9.A N GLU 5.A O no hydrogen 2.958 N/A THR 10.A N MET 7.A O no hydrogen 3.401 N/A THR 10.A OG1 LYS 6.A O no hydrogen 2.800 N/A GLY 11.A N LYS 8.A O no hydrogen 3.390 N/A ARG 12.A N MET 7.A O no hydrogen 2.887 N/A ARG 12.A NE THR 10.A O no hydrogen 3.525 N/A ARG 12.A NH1 GLY 43.A O no hydrogen 3.443 N/A ARG 12.A NH1 ASP 282.A OD2 no hydrogen 3.132 N/A ARG 12.A NH2 ASP 282.A OD2 no hydrogen 3.071 N/A ASN 13.A N ARG 42.A O no hydrogen 2.946 N/A ASN 13.A ND2 ASN 64.A O no hydrogen 3.148 N/A ILE 14.A N ARG 42.A O no hydrogen 3.210 N/A ILE 15.A N LEU 66.A O no hydrogen 3.100 N/A VAL 16.A N MET 44.A O no hydrogen 2.983 N/A PHE 17.A N VAL 68.A O no hydrogen 2.909 N/A TYR 18.A N ALA 46.A O no hydrogen 3.042 N/A GLY 19.A N CYS 70.A O no hydrogen 2.796 N/A SER 20.A N ASN 82.A OD1 no hydrogen 3.141 N/A GLN 21.A NE2 TYR 385.A OH no hydrogen 3.016 N/A GLU 27.A N GLY 23.A O no hydrogen 2.811 N/A PHE 28.A N THR 24.A O no hydrogen 2.938 N/A ALA 29.A N ALA 25.A O no hydrogen 2.879 N/A ASN 30.A N GLU 26.A O no hydrogen 3.073 N/A ARG 31.A N GLU 27.A O no hydrogen 3.006 N/A ARG 31.A NH1 GLU 27.A OE1 no hydrogen 3.164 N/A ARG 31.A NH1 GLU 147.A OE1 no hydrogen 3.260 N/A ARG 31.A NH1 GLU 147.A OE2 no hydrogen 3.356 N/A ARG 31.A NH2 GLU 147.A OE2 no hydrogen 3.116 N/A LEU 32.A N PHE 28.A O no hydrogen 3.109 N/A SER 33.A N ALA 29.A O no hydrogen 2.791 N/A LYS 34.A N ASN 30.A O no hydrogen 3.017 N/A ASP 35.A N ARG 31.A O no hydrogen 3.143 N/A ASP 35.A N LEU 32.A O no hydrogen 2.997 N/A ALA 36.A N SER 33.A O no hydrogen 3.315 N/A ARG 38.A N ASP 35.A O no hydrogen 2.994 N/A TYR 39.A N ALA 36.A O no hydrogen 2.682 N/A GLY 40.A N HIS 37.A O no hydrogen 3.218 N/A MET 41.A N ALA 36.A O no hydrogen 3.311 N/A ARG 42.A N ASN 13.A OD1 no hydrogen 2.961 N/A MET 44.A N ILE 14.A O no hydrogen 3.062 N/A SER 45.A OG ASN 30.A OD1 no hydrogen 2.722 N/A ALA 46.A N VAL 16.A O no hydrogen 2.857 N/A GLU 49.A N ASP 47.A OD1 no hydrogen 2.873 N/A GLU 50.A N ASP 47.A O no hydrogen 3.074 N/A TYR 51.A N PRO 48.A O no hydrogen 2.971 N/A ALA 54.A N ASP 52.A OD1 no hydrogen 3.343 N/A ASP 55.A N ASP 52.A O no hydrogen 3.069 N/A LEU 56.A N LEU 53.A O no hydrogen 2.813 N/A SER 57.A N ALA 54.A O no hydrogen 3.479 N/A SER 57.A OG ALA 54.A O no hydrogen 3.125 N/A SER 58.A N ASP 55.A O no hydrogen 2.999 N/A LEU 59.A N LEU 56.A O no hydrogen 3.059 N/A GLU 61.A N SER 58.A O no hydrogen 3.218 N/A ILE 62.A N LEU 59.A O no hydrogen 3.115 N/A LEU 66.A N ASN 13.A O no hydrogen 2.967 N/A VAL 67.A N LYS 101.A O no hydrogen 3.002 N/A VAL 68.A N ILE 15.A O no hydrogen 2.904 N/A PHE 69.A N ALA 103.A O no hydrogen 2.886 N/A CYS 70.A N PHE 17.A O no hydrogen 2.903 N/A MET 71.A N PHE 105.A O no hydrogen 3.205 N/A ALA 72.A N GLY 19.A O no hydrogen 2.995 N/A THR 73.A N LEU 107.A O no hydrogen 3.143 N/A TYR 74.A N ASP 78.A O no hydrogen 2.810 N/A GLY 77.A N TYR 74.A O no hydrogen 3.077 N/A ASP 78.A N TYR 74.A O no hydrogen 3.405 N/A THR 80.A OG1 ASN 82.A OD1 no hydrogen 2.810 N/A ASN 82.A ND2 TYR 18.A O no hydrogen 3.047 N/A ASN 82.A ND2 ASP 47.A OD1 no hydrogen 2.745 N/A ALA 83.A N THR 80.A O no hydrogen 3.019 N/A GLN 84.A N ASP 81.A O no hydrogen 3.387 N/A TYR 87.A N ALA 83.A O no hydrogen 2.865 N/A ASP 88.A N GLN 84.A O no hydrogen 2.932 N/A TRP 89.A N ASP 85.A O no hydrogen 3.018 N/A LEU 90.A N PHE 86.A O no hydrogen 3.007 N/A GLN 91.A N TYR 87.A O no hydrogen 3.111 N/A GLU 92.A N ASP 88.A O no hydrogen 3.271 N/A GLU 92.A N TRP 89.A O no hydrogen 3.149 N/A THR 93.A N TRP 89.A O no hydrogen 2.824 N/A VAL 95.A N THR 93.A OG1 no hydrogen 3.273 N/A LEU 97.A N LEU 129.A O no hydrogen 2.708 N/A SER 98.A N ASP 96.A OD1 no hydrogen 2.953 N/A SER 98.A OG ASP 96.A OD1 no hydrogen 2.748 N/A VAL 100.A N LEU 97.A O no hydrogen 2.945 N/A LYS 101.A NZ HIS 164.A NE2 no hydrogen 2.735 N/A PHE 102.A N GLN 132.A O no hydrogen 3.041 N/A ALA 103.A N VAL 67.A O no hydrogen 3.171 N/A PHE 105.A N PHE 69.A O no hydrogen 2.761 N/A GLY 106.A N GLY 138.A O no hydrogen 2.797 N/A LEU 107.A N MET 71.A O no hydrogen 2.830 N/A GLY 108.A N GLY 140.A O no hydrogen 2.890 N/A LYS 110.A N ASP 141.A OD1 no hydrogen 3.145 N/A LYS 110.A NZ ASP 141.A OD2 no hydrogen 2.631 N/A LYS 110.A NZ ASP 143.A OD2 no hydrogen 3.082 N/A THR 111.A N ASN 109.A OD1 no hydrogen 2.887 N/A THR 111.A OG1 ASN 109.A OD1 no hydrogen 2.755 N/A TYR 112.A N ASN 109.A O no hydrogen 3.264 N/A TYR 112.A OH VAL 605.A O no hydrogen 3.363 N/A ASN 116.A ND2 GLY 106.A O no hydrogen 3.606 N/A ASN 116.A ND2 GLY 140.A O no hydrogen 3.324 N/A ALA 117.A N HIS 114.A O no hydrogen 3.409 N/A MET 118.A N THR 73.A OG1 no hydrogen 2.865 N/A LYS 120.A N ASN 116.A O no hydrogen 2.957 N/A TYR 121.A N ALA 117.A O no hydrogen 2.941 N/A VAL 122.A N MET 118.A O no hydrogen 2.962 N/A ASP 123.A N GLY 119.A O no hydrogen 3.011 N/A LYS 124.A N LYS 120.A O no hydrogen 2.891 N/A ARG 125.A N TYR 121.A O no hydrogen 2.772 N/A ARG 125.A NE LEU 90.A O no hydrogen 2.594 N/A ARG 125.A NH1 GLN 128.A OE1 no hydrogen 3.003 N/A ARG 125.A NH2 LEU 90.A O no hydrogen 2.862 N/A LEU 126.A N VAL 122.A O no hydrogen 3.009 N/A GLN 128.A N LYS 124.A O no hydrogen 3.286 N/A LEU 129.A N ARG 125.A O no hydrogen 3.114 N/A GLY 130.A N GLU 127.A O no hydrogen 2.911 N/A ALA 131.A N LEU 126.A O no hydrogen 2.870 N/A GLN 132.A N VAL 100.A O no hydrogen 2.768 N/A ARG 133.A NE ASP 123.A OD2 no hydrogen 2.677 N/A ARG 133.A NH1 GLU 127.A OE2 no hydrogen 3.009 N/A ARG 133.A NH2 ASP 123.A O no hydrogen 3.353 N/A ARG 133.A NH2 ASP 123.A OD1 no hydrogen 2.831 N/A ARG 133.A NH2 ASP 123.A OD2 no hydrogen 3.449 N/A ARG 133.A NH2 GLU 127.A OE2 no hydrogen 2.781 N/A ILE 134.A N PHE 102.A O no hydrogen 2.790 N/A GLY 138.A N VAL 104.A O no hydrogen 2.929 N/A GLY 140.A N GLY 106.A O no hydrogen 2.808 N/A ASP 141.A N ASP 149.A OD2 no hydrogen 2.784 N/A ASP 142.A N GLY 108.A O no hydrogen 2.811 N/A ASP 143.A N ASP 141.A OD1 no hydrogen 2.689 N/A GLY 144.A N ASP 141.A O no hydrogen 2.959 N/A GLU 148.A N ASN 145.A OD1 no hydrogen 2.873 N/A ASP 149.A N ASN 145.A O no hydrogen 3.219 N/A PHE 150.A N LEU 146.A O no hydrogen 2.772 N/A ILE 151.A N GLU 147.A O no hydrogen 2.953 N/A THR 152.A N GLU 148.A O no hydrogen 3.036 N/A THR 152.A OG1 GLU 148.A O no hydrogen 2.586 N/A TRP 153.A N ASP 149.A O no hydrogen 2.978 N/A TRP 153.A NE1 GLU 136.A O no hydrogen 2.942 N/A ARG 154.A N PHE 150.A O no hydrogen 2.712 N/A GLU 155.A N ILE 151.A O no hydrogen 3.119 N/A GLN 156.A N THR 152.A O no hydrogen 3.355 N/A PHE 157.A N TRP 153.A O no hydrogen 2.755 N/A TRP 158.A N ARG 154.A O no hydrogen 3.047 N/A TRP 158.A NE1 ASP 35.A OD2 no hydrogen 2.979 N/A LEU 159.A N GLU 155.A O no hydrogen 3.330 N/A ALA 160.A N GLN 156.A O no hydrogen 3.064 N/A VAL 161.A N PHE 157.A O no hydrogen 2.889 N/A CYS 162.A N TRP 158.A O no hydrogen 2.802 N/A CYS 162.A SG TRP 158.A O no hydrogen 3.368 N/A GLU 163.A N LEU 159.A O no hydrogen 3.010 N/A HIS 164.A N ALA 160.A O no hydrogen 2.857 N/A PHE 165.A N VAL 161.A O no hydrogen 2.888 N/A GLY 166.A N CYS 162.A O no hydrogen 2.806 N/A THR 170.A N ARG 38.A O no hydrogen 3.056 N/A ARG 173.A NE GLU 376.A OE2 no hydrogen 2.754 N/A ARG 173.A NH2 ASP 372.A OD2 no hydrogen 3.425 N/A ARG 173.A NH2 GLU 376.A OE2 no hydrogen 3.013 N/A GLN 174.A N GLU 376.A OE1 no hydrogen 2.660 N/A TYR 175.A N GLU 376.A OE2 no hydrogen 3.249 N/A GLU 176.A N ASN 279.A O no hydrogen 2.963 N/A VAL 178.A N SER 277.A O no hydrogen 2.819 N/A HIS 180.A N VAL 275.A O no hydrogen 3.122 N/A LYS 187.A N ASP 184.A O no hydrogen 2.745 N/A VAL 188.A N ALA 185.A O no hydrogen 3.314 N/A TYR 189.A N PRO 294.A O no hydrogen 3.089 N/A TYR 189.A OH GLY 194.A O no hydrogen 2.663 N/A MET 190.A N GLU 192.A OE1 no hydrogen 2.534 N/A GLU 192.A N GLU 192.A OE1 no hydrogen 2.715 N/A LYS 197.A N GLU 192.A OE2 no hydrogen 2.998 N/A LYS 197.A NZ GLU 200.A OE1 no hydrogen 3.474 N/A SER 198.A N ARG 195.A O no hydrogen 3.229 N/A SER 198.A OG MET 193.A O no hydrogen 3.328 N/A SER 198.A OG ARG 195.A O no hydrogen 2.879 N/A ASN 201.A N LYS 197.A O no hydrogen 2.816 N/A GLN 202.A NE2 SER 198.A O no hydrogen 3.066 N/A GLN 202.A NE2 PRO 211.A O no hydrogen 3.194 N/A ASP 207.A N ASN 210.A O no hydrogen 3.107 N/A ASN 210.A N ASP 207.A O no hydrogen 2.943 N/A ASN 210.A ND2 LYS 203.A O no hydrogen 3.044 N/A ASN 210.A ND2 PRO 205.A O no hydrogen 2.984 N/A PHE 212.A N MET 441.A O no hydrogen 2.794 N/A LEU 213.A N GLN 202.A OE1 no hydrogen 2.662 N/A THR 217.A N GLU 234.A O no hydrogen 2.934 N/A THR 217.A OG1 GLU 234.A O no hydrogen 3.333 N/A THR 218.A N GLU 234.A O no hydrogen 3.491 N/A THR 218.A OG1 GLU 234.A OE2 no hydrogen 3.056 N/A ASN 219.A ND2 LEU 424.A O no hydrogen 2.933 N/A ASN 219.A ND2 ARG 425.A O no hydrogen 3.623 N/A ASN 219.A ND2 LYS 427.A O no hydrogen 2.882 N/A ARG 220.A N HIS 232.A O no hydrogen 3.098 N/A ARG 220.A NH2 GLU 508.A OE2 no hydrogen 3.032 N/A LYS 221.A NZ ASN 223.A O no hydrogen 2.513 N/A LYS 221.A NZ GLY 225.A O no hydrogen 2.993 N/A LEU 222.A N LEU 230.A O no hydrogen 2.599 N/A ASN 223.A ND2 ARG 228.A O no hydrogen 2.800 N/A GLN 224.A NE2 GLN 224.A O no hydrogen 3.501 N/A GLY 225.A N GLU 501.A O no hydrogen 2.837 N/A GLU 227.A N GLU 501.A OE2 no hydrogen 3.337 N/A ARG 228.A NH2 ASP 502.A OD2 no hydrogen 3.064 N/A LEU 230.A N ASN 223.A OD1 no hydrogen 3.029 N/A MET 231.A N ALA 403.A O no hydrogen 2.905 N/A HIS 232.A N ARG 220.A O no hydrogen 2.825 N/A HIS 232.A ND1 TYR 505.A OH no hydrogen 2.709 N/A HIS 232.A NE2 GLU 234.A OE1 no hydrogen 2.978 N/A LEU 233.A N ILE 401.A O no hydrogen 2.821 N/A GLU 234.A N THR 218.A O no hydrogen 3.144 N/A LEU 235.A N VAL 399.A O no hydrogen 2.816 N/A ASP 236.A N ALA 215.A O no hydrogen 2.925 N/A ILE 237.A N ASN 397.A O no hydrogen 2.920 N/A SER 238.A N ASP 236.A OD1 no hydrogen 3.111 N/A SER 238.A OG ASP 236.A OD1 no hydrogen 2.548 N/A SER 240.A OG ILE 237.A O no hydrogen 2.570 N/A ILE 242.A N SER 240.A OG no hydrogen 3.207 N/A TYR 244.A OH SER 390.A OG no hydrogen 3.163 N/A TYR 244.A OH HIS 395.A O no hydrogen 2.874 N/A TYR 244.A OH SER 398.A O no hydrogen 2.773 N/A GLU 245.A N ASP 248.A OD2 no hydrogen 2.772 N/A SER 246.A OG SER 390.A O no hydrogen 3.291 N/A ASP 248.A N GLU 245.A O no hydrogen 3.056 N/A HIS 249.A N ARG 444.A O no hydrogen 3.050 N/A VAL 250.A N TYR 386.A O no hydrogen 2.764 N/A ALA 251.A N PHE 442.A O no hydrogen 2.875 N/A VAL 252.A N ARG 384.A O no hydrogen 2.933 N/A TYR 253.A N PRO 440.A O no hydrogen 2.727 N/A TYR 253.A OH ALA 208.A O no hydrogen 2.931 N/A ASN 256.A N THR 302.A O no hydrogen 2.944 N/A ASN 256.A ND2 LEU 301.A O no hydrogen 2.800 N/A ASN 256.A ND2 LEU 305.A O no hydrogen 3.074 N/A ALA 259.A N ASP 257.A OD1 no hydrogen 2.810 N/A VAL 261.A N ASP 257.A O no hydrogen 3.058 N/A ASN 262.A N SER 258.A O no hydrogen 2.884 N/A GLN 263.A N ALA 259.A O no hydrogen 2.974 N/A GLN 263.A NE2 ALA 259.A O no hydrogen 3.587 N/A LEU 264.A N LEU 260.A O no hydrogen 3.110 N/A GLY 265.A N VAL 261.A O no hydrogen 3.110 N/A LYS 266.A N ASN 262.A O no hydrogen 3.094 N/A ILE 267.A N GLN 263.A O no hydrogen 2.903 N/A LEU 268.A N LEU 264.A O no hydrogen 3.074 N/A LEU 268.A N GLY 265.A O no hydrogen 3.024 N/A GLY 269.A N LYS 266.A O no hydrogen 3.081 N/A ALA 270.A N GLY 265.A O no hydrogen 3.158 N/A ASP 273.A N ASP 271.A OD1 no hydrogen 2.927 N/A MET 276.A N THR 295.A O no hydrogen 3.016 N/A SER 277.A N VAL 178.A O no hydrogen 2.811 N/A SER 277.A OG ASN 279.A OD1 no hydrogen 2.892 N/A ASN 279.A N GLU 176.A O no hydrogen 2.969 N/A ASN 280.A N LYS 288.A O no hydrogen 2.874 N/A ASN 280.A ND2 LYS 287.A O no hydrogen 2.728 N/A LEU 281.A N GLN 174.A O no hydrogen 2.976 N/A ASP 282.A N ASN 280.A OD1 no hydrogen 2.863 N/A GLU 283.A N GLU 283.A OE1 no hydrogen 2.573 N/A GLU 284.A N ASP 282.A OD1 no hydrogen 2.968 N/A SER 285.A N ASP 282.A O no hydrogen 3.080 N/A LYS 287.A N SER 285.A OG no hydrogen 3.012 N/A LYS 287.A NZ GLU 26.A OE1 no hydrogen 2.956 N/A HIS 289.A ND1 LEU 278.A O no hydrogen 2.863 N/A CYS 293.A SG PHE 291.A O no hydrogen 3.370 N/A THR 295.A N MET 276.A O no hydrogen 2.939 N/A THR 295.A OG1 TYR 189.A O no hydrogen 2.791 N/A SER 296.A OG THR 299.A OG1 no hydrogen 3.037 N/A TYR 297.A N VAL 274.A O no hydrogen 3.248 N/A ARG 298.A N LEU 272.A O no hydrogen 2.727 N/A ARG 298.A NE ASP 273.A OD1 no hydrogen 2.948 N/A ARG 298.A NH1 ASN 262.A OD1 no hydrogen 2.968 N/A ARG 298.A NH2 ASP 273.A OD1 no hydrogen 2.954 N/A ARG 298.A NH2 ASP 273.A OD2 no hydrogen 3.179 N/A THR 299.A N SER 296.A OG no hydrogen 3.263 N/A THR 299.A OG1 SER 296.A OG no hydrogen 3.037 N/A ALA 300.A N SER 296.A O no hydrogen 2.973 N/A LEU 301.A N TYR 297.A O no hydrogen 2.854 N/A THR 302.A N ARG 298.A O no hydrogen 2.938 N/A THR 302.A N THR 299.A O no hydrogen 3.191 N/A THR 302.A OG1 ARG 298.A O no hydrogen 2.762 N/A TYR 303.A N THR 299.A O no hydrogen 2.854 N/A TYR 304.A N ALA 300.A O no hydrogen 2.917 N/A TYR 304.A OH GLU 192.A O no hydrogen 2.673 N/A LEU 305.A N ALA 300.A O no hydrogen 3.010 N/A ASP 306.A N PRO 379.A O no hydrogen 2.773 N/A THR 308.A N ASP 306.A OD1 no hydrogen 3.207 N/A THR 308.A OG1 ASP 306.A OD1 no hydrogen 3.435 N/A ASN 309.A N ASP 306.A OD1 no hydrogen 2.985 N/A ARG 312.A NE GLU 27.A OE1 no hydrogen 2.809 N/A ARG 312.A NE GLU 27.A OE2 no hydrogen 3.138 N/A ARG 312.A NH2 GLU 27.A OE2 no hydrogen 2.857 N/A THR 313.A N GLU 147.A OE2 no hydrogen 2.880 N/A THR 313.A OG1 GLU 147.A OE2 no hydrogen 2.568 N/A VAL 315.A N ARG 312.A O no hydrogen 3.181 N/A LEU 316.A N ARG 312.A O no hydrogen 3.416 N/A TYR 317.A N THR 313.A O no hydrogen 3.087 N/A GLU 318.A N ASN 314.A O no hydrogen 3.182 N/A LEU 319.A N VAL 315.A O no hydrogen 3.297 N/A ALA 320.A N LEU 316.A O no hydrogen 3.141 N/A ALA 320.A N TYR 317.A O no hydrogen 3.145 N/A GLN 321.A N GLU 318.A O no hydrogen 3.395 N/A TYR 322.A N LEU 319.A O no hydrogen 2.761 N/A TYR 322.A OH HIS 373.A ND1 no hydrogen 2.825 N/A ALA 323.A N ALA 320.A O no hydrogen 2.954 N/A GLN 329.A N GLU 325.A O no hydrogen 3.122 N/A GLU 330.A N PRO 326.A O no hydrogen 3.014 N/A LEU 331.A N SER 327.A O no hydrogen 3.191 N/A LEU 332.A N GLU 328.A O no hydrogen 3.325 N/A ARG 333.A N GLN 329.A O no hydrogen 2.851 N/A LYS 334.A N GLU 330.A O no hydrogen 3.177 N/A LYS 334.A NZ GLU 341.A OE1 no hydrogen 2.988 N/A ALA 336.A N ARG 333.A O no hydrogen 3.487 N/A SER 337.A N LYS 334.A O no hydrogen 2.834 N/A SER 337.A OG LYS 334.A O no hydrogen 2.943 N/A SER 338.A OG GLU 155.A OE2 no hydrogen 2.723 N/A GLU 344.A N GLY 340.A O no hydrogen 3.237 N/A LEU 345.A N GLU 341.A O no hydrogen 2.964 N/A TYR 346.A N GLY 342.A O no hydrogen 3.080 N/A TYR 346.A OH PRO 311.A O no hydrogen 2.838 N/A LEU 347.A N LYS 343.A O no hydrogen 2.996 N/A SER 348.A N GLU 344.A O no hydrogen 2.892 N/A TRP 349.A N LEU 345.A O no hydrogen 2.557 N/A VAL 350.A N TYR 346.A O no hydrogen 2.930 N/A VAL 351.A N TYR 346.A O no hydrogen 3.098 N/A GLU 352.A N LEU 347.A O no hydrogen 2.692 N/A ALA 353.A N SER 348.A O no hydrogen 3.168 N/A ARG 354.A N VAL 351.A O no hydrogen 2.797 N/A ARG 354.A NH2 VAL 351.A O no hydrogen 2.905 N/A ARG 355.A N VAL 350.A O no hydrogen 3.027 N/A ARG 355.A NE ASP 363.A OD2 no hydrogen 2.644 N/A ARG 355.A NH1 TRP 349.A O no hydrogen 2.960 N/A ARG 355.A NH2 ASP 363.A OD2 no hydrogen 2.763 N/A ALA 359.A N HIS 356.A ND1 no hydrogen 3.099 N/A ILE 360.A N HIS 356.A O no hydrogen 3.023 N/A LEU 361.A N ILE 357.A O no hydrogen 2.997 N/A GLN 362.A N LEU 358.A O no hydrogen 2.917 N/A ASP 363.A N ALA 359.A O no hydrogen 2.978 N/A CYS 364.A SG ASP 363.A O no hydrogen 3.206 N/A SER 366.A N GLU 328.A OE1 no hydrogen 2.834 N/A SER 366.A OG GLU 328.A OE1 no hydrogen 2.355 N/A LEU 367.A N CYS 364.A O no hydrogen 2.952 N/A ARG 368.A N TYR 322.A O no hydrogen 2.984 N/A ARG 368.A NE PRO 365.A O no hydrogen 2.512 N/A ARG 368.A NH2 PRO 365.A O no hydrogen 2.783 N/A HIS 373.A N PRO 370.A O no hydrogen 2.989 N/A HIS 373.A ND1 TYR 322.A OH no hydrogen 2.825 N/A LEU 374.A N PRO 370.A O no hydrogen 3.295 N/A CYS 375.A N ILE 371.A O no hydrogen 3.065 N/A CYS 375.A SG ILE 371.A O no hydrogen 3.552 N/A GLU 376.A N HIS 373.A O no hydrogen 2.851 N/A LEU 377.A N HIS 373.A O no hydrogen 3.077 N/A LEU 378.A N LEU 374.A O no hydrogen 2.909 N/A ARG 380.A NE TYR 304.A O no hydrogen 2.958 N/A LEU 381.A N TYR 304.A O no hydrogen 2.767 N/A GLN 382.A NE2 ARG 380.A O no hydrogen 3.241 N/A ARG 384.A N VAL 252.A O no hydrogen 2.932 N/A ARG 384.A NH2 GLN 382.A O no hydrogen 2.711 N/A TYR 386.A N VAL 250.A O no hydrogen 2.803 N/A SER 387.A OG ASP 604.A OD2 no hydrogen 2.942 N/A ILE 388.A N ASP 248.A O no hydrogen 3.080 N/A ALA 389.A N HIS 400.A O no hydrogen 2.831 N/A SER 390.A OG TYR 244.A OH no hydrogen 3.163 N/A SER 391.A N GLN 475.A OE1 no hydrogen 3.103 N/A SER 391.A OG GLU 476.A OE1 no hydrogen 2.848 N/A SER 392.A OG TYR 244.A O no hydrogen 2.740 N/A SER 392.A OG GLU 245.A OE2 no hydrogen 3.319 N/A LYS 393.A N SER 391.A OG no hydrogen 3.020 N/A LYS 393.A NZ GLU 245.A OE1 no hydrogen 3.533 N/A LYS 393.A NZ GLU 476.A OE2 no hydrogen 2.973 N/A VAL 394.A N SER 391.A O no hydrogen 3.024 N/A HIS 395.A N SER 391.A O no hydrogen 2.771 N/A SER 398.A N HIS 395.A O no hydrogen 3.295 N/A SER 398.A OG LEU 235.A O no hydrogen 3.503 N/A VAL 399.A N LEU 235.A O no hydrogen 2.868 N/A HIS 400.A N SER 390.A OG no hydrogen 2.944 N/A ILE 401.A N LEU 233.A O no hydrogen 2.877 N/A ALA 403.A N MET 231.A O no hydrogen 2.960 N/A VAL 405.A N HIS 229.A O no hydrogen 2.896 N/A VAL 406.A N THR 421.A OG1 no hydrogen 2.851 N/A TYR 408.A N ASN 416.A O no hydrogen 3.114 N/A THR 410.A N ARG 414.A O no hydrogen 2.721 N/A THR 410.A OG1 ARG 414.A O no hydrogen 3.236 N/A GLY 413.A N THR 410.A O no hydrogen 3.144 N/A ARG 414.A N THR 410.A OG1 no hydrogen 2.846 N/A ARG 414.A NE GLN 362.A OE1 no hydrogen 3.049 N/A ARG 414.A NH1 GLN 362.A OE1 no hydrogen 2.867 N/A ARG 414.A NH1 ASP 363.A OD1 no hydrogen 2.486 N/A ARG 414.A NH2 ASP 363.A OD2 no hydrogen 2.899 N/A ASN 416.A N TYR 408.A O no hydrogen 2.857 N/A ASN 416.A ND2 ARG 354.A O no hydrogen 2.984 N/A ASN 416.A ND2 TYR 408.A OH no hydrogen 2.940 N/A GLY 418.A N VAL 406.A O no hydrogen 2.650 N/A ASN 422.A N GLY 418.A O no hydrogen 3.162 N/A ASN 422.A ND2 VAL 406.A O no hydrogen 3.316 N/A ASN 422.A ND2 GLY 418.A O no hydrogen 3.315 N/A TRP 423.A N VAL 419.A O no hydrogen 3.304 N/A LEU 424.A N ALA 420.A O no hydrogen 2.792 N/A ARG 425.A N THR 421.A O no hydrogen 2.928 N/A ALA 426.A N ASN 422.A O no hydrogen 3.302 N/A ALA 426.A N TRP 423.A O no hydrogen 3.111 N/A LYS 427.A N LEU 424.A O no hydrogen 3.179 N/A LYS 427.A NZ LEU 438.A O no hydrogen 3.032 N/A VAL 430.A N VAL 216.A O no hydrogen 2.815 N/A GLY 434.A N GLY 431.A O no hydrogen 2.795 N/A MET 441.A N PHE 212.A O no hydrogen 3.033 N/A PHE 442.A N ALA 251.A O no hydrogen 3.197 N/A ARG 444.A N HIS 249.A O no hydrogen 2.883 N/A ARG 444.A NH2 ASP 81.A OD1 no hydrogen 2.573 N/A SER 446.A N ASP 248.A OD1 no hydrogen 3.051 N/A SER 446.A OG GLY 247.A O no hydrogen 2.827 N/A PHE 448.A N SER 446.A OG no hydrogen 3.200 N/A ARG 449.A NH1 ASP 248.A OD1 no hydrogen 2.847 N/A ARG 449.A NH1 PHE 448.A O no hydrogen 2.895 N/A ARG 449.A NH2 ASP 248.A OD1 no hydrogen 2.832 N/A THR 456.A N LYS 453.A O no hydrogen 3.155 N/A VAL 458.A N GLU 489.A O no hydrogen 2.889 N/A ILE 459.A N HIS 555.A O no hydrogen 2.796 N/A MET 460.A N LEU 491.A O no hydrogen 2.927 N/A VAL 461.A N TYR 557.A O no hydrogen 2.799 N/A GLY 462.A N TYR 493.A O no hydrogen 3.039 N/A GLY 464.A N GLY 495.A O no hydrogen 2.870 N/A GLY 466.A N PRO 463.A O no hydrogen 3.170 N/A VAL 467.A N GLY 464.A O no hydrogen 3.090 N/A ALA 468.A N THR 465.A O no hydrogen 2.864 N/A ILE 471.A N VAL 467.A O no hydrogen 3.243 N/A ILE 471.A N ALA 468.A O no hydrogen 3.274 N/A PHE 473.A N PRO 469.A O no hydrogen 2.914 N/A ILE 474.A N PHE 470.A O no hydrogen 2.729 N/A GLN 475.A N ILE 471.A O no hydrogen 2.972 N/A GLU 476.A N GLY 472.A O no hydrogen 2.969 N/A ARG 477.A N PHE 473.A O no hydrogen 2.956 N/A ARG 477.A NE THR 490.A OG1 no hydrogen 3.035 N/A ARG 477.A NH1 THR 456.A O no hydrogen 3.365 N/A ARG 477.A NH2 THR 456.A O no hydrogen 2.836 N/A ARG 477.A NH2 GLU 489.A O no hydrogen 3.509 N/A ALA 478.A N ILE 474.A O no hydrogen 3.048 N/A TRP 479.A N GLN 475.A O no hydrogen 3.087 N/A LEU 480.A N GLU 476.A O no hydrogen 2.788 N/A ARG 481.A N ARG 477.A O no hydrogen 2.980 N/A ARG 481.A NH2 ASP 515.A O no hydrogen 3.139 N/A GLN 482.A N ALA 478.A O no hydrogen 2.816 N/A GLN 483.A N TRP 479.A O no hydrogen 2.924 N/A GLY 484.A N ARG 481.A O no hydrogen 2.920 N/A LYS 485.A N LEU 480.A O no hydrogen 3.343 N/A GLY 488.A N ALA 454.A O no hydrogen 3.077 N/A THR 490.A N THR 519.A OG1 no hydrogen 2.873 N/A THR 490.A OG1 GLY 488.A O no hydrogen 3.502 N/A LEU 491.A N VAL 458.A O no hydrogen 3.039 N/A LEU 492.A N GLN 520.A O no hydrogen 2.963 N/A TYR 493.A N MET 460.A O no hydrogen 2.676 N/A TYR 493.A OH ASP 542.A OD2 no hydrogen 3.008 N/A TYR 494.A N ASN 522.A O no hydrogen 2.792 N/A TYR 494.A OH ASP 502.A O no hydrogen 3.234 N/A CYS 496.A N ALA 524.A O no hydrogen 2.965 N/A CYS 496.A SG ARG 498.A O no hydrogen 3.731 N/A ARG 497.A N ASP 502.A OD1 no hydrogen 3.214 N/A ARG 498.A NE ASP 500.A OD1 no hydrogen 3.126 N/A SER 499.A N GLU 528.A OE1 no hydrogen 3.029 N/A SER 499.A OG GLU 528.A OE1 no hydrogen 3.035 N/A GLU 501.A N ARG 498.A O no hydrogen 3.211 N/A ASP 502.A N ARG 498.A O no hydrogen 3.323 N/A LEU 504.A N TYR 494.A OH no hydrogen 2.840 N/A TYR 505.A OH HIS 232.A ND1 no hydrogen 2.709 N/A GLU 508.A N GLU 508.A OE1 no hydrogen 2.635 N/A LEU 509.A N TYR 505.A O no hydrogen 2.844 N/A ALA 510.A N ARG 506.A O no hydrogen 2.967 N/A GLN 511.A N GLU 507.A O no hydrogen 2.927 N/A GLN 511.A NE2 ASP 515.A OD1 no hydrogen 3.039 N/A PHE 512.A N GLU 508.A O no hydrogen 2.973 N/A HIS 513.A N LEU 509.A O no hydrogen 3.044 N/A ARG 514.A N ALA 510.A O no hydrogen 3.049 N/A ASP 515.A N GLN 511.A O no hydrogen 2.869 N/A GLY 516.A N HIS 513.A O no hydrogen 3.365 N/A LEU 518.A N PHE 512.A O no hydrogen 3.110 N/A THR 519.A N THR 490.A O no hydrogen 2.847 N/A GLN 520.A N THR 490.A O no hydrogen 3.413 N/A ASN 522.A N LEU 492.A O no hydrogen 2.990 N/A ASN 522.A ND2 GLN 520.A OE1 no hydrogen 3.186 N/A ALA 524.A N TYR 494.A O no hydrogen 2.989 N/A SER 526.A N CYS 496.A O no hydrogen 2.827 N/A SER 526.A OG CYS 496.A O no hydrogen 3.204 N/A ARG 527.A N ARG 497.A O no hydrogen 2.998 N/A GLN 529.A NE2 PHE 525.A O no hydrogen 3.150 N/A GLN 529.A NE2 HIS 531.A O no hydrogen 2.674 N/A SER 530.A OG HIS 531.A ND1 no hydrogen 3.135 N/A HIS 531.A N HIS 531.A ND1 no hydrogen 2.735 N/A HIS 531.A ND1 SER 530.A OG no hydrogen 3.135 N/A TYR 534.A N HIS 537.A ND1 no hydrogen 2.986 N/A GLN 536.A N GLN 536.A OE1 no hydrogen 2.833 N/A HIS 537.A N TYR 534.A O no hydrogen 3.125 N/A LEU 538.A N TYR 534.A O no hydrogen 3.462 N/A LEU 539.A N VAL 535.A O no hydrogen 2.881 N/A LYS 540.A N GLN 536.A O no hydrogen 2.940 N/A GLN 541.A N HIS 537.A O no hydrogen 3.110 N/A ASP 542.A N LEU 538.A O no hydrogen 3.228 N/A ASP 542.A N LEU 539.A O no hydrogen 3.234 N/A ARG 543.A N LYS 540.A O no hydrogen 2.768 N/A ARG 543.A NE GLU 579.A OE1 no hydrogen 3.129 N/A ARG 543.A NH2 GLU 579.A OE1 no hydrogen 2.794 N/A HIS 545.A NE2 GLU 489.A OE1 no hydrogen 2.670 N/A LEU 546.A N ASP 542.A O no hydrogen 3.082 N/A TRP 547.A N ARG 543.A O no hydrogen 3.013 N/A LYS 548.A N GLU 544.A O no hydrogen 3.289 N/A LEU 549.A N HIS 545.A O no hydrogen 2.959 N/A ILE 550.A N LEU 546.A O no hydrogen 2.739 N/A GLU 551.A N TRP 547.A O no hydrogen 2.721 N/A GLY 552.A N LYS 548.A O no hydrogen 2.935 N/A GLY 553.A N ILE 550.A O no hydrogen 3.038 N/A ALA 554.A N LEU 549.A O no hydrogen 2.945 N/A HIS 555.A N PRO 457.A O no hydrogen 3.054 N/A ILE 556.A N ARG 600.A O no hydrogen 2.752 N/A TYR 557.A N ILE 459.A O no hydrogen 2.809 N/A TYR 557.A OH ARG 449.A O no hydrogen 2.397 N/A VAL 558.A N SER 602.A O no hydrogen 2.887 N/A CYS 559.A N VAL 461.A O no hydrogen 2.938 N/A CYS 559.A SG GLY 466.A O no hydrogen 3.189 N/A CYS 559.A SG ASP 604.A O no hydrogen 3.340 N/A CYS 559.A SG ASP 604.A OD2 no hydrogen 3.478 N/A GLY 560.A N ASP 604.A O no hydrogen 3.110 N/A ALA 562.A N TRP 606.A O no hydrogen 3.040 N/A ASN 564.A N ASP 561.A OD2 no hydrogen 3.005 N/A MET 565.A N ASP 561.A OD2 no hydrogen 3.088 N/A ALA 566.A N ASP 561.A O no hydrogen 3.128 N/A ARG 567.A NH2 ASN 564.A OD1 no hydrogen 3.014 N/A ASP 568.A N ASN 564.A O no hydrogen 2.927 N/A VAL 569.A N MET 565.A O no hydrogen 2.881 N/A GLN 570.A N ALA 566.A O no hydrogen 3.017 N/A GLN 570.A NE2 GLU 113.A OE2 no hydrogen 3.223 N/A GLN 570.A NE2 TYR 574.A OH no hydrogen 2.736 N/A ASN 571.A N ARG 567.A O no hydrogen 3.128 N/A THR 572.A N ASP 568.A O no hydrogen 2.967 N/A THR 572.A OG1 ASP 568.A O no hydrogen 3.053 N/A PHE 573.A N VAL 569.A O no hydrogen 3.046 N/A TYR 574.A N GLN 570.A O no hydrogen 2.999 N/A ASP 575.A N ASN 571.A O no hydrogen 2.986 N/A ILE 576.A N THR 572.A O no hydrogen 2.741 N/A VAL 577.A N PHE 573.A O no hydrogen 3.059 N/A ALA 578.A N TYR 574.A O no hydrogen 2.817 N/A GLU 579.A N ASP 575.A O no hydrogen 2.942 N/A LEU 580.A N ILE 576.A O no hydrogen 2.986 N/A GLY 581.A N VAL 577.A O no hydrogen 2.775 N/A GLU 584.A N GLN 587.A OE1 no hydrogen 2.759 N/A GLN 587.A N GLU 584.A O no hydrogen 2.823 N/A ALA 588.A N GLU 584.A O no hydrogen 2.958 N/A VAL 589.A N HIS 585.A O no hydrogen 2.957 N/A ASP 590.A N ALA 586.A O no hydrogen 3.181 N/A TYR 591.A N GLN 587.A O no hydrogen 2.747 N/A ILE 592.A N ALA 588.A O no hydrogen 2.719 N/A LYS 593.A N VAL 589.A O no hydrogen 2.887 N/A LYS 593.A NZ GLU 113.A OE1 no hydrogen 3.138 N/A LYS 593.A NZ TYR 574.A OH no hydrogen 3.469 N/A LYS 594.A N ASP 590.A O no hydrogen 2.778 N/A LYS 594.A N TYR 591.A O no hydrogen 3.053 N/A LEU 595.A N TYR 591.A O no hydrogen 3.156 N/A LEU 595.A N ILE 592.A O no hydrogen 3.034 N/A MET 596.A N ILE 592.A O no hydrogen 3.344 N/A THR 597.A OG1 LYS 594.A O no hydrogen 2.842 N/A LYS 598.A N LYS 594.A O no hydrogen 3.107 N/A LYS 598.A N LEU 595.A O no hydrogen 3.091 N/A GLY 599.A N MET 596.A O no hydrogen 2.949 N/A ARG 600.A N LEU 595.A O no hydrogen 2.774 N/A ARG 600.A NE ALA 554.A O no hydrogen 3.491 N/A ARG 600.A NH2 ALA 554.A O no hydrogen 3.386 N/A SER 602.A N ILE 556.A O no hydrogen 2.797 N/A ASP 604.A N VAL 558.A O no hydrogen 2.819 N/A TRP 606.A N GLY 560.A O no hydrogen 2.940 N/A