Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 7dmr_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): SER 1.A OG LEU 175.A O no hydrogen 3.113 N/A VAL 4.A N TRP 2.A O no hydrogen 2.474 N/A CYS 6.A N GLU 3.A O no hydrogen 3.268 N/A CYS 6.A SG GLU 3.A O no hydrogen 3.538 N/A GLY 7.A N PHE 165.A O no hydrogen 2.688 N/A ASN 18.A N ASP 16.A OD1 no hydrogen 3.343 N/A SER 19.A N ASP 16.A O no hydrogen 3.312 N/A SER 19.A OG TYR 21.A O no hydrogen 3.386 N/A TYR 21.A N SER 19.A OG no hydrogen 3.002 N/A TYR 21.A OH GLU 295.A OE1 no hydrogen 2.428 N/A ARG 22.A NH1 ASP 526.A OD1 no hydrogen 2.852 N/A ARG 22.A NH1 ASP 526.A OD2 no hydrogen 3.325 N/A ARG 22.A NH2 ASP 526.A OD2 no hydrogen 2.676 N/A THR 23.A OG1 ASP 27.A O no hydrogen 2.669 N/A THR 25.A OG1 ASP 27.A OD2 no hydrogen 2.796 N/A GLY 26.A N THR 23.A OG1 no hydrogen 3.060 N/A ASP 27.A N THR 25.A OG1 no hydrogen 3.279 N/A CYS 28.A N PRO 34.A O no hydrogen 2.850 N/A ASN 29.A ND2 ASP 526.A OD1 no hydrogen 2.885 N/A ASN 30.A ND2 ASN 333.A O no hydrogen 2.905 N/A ARG 31.A NH2 GLU 17.A O no hydrogen 2.702 N/A SER 33.A N ASN 30.A OD1 no hydrogen 2.907 N/A LEU 36.A N SER 33.A O no hydrogen 3.017 N/A ALA 38.A N ALA 35.A O no hydrogen 2.972 N/A ALA 39.A N THR 25.A O no hydrogen 2.787 N/A ASN 40.A N ASN 181.A O no hydrogen 2.711 N/A ARG 41.A NH1 ASP 27.A OD2 no hydrogen 3.535 N/A LEU 43.A N GLN 179.A O no hydrogen 2.846 N/A ALA 44.A N ILE 339.A O no hydrogen 3.085 N/A ARG 45.A NE GLU 178.A OE2 no hydrogen 2.750 N/A ARG 45.A NH1 HIS 444.A O no hydrogen 2.895 N/A ARG 45.A NH2 ARG 177.A O no hydrogen 3.316 N/A ARG 45.A NH2 GLU 178.A OE2 no hydrogen 3.502 N/A ARG 45.A NH2 HIS 444.A O no hydrogen 2.945 N/A GLU 50.A N GLY 445.A O no hydrogen 2.680 N/A TYR 51.A OH ARG 177.A O no hydrogen 2.902 N/A GLU 52.A N LEU 57.A O no hydrogen 2.660 N/A GLY 54.A N TYR 51.A O no hydrogen 3.127 N/A LEU 55.A N ASP 53.A OD1 no hydrogen 2.915 N/A ALA 56.A N ASP 53.A OD1 no hydrogen 2.991 N/A LEU 57.A N ASP 53.A OD1 no hydrogen 3.126 N/A TRP 61.A N PRO 58.A O no hydrogen 3.102 N/A THR 62.A N GLU 52.A OE2 no hydrogen 2.930 N/A THR 62.A OG1 GLU 52.A OE1 no hydrogen 2.540 N/A GLN 63.A N GLN 63.A OE1 no hydrogen 2.738 N/A GLN 63.A NE2 TRP 61.A O no hydrogen 3.536 N/A LYS 65.A N THR 62.A O no hydrogen 3.030 N/A ARG 67.A N PHE 70.A O no hydrogen 2.671 N/A ARG 67.A NH2 GLU 50.A OE1 no hydrogen 3.266 N/A ARG 67.A NH2 MET 446.A O no hydrogen 3.139 N/A ASN 68.A ND2 ASN 489.A OD1 no hydrogen 3.011 N/A PHE 70.A N ARG 67.A O no hydrogen 3.051 N/A ARG 71.A NH1 GLN 63.A O no hydrogen 2.705 N/A ARG 76.A NE ASP 148.A OD2 no hydrogen 2.687 N/A ARG 76.A NH1 ARG 418.A O no hydrogen 3.241 N/A ARG 76.A NH1 ASN 419.A OD1 no hydrogen 3.031 N/A ARG 76.A NH1 ASP 432.A OD2 no hydrogen 2.969 N/A ARG 76.A NH2 ASP 148.A OD1 no hydrogen 3.197 N/A ARG 76.A NH2 ASN 419.A OD1 no hydrogen 2.972 N/A GLU 77.A N LEU 74.A O no hydrogen 3.070 N/A VAL 78.A N LEU 74.A O no hydrogen 3.051 N/A SER 79.A N ALA 75.A O no hydrogen 3.173 N/A SER 79.A OG ASP 432.A OD1 no hydrogen 3.422 N/A SER 79.A OG ASP 432.A OD2 no hydrogen 2.712 N/A ASN 80.A N ARG 76.A O no hydrogen 2.970 N/A ASN 80.A ND2 ASP 148.A OD2 no hydrogen 2.800 N/A LYS 81.A N GLU 77.A O no hydrogen 3.016 N/A ILE 82.A N VAL 78.A O no hydrogen 2.946 N/A VAL 83.A N SER 79.A O no hydrogen 2.795 N/A GLY 84.A N SER 79.A O no hydrogen 3.265 N/A TYR 85.A OH GLU 88.A OE1 no hydrogen 2.675 N/A TYR 85.A OH GLU 88.A OE2 no hydrogen 3.081 N/A GLU 89.A N ASP 87.A OD1 no hydrogen 3.062 N/A VAL 91.A N GLU 88.A O no hydrogen 3.311 N/A ASP 93.A N SER 404.A O no hydrogen 2.770 N/A GLN 94.A NE2 LEU 92.A O no hydrogen 3.536 N/A ASN 95.A N ASP 93.A OD1 no hydrogen 3.078 N/A ARG 96.A NH1 ASN 95.A O no hydrogen 2.881 N/A ARG 96.A NH2 ILE 315.A O no hydrogen 2.930 N/A SER 97.A N PHE 567.A O no hydrogen 2.999 N/A SER 97.A OG ALA 566.A O no hydrogen 2.771 N/A LEU 98.A N LYS 402.A O no hydrogen 3.030 N/A LEU 99.A N LEU 399.A O no hydrogen 3.326 N/A PHE 100.A N SER 97.A O no hydrogen 3.180 N/A MET 101.A N SER 404.A OG no hydrogen 3.245 N/A GLN 102.A N LEU 98.A O no hydrogen 3.091 N/A GLN 102.A NE2 GLN 102.A O no hydrogen 3.073 N/A GLN 102.A NE2 GLN 105.A OE1 no hydrogen 3.204 N/A TRP 103.A N LEU 99.A O no hydrogen 2.738 N/A TRP 103.A NE1 THR 308.A OG1 no hydrogen 3.201 N/A GLY 104.A N PHE 100.A O no hydrogen 3.359 N/A GLN 105.A N MET 101.A O no hydrogen 3.332 N/A GLN 105.A NE2 GLU 258.A OE1 no hydrogen 3.093 N/A ILE 106.A N GLN 102.A O no hydrogen 3.122 N/A VAL 107.A N TRP 103.A O no hydrogen 2.901 N/A ASP 108.A N GLY 104.A O no hydrogen 2.881 N/A HIS 109.A N GLN 105.A O no hydrogen 2.947 N/A ASP 110.A N ILE 106.A O no hydrogen 3.025 N/A LEU 111.A N VAL 107.A O no hydrogen 3.153 N/A LEU 111.A N ASP 108.A O no hydrogen 3.044 N/A ASP 112.A N ASP 108.A O no hydrogen 3.000 N/A PHE 113.A N ASN 181.A OD1 no hydrogen 2.933 N/A THR 117.A N ARG 162.A O no hydrogen 2.894 N/A THR 117.A OG1 ARG 162.A O no hydrogen 2.800 N/A SER 125.A N GLU 123.A OE1 no hydrogen 3.399 N/A SER 125.A OG GLU 123.A OE1 no hydrogen 3.496 N/A LYS 126.A NZ GLY 120.A O no hydrogen 2.722 N/A GLN 128.A N HIS 124.A O no hydrogen 2.808 N/A CYS 129.A N SER 125.A O no hydrogen 2.960 N/A CYS 129.A SG PHE 160.A O no hydrogen 3.884 N/A GLU 130.A N LYS 126.A O no hydrogen 2.767 N/A GLU 131.A N THR 127.A O no hydrogen 2.819 N/A CYS 133.A SG GLU 130.A O no hydrogen 3.893 N/A ILE 134.A N GLN 128.A O no hydrogen 3.148 N/A GLN 135.A NE2 TRP 61.A O no hydrogen 2.862 N/A GLY 136.A N CYS 139.A O no hydrogen 2.971 N/A CYS 139.A N GLY 136.A O no hydrogen 2.934 N/A CYS 139.A SG ILE 134.A O no hydrogen 3.107 N/A PHE 140.A N PHE 160.A O no hydrogen 2.987 N/A ILE 142.A N MET 158.A O no hydrogen 2.966 N/A PHE 144.A N LYS 156.A O no hydrogen 2.901 N/A ASP 148.A N PRO 145.A O no hydrogen 3.277 N/A LYS 150.A N ASP 148.A OD1 no hydrogen 2.915 N/A LYS 150.A NZ GLN 154.A OE1 no hydrogen 2.610 N/A LYS 150.A NZ ASN 419.A O no hydrogen 2.842 N/A LYS 150.A NZ GLY 430.A O no hydrogen 3.029 N/A LEU 151.A N ASP 148.A O no hydrogen 2.869 N/A LYS 152.A N PRO 149.A O no hydrogen 3.127 N/A THR 153.A N LYS 150.A O no hydrogen 3.240 N/A GLN 154.A N LYS 150.A O no hydrogen 2.739 N/A GLN 154.A NE2 GLY 430.A O no hydrogen 2.956 N/A GLY 155.A N LYS 150.A O no hydrogen 3.271 N/A CYS 157.A SG CYS 129.A O no hydrogen 3.928 N/A MET 158.A N ILE 142.A O no hydrogen 2.865 N/A PHE 161.A N GLU 116.A OE1 no hydrogen 3.193 N/A ARG 162.A N ASN 138.A O no hydrogen 2.866 N/A ARG 162.A NE ASP 443.A OD1 no hydrogen 2.777 N/A ARG 162.A NH1 ALA 56.A O no hydrogen 2.697 N/A ARG 162.A NH2 ALA 56.A O no hydrogen 2.839 N/A ARG 162.A NH2 ASP 443.A O no hydrogen 2.956 N/A ARG 162.A NH2 ASP 443.A OD1 no hydrogen 3.257 N/A ALA 163.A N ASP 443.A OD2 no hydrogen 2.744 N/A GLY 164.A N PRO 115.A O no hydrogen 2.813 N/A VAL 166.A N GLU 178.A O no hydrogen 2.897 N/A TYR 172.A N THR 169.A O no hydrogen 2.540 N/A ARG 177.A N LEU 55.A O no hydrogen 2.829 N/A GLN 179.A NE2 TYR 51.A OH no hydrogen 2.911 N/A ILE 180.A N GLY 164.A O no hydrogen 3.316 N/A ASN 181.A N ARG 41.A O no hydrogen 2.835 N/A ASN 181.A ND2 LEU 111.A O no hydrogen 3.085 N/A ALA 182.A N PHE 113.A O no hydrogen 2.879 N/A VAL 183.A N ASN 181.A OD1 no hydrogen 3.264 N/A THR 184.A N SER 195.A OG no hydrogen 3.297 N/A THR 184.A OG1 PHE 186.A O no hydrogen 3.480 N/A THR 184.A OG1 ASP 188.A OD2 no hydrogen 2.379 N/A THR 184.A OG1 SER 190.A OG no hydrogen 3.372 N/A SER 185.A N GLY 37.A O no hydrogen 2.959 N/A ASP 188.A N ASP 110.A OD1 no hydrogen 3.226 N/A ALA 189.A N ASP 110.A OD2 no hydrogen 2.752 N/A SER 190.A N ASP 188.A OD1 no hydrogen 3.121 N/A SER 190.A OG ASP 110.A OD1 no hydrogen 3.300 N/A SER 190.A OG THR 184.A OG1 no hydrogen 3.372 N/A SER 190.A OG ASP 188.A OD1 no hydrogen 3.062 N/A VAL 192.A N ALA 189.A O no hydrogen 3.011 N/A TYR 193.A N ALA 189.A O no hydrogen 3.287 N/A TYR 193.A OH HIS 273.A ND1 no hydrogen 2.632 N/A GLY 194.A N SER 190.A O no hydrogen 2.834 N/A SER 198.A N GLU 196.A OE1 no hydrogen 2.873 N/A LEU 199.A N GLU 196.A OE2 no hydrogen 2.786 N/A ALA 200.A N GLU 196.A O no hydrogen 3.110 N/A SER 201.A N PRO 197.A O no hydrogen 3.071 N/A ARG 202.A N SER 198.A O no hydrogen 3.076 N/A LEU 203.A N LEU 199.A O no hydrogen 2.866 N/A ARG 204.A N SER 201.A O no hydrogen 2.891 N/A ARG 204.A NH1 GLU 290.A OE1 no hydrogen 2.918 N/A ARG 204.A NH2 GLU 290.A OE1 no hydrogen 3.378 N/A ASN 205.A N LEU 212.A O no hydrogen 2.872 N/A SER 207.A N ASN 205.A OD1 no hydrogen 3.143 N/A MET 213.A N ASN 274.A OD1 no hydrogen 2.744 N/A ALA 214.A N LEU 203.A O no hydrogen 2.817 N/A ASN 216.A N TYR 226.A O no hydrogen 2.920 N/A ASN 216.A ND2 LEU 227.A O no hydrogen 2.995 N/A GLN 217.A NE2 VAL 215.A O no hydrogen 2.957 N/A GLU 218.A N ASN 216.A OD1 no hydrogen 2.913 N/A ASP 221.A N LEU 224.A O no hydrogen 2.914 N/A HIS 222.A ND1 HIS 558.A ND1 no hydrogen 3.119 N/A LEU 224.A N ASP 221.A O no hydrogen 2.863 N/A ASN 230.A N CYS 248.A O no hydrogen 2.765 N/A LYS 232.A N ASN 230.A OD1 no hydrogen 3.027 N/A LYS 233.A NZ GLU 238.A OE1 no hydrogen 2.456 N/A CYS 237.A SG PHE 381.A O no hydrogen 3.180 N/A GLU 238.A N SER 235.A OG no hydrogen 3.190 N/A PHE 239.A N SER 235.A O no hydrogen 2.997 N/A ILE 240.A N PRO 236.A O no hydrogen 3.216 N/A ASN 241.A N GLU 238.A O no hydrogen 3.157 N/A ALA 244.A N ASN 241.A OD1 no hydrogen 3.020 N/A ARG 245.A N ASN 241.A O no hydrogen 2.806 N/A PHE 249.A N SER 257.A OG no hydrogen 2.924 N/A LEU 250.A N PRO 228.A O no hydrogen 2.845 N/A ARG 255.A N ASP 253.A OD2 no hydrogen 2.902 N/A ARG 255.A NE ASP 253.A OD2 no hydrogen 2.891 N/A ARG 255.A NH1 ASP 112.A O no hydrogen 3.019 N/A ARG 255.A NH2 ASP 112.A O no hydrogen 3.431 N/A ARG 255.A NH2 ASP 253.A OD1 no hydrogen 2.720 N/A ARG 255.A NH2 ASP 253.A OD2 no hydrogen 3.476 N/A ALA 256.A N ASP 253.A O no hydrogen 3.376 N/A GLU 258.A N ARG 255.A O no hydrogen 2.958 N/A GLN 259.A NE2 GLN 102.A OE1 no hydrogen 2.931 N/A GLN 259.A NE2 GLN 105.A OE1 no hydrogen 2.950 N/A LEU 261.A N GLN 259.A OE1 no hydrogen 2.896 N/A ALA 263.A N GLN 259.A O no hydrogen 3.160 N/A THR 264.A N ILE 260.A O no hydrogen 2.977 N/A THR 264.A OG1 ILE 260.A O no hydrogen 2.855 N/A ALA 265.A N LEU 261.A O no hydrogen 3.158 N/A HIS 266.A N LEU 262.A O no hydrogen 3.013 N/A THR 267.A N ALA 263.A O no hydrogen 2.919 N/A THR 267.A OG1 ALA 263.A O no hydrogen 2.886 N/A LEU 268.A N THR 264.A O no hydrogen 2.951 N/A LEU 269.A N ALA 265.A O no hydrogen 2.972 N/A LEU 270.A N HIS 266.A O no hydrogen 2.945 N/A ARG 271.A N THR 267.A O no hydrogen 2.945 N/A ARG 271.A NE ALA 225.A O no hydrogen 2.786 N/A ARG 271.A NH1 ASN 556.A O no hydrogen 2.855 N/A ARG 271.A NH2 ASP 221.A OD2 no hydrogen 3.020 N/A ARG 271.A NH2 ALA 225.A O no hydrogen 2.939 N/A GLU 272.A N LEU 268.A O no hydrogen 3.014 N/A HIS 273.A N LEU 269.A O no hydrogen 3.144 N/A HIS 273.A ND1 TYR 193.A OH no hydrogen 2.632 N/A HIS 273.A NE2 GLY 211.A O no hydrogen 2.911 N/A ASN 274.A N LEU 270.A O no hydrogen 3.219 N/A ASN 274.A ND2 MET 213.A O no hydrogen 3.162 N/A ARG 275.A N ARG 271.A O no hydrogen 2.875 N/A ARG 275.A NE GLU 272.A OE1 no hydrogen 2.932 N/A ARG 275.A NH2 GLU 272.A OE1 no hydrogen 3.554 N/A ARG 275.A NH2 GLU 272.A OE2 no hydrogen 2.854 N/A LEU 276.A N GLU 272.A O no hydrogen 2.840 N/A ALA 277.A N HIS 273.A O no hydrogen 2.923 N/A ARG 278.A N ASN 274.A O no hydrogen 2.906 N/A GLU 279.A N ARG 275.A O no hydrogen 3.039 N/A LEU 280.A N LEU 276.A O no hydrogen 2.955 N/A LYS 281.A N ALA 277.A O no hydrogen 2.950 N/A LYS 281.A NZ PRO 285.A O no hydrogen 2.933 N/A LYS 282.A N ARG 278.A O no hydrogen 3.150 N/A LEU 283.A N GLU 279.A O no hydrogen 3.005 N/A ASN 284.A N LEU 280.A O no hydrogen 2.888 N/A ASN 284.A ND2 TRP 590.A O no hydrogen 3.084 N/A HIS 286.A N HIS 286.A ND1 no hydrogen 2.844 N/A TRP 287.A N ASN 284.A O no hydrogen 3.102 N/A LYS 291.A N ASN 288.A OD1 no hydrogen 3.012 N/A LYS 291.A NZ TYR 21.A OH no hydrogen 3.525 N/A LYS 291.A NZ GLU 295.A OE1 no hydrogen 3.486 N/A LEU 292.A N ASN 288.A O no hydrogen 2.996 N/A TYR 293.A N GLY 289.A O no hydrogen 2.869 N/A GLN 294.A N GLU 290.A O no hydrogen 2.883 N/A GLN 294.A NE2 GLU 290.A OE2 no hydrogen 3.003 N/A GLU 295.A N LYS 291.A O no hydrogen 2.942 N/A ALA 296.A N LEU 292.A O no hydrogen 2.955 N/A ARG 297.A N TYR 293.A O no hydrogen 2.877 N/A ARG 297.A NH1 ARG 22.A O no hydrogen 3.005 N/A ARG 297.A NH1 GLN 294.A OE1 no hydrogen 3.084 N/A ARG 297.A NH2 THR 23.A O no hydrogen 2.930 N/A LYS 298.A N GLN 294.A O no hydrogen 2.775 N/A LYS 298.A NZ PRO 20.A O no hydrogen 3.317 N/A LYS 298.A NZ VAL 535.A O no hydrogen 2.691 N/A ILE 299.A N GLU 295.A O no hydrogen 2.991 N/A LEU 300.A N ALA 296.A O no hydrogen 2.843 N/A GLY 301.A N ARG 297.A O no hydrogen 2.963 N/A ALA 302.A N LYS 298.A O no hydrogen 3.221 N/A PHE 303.A N ILE 299.A O no hydrogen 2.832 N/A ILE 304.A N LEU 300.A O no hydrogen 3.010 N/A GLN 305.A N GLY 301.A O no hydrogen 3.141 N/A GLN 305.A NE2 LEU 187.A O no hydrogen 3.040 N/A GLN 305.A NE2 ASP 526.A OD2 no hydrogen 3.199 N/A ILE 306.A N ALA 302.A O no hydrogen 2.828 N/A ILE 307.A N PHE 303.A O no hydrogen 3.022 N/A THR 308.A N ILE 304.A O no hydrogen 3.080 N/A THR 308.A OG1 ILE 304.A O no hydrogen 2.765 N/A PHE 309.A N GLN 305.A O no hydrogen 3.032 N/A ARG 310.A N ILE 306.A O no hydrogen 2.826 N/A ARG 310.A NE ASP 311.A OD1 no hydrogen 2.845 N/A ARG 310.A NH1 VAL 547.A O no hydrogen 2.932 N/A ARG 310.A NH2 ASP 311.A OD1 no hydrogen 3.334 N/A ARG 310.A NH2 ASP 311.A OD2 no hydrogen 2.737 N/A ARG 310.A NH2 VAL 547.A O no hydrogen 2.982 N/A ASP 311.A N ILE 307.A O no hydrogen 2.916 N/A TYR 312.A N ILE 307.A O no hydrogen 3.167 N/A TYR 312.A N THR 308.A O no hydrogen 3.258 N/A LEU 313.A N THR 308.A O no hydrogen 2.833 N/A ILE 315.A N TYR 312.A O no hydrogen 3.039 N/A VAL 316.A N TYR 312.A O no hydrogen 3.203 N/A VAL 316.A N LEU 313.A O no hydrogen 3.019 N/A LEU 317.A N LEU 313.A O no hydrogen 2.695 N/A GLY 318.A N PRO 314.A O no hydrogen 2.845 N/A SER 319.A N GLU 503.A O no hydrogen 2.841 N/A SER 319.A OG GLU 320.A OE2 no hydrogen 2.778 N/A SER 319.A OG GLU 503.A O no hydrogen 3.477 N/A GLU 320.A N LEU 317.A O no hydrogen 3.009 N/A MET 321.A N GLY 318.A O no hydrogen 3.190 N/A TRP 324.A N GLU 320.A O no hydrogen 3.234 N/A TRP 324.A N MET 321.A O no hydrogen 3.307 N/A ILE 325.A N MET 321.A O no hydrogen 2.722 N/A ASN 332.A N ASP 524.A O no hydrogen 2.818 N/A SER 334.A N ASN 332.A OD1 no hydrogen 3.132 N/A SER 334.A OG ASN 333.A OD1 no hydrogen 3.518 N/A VAL 335.A N ASN 332.A O no hydrogen 3.020 N/A ARG 338.A N ASP 336.A OD1 no hydrogen 3.141 N/A ARG 338.A NE ASP 336.A OD1 no hydrogen 2.903 N/A ARG 338.A NE ASP 336.A OD2 no hydrogen 3.159 N/A ARG 338.A NH2 ASP 336.A OD2 no hydrogen 2.765 N/A ILE 339.A N SER 185.A OG no hydrogen 3.103 N/A SER 340.A N GLN 518.A OE1 no hydrogen 2.833 N/A SER 340.A OG GLN 518.A OE1 no hydrogen 2.941 N/A ASN 341.A N ALA 44.A O no hydrogen 2.859 N/A ASN 341.A ND2 GLN 179.A OE1 no hydrogen 2.980 N/A PHE 343.A N SER 340.A OG no hydrogen 3.319 N/A THR 344.A N ASN 341.A O no hydrogen 3.035 N/A THR 344.A OG1 ASN 341.A O no hydrogen 2.829 N/A PHE 345.A N VAL 342.A O no hydrogen 2.987 N/A ALA 346.A N VAL 342.A O no hydrogen 2.979 N/A PHE 347.A N PHE 343.A O no hydrogen 2.983 N/A ARG 348.A N PHE 345.A O no hydrogen 3.190 N/A ARG 348.A NE THR 344.A O no hydrogen 2.874 N/A ARG 348.A NH1 ASN 437.A OD1 no hydrogen 2.886 N/A PHE 349.A N ALA 346.A O no hydrogen 3.417 N/A GLY 350.A N PHE 347.A O no hydrogen 3.455 N/A HIS 351.A N ARG 348.A O no hydrogen 3.170 N/A MET 352.A N PHE 349.A O no hydrogen 2.958 N/A GLU 353.A N GLY 350.A O no hydrogen 2.793 N/A VAL 358.A N LEU 374.A O no hydrogen 2.880 N/A ARG 360.A N ALA 372.A O no hydrogen 2.980 N/A ARG 360.A NE ALA 372.A O no hydrogen 3.078 N/A ARG 360.A NH1 ASP 389.A OD2 no hydrogen 2.923 N/A ARG 360.A NH2 GLU 371.A O no hydrogen 2.338 N/A ARG 360.A NH2 ASP 389.A OD2 no hydrogen 3.338 N/A LEU 361.A N PRO 394.A O no hydrogen 3.051 N/A ASP 362.A N GLN 366.A O no hydrogen 2.688 N/A ASN 364.A N ASP 362.A OD1 no hydrogen 2.869 N/A TYR 365.A N ASP 362.A O no hydrogen 2.716 N/A TYR 365.A OH LYS 561.A O no hydrogen 2.694 N/A GLN 366.A N ASP 362.A OD1 no hydrogen 2.946 N/A GLN 366.A NE2 ASN 364.A O no hydrogen 3.469 N/A TRP 368.A N ARG 360.A O no hydrogen 2.968 N/A LEU 374.A N VAL 358.A O no hydrogen 2.809 N/A LEU 376.A N SER 356.A O no hydrogen 2.803 N/A HIS 377.A N GLU 416.A OE2 no hydrogen 2.846 N/A HIS 377.A ND1 GLU 416.A OE2 no hydrogen 2.559 N/A THR 378.A N PRO 375.A O no hydrogen 3.004 N/A THR 378.A OG1 PRO 375.A O no hydrogen 2.933 N/A LEU 379.A N LEU 376.A O no hydrogen 2.738 N/A PHE 381.A N GLU 258.A O no hydrogen 3.012 N/A ASN 382.A ND2 THR 378.A O no hydrogen 2.968 N/A THR 383.A OG1 PRO 247.A O no hydrogen 2.763 N/A ARG 385.A N ASN 382.A OD1 no hydrogen 2.967 N/A ARG 385.A NH1 ASP 389.A OD2 no hydrogen 2.770 N/A ARG 385.A NH2 GLU 371.A OE1 no hydrogen 3.515 N/A ILE 386.A N THR 383.A O no hydrogen 3.077 N/A ILE 387.A N THR 383.A O no hydrogen 3.068 N/A LYS 388.A N TRP 384.A O no hydrogen 2.750 N/A GLY 391.A N ILE 386.A O no hydrogen 2.972 N/A ILE 392.A N ASP 221.A OD2 no hydrogen 3.108 N/A VAL 396.A N ILE 392.A O no hydrogen 2.837 N/A ARG 397.A N ASP 393.A O no hydrogen 2.919 N/A ARG 397.A NH1 LEU 361.A O no hydrogen 3.334 N/A GLY 398.A N PRO 394.A O no hydrogen 3.362 N/A LEU 399.A N LEU 395.A O no hydrogen 3.022 N/A LEU 400.A N VAL 396.A O no hydrogen 3.124 N/A LEU 400.A N ARG 397.A O no hydrogen 3.075 N/A ALA 401.A N ARG 397.A O no hydrogen 2.913 N/A LYS 402.A N GLY 398.A O no hydrogen 2.700 N/A SER 404.A N ARG 96.A O no hydrogen 3.098 N/A SER 404.A OG SER 97.A O no hydrogen 2.561 N/A LYS 405.A N GLU 353.A O no hydrogen 2.846 N/A LYS 405.A NZ MET 352.A O no hydrogen 2.871 N/A LYS 405.A NZ LEU 406.A O no hydrogen 3.007 N/A LYS 405.A NZ LYS 411.A O no hydrogen 2.819 N/A LYS 405.A NZ MET 412.A O no hydrogen 2.710 N/A LEU 406.A N VAL 91.A O no hydrogen 2.916 N/A GLN 409.A NE2 LEU 471.A O no hydrogen 2.867 N/A GLN 409.A NE2 ALA 498.A O no hydrogen 2.821 N/A ASP 410.A N ASN 408.A OD1 no hydrogen 3.179 N/A LYS 411.A N ASN 408.A O no hydrogen 2.976 N/A LYS 411.A NZ ASP 87.A O no hydrogen 2.873 N/A VAL 413.A N VAL 83.A O no hydrogen 3.148 N/A THR 414.A OG1 GLU 88.A OE2 no hydrogen 2.734 N/A LEU 417.A N THR 414.A O no hydrogen 2.904 N/A ARG 418.A N THR 414.A O no hydrogen 2.926 N/A ARG 418.A NH1 SER 79.A OG no hydrogen 3.090 N/A ARG 418.A NH1 ASN 80.A OD1 no hydrogen 2.739 N/A ASN 419.A N SER 415.A O no hydrogen 2.777 N/A LEU 421.A N PHE 431.A O no hydrogen 3.080 N/A HIS 426.A N GLN 423.A O no hydrogen 3.042 N/A HIS 426.A ND1 GLU 130.A OE1 no hydrogen 2.465 N/A PHE 431.A N LEU 421.A O no hydrogen 2.929 N/A LEU 433.A N LEU 417.A O no hydrogen 3.021 N/A ALA 435.A N ASP 432.A OD1 no hydrogen 2.940 N/A ILE 436.A N ASP 432.A O no hydrogen 2.999 N/A ASN 437.A N LEU 433.A O no hydrogen 2.860 N/A ASN 437.A ND2 HIS 351.A ND1 no hydrogen 2.959 N/A LEU 438.A N ALA 434.A O no hydrogen 3.140 N/A GLN 439.A N ALA 435.A O no hydrogen 2.917 N/A GLN 439.A NE2 PHE 140.A O no hydrogen 2.961 N/A ARG 440.A N ILE 436.A O no hydrogen 2.924 N/A ARG 440.A NH1 PHE 161.A O no hydrogen 2.741 N/A ARG 440.A NH1 ASP 443.A OD2 no hydrogen 2.831 N/A ARG 440.A NH2 GLU 116.A OE1 no hydrogen 3.330 N/A ARG 440.A NH2 PHE 161.A O no hydrogen 3.429 N/A CYS 441.A N ASN 437.A O no hydrogen 3.035 N/A CYS 441.A SG ASN 437.A O no hydrogen 3.352 N/A ARG 442.A N LEU 438.A O no hydrogen 3.358 N/A ARG 442.A NE ASP 491.A OD1 no hydrogen 3.074 N/A ARG 442.A NH1 PRO 73.A O no hydrogen 2.939 N/A ARG 442.A NH2 PRO 73.A O no hydrogen 2.775 N/A ARG 442.A NH2 ASP 491.A OD2 no hydrogen 2.948 N/A ASP 443.A N GLN 439.A O no hydrogen 2.877 N/A HIS 444.A N ARG 440.A O no hydrogen 2.877 N/A HIS 444.A ND1 ASN 341.A OD1 no hydrogen 2.739 N/A GLY 445.A N ARG 442.A O no hydrogen 3.092 N/A MET 446.A N CYS 441.A O no hydrogen 3.043 N/A TYR 449.A N ILE 490.A O no hydrogen 2.978 N/A TYR 449.A OH GLU 499.A OE2 no hydrogen 2.789 N/A ASN 450.A ND2 PRO 461.A O no hydrogen 2.789 N/A ASN 450.A ND2 ASP 488.A OD1 no hydrogen 2.882 N/A TRP 452.A N GLY 448.A O no hydrogen 3.211 N/A TRP 452.A NE1 PRO 447.A O no hydrogen 3.099 N/A ARG 453.A N TYR 449.A O no hydrogen 2.900 N/A ARG 453.A NE SER 459.A O no hydrogen 2.860 N/A ARG 453.A NH1 GLU 499.A OE2 no hydrogen 2.699 N/A ARG 453.A NH2 SER 459.A O no hydrogen 2.937 N/A ARG 453.A NH2 SER 459.A OG no hydrogen 3.281 N/A GLY 454.A N ASN 450.A O no hydrogen 3.083 N/A PHE 455.A N SER 451.A O no hydrogen 3.042 N/A CYS 456.A N TRP 452.A O no hydrogen 2.943 N/A CYS 456.A N ARG 453.A O no hydrogen 3.026 N/A CYS 456.A SG LEU 510.A O no hydrogen 4.045 N/A GLY 457.A N GLY 454.A O no hydrogen 2.834 N/A LEU 458.A N ARG 453.A O no hydrogen 2.803 N/A LYS 462.A NZ ASP 488.A OD1 no hydrogen 3.012 N/A GLY 466.A N THR 463.A OG1 no hydrogen 3.175 N/A LEU 467.A N THR 463.A O no hydrogen 3.100 N/A GLN 468.A N LEU 464.A O no hydrogen 2.918 N/A THR 469.A N LYS 465.A O no hydrogen 3.209 N/A THR 469.A OG1 LYS 465.A O no hydrogen 2.896 N/A VAL 470.A N GLY 466.A O no hydrogen 3.153 N/A LEU 471.A N LEU 467.A O no hydrogen 2.866 N/A ASN 473.A N GLN 468.A O no hydrogen 3.195 N/A ASN 473.A ND2 GLN 409.A OE1 no hydrogen 2.866 N/A LEU 476.A N ASN 473.A OD1 no hydrogen 3.021 N/A ALA 477.A N ASN 473.A O no hydrogen 3.177 N/A LYS 478.A N LYS 474.A O no hydrogen 3.036 N/A LYS 478.A NZ ASP 482.A OD1 no hydrogen 2.918 N/A LYS 478.A NZ ASP 482.A OD2 no hydrogen 2.787 N/A LYS 479.A N ILE 475.A O no hydrogen 2.915 N/A LEU 480.A N LEU 476.A O no hydrogen 2.986 N/A MET 481.A N ALA 477.A O no hydrogen 2.952 N/A ASP 482.A N LYS 478.A O no hydrogen 2.854 N/A LEU 483.A N LYS 479.A O no hydrogen 3.139 N/A LEU 483.A N LEU 480.A O no hydrogen 3.111 N/A TYR 484.A N LEU 480.A O no hydrogen 2.776 N/A TYR 484.A OH ASP 491.A OD2 no hydrogen 2.604 N/A LYS 485.A N MET 481.A O no hydrogen 2.690 N/A LYS 485.A NZ ASP 482.A O no hydrogen 2.742 N/A ASP 488.A N THR 486.A OG1 no hydrogen 3.113 N/A ASN 489.A N THR 486.A O no hydrogen 2.897 N/A ASN 489.A ND2 ARG 67.A O no hydrogen 2.831 N/A ILE 490.A N PRO 487.A O no hydrogen 3.268 N/A TRP 493.A NE1 ARG 348.A O no hydrogen 3.204 N/A GLY 495.A N ASP 491.A O no hydrogen 2.960 N/A GLY 496.A N ILE 492.A O no hydrogen 2.945 N/A ASN 497.A N TRP 493.A O no hydrogen 3.380 N/A ASN 497.A ND2 TRP 493.A O no hydrogen 2.758 N/A ALA 498.A N ILE 494.A O no hydrogen 2.909 N/A VAL 502.A N VAL 507.A O no hydrogen 2.743 N/A GLY 505.A N VAL 502.A O no hydrogen 3.111 N/A ARG 506.A N VAL 316.A O no hydrogen 2.923 N/A ARG 506.A NE ASP 93.A OD2 no hydrogen 2.694 N/A ARG 506.A NH1 GLY 505.A O no hydrogen 3.048 N/A ARG 506.A NH2 ASP 93.A OD1 no hydrogen 3.069 N/A LEU 510.A N GLU 499.A OE1 no hydrogen 2.863 N/A ALA 512.A N GLY 508.A O no hydrogen 2.922 N/A CYS 513.A N PRO 509.A O no hydrogen 3.165 N/A LEU 514.A N LEU 510.A O no hydrogen 3.095 N/A LEU 515.A N LEU 511.A O no hydrogen 2.858 N/A GLY 516.A N ALA 512.A O no hydrogen 2.819 N/A ARG 517.A N CYS 513.A O no hydrogen 3.013 N/A GLN 518.A N LEU 514.A O no hydrogen 3.313 N/A GLN 518.A NE2 ARG 338.A O no hydrogen 2.981 N/A GLN 518.A NE2 GLN 518.A O no hydrogen 3.636 N/A PHE 519.A N LEU 515.A O no hydrogen 2.921 N/A GLN 520.A N GLY 516.A O no hydrogen 2.964 N/A GLN 520.A NE2 ASP 524.A OD2 no hydrogen 3.053 N/A GLN 521.A N ARG 517.A O no hydrogen 3.130 N/A GLN 521.A NE2 ASP 336.A O no hydrogen 2.927 N/A ILE 522.A N GLN 518.A O no hydrogen 2.869 N/A ARG 523.A N PHE 519.A O no hydrogen 3.199 N/A ARG 523.A NE ASP 524.A OD1 no hydrogen 3.033 N/A ARG 523.A NH1 PRO 326.A O no hydrogen 2.953 N/A ARG 523.A NH2 PRO 326.A O no hydrogen 2.804 N/A ARG 523.A NH2 ASP 524.A OD1 no hydrogen 3.514 N/A ASP 524.A N GLN 520.A O no hydrogen 2.945 N/A GLY 525.A N GLN 521.A O no hydrogen 2.922 N/A ASP 526.A N ARG 523.A O no hydrogen 3.305 N/A ARG 527.A N ASN 29.A OD1 no hydrogen 2.847 N/A ARG 527.A NE ASN 29.A O no hydrogen 2.762 N/A ARG 527.A NH2 CYS 28.A O no hydrogen 2.842 N/A PHE 528.A N ASP 526.A OD1 no hydrogen 3.017 N/A TRP 529.A N ASP 526.A O no hydrogen 3.176 N/A TRP 529.A NE1 GLU 531.A OE1 no hydrogen 3.015 N/A TRP 530.A N GLN 305.A OE1 no hydrogen 3.017 N/A ASN 532.A N TRP 529.A O no hydrogen 2.947 N/A ASN 532.A ND2 ARG 527.A O no hydrogen 2.938 N/A VAL 535.A N ASN 532.A O no hydrogen 3.015 N/A THR 537.A N GLN 540.A OE1 no hydrogen 2.890 N/A GLN 540.A N THR 537.A OG1 no hydrogen 3.018 N/A GLN 540.A NE2 PRO 589.A O no hydrogen 3.449 N/A ARG 541.A N THR 537.A O no hydrogen 3.100 N/A ASP 542.A N GLU 538.A O no hydrogen 2.999 N/A SER 543.A N LYS 539.A O no hydrogen 3.057 N/A SER 543.A OG ASP 586.A O no hydrogen 2.716 N/A LEU 544.A N GLN 540.A O no hydrogen 2.899 N/A GLN 545.A N ARG 541.A O no hydrogen 3.076 N/A LYS 546.A N SER 543.A O no hydrogen 3.098 N/A VAL 547.A N LEU 544.A O no hydrogen 3.015 N/A SER 550.A OG PRO 563.A O no hydrogen 2.783 N/A SER 550.A OG LEU 564.A O no hydrogen 3.429 N/A ARG 551.A N SER 548.A OG no hydrogen 3.171 N/A ARG 551.A NE ASP 555.A OD1 no hydrogen 3.109 N/A ARG 551.A NH1 CYS 579.A O no hydrogen 3.009 N/A ARG 551.A NH1 VAL 582.A O no hydrogen 2.809 N/A ARG 551.A NH2 ASP 555.A OD1 no hydrogen 3.025 N/A LEU 552.A N SER 548.A O no hydrogen 3.243 N/A ILE 553.A N PHE 549.A O no hydrogen 3.054 N/A CYS 554.A N SER 550.A O no hydrogen 2.988 N/A CYS 554.A SG SER 550.A O no hydrogen 3.308 N/A ASP 555.A N ARG 551.A O no hydrogen 2.780 N/A ASN 556.A N ILE 553.A O no hydrogen 3.153 N/A ASN 556.A ND2 GLU 272.A OE1 no hydrogen 2.877 N/A ASN 556.A ND2 LEU 552.A O no hydrogen 2.820 N/A THR 557.A OG1 ILE 553.A O no hydrogen 2.682 N/A HIS 558.A N ASP 393.A OD2 no hydrogen 3.009 N/A ILE 559.A N THR 557.A OG1 no hydrogen 3.115 N/A LYS 561.A NZ ASP 578.A OD1 no hydrogen 3.435 N/A VAL 562.A N VAL 577.A O no hydrogen 2.920 N/A ASN 570.A ND2 HIS 565.A O no hydrogen 2.845 N/A ASN 571.A N ASP 575.A OD2 no hydrogen 2.840 N/A ASP 575.A N ASN 571.A O no hydrogen 3.001 N/A PHE 576.A N PRO 573.A O no hydrogen 2.868 N/A VAL 577.A N VAL 562.A O no hydrogen 2.753 N/A CYS 579.A N THR 560.A O no hydrogen 2.901 N/A CYS 579.A SG ILE 559.A O no hydrogen 3.679 N/A SER 580.A N ASP 578.A OD2 no hydrogen 3.129 N/A SER 580.A OG ASP 578.A OD2 no hydrogen 2.827 N/A THR 581.A N ASP 578.A O no hydrogen 3.070 N/A THR 581.A OG1 ASP 578.A O no hydrogen 2.731 N/A VAL 582.A N CYS 579.A O no hydrogen 2.918 N/A SER 588.A N ASP 586.A OD1 no hydrogen 3.237 N/A SER 588.A OG ASP 586.A OD1 no hydrogen 2.579 N/A TRP 590.A N LEU 587.A O no hydrogen 2.938 N/A ALA 591.A N SER 588.A O no hydrogen 2.879 N/A SER 592.A N ASN 284.A OD1 no hydrogen 2.769 N/A ARG 593.A NH1 ARG 593.A O no hydrogen 3.534 N/A