Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4paa_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LYS 3.A NZ ASP 31.A OD1 no hydrogen 2.760 N/A ARG 5.A NE ARG 196.A O no hydrogen 3.376 N/A ARG 5.A NH2 ARG 196.A O no hydrogen 3.529 N/A ARG 5.A NH2 ASN 198.A OD1 no hydrogen 3.020 N/A ALA 6.A N ARG 196.A O no hydrogen 3.141 N/A GLU 7.A N ASP 31.A O no hydrogen 2.948 N/A VAL 9.A N ARG 199.A O no hydrogen 3.069 N/A ILE 10.A N VAL 33.A O no hydrogen 2.863 N/A ILE 11.A N VAL 201.A O no hydrogen 2.742 N/A GLY 12.A N LEU 35.A O no hydrogen 2.913 N/A GLY 13.A N GLU 36.A OE1 no hydrogen 2.757 N/A CYS 15.A N THR 45.A OG1 no hydrogen 3.139 N/A CYS 15.A SG THR 45.A OG1 no hydrogen 3.566 N/A CYS 15.A SG GLY 356.A O no hydrogen 3.547 N/A VAL 18.A N GLY 14.A O no hydrogen 3.103 N/A SER 19.A N CYS 15.A O no hydrogen 2.878 N/A SER 19.A OG ALA 360.A O no hydrogen 2.636 N/A LEU 20.A N VAL 16.A O no hydrogen 3.038 N/A ALA 21.A N GLY 17.A O no hydrogen 3.145 N/A TYR 22.A N VAL 18.A O no hydrogen 2.942 N/A TYR 22.A OH GLU 78.A OE1 no hydrogen 2.728 N/A TYR 22.A OH GLU 78.A OE2 no hydrogen 3.070 N/A HIS 23.A N SER 19.A O no hydrogen 3.114 N/A HIS 23.A ND1 SER 19.A O no hydrogen 2.771 N/A LEU 24.A N LEU 20.A O no hydrogen 3.028 N/A ALA 25.A N ALA 21.A O no hydrogen 3.209 N/A LYS 26.A N TYR 22.A O no hydrogen 2.929 N/A LYS 26.A NZ GLU 78.A OE2 no hydrogen 3.169 N/A ALA 27.A N HIS 23.A O no hydrogen 2.746 N/A GLY 28.A N ALA 25.A O no hydrogen 2.942 N/A MET 29.A N LEU 24.A O no hydrogen 2.856 N/A VAL 33.A N THR 8.A O no hydrogen 3.012 N/A LEU 34.A N LEU 168.A O no hydrogen 2.799 N/A LEU 35.A N ILE 10.A O no hydrogen 2.822 N/A GLU 36.A N LYS 170.A O no hydrogen 2.967 N/A SER 38.A N GLU 36.A OE2 no hydrogen 2.892 N/A SER 38.A OG GLU 36.A OE2 no hydrogen 3.500 N/A THR 41.A N GLY 13.A O no hydrogen 3.007 N/A THR 41.A OG1 LEU 40.A O no hydrogen 2.479 N/A ALA 42.A N GLU 39.A O no hydrogen 3.291 N/A SER 44.A OG PRO 327.A O no hydrogen 2.705 N/A TRP 46.A N THR 41.A O no hydrogen 3.237 N/A HIS 47.A N SER 44.A O no hydrogen 3.229 N/A ALA 48.A N THR 45.A O no hydrogen 3.416 N/A THR 52.A N GLY 147.A O no hydrogen 2.976 N/A THR 53.A OG1 ASP 146.A OD2 no hydrogen 2.840 N/A TYR 54.A N ASP 146.A OD2 no hydrogen 2.943 N/A PHE 55.A N THR 53.A OG1 no hydrogen 3.099 N/A GLY 58.A N HIS 56.A ND1 no hydrogen 3.085 N/A ASN 60.A ND2 ASP 379.A O no hydrogen 2.735 N/A ASN 60.A ND2 ASP 690.A OD2 no hydrogen 2.891 N/A LYS 62.A N ILE 59.A O no hydrogen 2.998 N/A LYS 62.A NZ HIS 56.A O no hydrogen 3.134 N/A LYS 62.A NZ THR 110.A OG1 no hydrogen 2.715 N/A LYS 63.A N ASN 60.A O no hydrogen 3.081 N/A LYS 63.A NZ ASN 60.A OD1 no hydrogen 3.052 N/A HIS 65.A N LEU 61.A O no hydrogen 3.050 N/A HIS 65.A ND1 THR 53.A O no hydrogen 2.692 N/A HIS 65.A NE2 HIS 359.A NE2 no hydrogen 3.039 N/A TYR 66.A N LYS 62.A O no hydrogen 2.749 N/A ASP 67.A N LYS 63.A O no hydrogen 2.766 N/A SER 68.A N ILE 64.A O no hydrogen 3.044 N/A SER 68.A OG ILE 64.A O no hydrogen 3.344 N/A SER 68.A OG ILE 358.A O no hydrogen 2.645 N/A ILE 69.A N HIS 65.A O no hydrogen 3.154 N/A LYS 70.A N TYR 66.A O no hydrogen 3.009 N/A LYS 70.A NZ TYR 54.A OH no hydrogen 2.832 N/A LEU 71.A N ASP 67.A O no hydrogen 2.998 N/A TYR 72.A N SER 68.A O no hydrogen 2.906 N/A TYR 72.A OH ILE 357.A O no hydrogen 2.634 N/A GLU 73.A N ILE 69.A O no hydrogen 2.988 N/A ARG 74.A N LEU 71.A O no hydrogen 2.859 N/A GLU 78.A N ARG 74.A O no hydrogen 3.129 N/A THR 79.A N LEU 75.A O no hydrogen 2.953 N/A THR 79.A OG1 LEU 75.A O no hydrogen 2.732 N/A GLY 80.A N GLU 76.A O no hydrogen 3.255 N/A GLN 81.A NE2 THR 160.A OG1 no hydrogen 2.739 N/A HIS 86.A N HIS 148.A O no hydrogen 2.897 N/A HIS 86.A ND1 GLU 243.A OE1 no hydrogen 2.718 N/A GLN 87.A NE2 GLU 73.A OE2 no hydrogen 3.045 N/A GLN 87.A NE2 GLY 145.A O no hydrogen 2.880 N/A GLY 89.A N ASP 146.A O no hydrogen 2.795 N/A SER 90.A N ASN 143.A O no hydrogen 3.099 N/A SER 90.A OG ASP 146.A OD1 no hydrogen 2.707 N/A ILE 91.A N VAL 246.A O no hydrogen 2.670 N/A ARG 92.A N LEU 141.A O no hydrogen 2.886 N/A LEU 93.A N ARG 248.A O no hydrogen 3.011 N/A ALA 94.A N ALA 139.A O no hydrogen 2.810 N/A THR 95.A OG1 GLU 251.A OE1 no hydrogen 3.452 N/A GLU 98.A N GLU 98.A OE1 no hydrogen 2.910 N/A ARG 99.A N THR 96.A O no hydrogen 3.106 N/A ARG 99.A N THR 96.A OG1 no hydrogen 3.179 N/A ARG 99.A NH1 GLU 102.A OE1 no hydrogen 3.535 N/A ARG 99.A NH1 ASN 409.A O no hydrogen 2.738 N/A ARG 99.A NH2 ASN 409.A O no hydrogen 3.266 N/A VAL 100.A N THR 96.A O no hydrogen 3.152 N/A ASP 101.A N PRO 97.A O no hydrogen 3.095 N/A GLU 102.A N GLU 98.A O no hydrogen 3.105 N/A PHE 103.A N ARG 99.A O no hydrogen 3.208 N/A LYS 104.A N VAL 100.A O no hydrogen 3.094 N/A TYR 105.A N ASP 101.A O no hydrogen 2.875 N/A TYR 105.A OH GLU 741.A OE2 no hydrogen 2.411 N/A GLN 106.A N GLU 102.A O no hydrogen 2.881 N/A GLN 106.A NE2 PRO 57.A O no hydrogen 3.315 N/A MET 107.A N PHE 103.A O no hydrogen 2.782 N/A THR 108.A N LYS 104.A O no hydrogen 3.198 N/A THR 108.A OG1 GLU 788.A O no hydrogen 2.554 N/A ARG 109.A N TYR 105.A O no hydrogen 3.344 N/A ARG 109.A NH2 PRO 57.A O no hydrogen 2.999 N/A THR 110.A N MET 107.A O no hydrogen 2.983 N/A THR 110.A OG1 GLN 106.A O no hydrogen 2.534 N/A ASN 111.A N MET 107.A O no hydrogen 2.874 N/A ASN 111.A ND2 GLU 788.A OE1 no hydrogen 3.025 N/A TRP 112.A NE1 ASN 743.A O no hydrogen 3.081 N/A HIS 113.A N THR 110.A O no hydrogen 3.069 N/A TYR 118.A N TYR 142.A O no hydrogen 2.909 N/A TYR 118.A OH GLU 116.A OE2 no hydrogen 2.716 N/A ILE 120.A N GLY 140.A O no hydrogen 2.846 N/A ILE 125.A N GLU 121.A O no hydrogen 3.105 N/A HIS 126.A N PRO 122.A O no hydrogen 2.786 N/A GLU 127.A N GLU 123.A O no hydrogen 3.048 N/A LEU 128.A N LYS 124.A O no hydrogen 3.147 N/A PHE 129.A N ILE 125.A O no hydrogen 2.789 N/A LEU 132.A N PHE 129.A O no hydrogen 3.336 N/A ASN 133.A N MET 311.A O no hydrogen 2.853 N/A ASN 133.A ND2 GLU 310.A O no hydrogen 3.140 N/A ASP 135.A N ASN 133.A OD1 no hydrogen 3.068 N/A ILE 137.A N MET 134.A O no hydrogen 3.204 N/A LEU 138.A N ALA 94.A O no hydrogen 2.886 N/A ALA 139.A N ALA 94.A O no hydrogen 3.454 N/A GLY 140.A N ILE 120.A O no hydrogen 3.068 N/A LEU 141.A N ARG 92.A O no hydrogen 2.743 N/A TYR 142.A N TYR 118.A O no hydrogen 2.712 N/A ASN 143.A N SER 90.A O no hydrogen 2.995 N/A ASN 143.A ND2 GLU 116.A O no hydrogen 2.927 N/A ASN 143.A ND2 GLN 117.A OE1 no hydrogen 2.959 N/A GLY 147.A N THR 52.A O no hydrogen 3.101 N/A HIS 148.A N HIS 86.A O no hydrogen 3.083 N/A HIS 148.A NE2 GLU 243.A OE2 no hydrogen 3.025 N/A ILE 149.A N GLY 50.A O no hydrogen 2.753 N/A SER 153.A N ASP 150.A OD2 no hydrogen 2.794 N/A SER 153.A OG ASP 150.A OD2 no hydrogen 2.880 N/A LEU 154.A N ASP 150.A O no hydrogen 2.950 N/A THR 155.A N PRO 151.A O no hydrogen 3.148 N/A THR 155.A OG1 PRO 151.A O no hydrogen 2.689 N/A MET 156.A N TYR 152.A O no hydrogen 2.903 N/A ALA 157.A N SER 153.A O no hydrogen 2.933 N/A LEU 158.A N LEU 154.A O no hydrogen 2.971 N/A ALA 159.A N THR 155.A O no hydrogen 2.912 N/A THR 160.A N MET 156.A O no hydrogen 3.012 N/A THR 160.A OG1 MET 156.A O no hydrogen 3.244 N/A GLY 161.A N ALA 157.A O no hydrogen 3.023 N/A ALA 162.A N LEU 158.A O no hydrogen 2.980 N/A ARG 163.A N ALA 159.A O no hydrogen 2.868 N/A ARG 163.A NH2 TYR 171.A OH no hydrogen 3.043 N/A LYS 164.A N THR 160.A O no hydrogen 2.825 N/A LYS 164.A NZ GLU 78.A O no hydrogen 2.944 N/A TYR 165.A N GLY 161.A O no hydrogen 2.988 N/A TYR 165.A N ALA 162.A O no hydrogen 3.275 N/A TYR 165.A OH GLU 78.A OE2 no hydrogen 2.513 N/A GLY 166.A N ARG 163.A O no hydrogen 3.310 N/A ALA 167.A N ALA 162.A O no hydrogen 2.851 N/A LEU 168.A N VAL 32.A O no hydrogen 2.904 N/A LYS 170.A N LEU 34.A O no hydrogen 2.852 N/A LYS 170.A NZ GLU 1.A O no hydrogen 2.960 N/A ALA 173.A N GLU 36.A O no hydrogen 2.879 N/A THR 176.A N GLU 189.A O no hydrogen 2.749 N/A THR 176.A OG1 GLU 189.A O no hydrogen 3.083 N/A LYS 179.A N ASP 187.A O no hydrogen 3.043 N/A ARG 181.A N THR 185.A O no hydrogen 2.797 N/A ARG 181.A NH1 ASP 187.A OD2 no hydrogen 3.093 N/A GLY 184.A N ARG 181.A O no hydrogen 3.013 N/A THR 185.A N ASP 183.A OD1 no hydrogen 3.138 N/A THR 185.A OG1 ASP 183.A OD1 no hydrogen 2.695 N/A TRP 186.A N ALA 197.A O no hydrogen 2.776 N/A TRP 186.A NE1 ARG 345.A O no hydrogen 2.958 N/A ASP 187.A N LYS 179.A O no hydrogen 2.896 N/A VAL 188.A N VAL 195.A O no hydrogen 2.697 N/A GLU 189.A N SER 177.A O no hydrogen 3.114 N/A THR 190.A N GLY 193.A O no hydrogen 3.204 N/A THR 190.A OG1 GLY 193.A O no hydrogen 2.904 N/A GLN 192.A N THR 190.A OG1 no hydrogen 3.103 N/A GLN 192.A NE2 PRO 172.A O no hydrogen 2.664 N/A GLY 193.A N THR 190.A O no hydrogen 3.036 N/A SER 194.A OG GLU 189.A OE1 no hydrogen 2.571 N/A VAL 195.A N VAL 188.A O no hydrogen 3.018 N/A ARG 196.A N ASP 4.A O no hydrogen 2.718 N/A ARG 196.A NE ASP 187.A OD1 no hydrogen 2.966 N/A ALA 197.A N TRP 186.A O no hydrogen 2.773 N/A ASN 198.A N ALA 6.A O no hydrogen 3.196 N/A ASN 198.A ND2 GLU 7.A OE1 no hydrogen 3.397 N/A ASN 198.A ND2 GLU 7.A OE2 no hydrogen 3.071 N/A ARG 199.A N GLU 7.A O no hydrogen 3.238 N/A ARG 199.A NE THR 8.A OG1 no hydrogen 2.977 N/A ARG 199.A NH2 GLU 7.A OE2 no hydrogen 2.933 N/A ILE 200.A N ASN 346.A O no hydrogen 3.053 N/A VAL 201.A N VAL 9.A O no hydrogen 2.795 N/A ASN 202.A N TRP 348.A O no hydrogen 2.932 N/A ASN 202.A ND2 ALA 208.A O no hydrogen 3.046 N/A ASN 202.A ND2 TYR 347.A OH no hydrogen 2.996 N/A ALA 203.A N ILE 11.A O no hydrogen 2.784 N/A ALA 204.A N ASN 202.A OD1 no hydrogen 3.042 N/A TRP 207.A N ALA 204.A O no hydrogen 2.944 N/A ALA 208.A N GLY 205.A O no hydrogen 2.887 N/A ARG 209.A NH1 HIS 219.A O no hydrogen 2.843 N/A VAL 211.A N TRP 207.A O no hydrogen 3.045 N/A GLY 212.A N ALA 208.A O no hydrogen 2.935 N/A LYS 213.A N ARG 209.A O no hydrogen 3.095 N/A LYS 213.A NZ ASP 218.A OD1 no hydrogen 3.501 N/A MET 214.A N VAL 211.A O no hydrogen 3.113 N/A ILE 215.A N GLY 212.A O no hydrogen 3.068 N/A GLY 216.A N LYS 213.A O no hydrogen 3.304 N/A LEU 217.A N GLY 212.A O no hydrogen 3.217 N/A HIS 219.A NE2 TYR 347.A OH no hydrogen 2.775 N/A ILE 222.A N TYR 330.A O no hydrogen 3.033 N/A VAL 224.A N ILE 328.A O no hydrogen 2.731 N/A GLN 225.A N LYS 275.A O no hydrogen 2.880 N/A GLN 225.A NE2 GLN 277.A OE1 no hydrogen 2.813 N/A HIS 226.A N GLY 326.A O no hydrogen 2.914 N/A HIS 226.A ND1 TYR 405.A OH no hydrogen 2.998 N/A HIS 226.A NE2 TYR 255.A OH no hydrogen 2.909 N/A GLN 227.A NE2 ASP 297.A O no hydrogen 3.119 N/A TYR 228.A N VAL 324.A O no hydrogen 3.095 N/A TYR 228.A OH HIS 47.A O no hydrogen 2.439 N/A VAL 229.A N PHE 265.A O no hydrogen 2.781 N/A ILE 230.A N ASN 322.A O no hydrogen 2.780 N/A THR 231.A N LEU 263.A O no hydrogen 2.746 N/A THR 231.A OG1 ASP 319.A O no hydrogen 3.436 N/A SER 232.A N ASP 319.A O no hydrogen 2.713 N/A SER 232.A OG ASP 319.A O no hydrogen 3.108 N/A ILE 234.A N ASP 261.A O no hydrogen 2.883 N/A GLU 236.A N GLU 236.A OE1 no hydrogen 2.766 N/A VAL 237.A N ILE 234.A O no hydrogen 2.925 N/A LYS 238.A N ILE 234.A O no hydrogen 2.929 N/A ALA 239.A N PRO 235.A O no hydrogen 2.896 N/A LEU 240.A N VAL 237.A O no hydrogen 3.379 N/A LEU 244.A N GLN 258.A OE1 no hydrogen 2.855 N/A VAL 246.A N GLY 89.A O no hydrogen 2.818 N/A LEU 247.A N LEU 256.A O no hydrogen 2.828 N/A ARG 248.A N ILE 91.A O no hydrogen 2.942 N/A ARG 248.A NH1 ASN 409.A OD1 no hydrogen 2.693 N/A ASP 249.A N TYR 254.A O no hydrogen 2.869 N/A GLY 252.A N ASP 249.A OD1 no hydrogen 3.216 N/A SER 253.A N LEU 250.A O no hydrogen 3.114 N/A SER 253.A OG TYR 268.A O no hydrogen 2.616 N/A TYR 254.A N ASP 249.A O no hydrogen 3.178 N/A TYR 254.A OH ASP 249.A OD2 no hydrogen 2.739 N/A TYR 255.A N GLY 266.A O no hydrogen 3.119 N/A TYR 255.A OH HIS 226.A NE2 no hydrogen 2.909 N/A LEU 256.A N LEU 247.A O no hydrogen 3.029 N/A ARG 257.A N LEU 264.A O no hydrogen 2.743 N/A ARG 257.A NE ALA 49.A O no hydrogen 3.059 N/A ARG 257.A NH1 GLN 258.A O no hydrogen 2.970 N/A ARG 257.A NH1 GLU 259.A OE1 no hydrogen 2.664 N/A ARG 257.A NH2 ALA 49.A O no hydrogen 2.811 N/A ARG 257.A NH2 GLU 259.A OE1 no hydrogen 3.546 N/A GLN 258.A NE2 ARG 260.A O no hydrogen 2.944 N/A GLU 259.A N GLY 262.A O no hydrogen 2.884 N/A GLY 262.A N GLU 259.A O no hydrogen 2.936 N/A LEU 264.A N ARG 257.A O no hydrogen 2.824 N/A PHE 265.A N VAL 229.A O no hydrogen 3.153 N/A GLY 266.A N TYR 255.A O no hydrogen 2.996 N/A TYR 268.A N SER 253.A O no hydrogen 2.938 N/A GLU 269.A N GLU 269.A OE1 no hydrogen 2.657 N/A GLU 272.A N SER 270.A OG no hydrogen 2.942 N/A LYS 273.A N SER 270.A O no hydrogen 3.080 N/A MET 274.A N SER 270.A O no hydrogen 2.907 N/A GLN 277.A N PRO 223.A O no hydrogen 2.789 N/A TRP 280.A N GLN 277.A O no hydrogen 2.941 N/A VAL 281.A N ALA 278.A O no hydrogen 3.050 N/A ALA 282.A N ALA 278.A O no hydrogen 3.144 N/A HIS 283.A N SER 279.A O no hydrogen 2.896 N/A VAL 285.A N GLU 210.A OE2 no hydrogen 2.486 N/A PHE 289.A N PRO 286.A O no hydrogen 3.171 N/A LYS 291.A N ALA 42.A O no hydrogen 3.239 N/A LYS 291.A NZ GLU 39.A OE2 no hydrogen 3.409 N/A PHE 294.A N ASN 325.A O no hydrogen 2.898 N/A ASP 297.A N GLN 227.A OE1 no hydrogen 2.780 N/A ARG 300.A NE GLU 269.A OE2 no hydrogen 3.211 N/A ARG 300.A NH1 GLN 225.A OE1 no hydrogen 3.224 N/A ARG 300.A NH1 ASP 297.A OD2 no hydrogen 3.153 N/A ARG 300.A NH2 GLN 225.A OE1 no hydrogen 2.819 N/A ILE 301.A N LEU 298.A O no hydrogen 3.036 N/A THR 302.A N ASP 299.A O no hydrogen 3.490 N/A THR 302.A OG1 ASP 299.A O no hydrogen 2.633 N/A HIS 304.A N ILE 301.A O no hydrogen 2.986 N/A HIS 304.A ND1 GLY 252.A O no hydrogen 2.814 N/A VAL 305.A N ILE 301.A O no hydrogen 3.042 N/A GLU 306.A N THR 302.A O no hydrogen 2.958 N/A ALA 307.A N GLU 303.A O no hydrogen 3.369 N/A ALA 308.A N HIS 304.A O no hydrogen 3.046 N/A MET 309.A N VAL 305.A O no hydrogen 2.910 N/A GLU 310.A N GLU 306.A O no hydrogen 3.105 N/A MET 311.A N ALA 307.A O no hydrogen 3.066 N/A VAL 312.A N ALA 308.A O no hydrogen 2.768 N/A LEU 315.A N VAL 312.A O no hydrogen 2.828 N/A LYS 316.A N PRO 313.A O no hydrogen 2.906 N/A LYS 316.A NZ GLU 310.A OE2 no hydrogen 3.434 N/A LYS 317.A N VAL 314.A O no hydrogen 3.412 N/A ALA 318.A N LEU 315.A O no hydrogen 2.953 N/A ASP 319.A N SER 232.A OG no hydrogen 3.294 N/A ILE 321.A N ILE 230.A O no hydrogen 2.971 N/A ASN 322.A N ILE 230.A O no hydrogen 3.329 N/A VAL 324.A N TYR 228.A O no hydrogen 2.850 N/A ASN 325.A ND2 GLN 225.A OE1 no hydrogen 3.153 N/A ASN 325.A ND2 GLU 295.A O no hydrogen 2.876 N/A GLY 326.A N HIS 226.A O no hydrogen 3.046 N/A ILE 328.A N VAL 224.A O no hydrogen 2.820 N/A TYR 330.A N ILE 222.A O no hydrogen 3.098 N/A SER 331.A OG LEU 335.A O no hydrogen 2.663 N/A SER 331.A OG TYR 388.A OH no hydrogen 2.724 N/A ASP 333.A N TYR 388.A OH no hydrogen 3.288 N/A ILE 334.A N SER 331.A O no hydrogen 3.165 N/A LEU 335.A N ASP 333.A OD1 no hydrogen 2.948 N/A MET 337.A N ILE 351.A O no hydrogen 2.828 N/A VAL 338.A N LEU 383.A O no hydrogen 2.852 N/A GLY 339.A N VAL 349.A O no hydrogen 3.028 N/A HIS 341.A N TYR 347.A O no hydrogen 2.921 N/A HIS 341.A ND1 GLN 342.A O no hydrogen 2.782 N/A GLN 342.A N ASN 386.A OD1 no hydrogen 2.895 N/A GLN 342.A NE2 GLU 564.A OE1 no hydrogen 2.642 N/A ASN 346.A ND2 GLY 184.A O no hydrogen 2.861 N/A TYR 347.A OH HIS 219.A NE2 no hydrogen 2.775 N/A TRP 348.A N ILE 200.A O no hydrogen 2.924 N/A VAL 349.A N GLY 339.A O no hydrogen 2.898 N/A ALA 350.A N ASN 202.A O no hydrogen 2.894 N/A ILE 351.A N MET 337.A O no hydrogen 3.005 N/A HIS 359.A N TYR 355.A O no hydrogen 3.105 N/A HIS 359.A NE2 HIS 65.A NE2 no hydrogen 3.039 N/A ALA 360.A N GLY 356.A O no hydrogen 2.866 N/A GLY 361.A N TYR 72.A OH no hydrogen 3.096 N/A GLY 362.A N SER 68.A OG no hydrogen 2.723 N/A VAL 363.A N HIS 359.A O no hydrogen 2.916 N/A GLY 364.A N ALA 360.A O no hydrogen 2.939 N/A THR 365.A N GLY 361.A O no hydrogen 3.345 N/A TYR 366.A N GLY 362.A O no hydrogen 2.917 N/A TYR 366.A OH PHE 378.A O no hydrogen 3.158 N/A LEU 367.A N VAL 363.A O no hydrogen 2.801 N/A SER 368.A N GLY 364.A O no hydrogen 2.936 N/A ASP 369.A N THR 365.A O no hydrogen 3.013 N/A TRP 370.A N TYR 366.A O no hydrogen 3.051 N/A ILE 371.A N LEU 367.A O no hydrogen 2.779 N/A LEU 372.A N SER 368.A O no hydrogen 2.884 N/A HIS 373.A N ASP 369.A O no hydrogen 2.769 N/A GLY 374.A N TRP 370.A O no hydrogen 2.936 N/A ASP 379.A N ASP 690.A OD1 no hydrogen 2.988 N/A ILE 381.A N ASP 379.A OD2 no hydrogen 3.103 N/A GLU 382.A N GLU 382.A OE1 no hydrogen 2.830 N/A LEU 383.A N LEU 380.A O no hydrogen 2.769 N/A ASP 384.A N ILE 381.A O no hydrogen 2.805 N/A ASN 386.A N ASP 384.A OD1 no hydrogen 3.098 N/A ARG 387.A N ASP 384.A O no hydrogen 3.139 N/A ARG 387.A NE ASP 333.A OD2 no hydrogen 2.834 N/A ARG 387.A NH1 PRO 336.A O no hydrogen 2.903 N/A ARG 387.A NH1 ASP 384.A O no hydrogen 3.242 N/A ARG 387.A NH2 ASP 333.A OD1 no hydrogen 2.646 N/A ARG 387.A NH2 ASP 333.A OD2 no hydrogen 3.120 N/A ARG 387.A NH2 LEU 335.A O no hydrogen 2.867 N/A ARG 387.A NH2 PRO 336.A O no hydrogen 3.454 N/A TYR 388.A OH SER 331.A OG no hydrogen 2.724 N/A GLY 389.A N THR 392.A OG1 no hydrogen 3.017 N/A THR 392.A N GLY 389.A O no hydrogen 3.095 N/A THR 392.A OG1 GLY 389.A O no hydrogen 3.271 N/A THR 393.A OG1 GLN 395.A OE1 no hydrogen 3.400 N/A THR 394.A OG1 GLN 395.A OE1 no hydrogen 3.192 N/A GLN 395.A N GLN 395.A OE1 no hydrogen 2.745 N/A TYR 396.A N THR 393.A OG1 no hydrogen 3.184 N/A THR 397.A N THR 393.A O no hydrogen 2.852 N/A THR 397.A OG1 THR 393.A O no hydrogen 2.760 N/A GLU 398.A N THR 394.A O no hydrogen 2.940 N/A ALA 399.A N GLN 395.A O no hydrogen 3.199 N/A LYS 400.A N TYR 396.A O no hydrogen 2.838 N/A LYS 400.A NZ GLU 403.A OE2 no hydrogen 2.901 N/A LYS 400.A NZ ALA 420.A O no hydrogen 2.948 N/A ALA 401.A N THR 397.A O no hydrogen 2.916 N/A ARG 402.A N GLU 398.A O no hydrogen 3.210 N/A ARG 402.A NH1 GLN 271.A O no hydrogen 3.285 N/A ARG 402.A NH1 MET 274.A O no hydrogen 2.984 N/A GLU 403.A N ALA 399.A O no hydrogen 3.178 N/A SER 404.A N LYS 400.A O no hydrogen 2.820 N/A SER 404.A OG PRO 332.A O no hydrogen 2.647 N/A SER 404.A OG LYS 400.A O no hydrogen 3.140 N/A TYR 405.A N ALA 401.A O no hydrogen 2.980 N/A TYR 405.A OH HIS 226.A ND1 no hydrogen 2.998 N/A TYR 405.A OH GLU 269.A OE1 no hydrogen 2.864 N/A GLY 406.A N ARG 402.A O no hydrogen 3.151 N/A PHE 407.A N GLU 403.A O no hydrogen 2.850 N/A ASN 408.A N TYR 405.A O no hydrogen 2.945 N/A ASN 408.A ND2 TYR 355.A OH no hydrogen 2.650 N/A ASN 409.A ND2 SER 253.A OG no hydrogen 3.040 N/A ILE 410.A N PHE 407.A O no hydrogen 3.133 N/A GLY 412.A N GLU 102.A OE2 no hydrogen 2.683 N/A LYS 415.A NZ GLU 741.A OE1 no hydrogen 3.375 N/A GLU 417.A N TYR 461.A OH no hydrogen 2.990 N/A ARG 418.A NE GLU 416.A OE1 no hydrogen 2.744 N/A ALA 420.A N GLU 403.A OE1 no hydrogen 3.148 N/A ARG 422.A N PHE 419.A O no hydrogen 3.364 N/A ARG 422.A NE GLU 447.A OE2 no hydrogen 2.834 N/A ARG 422.A NH1 ARG 418.A O no hydrogen 2.712 N/A ARG 422.A NH2 MET 440.A O no hydrogen 2.878 N/A ARG 422.A NH2 GLU 447.A OE1 no hydrogen 2.895 N/A ARG 422.A NH2 GLU 447.A OE2 no hydrogen 3.455 N/A THR 424.A OG1 GLY 445.A O no hydrogen 2.751 N/A ARG 426.A N THR 424.A OG1 no hydrogen 2.985 N/A ARG 426.A NE ASP 581.A OD1 no hydrogen 2.820 N/A ARG 426.A NH1 ALA 444.A O no hydrogen 2.778 N/A ARG 426.A NH2 GLU 556.A OE1 no hydrogen 2.887 N/A ARG 426.A NH2 GLU 556.A OE2 no hydrogen 3.363 N/A ARG 426.A NH2 ASP 581.A OD1 no hydrogen 3.528 N/A ARG 426.A NH2 ASP 581.A OD2 no hydrogen 3.275 N/A VAL 427.A N GLN 425.A O no hydrogen 2.989 N/A LEU 430.A N SER 428.A OG no hydrogen 3.057 N/A TYR 431.A N SER 428.A O no hydrogen 3.185 N/A LEU 434.A N LEU 430.A O no hydrogen 3.098 N/A GLU 435.A N TYR 431.A O no hydrogen 2.995 N/A LYS 437.A N LEU 434.A O no hydrogen 3.032 N/A CYS 438.A SG LEU 434.A O no hydrogen 3.201 N/A SER 439.A N TRP 451.A O no hydrogen 2.987 N/A GLY 441.A N GLN 448.A O no hydrogen 2.562 N/A HIS 443.A N TRP 446.A O no hydrogen 3.171 N/A HIS 443.A NE2 HIS 450.A NE2 no hydrogen 3.258 N/A TRP 446.A N HIS 443.A O no hydrogen 2.976 N/A GLN 448.A N GLY 441.A O no hydrogen 2.931 N/A GLN 448.A NE2 ASP 489.A O no hydrogen 2.870 N/A HIS 450.A N SER 439.A O no hydrogen 2.900 N/A HIS 450.A NE2 HIS 443.A NE2 no hydrogen 3.258 N/A PHE 452.A N GLU 477.A OE1 no hydrogen 2.872 N/A TYR 453.A N LYS 437.A O no hydrogen 3.116 N/A LYS 454.A NZ PHE 452.A O no hydrogen 3.443 N/A ARG 462.A NE THR 468.A OG1 no hydrogen 3.400 N/A SER 464.A OG ARG 466.A O no hydrogen 3.340 N/A ARG 466.A N SER 464.A OG no hydrogen 2.842 N/A ARG 466.A NH1 ASP 101.A OD2 no hydrogen 3.024 N/A ARG 466.A NH2 ASP 101.A OD1 no hydrogen 3.348 N/A ARG 466.A NH2 ASP 101.A OD2 no hydrogen 3.106 N/A ARG 467.A N ASN 737.A O no hydrogen 3.047 N/A ARG 467.A NE ASP 739.A OD2 no hydrogen 3.025 N/A ARG 467.A NH2 ASP 739.A OD1 no hydrogen 2.955 N/A THR 468.A OG1 ARG 462.A O no hydrogen 2.509 N/A THR 468.A OG1 ASN 469.A OD1 no hydrogen 3.411 N/A ASN 469.A N THR 468.A OG1 no hydrogen 2.726 N/A ASN 469.A ND2 ASP 458.A O no hydrogen 3.218 N/A ASN 469.A ND2 GLN 460.A O no hydrogen 2.762 N/A PHE 471.A N THR 468.A O no hydrogen 3.062 N/A VAL 474.A N TRP 470.A O no hydrogen 2.958 N/A GLY 475.A N PHE 471.A O no hydrogen 3.309 N/A SER 476.A N GLU 472.A O no hydrogen 3.046 N/A SER 476.A OG GLU 472.A O no hydrogen 3.320 N/A GLU 477.A N PRO 473.A O no hydrogen 3.004 N/A TYR 478.A N VAL 474.A O no hydrogen 2.907 N/A TYR 478.A OH GLU 677.A OE1 no hydrogen 2.431 N/A LYS 479.A N GLY 475.A O no hydrogen 3.013 N/A GLN 480.A N SER 476.A O no hydrogen 2.742 N/A GLN 480.A NE2 VAL 485.A O no hydrogen 3.142 N/A GLN 480.A NE2 GLY 662.A O no hydrogen 2.639 N/A VAL 481.A N GLU 477.A O no hydrogen 3.083 N/A VAL 481.A N TYR 478.A O no hydrogen 3.251 N/A MET 482.A N TYR 478.A O no hydrogen 3.115 N/A GLN 483.A N LYS 479.A O no hydrogen 2.759 N/A ARG 484.A N GLN 480.A O no hydrogen 2.947 N/A ARG 484.A NE GLN 480.A OE1 no hydrogen 3.441 N/A GLY 486.A N ALA 589.A O no hydrogen 2.748 N/A VAL 487.A N ASP 664.A O no hydrogen 2.902 N/A ILE 488.A N GLY 587.A O no hydrogen 2.925 N/A LEU 490.A N VAL 585.A O no hydrogen 2.968 N/A SER 491.A N ASP 489.A OD1 no hydrogen 3.076 N/A SER 491.A OG ASP 489.A OD1 no hydrogen 2.715 N/A SER 491.A OG VAL 585.A O no hydrogen 3.531 N/A PHE 493.A N LEU 490.A O no hydrogen 3.372 N/A GLY 494.A N THR 551.A O no hydrogen 2.680 N/A LYS 495.A N THR 580.A OG1 no hydrogen 3.031 N/A LYS 495.A NZ SER 491.A O no hydrogen 2.763 N/A LYS 495.A NZ PHE 493.A O no hydrogen 2.952 N/A LYS 495.A NZ THR 580.A O no hydrogen 2.711 N/A LYS 495.A NZ LEU 583.A O no hydrogen 3.110 N/A PHE 496.A N LEU 549.A O no hydrogen 2.902 N/A ASN 497.A N ARG 577.A O no hydrogen 2.881 N/A ILE 498.A N PHE 547.A O no hydrogen 3.021 N/A LYS 499.A N GLU 575.A O no hydrogen 2.998 N/A ASP 502.A N ASP 573.A O no hydrogen 3.113 N/A SER 503.A N GLY 500.A O no hydrogen 3.442 N/A SER 503.A OG GLY 500.A O no hydrogen 3.069 N/A SER 503.A OG GLY 545.A O no hydrogen 2.554 N/A LEU 506.A N ASP 502.A O no hydrogen 2.913 N/A LEU 507.A N SER 503.A O no hydrogen 3.140 N/A ASP 508.A N THR 504.A O no hydrogen 2.876 N/A HIS 509.A N GLN 505.A O no hydrogen 3.112 N/A LEU 510.A N LEU 506.A O no hydrogen 2.887 N/A CYS 511.A N LEU 507.A O no hydrogen 2.877 N/A CYS 511.A SG LEU 507.A O no hydrogen 3.447 N/A ALA 512.A N HIS 525.A O no hydrogen 2.936 N/A ASN 513.A ND2 ILE 523.A O no hydrogen 2.682 N/A VAL 514.A N ASN 513.A OD1 no hydrogen 2.765 N/A GLY 519.A N HIS 541.A O no hydrogen 2.685 N/A PHE 520.A N LYS 517.A O no hydrogen 3.009 N/A THR 521.A N LEU 613.A O no hydrogen 2.797 N/A THR 521.A OG1 SER 540.A OG no hydrogen 3.028 N/A ASN 522.A N VAL 539.A O no hydrogen 3.089 N/A ASN 522.A ND2 VAL 514.A O no hydrogen 2.765 N/A SER 524.A N LEU 537.A O no hydrogen 2.948 N/A HIS 525.A NE2 GLU 536.A OE1 no hydrogen 2.840 N/A MET 526.A N ALA 535.A O no hydrogen 2.938 N/A THR 528.A N ARG 532.A O no hydrogen 2.827 N/A THR 528.A OG1 GLU 375.A OE1 no hydrogen 2.874 N/A THR 528.A OG1 GLU 375.A OE2 no hydrogen 3.225 N/A ARG 530.A N GLU 375.A OE2 no hydrogen 2.989 N/A GLY 531.A N THR 528.A O no hydrogen 2.665 N/A ARG 532.A N THR 528.A OG1 no hydrogen 3.049 N/A ARG 532.A NH1 CYS 689.A O no hydrogen 2.752 N/A VAL 533.A N THR 691.A O no hydrogen 2.921 N/A TYR 534.A OH HIS 558.A O no hydrogen 2.686 N/A ALA 535.A N MET 526.A O no hydrogen 3.176 N/A LEU 537.A N SER 524.A O no hydrogen 2.738 N/A THR 538.A N ILE 550.A O no hydrogen 3.039 N/A VAL 539.A N ASN 522.A O no hydrogen 2.798 N/A SER 540.A N LEU 548.A O no hydrogen 2.899 N/A SER 540.A OG THR 521.A OG1 no hydrogen 3.028 N/A HIS 541.A N PHE 520.A O no hydrogen 3.005 N/A HIS 541.A ND1 PRO 516.A O no hydrogen 2.814 N/A GLN 542.A N GLU 546.A O no hydrogen 2.986 N/A GLY 545.A N HIS 541.A NE2 no hydrogen 3.300 N/A GLU 546.A N SER 543.A O no hydrogen 2.751 N/A PHE 547.A N ILE 498.A O no hydrogen 2.831 N/A LEU 548.A N SER 540.A O no hydrogen 2.855 N/A LEU 549.A N PHE 496.A O no hydrogen 2.906 N/A ILE 550.A N THR 538.A O no hydrogen 3.065 N/A THR 551.A N GLY 494.A O no hydrogen 2.889 N/A THR 551.A OG1 GLU 536.A O no hydrogen 3.487 N/A THR 551.A OG1 ASP 559.A OD2 no hydrogen 2.788 N/A SER 553.A OG PRO 492.A O no hydrogen 3.430 N/A SER 555.A N GLY 552.A O no hydrogen 3.074 N/A GLU 556.A N SER 553.A O no hydrogen 3.457 N/A HIS 558.A ND1 ASP 384.A OD2 no hydrogen 3.046 N/A ASP 559.A N SER 555.A O no hydrogen 2.786 N/A LEU 560.A N GLU 556.A O no hydrogen 3.018 N/A ARG 561.A N LEU 557.A O no hydrogen 2.822 N/A ARG 561.A NH1 ASP 384.A OD1 no hydrogen 2.801 N/A ARG 561.A NH1 ASN 386.A OD1 no hydrogen 2.841 N/A ARG 561.A NH2 ASP 384.A OD2 no hydrogen 2.799 N/A ARG 561.A NH2 TYR 534.A OH no hydrogen 3.302 N/A ILE 563.A N ASP 559.A O no hydrogen 3.012 N/A GLU 564.A N LEU 560.A O no hydrogen 2.766 N/A GLU 565.A N ARG 561.A O no hydrogen 2.992 N/A ALA 566.A N TRP 562.A O no hydrogen 3.180 N/A ALA 567.A N ILE 563.A O no hydrogen 3.105 N/A VAL 568.A N GLU 564.A O no hydrogen 3.082 N/A ARG 569.A N GLU 565.A O no hydrogen 2.761 N/A GLY 570.A N ALA 566.A O no hydrogen 2.961 N/A GLY 571.A N VAL 568.A O no hydrogen 3.306 N/A TYR 572.A N ALA 567.A O no hydrogen 2.934 N/A ASP 573.A N ASP 502.A OD2 no hydrogen 2.791 N/A GLU 575.A N LYS 499.A O no hydrogen 2.654 N/A ARG 577.A N ASN 497.A O no hydrogen 2.916 N/A ASN 578.A ND2 GLU 556.A OE2 no hydrogen 2.987 N/A ILE 579.A N LYS 495.A O no hydrogen 2.933 N/A THR 580.A N ASN 578.A OD1 no hydrogen 2.991 N/A THR 580.A OG1 ASN 578.A OD1 no hydrogen 2.589 N/A GLU 582.A N ILE 579.A O no hydrogen 3.108 N/A GLY 584.A N HIS 642.A O no hydrogen 2.813 N/A VAL 585.A N SER 491.A OG no hydrogen 3.015 N/A LEU 586.A N LEU 640.A O no hydrogen 3.177 N/A GLY 587.A N ILE 488.A O no hydrogen 2.919 N/A VAL 588.A N TRP 638.A O no hydrogen 2.875 N/A ALA 589.A N GLY 486.A O no hydrogen 2.999 N/A GLY 590.A N LEU 636.A O no hydrogen 2.718 N/A TYR 592.A N ARG 484.A O no hydrogen 3.116 N/A ALA 593.A N GLY 590.A O no hydrogen 2.907 N/A ARG 594.A NE LEU 605.A O no hydrogen 2.825 N/A ARG 595.A NE GLU 661.A OE2 no hydrogen 2.706 N/A ARG 595.A NH2 GLU 660.A OE2 no hydrogen 2.817 N/A VAL 596.A N TYR 592.A O no hydrogen 3.105 N/A LEU 597.A N ALA 593.A O no hydrogen 3.104 N/A GLN 598.A N ARG 594.A O no hydrogen 2.882 N/A GLN 598.A NE2 GLN 598.A O no hydrogen 3.063 N/A GLN 598.A NE2 THR 601.A O no hydrogen 3.027 N/A GLN 598.A NE2 GLU 603.A O no hydrogen 2.748 N/A LYS 599.A N VAL 596.A O no hydrogen 3.309 N/A LYS 599.A NZ ALA 657.A O no hydrogen 2.832 N/A LYS 599.A NZ GLU 660.A OE1 no hydrogen 2.698 N/A LYS 599.A NZ GLU 661.A OE1 no hydrogen 3.500 N/A LYS 599.A NZ GLU 661.A OE2 no hydrogen 2.983 N/A LEU 600.A N LEU 597.A O no hydrogen 2.894 N/A THR 601.A N GLN 598.A O no hydrogen 3.359 N/A THR 601.A OG1 LYS 619.A O no hydrogen 2.898 N/A GLU 603.A N THR 601.A OG1 no hydrogen 2.985 N/A LEU 605.A N GLN 598.A OE1 no hydrogen 2.749 N/A SER 606.A N ASP 604.A OD1 no hydrogen 3.080 N/A SER 606.A OG ASP 604.A OD1 no hydrogen 2.642 N/A PHE 610.A N SER 606.A O no hydrogen 2.887 N/A LYS 611.A N GLN 614.A OE1 no hydrogen 3.075 N/A LYS 611.A NZ ASP 607.A O no hydrogen 2.503 N/A LYS 611.A NZ ASP 608.A O no hydrogen 2.788 N/A LEU 613.A N ARG 629.A O no hydrogen 2.884 N/A GLN 614.A N LYS 611.A O no hydrogen 3.378 N/A THR 615.A N GLY 519.A O no hydrogen 2.797 N/A LYS 616.A N ALA 627.A O no hydrogen 3.018 N/A LYS 616.A NZ VAL 609.A O no hydrogen 3.025 N/A LYS 616.A NZ GLN 614.A OE1 no hydrogen 3.396 N/A LEU 618.A N VAL 625.A O no hydrogen 2.866 N/A ILE 620.A N ILE 623.A O no hydrogen 2.881 N/A SER 621.A N LEU 600.A O no hydrogen 2.776 N/A ILE 623.A N ILE 620.A O no hydrogen 3.192 N/A VAL 625.A N LEU 618.A O no hydrogen 2.782 N/A THR 626.A N TYR 641.A O no hydrogen 2.909 N/A ALA 627.A N LYS 616.A O no hydrogen 2.940 N/A ILE 628.A N GLU 639.A O no hydrogen 2.990 N/A ARG 629.A N GLN 614.A O no hydrogen 3.093 N/A ARG 629.A NH1 ASP 607.A OD1 no hydrogen 2.904 N/A ARG 629.A NH1 PHE 610.A O no hydrogen 2.954 N/A ARG 629.A NH2 ASP 607.A OD1 no hydrogen 3.520 N/A ARG 629.A NH2 GLU 807.A OE1 no hydrogen 3.411 N/A SER 631.A OG THR 633.A OG1 no hydrogen 2.599 N/A TYR 632.A OH ARG 681.A O no hydrogen 2.757 N/A THR 633.A N SER 631.A OG no hydrogen 3.248 N/A THR 633.A OG1 SER 631.A OG no hydrogen 2.599 N/A GLY 634.A N SER 631.A O no hydrogen 2.962 N/A GLU 635.A N THR 633.A OG1 no hydrogen 3.216 N/A TRP 638.A N VAL 588.A O no hydrogen 2.901 N/A GLU 639.A N ILE 628.A O no hydrogen 2.808 N/A LEU 640.A N LEU 586.A O no hydrogen 2.809 N/A TYR 641.A N THR 626.A O no hydrogen 2.933 N/A TYR 641.A OH GLU 639.A OE1 no hydrogen 2.660 N/A HIS 642.A N GLY 584.A O no hydrogen 3.146 N/A HIS 642.A ND1 LEU 640.A O no hydrogen 2.770 N/A HIS 642.A NE2 SER 647.A OG no hydrogen 2.859 N/A ARG 644.A N GLU 582.A O no hydrogen 3.018 N/A ARG 644.A NH2 ASP 581.A OD1 no hydrogen 3.005 N/A GLU 645.A N GLU 645.A OE1 no hydrogen 2.834 N/A ASP 646.A N ARG 643.A O no hydrogen 2.892 N/A SER 647.A N ARG 644.A O no hydrogen 3.255 N/A SER 647.A OG HIS 642.A NE2 no hydrogen 2.859 N/A SER 647.A OG ARG 644.A O no hydrogen 3.198 N/A LEU 650.A N ASP 646.A O no hydrogen 2.906 N/A TYR 651.A N SER 647.A O no hydrogen 2.960 N/A GLU 652.A N ALA 648.A O no hydrogen 2.981 N/A ARG 653.A N ALA 649.A O no hydrogen 3.007 N/A ILE 654.A N LEU 650.A O no hydrogen 3.050 N/A MET 655.A N TYR 651.A O no hydrogen 2.997 N/A ASN 656.A N GLU 652.A O no hydrogen 3.038 N/A ALA 657.A N ARG 653.A O no hydrogen 3.121 N/A GLY 658.A N ILE 654.A O no hydrogen 3.204 N/A GLN 659.A N ASN 656.A O no hydrogen 3.288 N/A GLU 661.A N GLU 661.A OE1 no hydrogen 2.660 N/A GLY 662.A N GLN 659.A O no hydrogen 2.932 N/A ILE 663.A N GLY 658.A O no hydrogen 3.063 N/A ASP 664.A N VAL 485.A O no hydrogen 3.339 N/A ASN 665.A N ASP 664.A OD1 no hydrogen 2.840 N/A ASN 665.A ND2 TYR 651.A OH no hydrogen 2.534 N/A PHE 666.A N VAL 487.A O no hydrogen 3.003 N/A GLY 667.A N GLU 477.A OE2 no hydrogen 2.813 N/A THR 668.A N PRO 449.A O no hydrogen 3.009 N/A TYR 669.A N HIS 450.A O no hydrogen 3.098 N/A LEU 671.A N GLY 667.A O no hydrogen 3.025 N/A ASN 672.A N THR 668.A O no hydrogen 2.891 N/A ASN 672.A ND2 GLY 759.A O no hydrogen 3.131 N/A ALA 673.A N TYR 669.A O no hydrogen 3.186 N/A LEU 674.A N ALA 670.A O no hydrogen 2.900 N/A ARG 675.A N LEU 671.A O no hydrogen 2.920 N/A ARG 675.A NE ASN 672.A OD1 no hydrogen 2.824 N/A ARG 675.A NH1 PHE 680.A O no hydrogen 2.925 N/A ARG 675.A NH1 GLU 686.A OE1 no hydrogen 2.784 N/A ARG 675.A NH2 ASN 672.A OD1 no hydrogen 2.739 N/A ARG 675.A NH2 SER 758.A OG no hydrogen 3.064 N/A LEU 676.A N ASN 672.A O no hydrogen 3.221 N/A GLU 677.A N ALA 673.A O no hydrogen 3.435 N/A LYS 678.A N LEU 674.A O no hydrogen 3.245 N/A LYS 678.A NZ THR 633.A O no hydrogen 2.752 N/A LYS 678.A NZ GLU 635.A OE2 no hydrogen 2.972 N/A ALA 679.A N LEU 676.A O no hydrogen 3.101 N/A PHE 680.A N ARG 675.A O no hydrogen 2.928 N/A ARG 681.A NE ALA 696.A O no hydrogen 2.951 N/A ARG 681.A NH1 ALA 679.A O no hydrogen 2.666 N/A ARG 681.A NH1 GLU 801.A OE1 no hydrogen 2.998 N/A ARG 681.A NH2 ALA 696.A O no hydrogen 3.447 N/A ARG 681.A NH2 GLU 801.A OE1 no hydrogen 3.336 N/A ALA 682.A N GLU 686.A OE1 no hydrogen 3.254 N/A TRP 683.A NE1 VAL 533.A O no hydrogen 2.930 N/A GLY 684.A N MET 687.A O no hydrogen 2.797 N/A SER 685.A N ALA 682.A O no hydrogen 3.239 N/A GLU 686.A N ALA 682.A O no hydrogen 3.022 N/A ASN 688.A N THR 691.A OG1 no hydrogen 2.970 N/A CYS 689.A N ASP 379.A OD1 no hydrogen 3.354 N/A ASP 690.A N ASN 688.A OD1 no hydrogen 3.209 N/A THR 691.A N ASN 688.A O no hydrogen 3.087 N/A THR 691.A OG1 ASN 688.A O no hydrogen 3.052 N/A ASN 692.A N GLU 695.A OE2 no hydrogen 3.089 N/A LEU 694.A N ASN 692.A OD1 no hydrogen 3.121 N/A GLU 695.A N ASN 692.A OD1 no hydrogen 3.112 N/A GLY 697.A N LEU 694.A O no hydrogen 3.066 N/A LEU 698.A N PRO 693.A O no hydrogen 2.847 N/A PHE 701.A N LEU 698.A O no hydrogen 2.872 N/A ILE 702.A N ASP 699.A O no hydrogen 2.959 N/A LYS 703.A N ALA 512.A O no hydrogen 2.756 N/A LYS 703.A NZ TYR 700.A O no hydrogen 2.982 N/A LYS 706.A N LYS 703.A O no hydrogen 3.385 N/A LYS 706.A NZ ASP 508.A O no hydrogen 2.866 N/A LYS 706.A NZ ASP 508.A OD1 no hydrogen 2.622 N/A LYS 706.A NZ CYS 511.A O no hydrogen 2.892 N/A LYS 706.A NZ ASN 513.A O no hydrogen 2.898 N/A PHE 710.A N ALA 708.A O no hydrogen 3.088 N/A THR 711.A N HIS 509.A O no hydrogen 3.027 N/A THR 711.A OG1 HIS 509.A O no hydrogen 3.509 N/A LYS 713.A N PHE 710.A O no hydrogen 2.992 N/A LYS 713.A NZ LYS 706.A O no hydrogen 2.586 N/A LYS 713.A NZ PRO 707.A O no hydrogen 3.316 N/A LYS 713.A NZ ALA 708.A O no hydrogen 3.221 N/A GLN 714.A N GLN 714.A OE1 no hydrogen 2.729 N/A GLN 714.A NE2 ASN 709.A OD1 no hydrogen 2.922 N/A LEU 716.A N GLY 712.A O no hydrogen 2.971 N/A LYS 717.A N LYS 713.A O no hydrogen 3.032 N/A LYS 717.A NZ LEU 704.A O no hydrogen 3.409 N/A GLN 718.A N GLN 714.A O no hydrogen 2.981 N/A ILE 719.A N ALA 715.A O no hydrogen 2.789 N/A LYS 720.A N LEU 716.A O no hydrogen 2.865 N/A ALA 721.A N LYS 717.A O no hydrogen 3.005 N/A LYS 722.A N GLN 718.A O no hydrogen 3.196 N/A GLY 723.A N ILE 719.A O no hydrogen 3.249 N/A GLY 723.A N LYS 720.A O no hydrogen 3.072 N/A ARG 726.A NE GLU 695.A OE1 no hydrogen 3.108 N/A ARG 726.A NH2 GLU 695.A OE2 no hydrogen 3.111 N/A ARG 727.A N VAL 774.A O no hydrogen 2.990 N/A LEU 728.A N GLU 695.A O no hydrogen 2.756 N/A VAL 729.A N ALA 772.A O no hydrogen 2.750 N/A CYS 730.A SG ALA 770.A O no hydrogen 3.947 N/A LEU 731.A N ALA 770.A O no hydrogen 2.726 N/A THR 732.A N THR 797.A O no hydrogen 2.919 N/A THR 732.A OG1 THR 797.A O no hydrogen 3.513 N/A LEU 733.A N SER 768.A O no hydrogen 3.074 N/A THR 735.A OG1 VAL 738.A O no hydrogen 3.002 N/A THR 735.A OG1 SER 768.A OG no hydrogen 3.372 N/A ASN 737.A N ASP 736.A OD1 no hydrogen 2.880 N/A GLU 741.A N GLU 744.A OE2 no hydrogen 2.841 N/A GLY 742.A N GLU 744.A OE1 no hydrogen 2.952 N/A ASN 743.A N THR 756.A O no hydrogen 2.613 N/A GLU 744.A N THR 756.A OG1 no hydrogen 2.714 N/A SER 745.A N THR 108.A OG1 no hydrogen 2.926 N/A SER 745.A OG THR 108.A O no hydrogen 2.501 N/A VAL 746.A N GLY 754.A O no hydrogen 2.978 N/A TRP 747.A N GLU 786.A O no hydrogen 2.794 N/A TRP 747.A NE1 GLU 788.A OE1 no hydrogen 2.820 N/A TYR 748.A N LYS 751.A O no hydrogen 2.836 N/A LYS 751.A N TYR 748.A O no hydrogen 3.267 N/A ILE 753.A N VAL 746.A O no hydrogen 2.904 N/A ASN 755.A N TYR 773.A O no hydrogen 3.267 N/A ASN 755.A ND2 THR 756.A O no hydrogen 3.151 N/A THR 756.A N GLU 744.A O no hydrogen 2.786 N/A THR 756.A OG1 GLU 744.A O no hydrogen 3.375 N/A THR 756.A OG1 GLU 744.A OE1 no hydrogen 2.424 N/A THR 757.A N PHE 771.A O no hydrogen 2.730 N/A THR 757.A OG1 GLU 686.A OE2 no hydrogen 2.550 N/A SER 758.A OG GLU 686.A OE1 no hydrogen 3.290 N/A SER 758.A OG GLU 686.A OE2 no hydrogen 2.550 N/A SER 760.A N LEU 769.A O no hydrogen 2.870 N/A SER 760.A OG TYR 761.A O no hydrogen 3.509 N/A SER 762.A N LYS 767.A O no hydrogen 2.770 N/A SER 762.A OG GLU 677.A OE2 no hydrogen 2.712 N/A TYR 763.A OH PHE 471.A O no hydrogen 2.699 N/A SER 764.A OG GLU 677.A OE2 no hydrogen 2.847 N/A SER 764.A OG SER 762.A OG no hydrogen 3.105 N/A LYS 767.A N SER 762.A O no hydrogen 3.409 N/A SER 768.A N LEU 733.A O no hydrogen 2.999 N/A SER 768.A OG THR 735.A OG1 no hydrogen 3.372 N/A SER 768.A OG ASP 739.A OD1 no hydrogen 2.628 N/A LEU 769.A N SER 760.A O no hydrogen 2.610 N/A ALA 770.A N LEU 731.A O no hydrogen 3.020 N/A PHE 771.A N SER 758.A O no hydrogen 2.896 N/A ALA 772.A N VAL 729.A O no hydrogen 2.829 N/A TYR 773.A N ASN 755.A O no hydrogen 2.864 N/A TYR 773.A OH GLU 686.A O no hydrogen 2.718 N/A VAL 774.A N ARG 727.A O no hydrogen 3.360 N/A VAL 776.A N LYS 725.A O no hydrogen 3.043 N/A GLU 777.A N GLU 777.A OE1 no hydrogen 2.703 N/A LEU 778.A N PRO 775.A O no hydrogen 2.889 N/A SER 779.A N VAL 776.A O no hydrogen 2.990 N/A SER 779.A OG VAL 776.A O no hydrogen 2.447 N/A GLY 782.A N ILE 798.A O no hydrogen 2.890 N/A GLN 783.A N GLU 780.A O no hydrogen 3.217 N/A GLN 783.A NE2 GLN 784.A O no hydrogen 3.409 N/A VAL 785.A N ALA 796.A O no hydrogen 2.900 N/A GLU 786.A N TRP 747.A O no hydrogen 2.970 N/A VAL 787.A N TYR 794.A O no hydrogen 2.768 N/A GLU 788.A N SER 745.A O no hydrogen 2.981 N/A LEU 789.A N LYS 792.A O no hydrogen 2.888 N/A LYS 792.A N LEU 789.A O no hydrogen 3.034 N/A ASN 793.A ND2 GLU 786.A OE2 no hydrogen 3.275 N/A TYR 794.A N VAL 787.A O no hydrogen 2.888 N/A TYR 794.A OH ASP 736.A OD1 no hydrogen 2.900 N/A TYR 794.A OH ASP 736.A OD2 no hydrogen 3.118 N/A ALA 796.A N VAL 785.A O no hydrogen 2.611 N/A THR 797.A N THR 732.A O no hydrogen 2.977 N/A ILE 798.A N GLN 783.A O no hydrogen 3.068 N/A ILE 799.A N CYS 730.A O no hydrogen 2.987 N/A GLN 800.A NE2 GLU 801.A O no hydrogen 3.346 N/A VAL 804.A N GLU 677.A O no hydrogen 3.014 N/A THR 806.A OG1 THR 809.A OG1 no hydrogen 2.913 N/A GLU 807.A N GLY 634.A O no hydrogen 2.796 N/A THR 809.A N THR 806.A OG1 no hydrogen 3.393 N/A THR 809.A OG1 THR 806.A OG1 no hydrogen 2.913 N/A ARG 810.A N THR 806.A O no hydrogen 2.792 N/A ARG 810.A NH1 GLU 635.A OE2 no hydrogen 3.166 N/A ARG 810.A NH1 LEU 805.A O no hydrogen 2.730 N/A ARG 810.A NH2 GLU 635.A OE1 no hydrogen 2.904 N/A THR 811.A N GLU 807.A O no hydrogen 2.761 N/A THR 811.A OG1 GLU 807.A O no hydrogen 2.721 N/A THR 811.A OG1 GLU 807.A OE2 no hydrogen 2.704 N/A ARG 812.A N PRO 808.A O no hydrogen 3.015 N/A GLN 814.A N THR 811.A O no hydrogen 3.321 N/A