Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1f8n_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ILE 3.A N PHE 68.A O no hydrogen 2.814 N/A LYS 4.A NZ GLU 98.A OE1 no hydrogen 2.635 N/A GLY 5.A N ILE 66.A O no hydrogen 2.788 N/A THR 6.A N THR 96.A O no hydrogen 2.955 N/A VAL 7.A N PHE 64.A O no hydrogen 2.873 N/A VAL 8.A N SER 94.A O no hydrogen 3.000 N/A LEU 9.A N SER 62.A O no hydrogen 3.026 N/A MET 10.A N PHE 91.A O no hydrogen 2.750 N/A LYS 12.A NZ GLU 89.A OE2 no hydrogen 2.614 N/A ASN 13.A N PRO 11.A O no hydrogen 2.649 N/A ALA 17.A N ASN 14.A O no hydrogen 2.637 N/A PHE 18.A N LEU 15.A O no hydrogen 2.695 N/A LEU 19.A N ASN 16.A O no hydrogen 3.045 N/A SER 22.A N LEU 19.A O no hydrogen 3.231 N/A SER 22.A OG ALA 17.A O no hydrogen 2.784 N/A SER 22.A OG LEU 19.A O no hydrogen 3.125 N/A SER 24.A N LYS 83.A O no hydrogen 3.160 N/A LEU 25.A N THR 45.A O no hydrogen 2.744 N/A GLN 26.A N TYR 81.A O no hydrogen 2.959 N/A GLN 26.A NE2 GLY 42.A O no hydrogen 3.255 N/A ILE 28.A N ALA 79.A O no hydrogen 2.716 N/A SER 29.A N LYS 40.A O no hydrogen 2.903 N/A SER 29.A OG LYS 32.A O no hydrogen 3.357 N/A SER 29.A OG MET 74.A O no hydrogen 2.669 N/A ALA 30.A N ILE 76.A O no hydrogen 2.947 N/A THR 31.A N SER 29.A OG no hydrogen 3.317 N/A LYS 32.A N SER 29.A OG no hydrogen 2.886 N/A ASP 34.A N LYS 38.A O no hydrogen 2.736 N/A HIS 36.A N ASP 34.A OD1 no hydrogen 2.559 N/A GLY 37.A N ASP 34.A O no hydrogen 3.177 N/A LYS 38.A N ASP 34.A OD1 no hydrogen 3.084 N/A GLY 39.A N PRO 136.A O no hydrogen 2.869 N/A LYS 40.A N LYS 32.A O no hydrogen 2.952 N/A GLY 42.A N LEU 27.A O no hydrogen 2.904 N/A THR 45.A N LEU 25.A O no hydrogen 2.873 N/A THR 45.A OG1 LYS 43.A O no hydrogen 3.043 N/A LEU 47.A N VAL 23.A O no hydrogen 3.400 N/A GLU 48.A N ASN 65.A O no hydrogen 3.053 N/A ASN 51.A N ALA 63.A O no hydrogen 2.845 N/A ASN 51.A ND2 ASN 65.A OD1 no hydrogen 2.499 N/A SER 53.A N ASN 51.A OD1 no hydrogen 2.997 N/A SER 53.A OG ASN 51.A OD1 no hydrogen 3.118 N/A GLU 61.A N GLY 58.A O no hydrogen 2.757 N/A SER 62.A N LEU 9.A O no hydrogen 2.935 N/A PHE 64.A N VAL 7.A O no hydrogen 2.702 N/A ASN 65.A N GLY 49.A O no hydrogen 2.788 N/A ILE 66.A N GLY 5.A O no hydrogen 3.212 N/A HIS 67.A ND1 GLU 48.A OE1 no hydrogen 3.207 N/A HIS 67.A ND1 GLU 48.A OE2 no hydrogen 3.057 N/A PHE 68.A N ILE 3.A O no hydrogen 3.040 N/A TRP 70.A N HIS 1.A O no hydrogen 2.777 N/A TRP 70.A NE1 GLY 75.A O no hydrogen 3.023 N/A SER 73.A N ASP 71.A OD2 no hydrogen 3.004 N/A SER 73.A OG ASP 71.A OD2 no hydrogen 2.514 N/A MET 74.A N ASP 71.A O no hydrogen 2.757 N/A GLY 75.A N GLY 72.A O no hydrogen 3.195 N/A ILE 76.A N THR 31.A OG1 no hydrogen 2.993 N/A GLY 78.A N ILE 28.A O no hydrogen 2.910 N/A ALA 79.A N ILE 28.A O no hydrogen 3.420 N/A PHE 80.A N PHE 122.A O no hydrogen 2.866 N/A TYR 81.A N GLN 26.A O no hydrogen 2.836 N/A ILE 82.A N ARG 120.A O no hydrogen 3.128 N/A LYS 83.A N SER 24.A O no hydrogen 2.974 N/A LYS 83.A NZ TYR 85.A OH no hydrogen 2.936 N/A ASN 84.A ND2 VAL 88.A O no hydrogen 3.235 N/A ASN 84.A ND2 VAL 110.A O no hydrogen 3.107 N/A TYR 85.A N SER 22.A O no hydrogen 2.759 N/A MET 86.A N ASN 84.A OD1 no hydrogen 2.940 N/A GLU 89.A N GLU 89.A OE1 no hydrogen 2.665 N/A PHE 90.A N VAL 110.A O no hydrogen 3.337 N/A PHE 91.A N MET 10.A O no hydrogen 2.869 N/A LEU 92.A N SER 108.A O no hydrogen 2.900 N/A LYS 93.A N VAL 8.A O no hydrogen 2.820 N/A LYS 93.A NZ ASN 107.A OD1 no hydrogen 2.824 N/A SER 94.A N VAL 8.A O no hydrogen 3.204 N/A LEU 95.A N PHE 104.A O no hydrogen 3.202 N/A THR 96.A N THR 6.A O no hydrogen 3.049 N/A LEU 97.A N ILE 102.A O no hydrogen 2.936 N/A GLU 98.A N LYS 4.A O no hydrogen 3.019 N/A ILE 102.A N LEU 97.A O no hydrogen 2.961 N/A PHE 104.A N LEU 95.A O no hydrogen 2.922 N/A CYS 106.A N LYS 93.A O no hydrogen 2.990 N/A CYS 106.A SG PHE 104.A O no hydrogen 4.034 N/A ASN 107.A N LYS 93.A O no hydrogen 3.256 N/A SER 108.A N LEU 92.A O no hydrogen 3.018 N/A SER 108.A OG TRP 109.A O no hydrogen 3.528 N/A SER 108.A OG ASP 222.A OD1 no hydrogen 3.450 N/A SER 108.A OG ASP 222.A OD2 no hydrogen 2.636 N/A TRP 109.A N ASP 222.A OD1 no hydrogen 3.031 N/A VAL 110.A N PHE 90.A O no hydrogen 2.922 N/A TYR 111.A N TYR 116.A OH no hydrogen 2.980 N/A TYR 111.A OH GLU 158.A OE2 no hydrogen 2.648 N/A ASN 112.A ND2 MET 86.A O no hydrogen 2.837 N/A THR 113.A N ASN 84.A O no hydrogen 2.886 N/A LYS 114.A N ASN 112.A OD1 no hydrogen 2.938 N/A LYS 114.A NZ ASN 112.A OD1 no hydrogen 2.720 N/A LEU 115.A N ASN 112.A O no hydrogen 2.995 N/A TYR 116.A N THR 113.A O no hydrogen 3.312 N/A ARG 120.A NH1 SER 108.A OG no hydrogen 3.250 N/A ARG 120.A NH1 TRP 109.A O no hydrogen 2.874 N/A ARG 120.A NH2 SER 108.A OG no hydrogen 2.967 N/A PHE 122.A N PHE 80.A O no hydrogen 2.907 N/A ALA 124.A N GLY 78.A O no hydrogen 2.937 N/A ASN 125.A N ARG 103.A O no hydrogen 2.926 N/A ASN 125.A ND2 HIS 750.A O no hydrogen 2.868 N/A HIS 126.A ND1 SER 753.A OG no hydrogen 2.829 N/A THR 127.A OG1 THR 752.A OG1 no hydrogen 2.893 N/A TYR 128.A N LEU 500.A O no hydrogen 2.925 N/A GLU 132.A N VAL 129.A O no hydrogen 2.928 N/A THR 133.A N PRO 130.A O no hydrogen 3.286 N/A THR 133.A OG1 VAL 129.A O no hydrogen 3.555 N/A THR 133.A OG1 PRO 130.A O no hydrogen 3.073 N/A LEU 137.A N PRO 134.A O no hydrogen 2.924 N/A VAL 138.A N ALA 135.A O no hydrogen 3.358 N/A TYR 140.A OH GLY 39.A O no hydrogen 2.663 N/A ARG 141.A N LEU 137.A O no hydrogen 2.918 N/A ARG 141.A NE GLU 623.A OE2 no hydrogen 2.794 N/A ARG 141.A NH1 TYR 128.A O no hydrogen 2.877 N/A ARG 141.A NH2 TYR 128.A O no hydrogen 3.124 N/A ARG 141.A NH2 GLU 623.A OE1 no hydrogen 2.914 N/A ARG 141.A NH2 GLU 623.A OE2 no hydrogen 3.437 N/A GLU 142.A N VAL 138.A O no hydrogen 3.172 N/A GLU 143.A N SER 139.A O no hydrogen 2.849 N/A GLU 144.A N TYR 140.A O no hydrogen 3.102 N/A LEU 145.A N ARG 141.A O no hydrogen 3.384 N/A LYS 146.A N GLU 142.A O no hydrogen 2.999 N/A SER 147.A N GLU 143.A O no hydrogen 2.970 N/A LEU 148.A N GLU 144.A O no hydrogen 3.019 N/A ARG 149.A N LEU 145.A O no hydrogen 3.103 N/A ARG 149.A N LYS 146.A O no hydrogen 3.275 N/A ARG 149.A NH1 ARG 495.A O no hydrogen 2.893 N/A ARG 149.A NH2 GLU 142.A OE2 no hydrogen 2.983 N/A GLY 150.A N LYS 146.A O no hydrogen 3.336 N/A THR 153.A N ASN 151.A OD1 no hydrogen 3.008 N/A THR 153.A OG1 ASN 151.A OD1 no hydrogen 2.782 N/A ARG 156.A N THR 199.A O no hydrogen 3.093 N/A ARG 156.A NE ASP 160.A OD2 no hydrogen 2.816 N/A ARG 156.A NH1 THR 153.A O no hydrogen 3.044 N/A ARG 156.A NH2 ASP 160.A OD2 no hydrogen 3.414 N/A LYS 157.A N ASP 160.A OD2 no hydrogen 2.906 N/A LYS 157.A NZ GLU 155.A OE1 no hydrogen 3.110 N/A ASP 160.A N LYS 157.A O no hydrogen 2.930 N/A ARG 161.A NH2 GLU 144.A OE2 no hydrogen 3.074 N/A TYR 163.A N LEU 148.A O no hydrogen 2.815 N/A TYR 163.A OH GLU 223.A OE2 no hydrogen 2.688 N/A TYR 165.A N ASP 164.A OD1 no hydrogen 2.726 N/A TYR 165.A OH GLU 630.A OE1 no hydrogen 2.734 N/A ASP 166.A N ARG 196.A O no hydrogen 2.963 N/A VAL 167.A N ASP 166.A OD1 no hydrogen 2.829 N/A TYR 168.A N LEU 185.A O no hydrogen 2.994 N/A ASN 169.A ND2 ASN 209.A O no hydrogen 3.217 N/A ASN 173.A N LEU 180.A O no hydrogen 2.927 N/A LYS 176.A N ASN 173.A O no hydrogen 3.141 N/A SER 177.A N ASN 173.A O no hydrogen 3.374 N/A LYS 179.A N SER 177.A OG no hydrogen 3.061 N/A LEU 180.A N SER 177.A O no hydrogen 2.919 N/A ALA 181.A N GLU 178.A O.A no hydrogen 3.244 N/A ALA 181.A N GLU 178.A O.B no hydrogen 3.103 N/A ARG 182.A NE GLU 533.A OE2 no hydrogen 2.931 N/A ARG 182.A NH1 LYS 179.A O no hydrogen 2.994 N/A ARG 182.A NH1 ALA 181.A O no hydrogen 2.803 N/A ARG 182.A NH2 GLU 533.A OE1 no hydrogen 2.906 N/A LEU 185.A N TYR 168.A O no hydrogen 3.128 N/A GLY 186.A N PHE 191.A O no hydrogen 2.703 N/A GLY 187.A N ASP 638.A OD1 no hydrogen 3.275 N/A GLY 187.A N ASP 638.A OD2 no hydrogen 2.805 N/A PHE 191.A N SER 188.A OG no hydrogen 2.924 N/A TYR 193.A N ASP 638.A OD2 no hydrogen 3.044 N/A TYR 193.A OH SER 546.A OG no hydrogen 2.815 N/A ARG 195.A N GLY 635.A O no hydrogen 3.019 N/A ARG 195.A NH1 ASP 638.A OD2 no hydrogen 2.997 N/A ARG 195.A NH2 ASP 638.A OD1 no hydrogen 2.902 N/A ARG 195.A NH2 ASP 638.A OD2 no hydrogen 3.549 N/A ARG 196.A N ASP 166.A O no hydrogen 2.965 N/A ARG 196.A NE VAL 167.A O no hydrogen 2.824 N/A ARG 196.A NH1 GLY 197.A O no hydrogen 2.867 N/A ARG 196.A NH1 THR 199.A OG1 no hydrogen 3.050 N/A ARG 196.A NH2 VAL 167.A O no hydrogen 3.256 N/A ARG 196.A NH2 ASN 169.A OD1 no hydrogen 2.928 N/A ARG 196.A NH2 GLU 211.A OE1 no hydrogen 2.890 N/A GLY 197.A N GLU 487.A OE2 no hydrogen 2.817 N/A ARG 198.A N ASP 164.A O no hydrogen 2.937 N/A ARG 198.A NH1 GLY 154.A O no hydrogen 2.932 N/A ARG 198.A NH2 GLY 154.A O no hydrogen 3.531 N/A THR 199.A OG1 GLU 211.A OE1 no hydrogen 3.213 N/A THR 199.A OG1 GLU 211.A OE2 no hydrogen 2.588 N/A ARG 201.A N GLU 211.A OE2 no hydrogen 2.902 N/A ARG 201.A NE LYS 212.A O no hydrogen 2.850 N/A ARG 201.A NH2 LYS 212.A O no hydrogen 3.364 N/A THR 204.A N THR 210.A O no hydrogen 2.971 N/A THR 204.A OG1 ASP 207.A O no hydrogen 2.621 N/A VAL 205.A N ASP 175.A OD2 no hydrogen 2.912 N/A THR 206.A N ASP 175.A OD1 no hydrogen 2.990 N/A THR 206.A OG1 ASP 175.A OD1 no hydrogen 2.889 N/A ASP 207.A N THR 204.A OG1 no hydrogen 2.840 N/A ASN 209.A N ASP 207.A OD1 no hydrogen 2.931 N/A THR 210.A N ASP 207.A O no hydrogen 3.283 N/A THR 210.A OG1 ASP 207.A OD2 no hydrogen 2.681 N/A GLU 211.A N ASN 169.A O no hydrogen 2.917 N/A LYS 212.A N GLY 202.A O no hydrogen 2.742 N/A TYR 218.A OH ILE 162.A O no hydrogen 2.828 N/A ARG 221.A N ASP 160.A O no hydrogen 2.963 N/A ARG 221.A NE TYR 111.A OH no hydrogen 2.908 N/A ARG 221.A NH1 ARG 221.A O no hydrogen 2.894 N/A ARG 221.A NH1 ASN 224.A O no hydrogen 3.097 N/A GLU 223.A N PRO 220.A O no hydrogen 2.879 N/A ASN 224.A N ARG 221.A O no hydrogen 3.104 N/A HIS 227.A ND1 ASP 739.A OD2 no hydrogen 2.835 N/A HIS 227.A NE2 GLU 235.A OE2 no hydrogen 2.963 N/A ASP 232.A N LYS 229.A O no hydrogen 2.829 N/A ALA 233.A N SER 230.A O no hydrogen 3.132 N/A GLU 235.A N GLU 235.A OE1 no hydrogen 2.878 N/A ILE 236.A N ALA 233.A O no hydrogen 3.083 N/A GLY 237.A N LEU 234.A O no hydrogen 3.024 N/A SER 240.A N ILE 236.A O no hydrogen 3.477 N/A LEU 241.A N GLY 237.A O no hydrogen 2.941 N/A SER 242.A N.A THR 238.A O no hydrogen 2.978 N/A SER 242.A N.B THR 238.A O no hydrogen 2.979 N/A SER 242.A OG.B THR 238.A O no hydrogen 2.922 N/A SER 242.A OG.B LYS 239.A O no hydrogen 3.089 N/A GLN 243.A N LYS 239.A O no hydrogen 2.932 N/A ILE 244.A N SER 240.A O no hydrogen 2.833 N/A VAL 245.A N SER 240.A O no hydrogen 2.998 N/A GLN 246.A N LEU 241.A O no hydrogen 2.732 N/A GLN 246.A NE2 GLU 250.A OE2 no hydrogen 3.349 N/A ALA 248.A N ILE 244.A O no hydrogen 3.438 N/A PHE 249.A N VAL 245.A O no hydrogen 2.943 N/A GLU 250.A N GLN 246.A O no hydrogen 2.942 N/A SER 251.A N PRO 247.A O no hydrogen 3.066 N/A SER 251.A OG ALA 248.A O no hydrogen 2.698 N/A ALA 252.A N ALA 248.A O no hydrogen 3.423 N/A PHE 253.A N PHE 249.A O no hydrogen 3.303 N/A ASP 254.A N GLU 250.A O no hydrogen 2.788 N/A LEU 255.A N SER 251.A O no hydrogen 2.886 N/A LYS 256.A N PHE 253.A O no hydrogen 3.026 N/A SER 257.A N ALA 252.A O no hydrogen 2.930 N/A HIS 263.A N ASP 267.A OD2 no hydrogen 2.774 N/A PHE 265.A N GLU 710.A OE1 no hydrogen 2.876 N/A GLN 266.A NE2 ASP 270.A OD1 no hydrogen 2.914 N/A GLN 266.A NE2 GLU 273.A OE1 no hydrogen 2.858 N/A ASP 267.A N SER 264.A O no hydrogen 3.052 N/A ASP 267.A N SER 264.A OG no hydrogen 3.410 N/A VAL 268.A N PHE 265.A O no hydrogen 2.940 N/A HIS 269.A N PHE 265.A O no hydrogen 3.041 N/A HIS 269.A ND1 TYR 272.A OH no hydrogen 2.572 N/A ASP 270.A N GLN 266.A O no hydrogen 2.878 N/A LEU 271.A N VAL 268.A O no hydrogen 3.073 N/A TYR 272.A N HIS 269.A O no hydrogen 3.172 N/A TYR 272.A OH HIS 269.A ND1 no hydrogen 2.572 N/A GLU 273.A N ASP 270.A O no hydrogen 3.065 N/A GLY 275.A N ASP 270.A O no hydrogen 2.770 N/A ILE 276.A N LEU 304.A O no hydrogen 2.857 N/A LEU 278.A N HIS 302.A O no hydrogen 2.718 N/A VAL 282.A N PRO 279.A O no hydrogen 2.953 N/A ILE 283.A N PRO 279.A O no hydrogen 3.197 N/A SER 284.A N ARG 280.A O no hydrogen 2.911 N/A SER 284.A OG ARG 280.A O no hydrogen 3.028 N/A THR 285.A N VAL 282.A O no hydrogen 3.198 N/A THR 285.A OG1 ASP 281.A O no hydrogen 2.816 N/A ILE 286.A N VAL 282.A O no hydrogen 3.365 N/A ILE 286.A N ILE 283.A O no hydrogen 3.243 N/A ILE 287.A N ILE 283.A O no hydrogen 3.002 N/A LEU 289.A N ILE 286.A O no hydrogen 3.006 N/A ILE 292.A N PRO 290.A O no hydrogen 2.738 N/A LYS 293.A N LEU 289.A O no hydrogen 2.892 N/A GLU 294.A N VAL 291.A O no hydrogen 3.026 N/A LEU 295.A N ILE 292.A O no hydrogen 2.992 N/A TYR 296.A OH SER 728.A OG no hydrogen 2.789 N/A ARG 297.A N LYS 305.A O no hydrogen 2.882 N/A THR 298.A OG1 ILE 303.A O no hydrogen 2.643 N/A GLY 300.A N THR 298.A OG1 no hydrogen 2.975 N/A GLN 301.A N ASP 299.A OD1 no hydrogen 2.817 N/A HIS 302.A N ASP 299.A OD1 no hydrogen 2.920 N/A ILE 303.A N ASP 299.A OD1 no hydrogen 2.975 N/A LEU 304.A N ILE 276.A O no hydrogen 3.075 N/A LYS 305.A N ARG 297.A O no hydrogen 2.841 N/A PHE 306.A N LEU 271.A O no hydrogen 2.861 N/A VAL 311.A N PRO 678.A O no hydrogen 2.992 N/A VAL 312.A N PRO 309.A O no hydrogen 3.071 N/A GLN 313.A N HIS 310.A O no hydrogen 3.111 N/A GLN 313.A NE2 GLN 308.A O no hydrogen 3.133 N/A SER 317.A N SER 315.A OG no hydrogen 3.391 N/A ALA 318.A N SER 315.A OG no hydrogen 3.106 N/A MET 320.A N SER 317.A O no hydrogen 3.056 N/A THR 321.A N ALA 318.A O no hydrogen 3.081 N/A THR 321.A OG1 ALA 318.A O no hydrogen 2.843 N/A GLU 324.A N THR 321.A OG1 no hydrogen 3.122 N/A PHE 325.A N THR 321.A O no hydrogen 3.111 N/A ALA 326.A N ASP 322.A O no hydrogen 3.145 N/A ARG 327.A N GLU 323.A O no hydrogen 2.941 N/A ARG 327.A NE GLU 324.A OE1 no hydrogen 2.876 N/A ARG 327.A NH1 ASN 787.A O no hydrogen 3.029 N/A ARG 327.A NH2 GLU 324.A OE1 no hydrogen 3.540 N/A ARG 327.A NH2 GLU 324.A OE2 no hydrogen 2.952 N/A ARG 327.A NH2 TYR 679.A OH no hydrogen 3.185 N/A GLU 328.A N GLU 324.A O no hydrogen 2.977 N/A MET 329.A N ALA 326.A O no hydrogen 3.001 N/A ILE 330.A N ARG 327.A O no hydrogen 3.061 N/A ALA 331.A N ARG 327.A O no hydrogen 2.928 N/A GLY 332.A N GLU 328.A O no hydrogen 2.890 N/A ASN 334.A ND2 SER 477.A OG no hydrogen 2.754 N/A ARG 339.A N MET 385.A O.A no hydrogen 2.906 N/A ARG 339.A N MET 385.A O.B no hydrogen 2.986 N/A GLY 340.A N ARG 567.A O no hydrogen 2.840 N/A LEU 341.A N LEU 383.A O no hydrogen 2.898 N/A SER 348.A OG ASP 390.A OD1 no hydrogen 2.751 N/A ASN 349.A N ASP 390.A OD2 no hydrogen 2.915 N/A LEU 350.A N SER 348.A OG no hydrogen 3.071 N/A ALA 353.A N ASP 351.A OD1 no hydrogen 3.051 N/A ILE 354.A N ASP 351.A O no hydrogen 3.088 N/A TYR 355.A N ASP 351.A O no hydrogen 3.202 N/A GLY 356.A N PRO 352.A O no hydrogen 2.816 N/A GLN 358.A NE2 GLY 356.A O no hydrogen 2.880 N/A GLN 358.A NE2 ASP 357.A O no hydrogen 3.508 N/A SER 359.A N.A ASP 357.A OD1 no hydrogen 2.978 N/A SER 359.A N.B ASP 357.A OD1 no hydrogen 2.985 N/A SER 359.A OG.A ASP 357.A OD1 no hydrogen 2.787 N/A SER 359.A OG.B ASP 357.A OD1 no hydrogen 3.268 N/A SER 359.A OG.B ASP 357.A OD2 no hydrogen 3.463 N/A SER 360.A OG GLU 428.A OE1 no hydrogen 2.750 N/A LYS 361.A N GLU 428.A OE2 no hydrogen 2.867 N/A LYS 361.A NZ LYS 361.A O no hydrogen 2.937 N/A ILE 362.A N SER 360.A OG no hydrogen 3.265 N/A THR 363.A OG1 ASP 365.A OD1.B no hydrogen 2.831 N/A THR 363.A OG1 SER 366.A OG no hydrogen 3.385 N/A SER 366.A N THR 363.A O no hydrogen 3.135 N/A SER 366.A OG THR 363.A O no hydrogen 2.814 N/A SER 366.A OG THR 363.A OG1 no hydrogen 3.385 N/A LEU 367.A N ALA 364.A O no hydrogen 3.161 N/A ASP 370.A N ASP 368.A OD1 no hydrogen 3.062 N/A TYR 372.A N LEU 369.A O no hydrogen 3.024 N/A TYR 372.A OH GLU 418.A OE2 no hydrogen 2.646 N/A THR 373.A N GLU 376.A OE1 no hydrogen 2.975 N/A GLU 376.A N THR 373.A OG1 no hydrogen 3.091 N/A ALA 377.A N THR 373.A O no hydrogen 2.875 N/A LEU 378.A N MET 374.A O no hydrogen 2.848 N/A GLY 379.A N ASP 375.A O no hydrogen 2.984 N/A SER 380.A N GLU 376.A O no hydrogen 3.018 N/A SER 380.A OG GLU 376.A O no hydrogen 2.882 N/A SER 380.A OG ALA 377.A O no hydrogen 3.421 N/A ARG 381.A N LEU 378.A O no hydrogen 3.210 N/A ARG 382.A N ALA 377.A O no hydrogen 3.004 N/A ARG 382.A NH1 LEU 416.A O no hydrogen 2.848 N/A PHE 384.A N LEU 414.A O no hydrogen 2.880 N/A MET 385.A N.A ARG 339.A O no hydrogen 2.847 N/A MET 385.A N.B ARG 339.A O no hydrogen 2.835 N/A LEU 386.A N THR 412.A O no hydrogen 2.913 N/A TYR 388.A N THR 410.A O no hydrogen 2.881 N/A TYR 388.A OH ASP 469.A OD1 no hydrogen 2.655 N/A HIS 389.A N ASP 387.A OD1 no hydrogen 3.161 N/A HIS 389.A ND1 ASP 390.A OD1 no hydrogen 2.869 N/A PHE 392.A N TYR 388.A O no hydrogen 3.038 N/A MET 393.A N HIS 389.A O no hydrogen 3.059 N/A TYR 395.A N PHE 392.A O no hydrogen 2.885 N/A TYR 395.A OH GLU 544.A OE1 no hydrogen 2.953 N/A VAL 396.A N MET 393.A O no hydrogen 3.314 N/A ARG 397.A NH1 ASP 437.A OD1 no hydrogen 2.752 N/A ARG 397.A NH2 ASP 437.A OD1 no hydrogen 3.079 N/A ILE 399.A N TYR 395.A O no hydrogen 3.038 N/A ASN 400.A N VAL 396.A O no hydrogen 2.852 N/A ASN 400.A ND2 THR 407.A O no hydrogen 3.190 N/A GLN 401.A N ARG 397.A O no hydrogen 3.241 N/A GLN 401.A N GLN 398.A O no hydrogen 3.362 N/A LEU 402.A N ILE 399.A O no hydrogen 3.064 N/A LYS 406.A N SER 690.A O no hydrogen 3.069 N/A LYS 406.A NZ ASN 400.A O no hydrogen 2.805 N/A LYS 406.A NZ ALA 405.A O no hydrogen 2.934 N/A THR 407.A N ASN 400.A OD1 no hydrogen 2.811 N/A THR 407.A OG1 TYR 408.A O no hydrogen 3.165 N/A ALA 409.A N SER 430.A O no hydrogen 2.901 N/A THR 410.A N ASN 468.A OD1 no hydrogen 2.995 N/A THR 410.A OG1 ASN 468.A OD1 no hydrogen 2.747 N/A ARG 411.A N GLU 428.A O no hydrogen 3.060 N/A ARG 411.A NE ASP 387.A OD1 no hydrogen 3.347 N/A ARG 411.A NH1 GLU 428.A OE1 no hydrogen 3.243 N/A THR 412.A N LEU 386.A O no hydrogen 3.000 N/A ILE 413.A N ALA 426.A O no hydrogen 2.918 N/A LEU 414.A N PHE 384.A O no hydrogen 2.873 N/A PHE 415.A N LYS 423.A O no hydrogen 2.906 N/A LEU 416.A N ARG 382.A O no hydrogen 2.790 N/A ARG 417.A N THR 421.A O no hydrogen 2.917 N/A ARG 417.A NE ASP 370.A OD2 no hydrogen 2.813 N/A ARG 417.A NH2 ASP 370.A OD1 no hydrogen 3.093 N/A ARG 417.A NH2 ASP 370.A OD2 no hydrogen 3.537 N/A GLY 420.A N ARG 417.A O no hydrogen 2.918 N/A THR 421.A N ASP 419.A OD1 no hydrogen 2.927 N/A THR 421.A OG1 ASP 419.A OD1 no hydrogen 2.685 N/A LYS 423.A N PHE 415.A O no hydrogen 2.900 N/A LYS 423.A NZ ASP 368.A O no hydrogen 3.003 N/A LYS 423.A NZ ASP 368.A OD1 no hydrogen 3.392 N/A LYS 423.A NZ ASP 370.A OD1 no hydrogen 2.899 N/A VAL 425.A N ILE 413.A O no hydrogen 2.889 N/A ILE 427.A N VAL 446.A O no hydrogen 2.979 N/A GLU 428.A N ARG 411.A O no hydrogen 2.841 N/A LEU 429.A N GLN 444.A O no hydrogen 2.804 N/A SER 430.A N ALA 409.A O no hydrogen 3.032 N/A LEU 431.A N SER 443.A OG no hydrogen 2.929 N/A HIS 433.A N TYR 355.A O no hydrogen 3.033 N/A SER 434.A N ASP 437.A OD2 no hydrogen 2.724 N/A SER 434.A OG ASP 437.A OD1 no hydrogen 3.073 N/A ASP 437.A N SER 434.A O no hydrogen 3.058 N/A ALA 441.A N SER 439.A OG no hydrogen 3.122 N/A GLN 444.A N LEU 429.A O no hydrogen 2.922 N/A VAL 446.A N ILE 427.A O no hydrogen 2.809 N/A GLU 454.A N GLU 454.A OE1 no hydrogen 2.805 N/A SER 455.A N GLU 451.A O no hydrogen 3.328 N/A SER 455.A N GLY 452.A O no hydrogen 2.971 N/A SER 455.A OG GLY 452.A O no hydrogen 2.647 N/A THR 456.A OG1 MET 705.A O no hydrogen 3.538 N/A ILE 457.A N VAL 453.A O no hydrogen 2.966 N/A TRP 458.A N GLU 454.A O no hydrogen 2.985 N/A TRP 458.A NE1 ASP 322.A OD1 no hydrogen 2.840 N/A LEU 459.A N SER 455.A O no hydrogen 2.981 N/A LEU 460.A N THR 456.A O no hydrogen 2.927 N/A ALA 461.A N ILE 457.A O no hydrogen 2.853 N/A LYS 462.A N TRP 458.A O no hydrogen 3.017 N/A LYS 462.A NZ MET 320.A O no hydrogen 2.908 N/A LYS 462.A NZ ASP 322.A OD1 no hydrogen 2.944 N/A ALA 463.A N LEU 459.A O no hydrogen 3.097 N/A TYR 464.A N LEU 460.A O no hydrogen 2.907 N/A TYR 464.A OH ARG 692.A O no hydrogen 2.656 N/A VAL 465.A N ALA 461.A O no hydrogen 3.092 N/A ILE 466.A N LYS 462.A O no hydrogen 2.878 N/A VAL 467.A N ALA 463.A O no hydrogen 2.899 N/A ASN 468.A N TYR 464.A O no hydrogen 3.164 N/A ASN 468.A ND2 TYR 408.A O no hydrogen 3.124 N/A ASP 469.A N VAL 465.A O no hydrogen 2.853 N/A SER 470.A N.A ILE 466.A O no hydrogen 2.695 N/A SER 470.A N.B ILE 466.A O no hydrogen 2.708 N/A SER 470.A OG.A ILE 466.A O no hydrogen 2.971 N/A SER 470.A OG.A PRO 687.A O no hydrogen 3.024 N/A CYS 471.A N VAL 467.A O no hydrogen 3.083 N/A CYS 471.A SG VAL 467.A O no hydrogen 3.412 N/A CYS 471.A SG THR 688.A O no hydrogen 3.867 N/A TYR 472.A N ASN 468.A O no hydrogen 2.901 N/A HIS 473.A N ASP 469.A O no hydrogen 2.712 N/A HIS 473.A NE2 VAL 672.A O no hydrogen 2.761 N/A GLN 474.A N SER 470.A O.A no hydrogen 2.954 N/A GLN 474.A N SER 470.A O.B no hydrogen 2.940 N/A GLN 474.A NE2 GLN 676.A OE1 no hydrogen 3.125 N/A LEU 475.A N CYS 471.A O no hydrogen 2.981 N/A MET 476.A N TYR 472.A O no hydrogen 2.852 N/A SER 477.A N TYR 472.A O no hydrogen 3.108 N/A HIS 478.A N.A HIS 473.A O no hydrogen 2.806 N/A HIS 478.A N.B HIS 473.A O no hydrogen 2.799 N/A TRP 479.A N GLN 474.A O no hydrogen 3.029 N/A TRP 479.A NE1 TYR 193.A OH no hydrogen 2.968 N/A LEU 480.A N LEU 475.A O no hydrogen 2.928 N/A ASN 481.A N MET 476.A O no hydrogen 2.904 N/A THR 482.A N HIS 478.A O.A no hydrogen 3.198 N/A THR 482.A N HIS 478.A O.B no hydrogen 3.115 N/A THR 482.A OG1 HIS 478.A O.A no hydrogen 2.542 N/A THR 482.A OG1 HIS 478.A O.B no hydrogen 2.609 N/A HIS 483.A N THR 482.A OG1 no hydrogen 2.803 N/A HIS 483.A ND1 ASN 518.A OD1 no hydrogen 3.048 N/A HIS 483.A NE2 HIS 478.A NE2.B no hydrogen 3.026 N/A ALA 484.A N TRP 479.A O no hydrogen 2.867 N/A ALA 485.A N LEU 480.A O no hydrogen 2.950 N/A MET 486.A N THR 482.A O no hydrogen 3.041 N/A PHE 489.A N MET 486.A O no hydrogen 2.976 N/A VAL 490.A N MET 486.A O no hydrogen 3.242 N/A ILE 491.A N GLU 487.A O no hydrogen 3.065 N/A ALA 492.A N PRO 488.A O no hydrogen 3.015 N/A THR 493.A N PHE 489.A O no hydrogen 3.050 N/A THR 493.A OG1 PHE 489.A O no hydrogen 2.699 N/A THR 493.A OG1 TYR 511.A OH no hydrogen 2.851 N/A HIS 494.A N VAL 490.A O no hydrogen 3.236 N/A ARG 495.A N ILE 491.A O no hydrogen 3.030 N/A ARG 495.A NE GLU 630.A OE1 no hydrogen 2.944 N/A ARG 495.A NE GLU 630.A OE2 no hydrogen 3.312 N/A ARG 495.A NH1 ARG 149.A O no hydrogen 3.109 N/A ARG 495.A NH1 TYR 163.A O no hydrogen 2.742 N/A ARG 495.A NH2 GLU 630.A OE2 no hydrogen 3.336 N/A HIS 496.A N ALA 492.A O no hydrogen 2.952 N/A HIS 496.A NE2 GLU 630.A OE2 no hydrogen 2.994 N/A LEU 497.A N THR 493.A O no hydrogen 2.948 N/A SER 498.A N GLU 623.A OE1 no hydrogen 3.066 N/A LEU 500.A N SER 498.A OG no hydrogen 3.106 N/A HIS 501.A N SER 498.A O no hydrogen 2.923 N/A HIS 501.A NE2 ASP 621.A OD2 no hydrogen 2.900 N/A ILE 503.A N HIS 501.A ND1 no hydrogen 2.994 N/A LYS 505.A N HIS 501.A O no hydrogen 3.122 N/A LYS 505.A NZ HIS 126.A O no hydrogen 3.236 N/A LYS 505.A NZ THR 127.A OG1 no hydrogen 2.822 N/A LYS 505.A NZ TRP 751.A O no hydrogen 3.474 N/A LEU 506.A N PRO 502.A O no hydrogen 3.007 N/A LEU 507.A N ILE 503.A O no hydrogen 2.955 N/A THR 508.A N TYR 504.A O no hydrogen 2.946 N/A THR 508.A OG1 TYR 504.A O no hydrogen 2.874 N/A HIS 510.A N LEU 507.A O no hydrogen 2.923 N/A HIS 510.A ND1 ASN 814.A O no hydrogen 2.768 N/A TYR 511.A N THR 508.A O no hydrogen 2.950 N/A TYR 511.A OH THR 493.A OG1 no hydrogen 2.851 N/A ARG 512.A NE.B GLU 740.A OE2 no hydrogen 3.346 N/A ARG 512.A NH2.B GLU 740.A OE2 no hydrogen 2.751 N/A ASN 513.A ND2 GLU 235.A OE1 no hydrogen 3.283 N/A ASN 513.A ND2 SER 817.A O no hydrogen 3.014 N/A ASN 514.A N TYR 511.A O no hydrogen 3.040 N/A ASN 516.A ND2 ASN 224.A OD1 no hydrogen 3.464 N/A ASN 516.A ND2 ASN 513.A OD1 no hydrogen 2.984 N/A ILE 517.A N.A ASN 513.A O no hydrogen 2.964 N/A ILE 517.A N.B ASN 513.A O no hydrogen 2.981 N/A ASN 518.A N ASN 514.A O no hydrogen 3.018 N/A ASN 518.A ND2 HIS 483.A O no hydrogen 2.933 N/A ASN 518.A ND2 GLU 487.A OE1 no hydrogen 2.893 N/A ALA 519.A N MET 515.A O no hydrogen 2.971 N/A LEU 520.A N ASN 516.A O no hydrogen 3.107 N/A ALA 521.A N ILE 517.A O.A no hydrogen 2.908 N/A ALA 521.A N ILE 517.A O.B no hydrogen 2.812 N/A ARG 522.A N ASN 518.A O no hydrogen 2.926 N/A ARG 522.A NE ASP 170.A OD2 no hydrogen 2.805 N/A GLN 523.A N ALA 519.A O no hydrogen 3.166 N/A GLN 523.A NE2 GLY 214.A O no hydrogen 3.583 N/A GLN 523.A NE2 GLU 215.A O no hydrogen 3.016 N/A SER 524.A N LEU 520.A O no hydrogen 3.010 N/A LEU 525.A N ALA 521.A O no hydrogen 2.836 N/A ILE 526.A N ALA 521.A O no hydrogen 2.896 N/A ALA 528.A N LEU 171.A O no hydrogen 2.896 N/A ASN 529.A N GLU 533.A OE1 no hydrogen 2.866 N/A GLY 530.A N ASN 527.A O no hydrogen 2.913 N/A ILE 531.A N.A SER 524.A O no hydrogen 3.144 N/A ILE 531.A N.B SER 524.A O no hydrogen 3.158 N/A ILE 532.A N.A LEU 525.A O no hydrogen 3.029 N/A ILE 532.A N.B LEU 525.A O no hydrogen 3.019 N/A THR 534.A N GLY 530.A O no hydrogen 3.081 N/A THR 534.A OG1 GLY 530.A O no hydrogen 2.827 N/A THR 534.A OG1 ILE 531.A O.A no hydrogen 3.296 N/A THR 534.A OG1 ILE 531.A O.B no hydrogen 3.327 N/A THR 535.A N ILE 532.A O.A no hydrogen 3.206 N/A THR 535.A N ILE 532.A O.B no hydrogen 3.218 N/A THR 535.A OG1 ILE 531.A O.A no hydrogen 2.788 N/A THR 535.A OG1 ILE 531.A O.B no hydrogen 2.748 N/A PHE 536.A N ILE 532.A O.A no hydrogen 2.895 N/A PHE 536.A N ILE 532.A O.B no hydrogen 2.905 N/A LEU 537.A N THR 688.A O no hydrogen 3.013 N/A SER 539.A N PHE 536.A O no hydrogen 3.264 N/A TYR 541.A N PRO 538.A O no hydrogen 2.909 N/A SER 542.A N SER 539.A O no hydrogen 3.046 N/A SER 542.A OG SER 539.A O no hydrogen 2.892 N/A MET 545.A N TYR 541.A O no hydrogen 3.134 N/A SER 546.A N VAL 543.A O no hydrogen 2.945 N/A SER 546.A OG TYR 193.A OH no hydrogen 2.815 N/A SER 546.A OG VAL 543.A O no hydrogen 2.649 N/A SER 547.A N VAL 543.A O no hydrogen 3.386 N/A SER 547.A N GLU 544.A O no hydrogen 2.939 N/A SER 547.A OG PRO 192.A O no hydrogen 2.718 N/A ALA 548.A N GLU 544.A O no hydrogen 3.159 N/A VAL 549.A N MET 545.A O no hydrogen 3.151 N/A TYR 550.A N SER 546.A O no hydrogen 2.986 N/A TYR 550.A OH HIS 636.A ND1 no hydrogen 2.665 N/A LYS 551.A N SER 547.A O no hydrogen 3.345 N/A LYS 551.A N ALA 548.A O no hydrogen 3.310 N/A ASN 552.A N VAL 549.A O no hydrogen 2.989 N/A TRP 553.A N TYR 550.A O no hydrogen 2.921 N/A ASP 557.A N VAL 554.A O no hydrogen 2.985 N/A GLN 558.A N PHE 555.A O no hydrogen 3.122 N/A GLN 558.A NE2 VAL 554.A O no hydrogen 3.165 N/A ASP 563.A N ALA 559.A O no hydrogen 2.932 N/A LEU 564.A N LEU 560.A O no hydrogen 2.985 N/A ILE 565.A N PRO 561.A O no hydrogen 2.993 N/A LYS 566.A N ALA 562.A O no hydrogen 2.837 N/A LYS 566.A NZ ASP 557.A OD2 no hydrogen 2.822 N/A ARG 567.A N ASP 563.A O no hydrogen 2.976 N/A ARG 567.A NE ASP 563.A OD1 no hydrogen 3.079 N/A ARG 567.A NE ASP 563.A OD2 no hydrogen 3.276 N/A ARG 567.A NH1 ILE 338.A O no hydrogen 2.796 N/A ARG 567.A NH1 TYR 587.A OH no hydrogen 3.093 N/A ARG 567.A NH2 ASP 563.A OD2 no hydrogen 2.925 N/A ARG 567.A NH2 TYR 587.A OH no hydrogen 3.162 N/A GLY 568.A N ILE 565.A O no hydrogen 3.043 N/A VAL 569.A N LEU 564.A O no hydrogen 3.087 N/A ILE 571.A N ARG 581.A O no hydrogen 2.894 N/A ASP 573.A N GLY 579.A O no hydrogen 2.935 N/A SER 575.A N ASP 573.A OD1 no hydrogen 3.086 N/A SER 575.A OG ASP 573.A OD1 no hydrogen 2.602 N/A THR 576.A N ASP 573.A O no hydrogen 3.046 N/A THR 576.A OG1 ASP 573.A O no hydrogen 2.614 N/A THR 576.A OG1 VAL 580.A O no hydrogen 3.230 N/A HIS 578.A NE2 GLU 595.A OE2 no hydrogen 2.935 N/A GLY 579.A N THR 576.A O no hydrogen 3.110 N/A ARG 581.A N ILE 571.A O no hydrogen 2.811 N/A LEU 583.A N VAL 569.A O no hydrogen 2.843 N/A TYR 587.A OH PRO 335.A O no hydrogen 2.634 N/A TYR 589.A N ILE 330.A O no hydrogen 3.302 N/A ALA 591.A N TYR 587.A O no hydrogen 2.825 N/A ASP 592.A N PRO 588.A O no hydrogen 2.983 N/A GLY 593.A N TYR 589.A O no hydrogen 2.795 N/A LEU 594.A N ALA 590.A O no hydrogen 2.902 N/A ILE 596.A N ASP 592.A O no hydrogen 3.239 N/A TRP 597.A N GLY 593.A O no hydrogen 2.834 N/A ALA 598.A N LEU 594.A O no hydrogen 2.966 N/A ALA 599.A N GLU 595.A O no hydrogen 3.143 N/A ILE 600.A N ILE 596.A O no hydrogen 2.993 N/A LYS 601.A N TRP 597.A O no hydrogen 2.910 N/A THR 602.A N ALA 598.A O no hydrogen 3.018 N/A THR 602.A OG1 ALA 598.A O no hydrogen 3.232 N/A TRP 603.A N ALA 599.A O no hydrogen 3.228 N/A VAL 604.A N ILE 600.A O no hydrogen 2.932 N/A GLN 605.A N LYS 601.A O no hydrogen 2.873 N/A GLU 606.A N THR 602.A O no hydrogen 3.002 N/A GLU 606.A N TRP 603.A O no hydrogen 3.156 N/A TYR 607.A N TRP 603.A O no hydrogen 2.944 N/A TYR 607.A OH PRO 502.A O no hydrogen 2.633 N/A VAL 608.A N VAL 604.A O no hydrogen 3.022 N/A LEU 610.A N TYR 607.A O no hydrogen 3.039 N/A TYR 611.A N VAL 608.A O no hydrogen 2.934 N/A TYR 611.A OH ASP 754.A OD2 no hydrogen 2.695 N/A TYR 612.A N VAL 608.A O no hydrogen 3.023 N/A TYR 612.A OH ASP 621.A OD2 no hydrogen 2.658 N/A ARG 614.A N ASP 617.A OD2 no hydrogen 2.864 N/A ASP 617.A N ARG 614.A O no hydrogen 3.055 N/A VAL 618.A N ASP 615.A O no hydrogen 3.193 N/A LYS 619.A N ASP 615.A O no hydrogen 3.191 N/A ASN 620.A N ASP 616.A O no hydrogen 2.915 N/A ASP 621.A N VAL 618.A O no hydrogen 3.306 N/A LEU 624.A N ASP 621.A OD1 no hydrogen 2.936 N/A GLN 625.A N ASP 621.A O no hydrogen 2.982 N/A GLN 625.A NE2 VAL 618.A O no hydrogen 2.936 N/A GLN 625.A NE2 LEU 648.A O no hydrogen 2.851 N/A HIS 626.A N SER 622.A O no hydrogen 3.064 N/A HIS 626.A ND1 SER 622.A O no hydrogen 2.608 N/A TRP 627.A N GLU 623.A O no hydrogen 2.886 N/A TRP 627.A NE1 THR 493.A OG1 no hydrogen 3.081 N/A TRP 628.A N LEU 624.A O no hydrogen 3.106 N/A TRP 628.A NE1 PRO 646.A O no hydrogen 2.976 N/A LYS 629.A N GLN 625.A O no hydrogen 3.127 N/A LYS 629.A NZ GLU 633.A OE1 no hydrogen 3.342 N/A GLU 630.A N HIS 626.A O no hydrogen 3.113 N/A ALA 631.A N TRP 627.A O no hydrogen 2.951 N/A VAL 632.A N TRP 628.A O no hydrogen 3.115 N/A GLU 633.A N LYS 629.A O no hydrogen 2.887 N/A LYS 634.A N GLU 630.A O no hydrogen 2.800 N/A GLY 635.A N GLU 630.A O no hydrogen 3.009 N/A HIS 636.A N ALA 631.A O no hydrogen 2.907 N/A HIS 636.A ND1 TYR 550.A OH no hydrogen 2.665 N/A HIS 636.A NE2 ALA 485.A O no hydrogen 3.033 N/A GLY 637.A N LYS 634.A O no hydrogen 3.142 N/A LEU 639.A N HIS 636.A O no hydrogen 3.031 N/A LYS 640.A N GLY 637.A O no hydrogen 3.140 N/A LYS 642.A N LEU 639.A O no hydrogen 3.204 N/A TRP 645.A NE1 LEU 639.A O no hydrogen 2.833 N/A LYS 647.A N ASP 653.A OD1 no hydrogen 3.292 N/A LEU 648.A N ASP 653.A OD1 no hydrogen 3.140 N/A GLN 649.A NE2 GLN 625.A OE1 no hydrogen 3.035 N/A GLN 649.A NE2 LYS 647.A O no hydrogen 2.811 N/A LEU 651.A N ASP 615.A OD1 no hydrogen 2.864 N/A ASP 653.A N THR 650.A OG1 no hydrogen 3.131 N/A LEU 654.A N THR 650.A O no hydrogen 3.149 N/A VAL 655.A N LEU 651.A O no hydrogen 3.140 N/A GLU 656.A N GLU 652.A O no hydrogen 3.003 N/A VAL 657.A N ASP 653.A O no hydrogen 2.927 N/A CYS 658.A N LEU 654.A O no hydrogen 3.078 N/A CYS 658.A SG LEU 654.A O no hydrogen 3.394 N/A LEU 659.A N VAL 655.A O no hydrogen 2.858 N/A ILE 660.A N GLU 656.A O no hydrogen 3.086 N/A ILE 661.A N VAL 657.A O no hydrogen 3.145 N/A ILE 662.A N CYS 658.A O no hydrogen 2.997 N/A TRP 663.A N LEU 659.A O no hydrogen 2.952 N/A ILE 664.A N ILE 660.A O no hydrogen 3.017 N/A ALA 665.A N ILE 661.A O no hydrogen 3.138 N/A SER 666.A N ILE 662.A O no hydrogen 3.072 N/A SER 666.A OG ILE 662.A O no hydrogen 2.666 N/A LEU 668.A N TRP 663.A O no hydrogen 3.046 N/A HIS 669.A N ILE 664.A O no hydrogen 3.278 N/A ALA 670.A N SER 666.A O no hydrogen 2.938 N/A ALA 671.A N ALA 667.A O no hydrogen 2.920 N/A VAL 672.A N LEU 668.A O no hydrogen 3.197 N/A ASN 673.A N HIS 669.A O no hydrogen 2.872 N/A ASN 673.A N ALA 670.A O no hydrogen 3.263 N/A ASN 673.A ND2 LEU 733.A O no hydrogen 2.846 N/A PHE 674.A N ALA 670.A O no hydrogen 3.122 N/A GLN 676.A N ASN 673.A O no hydrogen 3.225 N/A GLN 676.A NE2 ASN 673.A O no hydrogen 3.193 N/A TYR 677.A N SER 734.A OG no hydrogen 2.861 N/A TYR 677.A OH PRO 307.A O no hydrogen 2.656 N/A TYR 679.A N GLY 675.A O no hydrogen 2.942 N/A TYR 679.A OH ALA 331.A O no hydrogen 2.736 N/A GLY 680.A N GLN 676.A O no hydrogen 2.723 N/A GLY 681.A N TYR 677.A O no hydrogen 2.773 N/A ASN 685.A N LEU 682.A O no hydrogen 2.908 N/A ASN 685.A ND2 GLU 328.A OE1 no hydrogen 3.179 N/A ASN 685.A ND2 GLU 328.A OE2 no hydrogen 3.474 N/A ASN 685.A ND2 TYR 679.A O no hydrogen 2.925 N/A ARG 686.A N LEU 682.A O no hydrogen 3.402 N/A ARG 686.A NH1 ASP 469.A OD2 no hydrogen 3.328 N/A ARG 686.A NH2 ASP 469.A OD2 no hydrogen 2.833 N/A THR 688.A N THR 718.A OG1 no hydrogen 3.102 N/A THR 688.A OG1 THR 535.A O no hydrogen 2.747 N/A THR 688.A OG1 THR 718.A OG1 no hydrogen 2.761 N/A SER 690.A OG LYS 406.A O no hydrogen 2.650 N/A ARG 691.A N THR 716.A O no hydrogen 2.708 N/A ARG 691.A NE ILE 717.A O no hydrogen 2.960 N/A ARG 691.A NH1 GLU 261.A OE2 no hydrogen 2.920 N/A ARG 691.A NH2 GLU 261.A OE1 no hydrogen 2.933 N/A ARG 691.A NH2 LEU 714.A O no hydrogen 3.038 N/A ARG 691.A NH2 ILE 717.A O no hydrogen 3.122 N/A ARG 692.A NE THR 716.A OG1 no hydrogen 3.248 N/A ARG 692.A NH2 GLU 704.A OE1 no hydrogen 3.172 N/A ARG 692.A NH2 ALA 712.A O no hydrogen 2.986 N/A LEU 694.A N TYR 408.A OH no hydrogen 3.031 N/A THR 699.A OG1 GLU 696.A O no hydrogen 2.711 N/A TYR 702.A N THR 699.A OG1 no hydrogen 3.254 N/A GLU 703.A N THR 699.A O no hydrogen 3.117 N/A GLU 704.A N PRO 700.A O no hydrogen 2.992 N/A MET 705.A N GLU 701.A O no hydrogen 3.425 N/A MET 705.A N TYR 702.A O no hydrogen 3.116 N/A ASN 707.A N GLU 703.A O no hydrogen 3.009 N/A ASN 708.A N GLU 704.A O no hydrogen 2.728 N/A LYS 711.A N ASN 708.A OD1 no hydrogen 3.395 N/A LYS 711.A NZ PHE 262.A O no hydrogen 3.481 N/A LYS 711.A NZ HIS 263.A ND1 no hydrogen 3.039 N/A ALA 712.A N ASN 708.A O no hydrogen 3.040 N/A TYR 713.A N HIS 709.A O no hydrogen 3.048 N/A TYR 713.A OH MET 684.A O no hydrogen 2.700 N/A LEU 714.A N GLU 710.A O no hydrogen 2.956 N/A ARG 715.A N.A LYS 711.A O no hydrogen 2.913 N/A ARG 715.A N.B LYS 711.A O no hydrogen 2.916 N/A ARG 715.A NE.A GLU 704.A OE2 no hydrogen 2.752 N/A THR 716.A N TYR 713.A O no hydrogen 3.038 N/A THR 716.A OG1 ALA 712.A O no hydrogen 2.840 N/A ILE 717.A N TYR 713.A O no hydrogen 3.095 N/A THR 718.A OG1 THR 688.A OG1 no hydrogen 2.761 N/A SER 719.A OG GLU 261.A OE2 no hydrogen 2.820 N/A LYS 720.A NZ THR 258.A OG1 no hydrogen 3.035 N/A LYS 720.A NZ PRO 259.A O no hydrogen 2.756 N/A THR 723.A N SER 719.A O no hydrogen 2.938 N/A THR 723.A OG1 THR 718.A O no hydrogen 3.460 N/A THR 723.A OG1 SER 719.A O no hydrogen 2.877 N/A LEU 724.A N LYS 720.A O no hydrogen 2.995 N/A ILE 725.A N LEU 721.A O no hydrogen 3.312 N/A SER 726.A N.A PRO 722.A O no hydrogen 2.870 N/A SER 726.A N.B PRO 722.A O no hydrogen 2.864 N/A SER 726.A OG.A PRO 722.A O no hydrogen 3.140 N/A SER 726.A OG.A THR 723.A O no hydrogen 3.272 N/A LEU 727.A N THR 723.A O no hydrogen 2.866 N/A SER 728.A N LEU 724.A O no hydrogen 3.284 N/A SER 728.A OG TYR 296.A OH no hydrogen 2.789 N/A SER 728.A OG LEU 724.A O no hydrogen 2.854 N/A VAL 729.A N.A ILE 725.A O no hydrogen 3.115 N/A VAL 729.A N.B ILE 725.A O no hydrogen 3.101 N/A ILE 730.A N SER 726.A O.A no hydrogen 3.040 N/A ILE 730.A N SER 726.A O.B no hydrogen 3.012 N/A GLU 731.A N LEU 727.A O no hydrogen 3.034 N/A ILE 732.A N SER 728.A O no hydrogen 3.256 N/A LEU 733.A N VAL 729.A O.A no hydrogen 3.025 N/A LEU 733.A N VAL 729.A O.B no hydrogen 3.046 N/A SER 734.A N ILE 730.A O no hydrogen 3.051 N/A SER 734.A OG ILE 730.A O no hydrogen 2.784 N/A THR 735.A N ILE 732.A O no hydrogen 3.136 N/A THR 735.A OG1 GLU 731.A O no hydrogen 2.805 N/A HIS 736.A N GLY 806.A O no hydrogen 2.852 N/A HIS 736.A NE2 ARG 810.A O no hydrogen 2.626 N/A SER 738.A N ASP 232.A OD1 no hydrogen 2.907 N/A SER 738.A OG ASP 232.A OD2 no hydrogen 2.616 N/A GLU 740.A N ALA 737.A O no hydrogen 3.276 N/A VAL 741.A N GLU 740.A OE2 no hydrogen 2.863 N/A TYR 742.A N GLN 745.A OE1 no hydrogen 2.887 N/A LEU 743.A N ILE 812.A O no hydrogen 2.888 N/A GLN 745.A N TYR 742.A O no hydrogen 2.867 N/A ARG 746.A NH1 LYS 505.A O no hydrogen 2.672 N/A ARG 746.A NH2 LYS 505.A O no hydrogen 3.315 N/A HIS 750.A N ASN 748.A OD1 no hydrogen 2.702 N/A THR 752.A OG1 THR 127.A OG1 no hydrogen 2.893 N/A SER 753.A N ASN 125.A O no hydrogen 3.108 N/A SER 753.A OG HIS 126.A ND1 no hydrogen 2.829 N/A ASP 754.A N THR 752.A OG1 no hydrogen 3.267 N/A LEU 758.A N ASP 754.A O no hydrogen 3.103 N/A GLN 759.A N SER 755.A O no hydrogen 2.900 N/A ALA 760.A N LYS 756.A O no hydrogen 2.974 N/A PHE 761.A N ALA 757.A O no hydrogen 3.005 N/A GLN 762.A N LEU 758.A O no hydrogen 3.116 N/A LYS 763.A N GLN 759.A O no hydrogen 3.102 N/A LYS 763.A NZ GLU 606.A OE1 no hydrogen 3.536 N/A LYS 763.A NZ GLU 606.A OE2 no hydrogen 2.727 N/A PHE 764.A N ALA 760.A O no hydrogen 3.067 N/A GLY 765.A N PHE 761.A O no hydrogen 3.025 N/A ASN 766.A N GLN 762.A O no hydrogen 2.979 N/A LYS 767.A N LYS 763.A O no hydrogen 2.956 N/A LYS 767.A NZ GLU 770.A OE2 no hydrogen 3.040 N/A LEU 768.A N PHE 764.A O no hydrogen 3.085 N/A LYS 769.A N GLY 765.A O no hydrogen 3.228 N/A GLU 770.A N ASN 766.A O no hydrogen 3.077 N/A ILE 771.A N LYS 767.A O no hydrogen 2.841 N/A GLU 772.A N LEU 768.A O no hydrogen 2.963 N/A GLU 773.A N LYS 769.A O no hydrogen 3.238 N/A LYS 774.A N GLU 770.A O no hydrogen 3.270 N/A LYS 774.A NZ GLU 595.A OE1 no hydrogen 3.554 N/A LEU 775.A N ILE 771.A O no hydrogen 2.911 N/A VAL 776.A N GLU 772.A O no hydrogen 2.940 N/A ARG 777.A N GLU 773.A O no hydrogen 3.152 N/A ARG 778.A N LYS 774.A O no hydrogen 2.961 N/A ARG 778.A NH1 ASP 592.A OD1 no hydrogen 2.917 N/A ASN 779.A N LEU 775.A O no hydrogen 3.003 N/A ASN 779.A ND2 TYR 796.A O no hydrogen 3.002 N/A ASN 779.A ND2 TYR 800.A OH no hydrogen 2.944 N/A ASN 780.A N VAL 776.A O no hydrogen 3.033 N/A ASN 780.A N ARG 777.A O no hydrogen 3.200 N/A ASP 781.A N ARG 778.A O no hydrogen 3.139 N/A SER 783.A N.A ASP 781.A OD1 no hydrogen 2.970 N/A SER 783.A N.B ASP 781.A OD1 no hydrogen 2.970 N/A SER 783.A OG.A ASP 781.A OD1 no hydrogen 2.737 N/A SER 783.A OG.A ASP 781.A OD2 no hydrogen 3.262 N/A LEU 784.A N ASP 781.A O no hydrogen 2.981 N/A GLN 785.A N PRO 782.A O no hydrogen 3.325 N/A GLN 785.A NE2 GLY 790.A O no hydrogen 3.020 N/A ASN 787.A ND2 GLY 420.A O no hydrogen 2.958 N/A ASN 787.A ND2 ASP 586.A O no hydrogen 2.794 N/A ARG 788.A N LEU 784.A O no hydrogen 3.058 N/A ARG 788.A NE ASN 779.A OD1 no hydrogen 2.803 N/A ARG 788.A NH1 ASP 592.A OD1 no hydrogen 2.968 N/A ARG 788.A NH2 ASP 592.A OD1 no hydrogen 3.523 N/A ARG 788.A NH2 ASP 592.A OD2 no hydrogen 2.862 N/A ARG 788.A NH2 ASN 779.A OD1 no hydrogen 3.247 N/A LEU 789.A N GLN 785.A O no hydrogen 3.000 N/A GLY 790.A N GLN 785.A O no hydrogen 2.954 N/A GLN 793.A N GLY 790.A O no hydrogen 2.903 N/A LEU 794.A N LEU 789.A O no hydrogen 3.055 N/A TYR 796.A N ARG 788.A O no hydrogen 2.958 N/A THR 797.A OG1 PHE 809.A O no hydrogen 2.707 N/A TYR 800.A N THR 797.A O no hydrogen 3.044 N/A SER 802.A N GLU 772.A OE1 no hydrogen 3.114 N/A SER 802.A OG GLU 772.A OE1 no hydrogen 2.707 N/A SER 802.A OG GLU 772.A OE2 no hydrogen 3.148 N/A SER 803.A OG GLU 804.A O no hydrogen 2.740 N/A SER 803.A OG THR 808.A OG1 no hydrogen 2.709 N/A SER 803.A OG ARG 810.A O no hydrogen 3.495 N/A GLU 805.A N GLU 805.A OE1 no hydrogen 2.886 N/A GLY 806.A N HIS 736.A O no hydrogen 2.923 N/A THR 808.A OG1 SER 803.A OG no hydrogen 2.709 N/A THR 808.A OG1 ARG 810.A O no hydrogen 3.159 N/A ARG 810.A NE SER 802.A O no hydrogen 2.888 N/A ARG 810.A NH2 SER 802.A O no hydrogen 3.049 N/A ARG 810.A NH2 SER 802.A OG no hydrogen 3.219 N/A GLY 811.A N TYR 800.A O no hydrogen 3.040 N/A ILE 812.A N PRO 801.A O no hydrogen 2.999 N/A ASN 814.A N VAL 741.A O no hydrogen 3.067 N/A ASN 814.A ND2 GLN 745.A O no hydrogen 3.079 N/A SER 815.A OG ARG 512.A O.A no hydrogen 2.678 N/A SER 815.A OG ARG 512.A O.B no hydrogen 2.685 N/A SER 817.A OG GLU 740.A OE1 no hydrogen 2.677 N/A