Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3iay_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ARG 5.A NE ASP 300.A OD2 no hydrogen 2.628 N/A ARG 5.A NH1 ASP 300.A O no hydrogen 2.759 N/A ARG 5.A NH1 ASP 302.A OD2 no hydrogen 2.864 N/A ARG 5.A NH2 GLY 52.A O no hydrogen 2.909 N/A LYS 6.A NZ GLU 51.A O no hydrogen 3.011 N/A PHE 12.A N PRO 9.A O no hydrogen 3.182 N/A SER 15.A N ASP 13.A OD2 no hydrogen 2.868 N/A SER 15.A OG ASP 13.A OD2 no hydrogen 2.628 N/A LEU 16.A N ASP 13.A O no hydrogen 2.897 N/A TYR 17.A N ASP 13.A O no hydrogen 3.259 N/A TYR 17.A OH ASP 11.A OD1 no hydrogen 2.568 N/A ILE 19.A N LEU 178.A O no hydrogen 2.913 N/A SER 20.A OG THR 177.A OG1 no hydrogen 2.505 N/A PHE 21.A N ILE 176.A O no hydrogen 2.973 N/A GLN 22.A N VAL 48.A O no hydrogen 2.821 N/A GLN 22.A NE2 MET 173.A O no hydrogen 3.086 N/A GLN 23.A N SER 174.A O no hydrogen 2.780 N/A ILE 24.A N PHE 46.A O no hydrogen 2.849 N/A GLU 27.A N ARG 44.A O no hydrogen 2.945 N/A SER 29.A N VAL 42.A O no hydrogen 2.975 N/A LEU 31.A N SER 40.A O no hydrogen 2.780 N/A ASP 36.A N THR 39.A O no hydrogen 2.958 N/A ASN 38.A ND2 ASP 98.A OD1 no hydrogen 2.734 N/A THR 39.A N ASP 36.A O no hydrogen 3.051 N/A THR 39.A OG1 THR 125.A O no hydrogen 2.626 N/A THR 41.A N THR 39.A OG1 no hydrogen 3.202 N/A VAL 42.A N SER 29.A O no hydrogen 2.743 N/A VAL 43.A N VAL 59.A O no hydrogen 3.240 N/A ARG 44.A N GLU 27.A O no hydrogen 2.795 N/A ARG 44.A NE SER 29.A OG no hydrogen 3.176 N/A PHE 45.A N CYS 57.A O no hydrogen 2.931 N/A PHE 46.A N ASP 25.A O no hydrogen 2.899 N/A GLY 47.A N VAL 55.A O no hydrogen 3.041 N/A VAL 48.A N GLN 22.A O no hydrogen 3.120 N/A THR 49.A N HIS 53.A O no hydrogen 2.927 N/A THR 49.A OG1 GLU 51.A OE1 no hydrogen 2.633 N/A SER 50.A OG GLU 51.A OE2 no hydrogen 3.482 N/A GLY 52.A N THR 49.A O no hydrogen 3.006 N/A HIS 53.A N THR 49.A OG1 no hydrogen 3.082 N/A HIS 53.A ND1 GLN 196.A OE1 no hydrogen 2.942 N/A SER 54.A OG ASP 300.A OD2 no hydrogen 2.971 N/A VAL 55.A N GLY 47.A O no hydrogen 2.860 N/A LEU 56.A N LEU 197.A O no hydrogen 2.773 N/A CYS 57.A N PHE 45.A O no hydrogen 2.867 N/A ASN 58.A N VAL 199.A O no hydrogen 2.860 N/A ASN 58.A ND2 SER 200.A OG no hydrogen 3.170 N/A VAL 59.A N VAL 43.A O no hydrogen 2.849 N/A THR 60.A N ILE 201.A O no hydrogen 2.778 N/A THR 60.A OG1 ASP 36.A OD2 no hydrogen 2.487 N/A THR 60.A OG1 ILE 201.A O no hydrogen 3.299 N/A LYS 63.A NZ GLU 37.A O no hydrogen 2.976 N/A ASN 64.A ND2 PRO 127.A O no hydrogen 3.094 N/A TYR 65.A OH ASP 167.A OD1 no hydrogen 2.431 N/A TYR 65.A OH ASP 167.A OD2 no hydrogen 3.384 N/A LEU 66.A N ILE 122.A O no hydrogen 3.124 N/A VAL 68.A N TRP 120.A O no hydrogen 3.046 N/A ALA 70.A N PRO 118.A O no hydrogen 2.988 N/A SER 73.A OG ASP 75.A OD1 no hydrogen 2.465 N/A ALA 76.A N SER 73.A O no hydrogen 2.982 N/A ASN 77.A ND2 SER 74.A O no hydrogen 2.886 N/A ASP 78.A N ASP 75.A O no hydrogen 3.151 N/A GLN 79.A NE2 GLN 79.A O no hydrogen 3.489 N/A GLN 79.A NE2 ASN 83.A OD1 no hydrogen 3.036 N/A GLU 80.A N ASP 78.A OD2 no hydrogen 2.927 N/A GLN 81.A N ASP 78.A O no hydrogen 3.043 N/A ILE 82.A N ASP 78.A O no hydrogen 3.139 N/A ASN 83.A N GLN 79.A O no hydrogen 2.869 N/A LYS 84.A N GLU 80.A O no hydrogen 2.978 N/A PHE 85.A N GLN 81.A O no hydrogen 2.860 N/A VAL 86.A N ILE 82.A O no hydrogen 2.935 N/A HIS 87.A N ASN 83.A O no hydrogen 3.098 N/A TYR 88.A N LYS 84.A O no hydrogen 2.906 N/A LEU 89.A N PHE 85.A O no hydrogen 2.826 N/A ASN 90.A N VAL 86.A O no hydrogen 2.866 N/A ASN 90.A ND2 ILE 97.A O no hydrogen 2.849 N/A GLU 91.A N HIS 87.A O no hydrogen 2.964 N/A THR 92.A N LEU 89.A O no hydrogen 2.925 N/A THR 92.A OG1 TYR 88.A O no hydrogen 2.804 N/A PHE 93.A N LEU 89.A O no hydrogen 2.833 N/A HIS 95.A N ASN 90.A O no hydrogen 2.928 N/A ALA 96.A N PHE 93.A O no hydrogen 3.102 N/A ILE 97.A N ASN 90.A OD1 no hydrogen 2.669 N/A ASP 98.A N TYR 123.A O no hydrogen 2.757 N/A SER 99.A OG ASP 98.A OD2 no hydrogen 2.552 N/A GLU 101.A N LYS 121.A O no hydrogen 2.782 N/A VAL 103.A N PHE 119.A O no hydrogen 2.817 N/A LYS 105.A N LEU 117.A O no hydrogen 2.891 N/A GLN 106.A N ASP 472.A O no hydrogen 3.023 N/A ILE 108.A N VAL 474.A O no hydrogen 2.847 N/A TRP 109.A N SER 107.A OG no hydrogen 3.080 N/A GLY 110.A N ILE 108.A O no hydrogen 3.037 N/A GLY 110.A N TYR 524.A O no hydrogen 2.772 N/A TYR 111.A N LEU 527.A O no hydrogen 2.759 N/A LYS 116.A NZ SER 104.A O no hydrogen 3.535 N/A LEU 117.A N LYS 105.A O no hydrogen 2.751 N/A PHE 119.A N VAL 103.A O no hydrogen 2.673 N/A TRP 120.A N VAL 68.A O no hydrogen 2.752 N/A LYS 121.A N GLU 101.A O no hydrogen 2.851 N/A LYS 121.A NZ TYR 123.A OH no hydrogen 3.050 N/A ILE 122.A N LEU 66.A O no hydrogen 2.906 N/A TYR 123.A N SER 99.A O no hydrogen 3.021 N/A TYR 123.A OH GLU 101.A OE1 no hydrogen 2.546 N/A VAL 124.A N ASN 64.A O no hydrogen 3.006 N/A THR 125.A N ALA 96.A O no hydrogen 2.877 N/A THR 125.A OG1 ALA 96.A O no hydrogen 3.438 N/A TYR 126.A OH ASP 94.A OD2 no hydrogen 2.648 N/A MET 129.A N TYR 126.A O no hydrogen 3.180 N/A VAL 130.A N PRO 127.A O no hydrogen 3.009 N/A ASN 131.A N HIS 128.A O no hydrogen 3.165 N/A ASN 131.A ND2 HIS 128.A ND1 no hydrogen 3.496 N/A LEU 133.A N MET 129.A O no hydrogen 2.998 N/A ARG 134.A N VAL 130.A O no hydrogen 2.745 N/A ARG 134.A NH1 THR 154.A OG1 no hydrogen 2.767 N/A ARG 134.A NH1 TYR 155.A O no hydrogen 3.218 N/A ARG 134.A NH2 TYR 155.A O no hydrogen 3.427 N/A THR 135.A N ASN 131.A O no hydrogen 2.986 N/A THR 135.A OG1 ASN 131.A O no hydrogen 3.146 N/A ALA 136.A N LYS 132.A O no hydrogen 2.931 N/A PHE 137.A N LEU 133.A O no hydrogen 2.940 N/A GLU 138.A N ARG 134.A O no hydrogen 3.011 N/A ARG 139.A N THR 135.A O no hydrogen 2.736 N/A GLY 140.A N ALA 136.A O no hydrogen 2.665 N/A SER 143.A N TYR 88.A OH no hydrogen 3.145 N/A ASN 145.A ND2 GLN 81.A OE1 no hydrogen 2.972 N/A SER 146.A N SER 143.A O no hydrogen 3.061 N/A TRP 147.A N PHE 144.A O no hydrogen 3.084 N/A TRP 147.A NE1 ASP 75.A OD1 no hydrogen 2.925 N/A SER 149.A OG SER 149.A O no hydrogen 2.564 N/A THR 152.A N PHE 137.A O no hydrogen 3.001 N/A THR 152.A OG1 THR 153.A O no hydrogen 3.269 N/A THR 154.A OG1 GLU 138.A OE2 no hydrogen 2.553 N/A TYR 155.A N TYR 67.A O no hydrogen 2.969 N/A ASP 156.A N ILE 475.A O no hydrogen 2.680 N/A ASN 157.A ND2 ASN 477.A OD1 no hydrogen 2.916 N/A TYR 160.A OH PHE 62.A O no hydrogen 2.539 N/A ARG 163.A N ALA 159.A O no hydrogen 2.897 N/A ARG 163.A NE ARG 163.A O no hydrogen 3.489 N/A ARG 163.A NE ASP 167.A OD2 no hydrogen 3.271 N/A ARG 163.A NH1 ASP 156.A OD2 no hydrogen 2.860 N/A ARG 163.A NH2 ASP 167.A OD2 no hydrogen 2.890 N/A LEU 164.A N TYR 160.A O no hydrogen 3.041 N/A MET 165.A N THR 161.A O no hydrogen 3.092 N/A VAL 166.A N LEU 162.A O no hydrogen 2.856 N/A ASP 167.A N ARG 163.A O no hydrogen 2.975 N/A CYS 168.A N LEU 164.A O no hydrogen 2.850 N/A CYS 168.A SG LEU 164.A O no hydrogen 3.426 N/A GLY 169.A N VAL 166.A O no hydrogen 3.236 N/A ILE 170.A N MET 165.A O no hydrogen 2.795 N/A GLY 172.A N ALA 441.A O no hydrogen 3.333 N/A SER 174.A OG GLN 23.A OE1 no hydrogen 3.206 N/A SER 174.A OG VAL 171.A O no hydrogen 3.047 N/A TRP 175.A NE1 HIS 217.A O no hydrogen 2.735 N/A ILE 176.A N PHE 21.A O no hydrogen 2.988 N/A THR 177.A N ILE 207.A O no hydrogen 2.859 N/A THR 177.A OG1 SER 20.A OG no hydrogen 2.505 N/A THR 177.A OG1 HIS 209.A NE2 no hydrogen 2.603 N/A LEU 178.A N ILE 19.A O no hydrogen 2.685 N/A LYS 180.A N ASP 18.A OD1 no hydrogen 2.760 N/A LYS 180.A NZ LEU 16.A O no hydrogen 2.949 N/A GLY 181.A N PRO 14.A O no hydrogen 2.835 N/A LYS 182.A N PRO 179.A O no hydrogen 2.982 N/A TYR 183.A OH TYR 17.A O no hydrogen 2.622 N/A SER 184.A N SER 200.A O no hydrogen 2.974 N/A ILE 186.A N GLU 198.A O no hydrogen 2.923 N/A GLU 187.A N GLU 187.A OE2 no hydrogen 2.147 N/A ASN 190.A N GLU 187.A O no hydrogen 2.767 N/A ARG 191.A NH1 SER 193.A O no hydrogen 3.255 N/A ARG 191.A NH1 CYS 195.A O no hydrogen 2.900 N/A ARG 191.A NH2 CYS 195.A O no hydrogen 2.919 N/A VAL 192.A N GLU 198.A OE1 no hydrogen 3.287 N/A VAL 192.A N GLU 198.A OE2 no hydrogen 2.768 N/A SER 193.A N GLU 198.A OE1 no hydrogen 2.954 N/A SER 193.A OG GLU 198.A OE1 no hydrogen 2.819 N/A SER 194.A N ARG 334.A O no hydrogen 3.014 N/A CYS 195.A N SER 193.A OG no hydrogen 3.007 N/A GLN 196.A N SER 54.A OG no hydrogen 2.961 N/A GLN 196.A NE2 LYS 6.A O no hydrogen 2.765 N/A LEU 197.A N SER 54.A O no hydrogen 2.983 N/A VAL 199.A N LEU 56.A O no hydrogen 2.920 N/A SER 200.A N SER 184.A O no hydrogen 2.816 N/A ILE 201.A N ASN 58.A O no hydrogen 2.864 N/A ASN 202.A ND2 ASP 36.A OD2 no hydrogen 2.888 N/A ASN 202.A ND2 GLU 37.A OE2 no hydrogen 2.970 N/A TYR 203.A N THR 60.A O no hydrogen 2.968 N/A ARG 204.A N ASN 202.A OD1 no hydrogen 2.902 N/A ARG 204.A NE GLU 37.A OE2 no hydrogen 2.704 N/A ARG 204.A NH1 GLU 37.A OE1 no hydrogen 2.903 N/A ARG 204.A NH1 GLU 37.A OE2 no hydrogen 3.560 N/A ASN 205.A N ASN 202.A O no hydrogen 2.845 N/A ILE 207.A N THR 177.A O no hydrogen 2.897 N/A HIS 209.A N TRP 175.A O no hydrogen 2.973 N/A HIS 209.A NE2 THR 177.A OG1 no hydrogen 2.603 N/A GLU 212.A N PRO 210.A O no hydrogen 2.717 N/A TRP 215.A N GLU 212.A O no hydrogen 2.825 N/A SER 216.A N GLY 213.A O no hydrogen 3.122 N/A SER 216.A OG GLY 213.A O no hydrogen 2.732 N/A ALA 219.A N GLN 22.A OE1 no hydrogen 2.577 N/A LEU 221.A N ALA 219.A O no hydrogen 2.720 N/A ARG 222.A N ASP 302.A OD2 no hydrogen 2.900 N/A ARG 222.A NH1 GLU 4.A O no hydrogen 3.258 N/A ARG 222.A NH2 PHE 3.A O no hydrogen 3.035 N/A ARG 222.A NH2 VAL 299.A O no hydrogen 2.896 N/A ILE 223.A N SER 253.A O no hydrogen 2.680 N/A MET 224.A N VAL 303.A O no hydrogen 2.754 N/A SER 225.A N VAL 251.A O no hydrogen 2.894 N/A SER 225.A OG ALA 421.A O no hydrogen 2.648 N/A PHE 226.A N ILE 305.A O no hydrogen 3.166 N/A ASP 227.A N ALA 249.A O no hydrogen 3.202 N/A ILE 228.A N ASP 313.A OD1 no hydrogen 2.883 N/A GLU 229.A N GLN 247.A O no hydrogen 2.845 N/A ALA 231.A N PRO 244.A O no hydrogen 3.000 N/A ARG 233.A NE ASP 243.A OD1 no hydrogen 3.007 N/A ARG 233.A NH2 GLU 239.A OE1 no hydrogen 2.705 N/A ARG 233.A NH2 ASP 243.A OD2 no hydrogen 3.169 N/A VAL 236.A N ARG 233.A O no hydrogen 3.045 N/A GLU 239.A N ASP 243.A OD2 no hydrogen 2.605 N/A GLU 241.A N GLU 241.A OE1 no hydrogen 2.610 N/A TYR 242.A N GLU 239.A O no hydrogen 2.893 N/A ASP 243.A N GLU 239.A O no hydrogen 2.798 N/A VAL 245.A N GLU 285.A OE2 no hydrogen 2.957 N/A ILE 246.A N GLU 229.A O no hydrogen 2.807 N/A GLN 247.A N GLU 229.A O no hydrogen 3.390 N/A GLN 247.A NE2 ARG 410.A O no hydrogen 3.103 N/A ILE 248.A N PHE 266.A O no hydrogen 2.866 N/A ALA 249.A N ASP 227.A O no hydrogen 3.014 N/A ASN 250.A N ASN 264.A O no hydrogen 2.876 N/A ASN 250.A ND2 ASN 264.A OD1 no hydrogen 3.029 N/A VAL 251.A N SER 225.A O no hydrogen 2.940 N/A VAL 252.A N ILE 262.A O no hydrogen 2.898 N/A SER 253.A N ILE 223.A O no hydrogen 2.938 N/A ALA 255.A N LEU 221.A O no hydrogen 2.805 N/A GLY 256.A N GLU 429.A OE2 no hydrogen 2.829 N/A ALA 257.A N ILE 254.A O no hydrogen 2.733 N/A PHE 261.A N VAL 252.A O no hydrogen 2.735 N/A ILE 262.A N VAL 252.A O no hydrogen 2.995 N/A ARG 263.A NE.A PRO 260.A O no hydrogen 3.438 N/A ARG 263.A NH1.A GLY 276.A O no hydrogen 3.539 N/A ARG 263.A NH2.A PRO 260.A O no hydrogen 3.284 N/A ASN 264.A N ASN 250.A O no hydrogen 2.932 N/A VAL 265.A N MET 278.A O no hydrogen 2.926 N/A PHE 266.A N ILE 248.A O no hydrogen 2.670 N/A THR 267.A N PHE 280.A O no hydrogen 2.891 N/A THR 267.A OG1 ASN 269.A O no hydrogen 2.806 N/A LEU 268.A N ILE 246.A O no hydrogen 2.978 N/A ASN 269.A N HIS 282.A O no hydrogen 2.694 N/A THR 270.A N ASN 269.A OD1 no hydrogen 2.642 N/A CYS 271.A SG SER 272.A O no hydrogen 3.646 N/A SER 272.A N SER 407.A O no hydrogen 3.020 N/A SER 277.A N ILE 274.A O no hydrogen 3.009 N/A SER 277.A OG ILE 274.A O no hydrogen 3.521 N/A MET 278.A N ARG 263.A O no hydrogen 2.846 N/A PHE 280.A N VAL 265.A O no hydrogen 2.866 N/A HIS 282.A N THR 267.A O no hydrogen 2.918 N/A GLU 286.A N GLU 286.A OE1 no hydrogen 2.778 N/A GLU 287.A N THR 284.A OG1 no hydrogen 3.259 N/A MET 288.A N THR 284.A O no hydrogen 3.183 N/A LEU 289.A N GLU 285.A O no hydrogen 2.951 N/A SER 290.A N GLU 286.A O no hydrogen 3.053 N/A SER 290.A OG GLU 286.A O no hydrogen 3.415 N/A ASN 291.A N GLU 287.A O no hydrogen 2.872 N/A TRP 292.A N MET 288.A O no hydrogen 2.964 N/A TRP 292.A NE1 ASN 250.A OD1 no hydrogen 2.852 N/A ARG 293.A N LEU 289.A O no hydrogen 3.064 N/A ARG 293.A NE TYR 331.A O no hydrogen 2.943 N/A ASN 294.A N SER 290.A O no hydrogen 3.125 N/A PHE 295.A N ASN 291.A O no hydrogen 2.859 N/A ILE 296.A N TRP 292.A O no hydrogen 2.989 N/A ILE 297.A N ARG 293.A O no hydrogen 3.072 N/A LYS 298.A N ASN 294.A O no hydrogen 2.902 N/A VAL 299.A N PHE 295.A O no hydrogen 2.840 N/A ASP 300.A N ILE 296.A O no hydrogen 2.780 N/A ASP 302.A N ARG 222.A O no hydrogen 2.803 N/A VAL 303.A N ARG 222.A O no hydrogen 3.142 N/A ILE 304.A N LEU 366.A O no hydrogen 2.826 N/A ILE 305.A N MET 224.A O no hydrogen 2.693 N/A TYR 307.A OH TYR 383.A O no hydrogen 2.840 N/A ASN 308.A N ASP 369.A OD1 no hydrogen 2.792 N/A THR 310.A N ASP 369.A OD2 no hydrogen 2.955 N/A THR 310.A OG1 ASP 369.A OD2 no hydrogen 3.391 N/A PHE 312.A N ASN 308.A O no hydrogen 2.859 N/A ILE 314.A N THR 309.A O no hydrogen 2.902 N/A TYR 316.A N PHE 312.A O no hydrogen 2.794 N/A TYR 316.A OH ASP 243.A O no hydrogen 2.615 N/A LEU 317.A N ASP 313.A O no hydrogen 3.058 N/A LEU 318.A N ILE 314.A O no hydrogen 3.018 N/A ASN 319.A N PRO 315.A O no hydrogen 2.804 N/A ARG 320.A N TYR 316.A O no hydrogen 2.685 N/A ARG 320.A NE GLU 285.A OE1 no hydrogen 3.335 N/A ARG 320.A NE GLU 285.A OE2 no hydrogen 2.609 N/A ARG 320.A NH1 PRO 240.A O no hydrogen 2.915 N/A ARG 320.A NH2 GLU 285.A OE1 no hydrogen 2.790 N/A ALA 321.A N LEU 317.A O no hydrogen 2.923 N/A LYS 322.A N LEU 318.A O no hydrogen 3.117 N/A ALA 323.A N ASN 319.A O no hydrogen 3.042 N/A LEU 324.A N ARG 320.A O no hydrogen 2.923 N/A LYS 325.A N LYS 322.A O no hydrogen 3.089 N/A VAL 326.A N ALA 321.A O no hydrogen 2.856 N/A PHE 329.A N VAL 326.A O no hydrogen 3.082 N/A TYR 331.A N PHE 329.A O no hydrogen 2.745 N/A PHE 332.A N GLN 340.A OE1 no hydrogen 2.871 N/A GLY 333.A N GLN 340.A OE1 no hydrogen 3.271 N/A ARG 334.A N ASP 363.A O no hydrogen 2.832 N/A ARG 334.A NE ASP 300.A OD1 no hydrogen 2.828 N/A ARG 334.A NH1 ASP 302.A OD1 no hydrogen 2.993 N/A ARG 334.A NH1 GLY 364.A O no hydrogen 2.945 N/A ARG 334.A NH2 ASP 300.A OD1 no hydrogen 3.376 N/A ARG 334.A NH2 ASP 300.A OD2 no hydrogen 3.043 N/A ARG 334.A NH2 ASP 302.A OD1 no hydrogen 2.816 N/A LYS 336.A N VAL 192.A O no hydrogen 2.788 N/A VAL 338.A N LEU 335.A O no hydrogen 3.150 N/A GLN 340.A N PRO 330.A O no hydrogen 2.882 N/A GLN 340.A NE2 VAL 338.A O no hydrogen 3.467 N/A GLN 340.A NE2 ASN 361.A O no hydrogen 2.883 N/A GLU 341.A N ASN 361.A OD1 no hydrogen 2.770 N/A LYS 343.A N ASN 359.A O no hydrogen 2.909 N/A SER 345.A N THR 357.A O no hydrogen 3.098 N/A VAL 346.A N SER 345.A OG no hydrogen 2.720 N/A PHE 347.A N ARG 355.A O no hydrogen 2.821 N/A SER 348.A OG THR 354.A OG1 no hydrogen 2.396 N/A SER 349.A N GLY 353.A O no hydrogen 3.031 N/A TYR 352.A N SER 349.A OG no hydrogen 3.077 N/A GLY 353.A N SER 349.A O no hydrogen 2.728 N/A THR 354.A OG1 SER 348.A OG no hydrogen 2.396 N/A ARG 355.A N PHE 347.A O no hydrogen 2.905 N/A ARG 355.A NH1 GLY 821.A O no hydrogen 3.091 N/A ARG 355.A NH2 TYR 352.A O no hydrogen 2.770 N/A THR 357.A N SER 345.A O no hydrogen 2.807 N/A ASN 361.A ND2 LYS 339.A O no hydrogen 2.944 N/A ASN 361.A ND2 ASP 363.A OD2 no hydrogen 2.897 N/A ARG 365.A N ILE 362.A O no hydrogen 2.873 N/A ARG 365.A NE PHE 332.A O no hydrogen 2.978 N/A ARG 365.A NH1 PHE 332.A O no hydrogen 3.260 N/A ARG 365.A NH2 ASP 300.A OD1 no hydrogen 2.966 N/A ARG 365.A NH2 PRO 301.A O no hydrogen 2.965 N/A LEU 366.A N ASP 302.A O no hydrogen 2.816 N/A GLN 367.A NE2 VAL 360.A O no hydrogen 2.791 N/A LEU 368.A N ILE 304.A O no hydrogen 2.926 N/A LEU 370.A N GLY 306.A O no hydrogen 2.873 N/A LEU 371.A N ASP 369.A OD1 no hydrogen 2.874 N/A PHE 373.A N ASP 369.A O no hydrogen 3.059 N/A ILE 374.A N LEU 370.A O no hydrogen 2.869 N/A GLN 375.A N LEU 371.A O no hydrogen 3.032 N/A ARG 376.A N GLN 372.A O no hydrogen 3.149 N/A ARG 376.A NH1 ARG 454.A O no hydrogen 2.863 N/A ARG 376.A NH2 ARG 454.A O no hydrogen 2.870 N/A GLU 377.A N PHE 373.A O no hydrogen 2.943 N/A GLU 377.A N ILE 374.A O no hydrogen 3.225 N/A TYR 378.A N ILE 374.A O no hydrogen 2.837 N/A LEU 380.A N TYR 383.A OH no hydrogen 3.019 N/A TYR 383.A OH TYR 378.A O no hydrogen 2.543 N/A ALA 387.A N THR 384.A OG1 no hydrogen 2.954 N/A VAL 388.A N THR 384.A O no hydrogen 2.951 N/A SER 389.A N LEU 385.A O no hydrogen 2.891 N/A SER 389.A OG LEU 385.A O no hydrogen 2.687 N/A ALA 390.A N ASN 386.A O no hydrogen 3.019 N/A HIS 391.A N ALA 387.A O no hydrogen 3.008 N/A PHE 392.A N VAL 388.A O no hydrogen 2.841 N/A LEU 393.A N SER 389.A O no hydrogen 2.784 N/A GLY 394.A N ALA 390.A O no hydrogen 3.161 N/A GLU 395.A N SER 389.A O no hydrogen 3.158 N/A SER 400.A OG GLY 232.A O no hydrogen 3.205 N/A LEU 402.A N ILE 398.A O no hydrogen 2.942 N/A GLN 403.A N ILE 399.A O no hydrogen 3.057 N/A GLN 403.A NE2 LEU 268.A O no hydrogen 3.034 N/A ASN 404.A N SER 400.A O no hydrogen 3.150 N/A ASN 404.A N ASP 401.A O no hydrogen 3.039 N/A GLY 405.A N LEU 402.A O no hydrogen 3.276 N/A ASP 406.A N THR 409.A OG1 no hydrogen 2.964 N/A GLU 408.A N ASP 406.A OD1 no hydrogen 2.739 N/A THR 409.A N ASP 406.A OD1 no hydrogen 2.935 N/A THR 409.A OG1 LEU 402.A O no hydrogen 2.483 N/A THR 409.A OG1 ASP 406.A O no hydrogen 3.268 N/A ARG 410.A N ASP 406.A O no hydrogen 3.085 N/A ARG 410.A NE THR 270.A O no hydrogen 2.582 N/A ARG 410.A NH1 GLN 403.A O no hydrogen 2.863 N/A ARG 410.A NH2 THR 270.A OG1 no hydrogen 2.894 N/A ARG 411.A N SER 407.A O no hydrogen 3.069 N/A ARG 411.A NE PRO 273.A O no hydrogen 2.976 N/A ARG 412.A N GLU 408.A O no hydrogen 2.981 N/A LEU 413.A N THR 409.A O no hydrogen 3.043 N/A ALA 414.A N ARG 410.A O no hydrogen 2.771 N/A VAL 415.A N ARG 411.A O no hydrogen 2.893 N/A TYR 416.A N ARG 412.A O no hydrogen 3.321 N/A CYS 417.A N LEU 413.A O no hydrogen 2.899 N/A CYS 417.A SG ASP 227.A O no hydrogen 3.345 N/A CYS 417.A SG ASP 227.A OD2 no hydrogen 3.906 N/A LEU 418.A N ALA 414.A O no hydrogen 2.730 N/A LYS 419.A N VAL 415.A O no hydrogen 2.875 N/A ASP 420.A N TYR 416.A O no hydrogen 2.944 N/A ALA 421.A N CYS 417.A O no hydrogen 2.982 N/A ALA 421.A N LEU 418.A O no hydrogen 2.952 N/A TYR 422.A N LEU 418.A O no hydrogen 2.863 N/A LEU 423.A N LYS 419.A O no hydrogen 2.950 N/A ARG 426.A N TYR 422.A O no hydrogen 3.025 N/A LEU 427.A N LEU 423.A O no hydrogen 2.775 N/A MET 428.A N PRO 424.A O no hydrogen 2.880 N/A GLU 429.A N LEU 425.A O no hydrogen 3.108 N/A LYS 430.A N ARG 426.A O no hydrogen 2.898 N/A LEU 431.A N LEU 427.A O no hydrogen 2.856 N/A MET 432.A N GLU 429.A O no hydrogen 3.168 N/A ALA 433.A N MET 428.A O no hydrogen 2.979 N/A ASN 436.A N MET 432.A O no hydrogen 2.861 N/A TYR 437.A N ALA 433.A O no hydrogen 3.115 N/A TYR 437.A OH GLU 377.A OE2 no hydrogen 2.699 N/A THR 438.A N LEU 434.A O no hydrogen 2.898 N/A THR 438.A OG1 LEU 434.A O no hydrogen 2.691 N/A GLU 439.A N VAL 435.A O no hydrogen 3.101 N/A MET 440.A N ASN 436.A O no hydrogen 2.971 N/A ALA 441.A N TYR 437.A O no hydrogen 2.853 N/A ARG 442.A N THR 438.A O no hydrogen 2.997 N/A ARG 442.A NE MET 173.A O no hydrogen 2.998 N/A ARG 442.A NH1 SER 216.A O no hydrogen 2.707 N/A ARG 442.A NH2 MET 173.A O no hydrogen 3.046 N/A ARG 442.A NH2 HIS 217.A O no hydrogen 2.930 N/A VAL 443.A N GLU 439.A O no hydrogen 2.823 N/A THR 444.A N MET 440.A O no hydrogen 2.929 N/A THR 444.A OG1 MET 440.A O no hydrogen 2.830 N/A GLY 445.A N ALA 441.A O no hydrogen 2.864 N/A TYR 450.A N PRO 447.A O no hydrogen 2.893 N/A LEU 451.A N PHE 448.A O no hydrogen 3.063 N/A ARG 454.A N TYR 450.A O no hydrogen 2.798 N/A LYS 459.A NZ GLN 456.A OE1 no hydrogen 2.906 N/A LYS 459.A NZ SER 603.A OG no hydrogen 2.999 N/A VAL 460.A N GLN 456.A O no hydrogen 3.186 N/A VAL 461.A N GLN 457.A O no hydrogen 2.817 N/A SER 462.A N ILE 458.A O no hydrogen 2.946 N/A SER 462.A OG THR 444.A O no hydrogen 2.790 N/A GLN 463.A N LYS 459.A O no hydrogen 3.222 N/A GLN 463.A NE2 LYS 459.A O no hydrogen 2.928 N/A LEU 464.A N VAL 460.A O no hydrogen 2.907 N/A PHE 465.A N VAL 461.A O no hydrogen 2.908 N/A ARG 466.A N SER 462.A O no hydrogen 3.071 N/A ARG 466.A NE SER 462.A OG no hydrogen 2.866 N/A ARG 466.A NH1 ILE 170.A O no hydrogen 2.949 N/A ARG 466.A NH1 GLY 445.A O no hydrogen 2.665 N/A ARG 466.A NH2 MET 165.A O no hydrogen 3.540 N/A ARG 466.A NH2 ILE 170.A O no hydrogen 3.006 N/A LYS 467.A N GLN 463.A O no hydrogen 2.967 N/A LYS 467.A NZ GLU 569.A OE1 no hydrogen 3.108 N/A CYS 468.A N LEU 464.A O no hydrogen 2.839 N/A CYS 468.A SG LEU 464.A O no hydrogen 3.388 N/A LEU 469.A N PHE 465.A O no hydrogen 2.979 N/A ILE 471.A N CYS 468.A O no hydrogen 2.967 N/A ASP 472.A N LEU 469.A O no hydrogen 3.327 N/A THR 473.A N CYS 468.A O no hydrogen 2.982 N/A THR 473.A OG1 ILE 471.A O no hydrogen 3.067 N/A VAL 474.A N GLN 106.A O no hydrogen 2.791 N/A ILE 475.A N ASP 156.A OD1 no hydrogen 2.871 N/A ASN 477.A N THR 154.A O no hydrogen 2.841 N/A ASN 477.A ND2 GLU 138.A OE2 no hydrogen 2.794 N/A GLN 481.A N THR 614.A O no hydrogen 3.331 N/A SER 483.A N THR 614.A OG1 no hydrogen 2.938 N/A SER 483.A OG ASP 485.A O no hydrogen 3.483 N/A ASP 485.A N SER 483.A OG no hydrogen 3.268 N/A TYR 487.A OH TYR 608.A OH no hydrogen 2.831 N/A ILE 493.A N GLY 661.A O no hydrogen 2.748 N/A ILE 496.A N VAL 659.A O no hydrogen 2.910 N/A ARG 497.A NH1 GLU 494.A OE2 no hydrogen 3.246 N/A ARG 497.A NH2 GLU 494.A OE2 no hydrogen 3.341 N/A ARG 497.A NH2 ASN 712.A OD1 no hydrogen 3.456 N/A GLY 498.A N LEU 710.A O no hydrogen 2.889 N/A TYR 500.A N TYR 708.A O no hydrogen 2.667 N/A TYR 500.A OH ILE 496.A O no hydrogen 2.631 N/A ILE 504.A N TYR 705.A O no hydrogen 2.782 N/A ALA 505.A N VAL 668.A O no hydrogen 2.865 N/A THR 506.A N LYS 703.A O no hydrogen 2.800 N/A LEU 507.A N VAL 666.A O no hydrogen 3.022 N/A ASP 508.A N GLU 700.A O no hydrogen 2.887 N/A PHE 509.A N ASP 664.A O no hydrogen 3.107 N/A ASN 510.A N ASN 698.A O no hydrogen 3.010 N/A SER 515.A N SER 511.A O no hydrogen 2.965 N/A SER 515.A OG SER 511.A O no hydrogen 3.397 N/A SER 515.A OG LEU 512.A O no hydrogen 2.737 N/A ILE 516.A N LEU 512.A O no hydrogen 2.945 N/A MET 517.A N TYR 513.A O no hydrogen 3.050 N/A MET 518.A N PRO 514.A O no hydrogen 2.897 N/A ALA 519.A N SER 515.A O no hydrogen 2.797 N/A HIS 520.A N ILE 516.A O no hydrogen 3.031 N/A ASN 521.A N MET 518.A O no hydrogen 3.312 N/A ASN 521.A ND2 VAL 554.A O no hydrogen 2.996 N/A ASN 521.A ND2 ARG 559.A O no hydrogen 2.665 N/A LEU 522.A N MET 517.A O no hydrogen 2.955 N/A CYS 523.A SG THR 525.A OG1 no hydrogen 3.066 N/A TYR 524.A OH LEU 618.A O no hydrogen 2.638 N/A THR 526.A N CYS 523.A O no hydrogen 3.221 N/A THR 526.A OG1 ASN 521.A O no hydrogen 2.632 N/A THR 526.A OG1 CYS 523.A O no hydrogen 3.187 N/A CYS 528.A N TYR 552.A O no hydrogen 2.744 N/A CYS 528.A SG TYR 111.A O no hydrogen 3.714 N/A VAL 533.A N ASN 529.A O no hydrogen 3.088 N/A ARG 535.A N ALA 531.A O no hydrogen 3.012 N/A ARG 535.A NH2 SER 112.A O no hydrogen 3.299 N/A LEU 536.A N THR 532.A O no hydrogen 2.836 N/A ASN 537.A N GLU 534.A O no hydrogen 3.003 N/A LEU 538.A N VAL 533.A O no hydrogen 2.769 N/A LYS 539.A N ASP 543.A OD2 no hydrogen 2.659 N/A ASP 541.A N TYR 544.A O no hydrogen 2.442 N/A ASP 543.A N LYS 539.A O no hydrogen 2.774 N/A VAL 545.A N PHE 553.A O no hydrogen 2.938 N/A THR 547.A N ASP 551.A O no hydrogen 2.838 N/A THR 547.A OG1 SER 626.A OG no hydrogen 2.654 N/A ASN 549.A N THR 547.A OG1 no hydrogen 2.961 N/A ASN 549.A ND2 ASP 551.A OD2 no hydrogen 2.684 N/A GLY 550.A N THR 547.A O no hydrogen 2.765 N/A ASP 551.A N THR 547.A OG1 no hydrogen 3.384 N/A PHE 553.A N VAL 545.A O no hydrogen 3.088 N/A VAL 554.A N THR 526.A O no hydrogen 2.792 N/A THR 555.A N ASP 543.A O no hydrogen 3.047 N/A THR 555.A OG1 GLU 542.A O no hydrogen 2.716 N/A LYS 557.A NZ ASP 543.A OD1 no hydrogen 2.974 N/A ARG 558.A N THR 555.A O no hydrogen 2.815 N/A ARG 558.A NE ASP 543.A OD1 no hydrogen 3.048 N/A ARG 558.A NH2 ASP 543.A OD1 no hydrogen 3.301 N/A ARG 558.A NH2 ASP 543.A OD2 no hydrogen 3.396 N/A ARG 559.A N THR 555.A O no hydrogen 3.011 N/A ARG 559.A NE THR 525.A O no hydrogen 3.112 N/A ARG 559.A NH1 GLY 113.A O no hydrogen 3.511 N/A ARG 559.A NH1 ASP 114.A OD1 no hydrogen 3.259 N/A ARG 559.A NH2 THR 525.A O no hydrogen 2.882 N/A GLY 561.A N ASN 521.A OD1 no hydrogen 2.900 N/A ILE 566.A N ILE 562.A O no hydrogen 3.037 N/A LEU 567.A N LEU 563.A O no hydrogen 2.896 N/A ASP 568.A N PRO 564.A O no hydrogen 2.875 N/A GLU 569.A N ILE 565.A O no hydrogen 3.017 N/A LEU 570.A N ILE 566.A O no hydrogen 3.054 N/A ILE 571.A N LEU 567.A O no hydrogen 2.837 N/A SER 572.A N ASP 568.A O no hydrogen 2.951 N/A SER 572.A OG ASP 568.A O no hydrogen 2.824 N/A ALA 573.A N GLU 569.A O no hydrogen 3.096 N/A ARG 574.A N LEU 570.A O no hydrogen 2.937 N/A ARG 574.A NE GLN 597.A OE1 no hydrogen 2.809 N/A ARG 574.A NH2 GLN 597.A OE1 no hydrogen 2.933 N/A LYS 575.A N ILE 571.A O no hydrogen 2.761 N/A ARG 576.A N SER 572.A O no hydrogen 2.950 N/A ALA 577.A N ALA 573.A O no hydrogen 2.985 N/A LYS 578.A N ARG 574.A O no hydrogen 2.834 N/A LYS 579.A N LYS 575.A O no hydrogen 3.056 N/A LYS 579.A NZ ASP 583.A OD2 no hydrogen 3.424 N/A ASP 580.A N ARG 576.A O no hydrogen 3.096 N/A LEU 581.A N ALA 577.A O no hydrogen 2.872 N/A ARG 582.A N LYS 578.A O no hydrogen 2.730 N/A ASP 583.A N LYS 579.A O no hydrogen 2.905 N/A ASP 583.A N ASP 580.A O no hydrogen 3.268 N/A GLU 584.A N LEU 581.A O no hydrogen 3.361 N/A ASP 586.A N GLU 584.A OE2 no hydrogen 2.480 N/A LYS 589.A N ASP 586.A OD1 no hydrogen 2.704 N/A ARG 590.A N ASP 586.A O no hydrogen 2.899 N/A ARG 590.A NE GLU 584.A O no hydrogen 2.736 N/A ASP 591.A N PRO 587.A O no hydrogen 3.125 N/A VAL 592.A N PHE 588.A O no hydrogen 3.209 N/A LEU 593.A N LYS 589.A O no hydrogen 2.812 N/A ASN 594.A N ARG 590.A O no hydrogen 2.652 N/A GLY 595.A N ASP 591.A O no hydrogen 3.052 N/A ARG 596.A N VAL 592.A O no hydrogen 3.094 N/A ARG 596.A NE GLU 439.A OE1 no hydrogen 2.998 N/A ARG 596.A NH1 ASP 580.A OD2 no hydrogen 2.747 N/A ARG 596.A NH2 GLU 439.A OE2 no hydrogen 3.440 N/A ARG 596.A NH2 ASP 580.A OD2 no hydrogen 3.488 N/A GLN 597.A N LEU 593.A O no hydrogen 3.147 N/A GLN 597.A NE2 ASN 594.A O no hydrogen 3.403 N/A GLN 597.A NE2 ASN 594.A OD1 no hydrogen 3.000 N/A LEU 598.A N ASN 594.A O no hydrogen 2.979 N/A ALA 599.A N GLY 595.A O no hydrogen 2.739 N/A LEU 600.A N ARG 596.A O no hydrogen 3.247 N/A LYS 601.A N GLN 597.A O no hydrogen 3.010 N/A ILE 602.A N LEU 598.A O no hydrogen 2.895 N/A SER 603.A N ALA 599.A O no hydrogen 3.096 N/A SER 603.A OG ALA 599.A O no hydrogen 2.987 N/A ALA 604.A N LEU 600.A O no hydrogen 3.074 N/A ASN 605.A N LYS 601.A O no hydrogen 2.885 N/A SER 606.A N ILE 602.A O no hydrogen 2.768 N/A SER 606.A OG ILE 602.A O no hydrogen 2.752 N/A VAL 607.A N ALA 604.A O no hydrogen 3.090 N/A GLY 609.A N ASN 605.A O no hydrogen 2.906 N/A PHE 610.A N SER 606.A O no hydrogen 2.784 N/A THR 611.A OG1 TYR 608.A O no hydrogen 2.711 N/A GLY 612.A N GLY 609.A O no hydrogen 2.856 N/A ALA 613.A N PHE 610.A O no hydrogen 3.162 N/A LYS 617.A NZ ASN 477.A OD1 no hydrogen 2.857 N/A LYS 617.A NZ MET 478.A O no hydrogen 2.475 N/A CYS 620.A N THR 611.A O no hydrogen 2.758 N/A ILE 623.A N CYS 620.A O no hydrogen 2.897 N/A SER 624.A N CYS 620.A O no hydrogen 3.233 N/A SER 625.A N LEU 621.A O no hydrogen 2.815 N/A SER 626.A N ALA 622.A O no hydrogen 3.047 N/A SER 626.A OG THR 547.A OG1 no hydrogen 2.654 N/A SER 626.A OG ASP 551.A OD2 no hydrogen 2.763 N/A SER 626.A OG ALA 622.A O no hydrogen 2.778 N/A VAL 627.A N ILE 623.A O no hydrogen 2.838 N/A THR 628.A N SER 624.A O no hydrogen 3.074 N/A THR 628.A OG1 GLU 488.A O no hydrogen 2.773 N/A THR 628.A OG1 SER 625.A O no hydrogen 3.259 N/A ALA 629.A N SER 625.A O no hydrogen 2.969 N/A TYR 630.A N SER 626.A O no hydrogen 2.830 N/A GLY 631.A N VAL 627.A O no hydrogen 3.043 N/A ARG 632.A N THR 628.A O no hydrogen 2.953 N/A ARG 632.A NH1 GLY 489.A O no hydrogen 2.971 N/A THR 633.A N ALA 629.A O no hydrogen 3.094 N/A THR 633.A OG1 TYR 630.A O no hydrogen 2.605 N/A MET 634.A N TYR 630.A O no hydrogen 2.893 N/A ILE 635.A N GLY 631.A O no hydrogen 3.075 N/A LEU 636.A N ARG 632.A O no hydrogen 3.182 N/A LYS 637.A N THR 633.A O no hydrogen 2.881 N/A LYS 637.A NZ LEU 692.A O no hydrogen 3.494 N/A THR 638.A N MET 634.A O no hydrogen 2.793 N/A THR 638.A OG1 MET 634.A O no hydrogen 2.750 N/A LYS 639.A N ILE 635.A O no hydrogen 2.878 N/A THR 640.A N LEU 636.A O no hydrogen 2.889 N/A THR 640.A OG1 LEU 636.A O no hydrogen 2.772 N/A ALA 641.A N LYS 637.A O no hydrogen 2.801 N/A VAL 642.A N THR 638.A O no hydrogen 2.966 N/A GLN 643.A N LYS 639.A O no hydrogen 3.038 N/A GLU 644.A N THR 640.A O no hydrogen 2.918 N/A LYS 645.A N ALA 641.A O no hydrogen 3.013 N/A TYR 646.A N VAL 642.A O no hydrogen 3.071 N/A TYR 646.A OH GLU 684.A OE2 no hydrogen 2.730 N/A CYS 647.A N LYS 645.A O no hydrogen 2.992 N/A CYS 647.A SG GLU 644.A O no hydrogen 3.600 N/A CYS 647.A SG LYS 645.A O no hydrogen 4.036 N/A ILE 648.A N ASP 655.A OD1 no hydrogen 2.662 N/A ASN 650.A N CYS 647.A O no hydrogen 2.937 N/A ASN 650.A ND2 LYS 645.A O no hydrogen 3.068 N/A GLY 651.A N ILE 648.A O no hydrogen 2.809 N/A TYR 652.A N CYS 647.A O no hydrogen 3.226 N/A ALA 656.A N TYR 646.A O no hydrogen 2.789 N/A VAL 657.A N LYS 669.A O no hydrogen 2.928 N/A VAL 658.A N GLN 643.A OE1 no hydrogen 3.058 N/A VAL 659.A N MET 667.A O no hydrogen 2.863 N/A ASP 662.A N SER 665.A OG no hydrogen 3.103 N/A THR 663.A N THR 491.A O no hydrogen 2.779 N/A THR 663.A OG1 ASP 662.A OD1 no hydrogen 2.653 N/A ASP 664.A N ASP 662.A O no hydrogen 2.741 N/A SER 665.A OG ASP 662.A O no hydrogen 3.215 N/A VAL 666.A N LEU 507.A O no hydrogen 2.901 N/A MET 667.A N TYR 660.A O no hydrogen 2.749 N/A VAL 668.A N ALA 505.A O no hydrogen 2.776 N/A LYS 669.A N VAL 657.A O no hydrogen 2.683 N/A THR 672.A OG1 GLU 677.A OE2 no hydrogen 3.027 N/A ASP 674.A N THR 672.A OG1 no hydrogen 2.915 N/A LYS 676.A NZ ASP 680.A OD2 no hydrogen 2.515 N/A GLU 677.A N ASP 674.A OD2 no hydrogen 3.002 N/A ALA 678.A N ASP 674.A O no hydrogen 3.148 N/A MET 679.A N LEU 675.A O no hydrogen 2.978 N/A ASP 680.A N LYS 676.A O no hydrogen 2.825 N/A LEU 681.A N GLU 677.A O no hydrogen 2.854 N/A GLY 682.A N ALA 678.A O no hydrogen 2.859 N/A THR 683.A N MET 679.A O no hydrogen 2.982 N/A THR 683.A OG1 MET 679.A O no hydrogen 3.015 N/A GLU 684.A N ASP 680.A O no hydrogen 2.962 N/A ALA 685.A N LEU 681.A O no hydrogen 2.733 N/A ALA 686.A N GLY 682.A O no hydrogen 2.988 N/A LYS 687.A N THR 683.A O no hydrogen 3.161 N/A TYR 688.A N GLU 684.A O no hydrogen 2.976 N/A VAL 689.A N ALA 685.A O no hydrogen 2.800 N/A SER 690.A N ALA 686.A O no hydrogen 2.983 N/A SER 690.A OG ALA 686.A O no hydrogen 2.652 N/A SER 690.A OG LEU 699.A O no hydrogen 3.084 N/A THR 691.A N TYR 688.A O no hydrogen 3.001 N/A THR 691.A OG1 TYR 688.A O no hydrogen 2.541 N/A LEU 692.A N VAL 689.A O no hydrogen 2.945 N/A PHE 693.A N SER 690.A O no hydrogen 3.285 N/A LYS 694.A NZ ALA 519.A O no hydrogen 2.572 N/A ILE 697.A N LYS 694.A O no hydrogen 2.999 N/A LEU 699.A N SER 690.A OG no hydrogen 2.717 N/A GLU 700.A N ASP 508.A O no hydrogen 3.087 N/A GLU 702.A N THR 506.A O no hydrogen 2.784 N/A LYS 703.A N THR 506.A O no hydrogen 3.493 N/A LYS 703.A NZ GLU 702.A OE1 no hydrogen 2.964 N/A ALA 704.A N TRP 721.A O no hydrogen 2.926 N/A TYR 705.A N ILE 504.A O no hydrogen 2.799 N/A TYR 705.A OH ASP 731.A OD2 no hydrogen 2.674 N/A PHE 706.A N LEU 719.A O no hydrogen 2.968 N/A TYR 708.A N TYR 500.A O no hydrogen 3.025 N/A LEU 709.A N ALA 717.A O no hydrogen 2.842 N/A LEU 710.A N GLY 498.A O no hydrogen 2.873 N/A ILE 711.A N ARG 715.A O no hydrogen 2.972 N/A ASN 712.A N ARG 715.A O no hydrogen 3.086 N/A ASN 712.A ND2 ILE 711.A O no hydrogen 3.471 N/A LYS 713.A N ASN 712.A OD1 no hydrogen 3.034 N/A LYS 713.A NZ VAL 492.A O no hydrogen 3.516 N/A LYS 714.A N TYR 660.A OH no hydrogen 2.748 N/A LYS 714.A NZ ASP 662.A OD1 no hydrogen 3.403 N/A LYS 714.A NZ ASP 662.A OD2 no hydrogen 2.691 N/A ARG 715.A N ASN 712.A O no hydrogen 2.993 N/A TYR 716.A N LYS 733.A O no hydrogen 3.089 N/A ALA 717.A N LEU 709.A O no hydrogen 3.024 N/A GLY 718.A N ASP 731.A O no hydrogen 2.869 N/A LEU 719.A N PRO 707.A O no hydrogen 3.260 N/A PHE 720.A N LYS 729.A O no hydrogen 2.942 N/A TRP 721.A N ALA 704.A O no hydrogen 2.789 N/A TRP 721.A NE1 PHE 706.A O no hydrogen 2.834 N/A THR 722.A OG1 ASP 728.A OD1 no hydrogen 3.338 N/A THR 722.A OG1 ASP 728.A OD2 no hydrogen 2.447 N/A ASP 725.A N ASN 723.A OD1 no hydrogen 2.923 N/A LYS 726.A N ASN 723.A OD1 no hydrogen 3.058 N/A ASP 728.A N PHE 720.A O no hydrogen 2.697 N/A ASP 731.A N GLY 718.A O no hydrogen 2.836 N/A GLN 732.A NE2 SER 737.A OG no hydrogen 2.142 N/A LYS 733.A N TYR 716.A O no hydrogen 2.831 N/A LYS 733.A NZ ASP 731.A OD1 no hydrogen 3.261 N/A LYS 733.A NZ ASP 731.A OD2 no hydrogen 2.883 N/A VAL 738.A N LEU 735.A O no hydrogen 2.767 N/A ARG 739.A N ALA 736.A O no hydrogen 3.118 N/A ARG 739.A NE ASP 741.A OD1 no hydrogen 3.170 N/A ARG 739.A NH2 ASP 741.A OD2 no hydrogen 3.041 N/A ARG 740.A NH1 LEU 380.A O no hydrogen 3.138 N/A SER 742.A N ARG 739.A O no hydrogen 3.166 N/A SER 742.A OG ALA 736.A O no hydrogen 2.431 N/A SER 742.A OG ARG 739.A O no hydrogen 3.554 N/A LEU 745.A N LYS 786.A O no hydrogen 2.979 N/A SER 747.A N CYS 743.A O no hydrogen 3.275 N/A SER 747.A OG ALA 736.A O no hydrogen 3.523 N/A ILE 748.A N SER 744.A O no hydrogen 2.786 N/A VAL 749.A N LEU 745.A O no hydrogen 3.203 N/A MET 750.A N VAL 746.A O no hydrogen 2.939 N/A ASN 751.A N SER 747.A O no hydrogen 2.863 N/A LYS 752.A N ILE 748.A O no hydrogen 2.967 N/A VAL 753.A N VAL 749.A O no hydrogen 2.833 N/A LEU 754.A N MET 750.A O no hydrogen 2.899 N/A LYS 755.A N ASN 751.A O no hydrogen 3.030 N/A LYS 756.A N LYS 752.A O no hydrogen 2.864 N/A ILE 757.A N VAL 753.A O no hydrogen 2.962 N/A LEU 758.A N LEU 754.A O no hydrogen 2.797 N/A ILE 759.A N LYS 755.A O no hydrogen 2.995 N/A GLU 760.A N LYS 755.A O no hydrogen 3.056 N/A ASN 762.A N LYS 756.A O no hydrogen 2.707 N/A GLY 765.A N ASN 762.A OD1 no hydrogen 2.979 N/A ALA 766.A N ASN 762.A O no hydrogen 3.043 N/A LEU 767.A N VAL 763.A O no hydrogen 2.842 N/A ALA 768.A N ASP 764.A O no hydrogen 2.944 N/A PHE 769.A N GLY 765.A O no hydrogen 3.028 N/A VAL 770.A N ALA 766.A O no hydrogen 2.973 N/A ARG 771.A N LEU 767.A O no hydrogen 2.922 N/A GLU 772.A N ALA 768.A O no hydrogen 2.995 N/A THR 773.A N PHE 769.A O no hydrogen 2.953 N/A THR 773.A OG1 PHE 769.A O no hydrogen 2.863 N/A ILE 774.A N VAL 770.A O no hydrogen 2.855 N/A ASN 775.A N ARG 771.A O no hydrogen 3.023 N/A ASP 776.A N GLU 772.A O no hydrogen 2.902 N/A ILE 777.A N THR 773.A O no hydrogen 2.967 N/A LEU 778.A N ILE 774.A O no hydrogen 3.065 N/A HIS 779.A N ASN 775.A O no hydrogen 2.904 N/A HIS 779.A ND1 ASN 775.A O no hydrogen 3.257 N/A ASN 780.A N ILE 777.A O no hydrogen 3.099 N/A ARG 781.A N ASP 776.A O no hydrogen 2.809 N/A ARG 781.A NE.A ASP 776.A OD1 no hydrogen 2.534 N/A ARG 781.A NH1.A ASP 776.A OD1 no hydrogen 2.705 N/A ARG 781.A NH1.A ASP 776.A OD2 no hydrogen 3.539 N/A SER 785.A N ASP 783.A OD2 no hydrogen 2.866 N/A SER 785.A OG ASP 783.A OD2 no hydrogen 2.575 N/A LYS 786.A N ASP 783.A O no hydrogen 2.923 N/A LEU 787.A N ILE 784.A O no hydrogen 2.974 N/A ILE 789.A N TYR 826.A O no hydrogen 2.852 N/A SER 790.A OG ASP 825.A OD2 no hydrogen 2.547 N/A LYS 791.A N VAL 824.A O no hydrogen 3.121 N/A LEU 793.A N ASP 822.A O no hydrogen 2.930 N/A ALA 794.A N TYR 797.A OH no hydrogen 2.931 N/A TYR 797.A OH HIS 803.A NE2 no hydrogen 3.358 N/A GLN 801.A NE2 ASN 799.A O no hydrogen 3.177 N/A HIS 803.A NE2 THR 792.A O no hydrogen 2.979 N/A VAL 805.A N GLN 801.A O no hydrogen 2.930 N/A LEU 806.A N PRO 802.A O no hydrogen 3.004 N/A ALA 807.A N HIS 803.A O no hydrogen 2.924 N/A GLU 808.A N ALA 804.A O no hydrogen 3.305 N/A ARG 809.A N VAL 805.A O no hydrogen 3.156 N/A ARG 809.A NH1 ALA 839.A O no hydrogen 2.801 N/A ARG 809.A NH1 GLU 840.A OE1 no hydrogen 2.833 N/A MET 810.A N LEU 806.A O no hydrogen 2.896 N/A LYS 811.A N ALA 807.A O no hydrogen 3.231 N/A LYS 811.A NZ PRO 818.A O no hydrogen 2.560 N/A ARG 812.A N GLU 808.A O no hydrogen 2.977 N/A ARG 813.A N ARG 809.A O no hydrogen 3.023 N/A ARG 813.A NH1 GLU 840.A OE2 no hydrogen 2.650 N/A ARG 813.A NH2 GLU 840.A OE1 no hydrogen 3.315 N/A GLU 814.A N MET 810.A O no hydrogen 2.862 N/A GLY 815.A N LYS 811.A O no hydrogen 2.672 N/A ASN 819.A N ASP 822.A OD2 no hydrogen 2.687 N/A GLY 821.A N LEU 793.A O no hydrogen 2.806 N/A ASP 822.A N ASN 819.A O no hydrogen 2.889 N/A ARG 823.A NH2 ARG 740.A O no hydrogen 2.968 N/A VAL 824.A N LYS 791.A O no hydrogen 2.760 N/A TYR 826.A N ILE 789.A O no hydrogen 2.938 N/A VAL 827.A N GLU 840.A O no hydrogen 3.003 N/A ILE 828.A N TYR 857.A OH no hydrogen 3.025 N/A ILE 829.A N ARG 838.A O no hydrogen 2.929 N/A GLY 830.A N GLN 851.A O no hydrogen 3.031 N/A ASN 832.A ND2 ASN 832.A O no hydrogen 2.430 N/A ASN 837.A N LYS 834.A O no hydrogen 2.892 N/A ARG 838.A N LEU 835.A O no hydrogen 2.744 N/A ARG 838.A NE ASP 833.A O no hydrogen 2.824 N/A ARG 838.A NH2 ILE 829.A O no hydrogen 2.965 N/A ARG 838.A NH2 ASP 853.A OD2 no hydrogen 2.833 N/A GLU 840.A N VAL 827.A O no hydrogen 2.995 N/A ASP 841.A N GLU 840.A OE2 no hydrogen 2.785 N/A LEU 843.A N ASP 841.A OD1 no hydrogen 3.207 N/A VAL 845.A N ASP 841.A O no hydrogen 2.863 N/A LEU 846.A N PRO 842.A O no hydrogen 2.937 N/A GLU 847.A N LEU 843.A O no hydrogen 2.894 N/A ASN 848.A N PHE 844.A O no hydrogen 3.109 N/A ASN 848.A ND2 PHE 844.A O no hydrogen 3.043 N/A ASN 849.A N LEU 846.A O no hydrogen 3.294 N/A ILE 850.A N VAL 845.A O no hydrogen 3.036 N/A GLN 851.A NE2 VAL 852.A O no hydrogen 2.756 N/A ASP 853.A N ILE 828.A O no hydrogen 2.821 N/A SER 854.A N VAL 852.A O no hydrogen 2.862 N/A TYR 856.A N ASP 853.A OD1 no hydrogen 3.073 N/A TYR 856.A OH GLN 861.A OE1 no hydrogen 3.368 N/A TYR 857.A N ASP 853.A O no hydrogen 3.209 N/A TYR 857.A OH LEU 787.A O no hydrogen 2.657 N/A LEU 858.A N SER 854.A O no hydrogen 3.121 N/A THR 859.A N ARG 855.A O no hydrogen 2.882 N/A THR 859.A OG1 ARG 855.A O no hydrogen 2.943 N/A THR 859.A OG1 ASN 860.A OD1 no hydrogen 2.622 N/A ASN 860.A N TYR 856.A O no hydrogen 2.774 N/A LEU 862.A N TYR 857.A O no hydrogen 2.921 N/A GLN 863.A N LEU 858.A O no hydrogen 2.927 N/A ILE 866.A N LEU 862.A O no hydrogen 3.210 N/A ILE 867.A N GLN 863.A O no hydrogen 2.970 N/A SER 868.A N ASN 864.A O no hydrogen 2.971 N/A SER 868.A OG PRO 865.A O no hydrogen 2.841 N/A ILE 869.A N PRO 865.A O no hydrogen 3.254 N/A ILE 869.A N ILE 866.A O no hydrogen 3.086 N/A VAL 870.A N ILE 866.A O no hydrogen 3.041 N/A ALA 871.A N ILE 867.A O no hydrogen 2.842 N/A ILE 873.A N VAL 870.A O no hydrogen 2.799 N/A ILE 874.A N VAL 870.A O no hydrogen 2.878 N/A GLY 875.A N ALA 871.A O no hydrogen 2.717 N/A ALA 879.A N GLY 875.A O no hydrogen 3.107 N/A ASN 880.A N ASP 876.A O no hydrogen 2.963 N/A ASN 880.A ND2 ASP 876.A O no hydrogen 2.576 N/A GLY 881.A N LYS 877.A O no hydrogen 2.877 N/A MET 882.A N GLN 878.A O no hydrogen 2.987 N/A PHE 883.A N ASN 880.A O no hydrogen 3.014 N/A VAL 884.A N GLY 881.A O no hydrogen 3.005 N/A