Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1k32_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): MET 1.A N ASP 272.A OD1 no hydrogen 3.362 N/A ASN 3.A ND2 GLU 274.A O no hydrogen 2.717 N/A LEU 5.A N GLY 253.A O no hydrogen 2.847 N/A LEU 6.A N VAL 18.A O no hydrogen 3.072 N/A ASP 9.A N ILE 16.A O no hydrogen 3.016 N/A ILE 10.A N ASP 9.A OD2 no hydrogen 2.778 N/A HIS 11.A N ARG 14.A O no hydrogen 2.847 N/A GLY 12.A N ASP 243.A OD1 no hydrogen 2.968 N/A ARG 14.A N HIS 11.A O no hydrogen 2.925 N/A ARG 14.A NE GLU 25.A OE2 no hydrogen 3.527 N/A ARG 14.A NH1 GLY 52.A O no hydrogen 2.586 N/A ILE 15.A N HIS 26.A O no hydrogen 2.870 N/A ILE 16.A N ASP 9.A O no hydrogen 3.137 N/A PHE 17.A N TRP 24.A O no hydrogen 3.073 N/A VAL 18.A N LEU 6.A O no hydrogen 2.923 N/A CYS 19.A N ASP 22.A O no hydrogen 3.025 N/A CYS 20.A SG GLU 274.A O no hydrogen 3.990 N/A ASP 22.A N CYS 19.A O no hydrogen 3.114 N/A LEU 23.A N VAL 37.A O no hydrogen 2.930 N/A TRP 24.A N PHE 17.A O no hydrogen 2.801 N/A TRP 24.A NE1 CYS 19.A O no hydrogen 2.981 N/A GLU 25.A N ARG 34.A O no hydrogen 2.613 N/A HIS 26.A N ILE 15.A O no hydrogen 2.713 N/A ASP 27.A N SER 32.A O no hydrogen 2.911 N/A LEU 28.A N ASP 13.A O no hydrogen 2.750 N/A LYS 29.A N ASP 27.A OD1 no hydrogen 3.341 N/A SER 30.A N ASP 27.A OD2 no hydrogen 2.594 N/A SER 30.A OG ASP 27.A OD2 no hydrogen 2.527 N/A SER 30.A OG SER 32.A OG no hydrogen 2.874 N/A GLY 31.A N ASP 27.A O no hydrogen 2.658 N/A SER 32.A N SER 30.A OG no hydrogen 3.302 N/A SER 32.A OG SER 30.A OG no hydrogen 2.874 N/A ARG 34.A N GLU 25.A O no hydrogen 2.789 N/A LYS 35.A NZ ASP 22.A OD1 no hydrogen 3.033 N/A LYS 35.A NZ GLU 274.A OE1 no hydrogen 3.398 N/A LYS 35.A NZ GLU 274.A OE2 no hydrogen 2.620 N/A ILE 36.A N LEU 23.A O no hydrogen 2.927 N/A VAL 37.A N LEU 23.A O no hydrogen 3.424 N/A ASN 39.A N ASP 22.A OD2 no hydrogen 3.362 N/A VAL 42.A N MET 60.A O no hydrogen 2.962 N/A ILE 43.A N ASP 21.A O no hydrogen 3.124 N/A ASN 44.A N ARG 58.A O no hydrogen 3.348 N/A ASN 44.A ND2 ARG 58.A O no hydrogen 3.619 N/A ASN 45.A ND2 ASP 98.A OD2 no hydrogen 2.941 N/A ARG 47.A N ALA 56.A O no hydrogen 2.827 N/A PHE 48.A N ASP 9.A OD1 no hydrogen 2.647 N/A PHE 49.A N LYS 54.A O no hydrogen 2.812 N/A GLY 52.A N PHE 49.A O no hydrogen 2.736 N/A ARG 53.A N ASP 51.A OD2 no hydrogen 2.830 N/A ILE 55.A N TYR 73.A O no hydrogen 2.837 N/A ALA 56.A N ARG 47.A O no hydrogen 2.761 N/A ILE 57.A N TYR 71.A O no hydrogen 2.676 N/A ARG 58.A N ASN 45.A O no hydrogen 3.054 N/A ARG 58.A NE PHE 96.A O no hydrogen 3.204 N/A ARG 58.A NE THR 97.A O no hydrogen 2.777 N/A ARG 58.A NH1 SER 90.A OG no hydrogen 2.874 N/A ARG 58.A NH1 PHE 96.A O no hydrogen 2.911 N/A VAL 59.A N ASP 69.A O no hydrogen 3.198 N/A MET 60.A N VAL 42.A O no hydrogen 2.734 N/A ARG 61.A N THR 67.A O no hydrogen 2.982 N/A ARG 61.A NE LEU 40.A O no hydrogen 2.736 N/A ARG 61.A NH1 LEU 40.A O no hydrogen 2.896 N/A GLY 62.A N LYS 719.A O no hydrogen 2.955 N/A SER 64.A OG GLY 714.A O no hydrogen 2.850 N/A LEU 65.A N GLY 62.A O no hydrogen 2.670 N/A THR 67.A N ARG 61.A O no hydrogen 3.221 N/A THR 67.A OG1 ARG 61.A O no hydrogen 2.972 N/A ALA 68.A N GLY 88.A O no hydrogen 2.893 N/A ASP 69.A N VAL 59.A O no hydrogen 3.331 N/A LEU 70.A N THR 84.A OG1 no hydrogen 2.782 N/A TYR 71.A N ILE 57.A O no hydrogen 2.803 N/A PHE 72.A N LYS 81.A O no hydrogen 2.763 N/A TYR 73.A N ILE 55.A O no hydrogen 2.737 N/A ASN 74.A N GLU 79.A O no hydrogen 2.870 N/A GLU 76.A N ASN 74.A OD1 no hydrogen 2.912 N/A GLY 78.A N ASN 74.A O no hydrogen 2.615 N/A GLU 79.A N ASN 74.A O no hydrogen 3.255 N/A GLU 79.A N ASN 77.A OD1 no hydrogen 3.064 N/A LYS 81.A N PHE 72.A O no hydrogen 3.009 N/A ARG 82.A NE THR 84.A O no hydrogen 2.814 N/A ARG 82.A NH1 ASP 69.A OD1 no hydrogen 2.659 N/A ARG 82.A NH1 ARG 723.A O no hydrogen 3.313 N/A ILE 83.A N LEU 70.A O no hydrogen 2.667 N/A THR 84.A N LEU 70.A O no hydrogen 3.326 N/A THR 84.A OG1 ASP 69.A OD2 no hydrogen 2.556 N/A PHE 86.A N ASP 69.A OD2 no hydrogen 3.010 N/A SER 87.A N ASP 69.A OD1 no hydrogen 2.833 N/A SER 87.A N ASP 69.A OD2 no hydrogen 3.244 N/A SER 87.A OG PHE 722.A O no hydrogen 2.772 N/A SER 90.A N ASN 66.A O no hydrogen 2.975 N/A THR 91.A N ARG 94.A O no hydrogen 3.187 N/A ARG 94.A N THR 91.A O no hydrogen 3.060 N/A ARG 94.A N THR 91.A OG1 no hydrogen 3.036 N/A THR 97.A OG1 THR 112.A OG1 no hydrogen 2.919 N/A ASP 98.A N SER 111.A O no hydrogen 2.904 N/A VAL 99.A N ASP 98.A OD2 no hydrogen 2.542 N/A ALA 100.A N ILE 109.A O no hydrogen 2.823 N/A GLY 101.A N ILE 109.A O no hydrogen 3.284 N/A ASP 103.A N ASN 107.A O no hydrogen 3.100 N/A GLY 106.A N ASP 103.A O no hydrogen 2.823 N/A ASN 107.A N ASP 103.A OD2 no hydrogen 2.914 N/A ILE 109.A N GLY 101.A O no hydrogen 2.860 N/A ILE 110.A N TYR 125.A O no hydrogen 2.897 N/A SER 111.A N ASP 98.A O no hydrogen 2.859 N/A SER 111.A OG THR 122.A O no hydrogen 3.353 N/A SER 111.A OG ALA 142.A O no hydrogen 2.688 N/A THR 112.A N CYS 123.A O no hydrogen 2.860 N/A THR 112.A OG1 THR 97.A OG1 no hydrogen 2.919 N/A ALA 114.A N THR 112.A OG1 no hydrogen 2.967 N/A GLN 116.A N ASP 113.A O no hydrogen 2.828 N/A GLN 116.A NE2 TYR 125.A OH no hydrogen 2.969 N/A MET 121.A N PHE 118.A O no hydrogen 3.048 N/A THR 122.A OG1 ALA 142.A O no hydrogen 3.170 N/A CYS 123.A SG MET 121.A O no hydrogen 3.642 N/A TYR 125.A N ILE 110.A O no hydrogen 3.005 N/A ARG 126.A N VAL 135.A O no hydrogen 2.689 N/A VAL 127.A N LEU 108.A O no hydrogen 2.864 N/A GLU 128.A N ASN 133.A O no hydrogen 3.065 N/A GLY 131.A N GLU 128.A O no hydrogen 2.981 N/A ILE 132.A N ASN 129.A O no hydrogen 3.212 N/A ASN 133.A N GLU 128.A O no hydrogen 3.434 N/A ASN 133.A ND2 GLU 128.A OE2 no hydrogen 2.852 N/A VAL 135.A N ARG 126.A O no hydrogen 3.028 N/A LEU 137.A N LEU 124.A O no hydrogen 2.973 N/A ALA 142.A N THR 122.A O no hydrogen 3.014 N/A THR 143.A N GLY 155.A O no hydrogen 2.859 N/A HIS 144.A N GLY 155.A O no hydrogen 3.254 N/A HIS 144.A ND1 THR 158.A OG1 no hydrogen 2.730 N/A ILE 145.A N ALA 100.A O no hydrogen 2.990 N/A LEU 146.A N VAL 153.A O no hydrogen 2.822 N/A ALA 148.A N ARG 151.A O no hydrogen 2.939 N/A ARG 151.A N ALA 148.A O no hydrogen 2.735 N/A ARG 151.A NH2 GLU 178.A O no hydrogen 3.246 N/A ARG 152.A N GLU 178.A OE2 no hydrogen 3.049 N/A VAL 153.A N LEU 146.A O no hydrogen 2.670 N/A ILE 154.A N TRP 176.A O no hydrogen 2.743 N/A GLY 155.A N HIS 144.A O no hydrogen 2.763 N/A ARG 156.A N LYS 174.A O no hydrogen 2.828 N/A ARG 156.A NH1 TYR 997.A O no hydrogen 2.830 N/A ARG 156.A NH2 TYR 997.A O no hydrogen 3.160 N/A ASN 157.A ND2 TYR 924.A OH no hydrogen 2.776 N/A THR 158.A OG1 HIS 144.A ND1 no hydrogen 2.730 N/A TRP 164.A N LEU 161.A O no hydrogen 3.106 N/A LYS 165.A N GLY 702.A O no hydrogen 3.101 N/A LYS 165.A NZ PRO 162.A O no hydrogen 3.121 N/A LYS 165.A NZ GLU 699.A O no hydrogen 2.520 N/A LYS 165.A NZ GLU 699.A OE2 no hydrogen 2.602 N/A GLY 166.A N ASP 209.A OD1 no hydrogen 2.656 N/A TYR 167.A OH TRP 950.A O no hydrogen 2.749 N/A ARG 168.A NH2 GLY 166.A O no hydrogen 3.080 N/A GLY 170.A N THR 949.A O no hydrogen 3.021 N/A THR 171.A N TYR 167.A OH no hydrogen 2.970 N/A THR 171.A OG1 TYR 167.A OH no hydrogen 3.354 N/A THR 171.A OG1 GLU 923.A O no hydrogen 2.443 N/A ARG 172.A N GLY 169.A O no hydrogen 3.105 N/A ARG 172.A NE MET 190.A O no hydrogen 2.694 N/A ARG 172.A NH1 ASP 189.A OD1 no hydrogen 2.750 N/A ARG 172.A NH2 GLY 169.A O no hydrogen 3.118 N/A GLY 173.A N HIS 193.A ND1 no hydrogen 2.787 N/A LYS 174.A N ARG 156.A O no hydrogen 2.961 N/A LYS 174.A NZ ASP 189.A OD2 no hydrogen 3.084 N/A ILE 175.A N VAL 188.A O no hydrogen 2.986 N/A TRP 176.A N ILE 154.A O no hydrogen 2.792 N/A ILE 177.A N LYS 185.A O no hydrogen 2.844 N/A GLU 178.A N ARG 152.A O no hydrogen 2.926 N/A VAL 179.A N ALA 183.A O no hydrogen 2.841 N/A GLY 182.A N GLU 178.A OE1 no hydrogen 2.622 N/A ALA 183.A N ASN 180.A O no hydrogen 2.397 N/A LYS 185.A N ILE 177.A O no hydrogen 2.950 N/A LYS 186.A NZ ASP 189.A OD2 no hydrogen 2.836 N/A ILE 187.A N ILE 175.A O no hydrogen 2.917 N/A VAL 188.A N ILE 175.A O no hydrogen 3.238 N/A THR 192.A OG1 THR 208.A OG1 no hydrogen 2.517 N/A HIS 193.A NE2 PHE 159.A O no hydrogen 2.725 N/A SER 195.A N ILE 207.A O no hydrogen 2.911 N/A SER 195.A OG GLU 160.A OE1 no hydrogen 3.306 N/A SER 195.A OG GLU 160.A OE2 no hydrogen 2.780 N/A SER 195.A OG ILE 207.A O no hydrogen 3.401 N/A SER 196.A N THR 158.A O no hydrogen 2.916 N/A SER 196.A OG GLU 160.A OE1 no hydrogen 2.736 N/A VAL 198.A N TYR 205.A O no hydrogen 2.610 N/A VAL 200.A N ARG 203.A O no hydrogen 3.039 N/A ARG 203.A N VAL 200.A O no hydrogen 3.125 N/A ARG 203.A NH1 ASP 225.A O no hydrogen 3.036 N/A ARG 203.A NH2 SER 218.A OG no hydrogen 2.866 N/A ARG 203.A NH2 ASP 225.A O no hydrogen 3.281 N/A ILE 204.A N THR 219.A O no hydrogen 2.937 N/A TYR 205.A N VAL 198.A O no hydrogen 2.522 N/A PHE 206.A N TYR 217.A O no hydrogen 3.042 N/A ILE 207.A N SER 195.A O no hydrogen 2.934 N/A THR 208.A N GLN 215.A O no hydrogen 3.264 N/A THR 208.A OG1 THR 192.A OG1 no hydrogen 2.517 N/A THR 208.A OG1 HIS 193.A O no hydrogen 2.790 N/A GLY 212.A N ASP 209.A O no hydrogen 2.861 N/A GLN 215.A N THR 208.A O no hydrogen 3.101 N/A GLN 215.A NE2 THR 230.A OG1 no hydrogen 2.616 N/A ILE 216.A N THR 230.A OG1 no hydrogen 2.892 N/A TYR 217.A N PHE 206.A O no hydrogen 2.898 N/A TYR 217.A OH ASP 211.A OD1 no hydrogen 2.676 N/A SER 218.A N ARG 227.A O no hydrogen 3.017 N/A THR 219.A N ILE 204.A O no hydrogen 3.124 N/A THR 219.A OG1 ASP 220.A O no hydrogen 3.088 N/A ASP 220.A N LYS 224.A O no hydrogen 2.940 N/A ASP 222.A N ASP 220.A OD1 no hydrogen 2.709 N/A GLY 223.A N ASP 220.A O no hydrogen 2.779 N/A LYS 224.A N ASP 220.A OD1 no hydrogen 2.948 N/A ARG 227.A N SER 218.A O no hydrogen 2.915 N/A ARG 227.A NH1 ASP 225.A OD1 no hydrogen 2.918 N/A LYS 228.A NZ THR 230.A O no hydrogen 2.767 N/A HIS 229.A N ILE 216.A O no hydrogen 2.794 N/A TYR 235.A N ASP 234.A OD2 no hydrogen 2.565 N/A TYR 235.A OH LYS 679.A O no hydrogen 2.765 N/A ARG 238.A N SER 250.A O no hydrogen 2.796 N/A ARG 238.A NE GLU 699.A OE1 no hydrogen 2.981 N/A ARG 238.A NH1 GLU 699.A OE1 no hydrogen 3.518 N/A ARG 238.A NH1 GLU 699.A OE2 no hydrogen 3.132 N/A ARG 238.A NH2 GLU 160.A OE2 no hydrogen 3.092 N/A HIS 239.A N GLU 160.A OE1 no hydrogen 2.938 N/A ASN 241.A N LEU 248.A O no hydrogen 2.993 N/A THR 242.A OG1 ARG 246.A O no hydrogen 2.688 N/A GLY 244.A N THR 242.A OG1 no hydrogen 2.909 N/A ARG 245.A N ASP 243.A OD2 no hydrogen 2.807 N/A ARG 246.A N ASP 243.A OD2 no hydrogen 2.936 N/A ARG 246.A NH1 GLU 266.A OE1 no hydrogen 3.299 N/A ILE 247.A N PHE 258.A O no hydrogen 2.950 N/A LEU 248.A N ASN 241.A O no hydrogen 2.822 N/A PHE 249.A N TYR 256.A O no hydrogen 3.016 N/A SER 250.A N ARG 238.A O no hydrogen 2.940 N/A SER 250.A OG ARG 238.A O no hydrogen 3.255 N/A LYS 251.A N SER 254.A O no hydrogen 2.947 N/A LYS 251.A NZ ASP 234.A OD1 no hydrogen 2.998 N/A LYS 251.A NZ ASP 234.A OD2 no hydrogen 3.040 N/A LYS 251.A NZ TYR 256.A OH no hydrogen 3.296 N/A SER 254.A N LYS 251.A O no hydrogen 2.960 N/A TYR 256.A N PHE 249.A O no hydrogen 2.901 N/A ILE 257.A N GLU 266.A O no hydrogen 2.815 N/A PHE 258.A N ILE 247.A O no hydrogen 2.620 N/A ASN 259.A N LYS 264.A O no hydrogen 2.934 N/A GLU 263.A N ASN 259.A O no hydrogen 2.506 N/A GLU 266.A N ILE 257.A O no hydrogen 2.938 N/A LYS 267.A NZ ILE 268.A O no hydrogen 3.543 N/A LYS 267.A NZ GLU 269.A OE2 no hydrogen 3.303 N/A ILE 268.A N ILE 255.A O no hydrogen 2.926 N/A LEU 273.A N ASN 3.A OD1 no hydrogen 2.867 N/A GLU 274.A N ASN 3.A OD1 no hydrogen 2.858 N/A ASP 278.A N GLU 277.A OE1 no hydrogen 3.217 N/A ILE 280.A N SER 642.A O no hydrogen 2.733 N/A SER 282.A N LEU 640.A O no hydrogen 2.867 N/A SER 285.A N ASP 636.A OD1 no hydrogen 2.689 N/A SER 285.A OG ASP 636.A OD1 no hydrogen 3.410 N/A SER 285.A OG ASP 636.A OD2 no hydrogen 2.490 N/A LYS 286.A N ILE 283.A O no hydrogen 3.114 N/A PHE 287.A N PRO 284.A O no hydrogen 3.063 N/A GLU 289.A N VAL 302.A O no hydrogen 2.650 N/A SER 292.A N ALA 300.A O no hydrogen 2.646 N/A LEU 294.A N LEU 298.A O no hydrogen 2.877 N/A LEU 298.A N ASP 295.A O no hydrogen 3.241 N/A ILE 299.A N GLN 310.A O no hydrogen 2.771 N/A ALA 300.A N SER 292.A O no hydrogen 2.689 N/A PHE 301.A N PHE 308.A O no hydrogen 3.106 N/A VAL 302.A N GLU 289.A O no hydrogen 3.355 N/A VAL 302.A N ASP 290.A O no hydrogen 3.070 N/A SER 303.A N GLN 306.A O no hydrogen 2.736 N/A SER 303.A OG PRO 284.A O no hydrogen 2.910 N/A ARG 304.A N PHE 287.A O no hydrogen 3.250 N/A ARG 304.A NE GLU 647.A OE1 no hydrogen 2.607 N/A ARG 304.A NE GLU 647.A OE2 no hydrogen 3.142 N/A ARG 304.A NH1 GLU 647.A OE2 no hydrogen 2.707 N/A GLN 306.A N SER 303.A O no hydrogen 2.856 N/A GLN 306.A NE2 VAL 641.A O no hydrogen 3.112 N/A PHE 308.A N PHE 301.A O no hydrogen 2.938 N/A ILE 309.A N LEU 318.A O no hydrogen 2.852 N/A GLN 310.A N ILE 299.A O no hydrogen 2.931 N/A GLN 310.A NE2 ASP 311.A O no hydrogen 2.823 N/A GLN 310.A NE2 GLU 634.A O no hydrogen 2.877 N/A ASP 311.A N TYR 316.A O no hydrogen 3.179 N/A SER 313.A N ASP 311.A OD2 no hydrogen 3.185 N/A SER 313.A OG ASP 311.A OD2 no hydrogen 2.377 N/A GLY 314.A N ASP 311.A O no hydrogen 3.119 N/A THR 315.A N ASP 311.A OD1 no hydrogen 2.868 N/A TYR 316.A N ASP 311.A OD1 no hydrogen 2.606 N/A LEU 318.A N ILE 309.A O no hydrogen 2.809 N/A VAL 320.A N ALA 307.A O no hydrogen 2.783 N/A GLU 322.A N VAL 320.A O no hydrogen 2.789 N/A ARG 325.A NH1 ARG 961.A O no hydrogen 3.228 N/A ARG 325.A NH2 ARG 961.A O no hydrogen 3.213 N/A ILE 326.A N GLY 305.A O no hydrogen 3.038 N/A ARG 327.A N ILE 340.A O no hydrogen 2.695 N/A ARG 327.A NE ASP 347.A OD2 no hydrogen 2.661 N/A ARG 327.A NH1 GLU 654.A OE1 no hydrogen 2.918 N/A ARG 327.A NH2 GLU 654.A OE1 no hydrogen 3.095 N/A VAL 329.A N ASP 290.A OD1 no hydrogen 3.129 N/A ARG 330.A N ALA 338.A O no hydrogen 2.782 N/A ARG 330.A NE MET 372.A O no hydrogen 3.036 N/A ARG 330.A NH1 MET 372.A O no hydrogen 3.455 N/A ARG 330.A NH2 ASP 290.A OD2 no hydrogen 2.733 N/A ARG 331.A NE ASP 295.A OD1 no hydrogen 2.869 N/A ARG 331.A NE ASP 295.A OD2 no hydrogen 2.823 N/A ARG 331.A NH1 ASP 295.A OD1 no hydrogen 2.934 N/A GLY 332.A N LYS 336.A O no hydrogen 2.772 N/A THR 335.A OG1 ASP 353.A OD2 no hydrogen 3.120 N/A LYS 336.A N GLY 333.A O no hydrogen 3.494 N/A VAL 337.A N TYR 352.A O no hydrogen 2.903 N/A ALA 338.A N ARG 330.A O no hydrogen 2.740 N/A PHE 339.A N GLY 350.A O no hydrogen 2.941 N/A ILE 340.A N TYR 328.A O no hydrogen 2.922 N/A HIS 341.A N PHE 348.A O no hydrogen 2.793 N/A GLY 342.A N ARG 325.A O no hydrogen 2.788 N/A THR 343.A N GLY 346.A O no hydrogen 2.898 N/A THR 343.A OG1 GLY 346.A O no hydrogen 3.440 N/A GLU 345.A N THR 343.A OG1 no hydrogen 3.178 N/A GLY 346.A N THR 343.A O no hydrogen 3.148 N/A ASP 347.A N GLY 367.A O no hydrogen 2.835 N/A PHE 348.A N HIS 341.A O no hydrogen 2.729 N/A GLY 350.A N PHE 339.A O no hydrogen 2.881 N/A ILE 351.A N GLU 360.A O no hydrogen 2.735 N/A TYR 352.A N VAL 337.A O no hydrogen 2.843 N/A ASP 353.A N LYS 358.A O no hydrogen 2.983 N/A TYR 354.A N THR 335.A O no hydrogen 2.934 N/A ARG 355.A N ASP 353.A OD2 no hydrogen 2.774 N/A THR 356.A N ASP 353.A OD2 no hydrogen 3.187 N/A GLY 357.A N ASP 353.A O no hydrogen 2.659 N/A LYS 358.A N THR 356.A OG1 no hydrogen 3.205 N/A GLU 360.A N ILE 351.A O no hydrogen 2.824 N/A LYS 361.A NZ HIS 341.A ND1 no hydrogen 3.164 N/A PHE 362.A N LEU 349.A O no hydrogen 2.850 N/A GLU 363.A N GLU 363.A OE2 no hydrogen 2.430 N/A ASN 365.A ND2 ASP 347.A O no hydrogen 3.629 N/A LEU 366.A N ASP 347.A O no hydrogen 2.842 N/A ASN 368.A ND2 ASP 386.A OD2 no hydrogen 2.888 N/A ASN 368.A ND2 ASP 661.A OD1 no hydrogen 3.283 N/A VAL 369.A N ASP 347.A OD1 no hydrogen 2.834 N/A PHE 370.A N ALA 384.A O no hydrogen 2.840 N/A GLY 373.A N VAL 382.A O no hydrogen 2.885 N/A ASP 375.A N PHE 380.A O no hydrogen 3.022 N/A ARG 376.A NH2 ASP 418.A OD1 no hydrogen 3.054 N/A ASN 377.A N ASP 375.A OD1 no hydrogen 2.680 N/A GLY 378.A N ASP 375.A O no hydrogen 3.081 N/A LYS 379.A N ASP 375.A OD2 no hydrogen 2.648 N/A PHE 380.A N ASP 375.A OD2 no hydrogen 2.743 N/A ALA 381.A N VAL 393.A O no hydrogen 3.073 N/A VAL 382.A N GLY 373.A O no hydrogen 2.693 N/A VAL 383.A N MET 391.A O no hydrogen 2.831 N/A ALA 384.A N ALA 371.A O no hydrogen 3.103 N/A ASN 385.A N GLU 389.A O no hydrogen 3.253 N/A ASP 386.A N ASN 368.A O no hydrogen 2.924 N/A PHE 388.A N ASN 385.A O no hydrogen 3.063 N/A ILE 390.A N GLU 404.A O no hydrogen 3.040 N/A MET 391.A N VAL 383.A O no hydrogen 2.903 N/A THR 392.A N THR 401.A O no hydrogen 2.934 N/A VAL 393.A N ALA 381.A O no hydrogen 2.860 N/A ASP 394.A N LYS 399.A O no hydrogen 2.968 N/A LEU 395.A N LYS 379.A O no hydrogen 2.957 N/A GLU 396.A N ASP 394.A OD1 no hydrogen 2.682 N/A THR 397.A N ASP 394.A OD1 no hydrogen 3.042 N/A GLY 398.A N ASP 394.A O no hydrogen 2.814 N/A LYS 399.A N THR 397.A OG1 no hydrogen 3.221 N/A THR 401.A N THR 392.A O no hydrogen 2.761 N/A ILE 403.A N ILE 390.A O no hydrogen 2.876 N/A ARG 405.A NE ARG 387.A O no hydrogen 2.932 N/A SER 406.A N PHE 388.A O no hydrogen 2.800 N/A SER 406.A OG ALA 409.A O no hydrogen 3.314 N/A SER 406.A OG PRO 428.A O no hydrogen 2.849 N/A GLU 408.A N SER 406.A OG no hydrogen 2.963 N/A ALA 409.A N SER 406.A OG no hydrogen 3.344 N/A THR 415.A N ALA 424.A O no hydrogen 2.870 N/A SER 417.A N PHE 422.A O no hydrogen 2.996 N/A SER 417.A OG ASN 419.A OD1 no hydrogen 2.900 N/A SER 417.A OG PHE 422.A O no hydrogen 3.350 N/A ASN 419.A N SER 471.A OG no hydrogen 3.374 N/A SER 420.A N SER 417.A O no hydrogen 2.879 N/A SER 420.A OG ASP 375.A OD1 no hydrogen 2.758 N/A SER 420.A OG ASN 377.A OD1 no hydrogen 2.856 N/A ARG 421.A N ASN 419.A OD1 no hydrogen 2.904 N/A ARG 421.A NE ASP 446.A OD1 no hydrogen 3.250 N/A ARG 421.A NH1 ASP 446.A OD2 no hydrogen 3.413 N/A PHE 422.A N SER 417.A OG no hydrogen 2.826 N/A ILE 423.A N TYR 445.A O no hydrogen 2.956 N/A ALA 424.A N THR 415.A O no hydrogen 3.095 N/A TYR 425.A N HIS 443.A O no hydrogen 2.877 N/A TYR 425.A OH GLU 404.A OE2 no hydrogen 2.337 N/A GLY 426.A N ASP 413.A O no hydrogen 2.925 N/A PHE 427.A N ALA 441.A O no hydrogen 2.600 N/A LEU 429.A N MET 439.A O no hydrogen 2.912 N/A LYS 430.A NZ GLU 433.A O no hydrogen 3.385 N/A LYS 430.A NZ ASP 435.A O no hydrogen 2.864 N/A HIS 431.A ND1 ASP 435.A OD1 no hydrogen 2.548 N/A GLY 432.A N ASP 435.A OD1 no hydrogen 2.781 N/A ASP 435.A N GLY 432.A O no hydrogen 3.307 N/A MET 439.A N LEU 429.A O no hydrogen 2.765 N/A GLN 440.A N SER 460.A O no hydrogen 2.957 N/A GLN 440.A NE2 ASP 462.A O no hydrogen 2.888 N/A ALA 441.A N PHE 427.A O no hydrogen 3.204 N/A HIS 443.A N TYR 425.A O no hydrogen 2.790 N/A VAL 444.A N PHE 453.A O no hydrogen 2.720 N/A TYR 445.A N ILE 423.A O no hydrogen 2.709 N/A ASP 446.A N LYS 451.A O no hydrogen 2.967 N/A MET 447.A N ARG 421.A O no hydrogen 2.841 N/A GLU 448.A N ASP 446.A OD1 no hydrogen 2.784 N/A LYS 451.A NZ ASP 446.A OD2 no hydrogen 3.563 N/A PHE 453.A N VAL 444.A O no hydrogen 2.772 N/A ALA 455.A N ILE 442.A O no hydrogen 2.882 N/A THR 456.A OG1 ASP 462.A OD1 no hydrogen 2.754 N/A ASP 462.A N GLN 440.A O no hydrogen 2.806 N/A TYR 463.A N LEU 477.A O no hydrogen 2.827 N/A TYR 463.A OH TYR 547.A O no hydrogen 2.832 N/A ALA 464.A N ASP 413.A OD1 no hydrogen 2.721 N/A ALA 466.A N TYR 475.A O no hydrogen 2.770 N/A ASP 468.A N ASN 473.A O no hydrogen 3.186 N/A SER 471.A N ASP 468.A O no hydrogen 2.893 N/A LYS 472.A N ASP 468.A OD2 no hydrogen 2.829 N/A ASN 473.A N ASP 468.A OD2 no hydrogen 3.105 N/A LEU 474.A N ILE 504.A O no hydrogen 2.948 N/A TYR 475.A N ALA 466.A O no hydrogen 2.765 N/A TYR 476.A N PHE 502.A O no hydrogen 2.995 N/A LEU 477.A N TYR 463.A O no hydrogen 3.018 N/A SER 478.A N LYS 500.A O no hydrogen 3.060 N/A SER 478.A OG ASP 462.A OD2 no hydrogen 2.809 N/A TYR 479.A N HIS 461.A O no hydrogen 3.242 N/A TYR 479.A OH ASP 546.A OD1 no hydrogen 2.845 N/A ARG 480.A NE ASP 462.A OD2 no hydrogen 2.829 N/A ARG 480.A NH1 THR 457.A OG1 no hydrogen 2.967 N/A ARG 480.A NH1 ASP 462.A OD1 no hydrogen 2.871 N/A ARG 480.A NH2 THR 457.A OG1 no hydrogen 3.257 N/A SER 481.A N VAL 498.A O no hydrogen 3.205 N/A LEU 482.A N ARG 480.A O no hydrogen 2.829 N/A SER 485.A N SER 494.A O no hydrogen 2.877 N/A ASP 487.A N ASN 492.A O no hydrogen 2.922 N/A VAL 489.A N ASP 487.A OD2 no hydrogen 2.671 N/A VAL 490.A N ASP 487.A OD2 no hydrogen 2.588 N/A SER 494.A N SER 485.A O no hydrogen 2.983 N/A SER 494.A OG GLU 496.A OE1 no hydrogen 2.930 N/A SER 499.A N GLY 545.A O no hydrogen 2.838 N/A SER 499.A OG TYR 463.A OH no hydrogen 2.880 N/A LYS 500.A N SER 478.A O no hydrogen 2.951 N/A LYS 500.A NZ ILE 540.A O no hydrogen 3.398 N/A LYS 500.A NZ VAL 542.A O no hydrogen 2.953 N/A PHE 502.A N TYR 476.A O no hydrogen 2.756 N/A VAL 503.A N SER 538.A O no hydrogen 2.811 N/A ILE 504.A N LEU 474.A O no hydrogen 2.769 N/A LEU 506.A N LYS 472.A O no hydrogen 2.826 N/A SER 510.A N ILE 507.A O no hydrogen 3.126 N/A ASN 512.A ND2 SER 538.A OG no hydrogen 2.653 N/A ASN 512.A ND2 PRO 539.A O no hydrogen 2.960 N/A THR 514.A N ASN 512.A OD1 no hydrogen 2.767 N/A THR 514.A OG1 ASN 512.A OD1 no hydrogen 2.767 N/A LYS 515.A N ASN 512.A O no hydrogen 3.049 N/A MET 521.A N PRO 518.A O no hydrogen 3.027 N/A THR 522.A N ARG 519.A O no hydrogen 2.875 N/A THR 522.A OG1 PRO 518.A O no hydrogen 2.969 N/A SER 523.A OG SER 523.A O no hydrogen 2.664 N/A TYR 528.A OH SER 471.A O no hydrogen 2.590 N/A ASP 529.A N LEU 506.A O no hydrogen 3.172 N/A ASN 531.A N ASP 529.A OD1 no hydrogen 3.199 N/A LYS 535.A N ASP 532.A O no hydrogen 3.181 N/A ARG 536.A N MET 533.A O no hydrogen 3.098 N/A ARG 536.A NE PRO 505.A O no hydrogen 3.046 N/A ARG 536.A NH1 PRO 505.A O no hydrogen 3.070 N/A ARG 536.A NH1 ASP 529.A O no hydrogen 2.871 N/A ARG 536.A NH2 ASP 529.A O no hydrogen 3.485 N/A ARG 536.A NH2 ASN 531.A O no hydrogen 3.145 N/A SER 537.A N TYR 534.A O no hydrogen 3.229 N/A SER 537.A OG TYR 534.A O no hydrogen 2.965 N/A SER 538.A N VAL 503.A O no hydrogen 3.066 N/A SER 538.A OG PRO 539.A O no hydrogen 3.450 N/A ILE 540.A N PRO 501.A O no hydrogen 3.044 N/A VAL 542.A N ILE 540.A O no hydrogen 2.706 N/A GLY 545.A N SER 499.A O no hydrogen 3.063 N/A TYR 547.A N SER 499.A OG no hydrogen 3.241 N/A TYR 547.A OH ASP 543.A O no hydrogen 2.481 N/A ARG 548.A N TYR 560.A O no hydrogen 2.859 N/A ARG 548.A NE ASP 546.A OD1 no hydrogen 3.129 N/A ARG 548.A NH1 ASP 546.A OD2 no hydrogen 2.971 N/A ARG 548.A NH1 GLU 577.A OE1 no hydrogen 2.845 N/A ARG 548.A NH1 GLU 577.A OE2 no hydrogen 3.556 N/A ARG 548.A NH2 GLU 577.A OE2 no hydrogen 2.844 N/A ILE 551.A N LEU 558.A O no hydrogen 2.819 N/A LEU 553.A N SER 556.A O no hydrogen 2.645 N/A ILE 557.A N TYR 584.A O no hydrogen 2.924 N/A LEU 558.A N ILE 551.A O no hydrogen 2.837 N/A ILE 559.A N LEU 582.A O no hydrogen 2.831 N/A TYR 560.A N MET 549.A O no hydrogen 2.904 N/A SER 561.A N VAL 580.A O no hydrogen 2.719 N/A VAL 562.A N ASP 546.A O no hydrogen 2.843 N/A HIS 565.A ND1 PRO 563.A O no hydrogen 2.880 N/A TYR 571.A N GLU 567.A O no hydrogen 2.807 N/A TYR 572.A N PHE 568.A O no hydrogen 2.898 N/A TYR 572.A OH ASP 848.A OD1 no hydrogen 2.479 N/A GLN 573.A N ALA 569.A O no hydrogen 2.729 N/A ALA 575.A N ALA 569.A O no hydrogen 3.293 N/A LYS 578.A NZ ASP 615.A OD2 no hydrogen 3.509 N/A GLY 579.A N LEU 598.A O no hydrogen 2.792 N/A VAL 580.A N SER 561.A O no hydrogen 2.682 N/A LEU 581.A N LYS 595.A O no hydrogen 2.848 N/A LEU 582.A N ILE 559.A O no hydrogen 2.723 N/A LYS 583.A N THR 592.A O no hydrogen 2.719 N/A TYR 584.A N ILE 557.A O no hydrogen 2.835 N/A ASP 585.A N LYS 590.A O no hydrogen 2.760 N/A VAL 586.A N SER 555.A O no hydrogen 3.439 N/A THR 588.A N ASP 585.A OD1 no hydrogen 2.609 N/A THR 588.A OG1 ASP 585.A OD1 no hydrogen 2.915 N/A ARG 589.A N ASP 585.A O no hydrogen 2.468 N/A LYS 590.A N THR 588.A OG1 no hydrogen 3.245 N/A THR 592.A N LYS 583.A O no hydrogen 2.821 N/A VAL 594.A N LEU 581.A O no hydrogen 2.851 N/A LYS 595.A NZ PRO 627.A O no hydrogen 2.614 N/A LYS 595.A NZ GLU 630.A OE1 no hydrogen 2.632 N/A LEU 598.A N GLY 579.A O no hydrogen 2.929 N/A THR 599.A N ARG 613.A O no hydrogen 2.836 N/A THR 599.A OG1 ARG 613.A O no hydrogen 3.069 N/A THR 599.A OG1 LYS 614.A O no hydrogen 3.534 N/A ARG 602.A N MET 611.A O no hydrogen 2.670 N/A SER 604.A N THR 609.A O no hydrogen 2.875 N/A SER 604.A OG ASP 606.A OD2 no hydrogen 2.577 N/A SER 604.A OG THR 609.A O no hydrogen 3.338 N/A ARG 607.A N SER 604.A O no hydrogen 3.023 N/A ARG 607.A NH1 ASP 418.A OD1 no hydrogen 3.358 N/A ARG 607.A NH1 ASP 418.A OD2 no hydrogen 2.878 N/A ARG 607.A NH1 PHE 467.A O no hydrogen 3.479 N/A ARG 607.A NH2 ASP 418.A OD1 no hydrogen 2.768 N/A ARG 607.A NH2 ASP 418.A OD2 no hydrogen 3.553 N/A LYS 608.A N SER 604.A OG no hydrogen 3.184 N/A LYS 608.A N ASP 606.A OD2 no hydrogen 2.914 N/A THR 609.A N SER 604.A OG no hydrogen 2.930 N/A VAL 610.A N PHE 622.A O no hydrogen 3.005 N/A MET 611.A N ARG 602.A O no hydrogen 2.780 N/A VAL 612.A N TYR 620.A O no hydrogen 2.879 N/A ARG 613.A N ASP 600.A O no hydrogen 3.017 N/A ARG 613.A NH2 GLY 617.A O no hydrogen 2.565 N/A LYS 614.A N LYS 618.A O no hydrogen 3.148 N/A LYS 614.A NZ GLU 630.A OE1 no hydrogen 2.841 N/A LYS 614.A NZ GLU 630.A OE2 no hydrogen 2.971 N/A ASP 615.A N ASN 597.A O no hydrogen 2.883 N/A GLY 617.A N LYS 614.A O no hydrogen 2.848 N/A LYS 618.A N ASP 616.A OD1 no hydrogen 2.783 N/A TYR 620.A N VAL 612.A O no hydrogen 2.792 N/A TYR 620.A OH ASP 616.A OD2 no hydrogen 2.604 N/A THR 621.A N ARG 631.A O no hydrogen 2.825 N/A PHE 622.A N VAL 610.A O no hydrogen 3.065 N/A LEU 624.A N LYS 608.A O no hydrogen 2.737 N/A LYS 626.A N PRO 623.A O no hydrogen 3.040 N/A ASP 629.A N LYS 626.A O no hydrogen 2.846 N/A GLU 630.A N GLU 628.A O no hydrogen 2.849 N/A ARG 631.A N THR 621.A O no hydrogen 2.811 N/A ARG 631.A NH1 ASP 297.A OD1 no hydrogen 2.705 N/A ARG 631.A NH2 ASP 297.A OD1 no hydrogen 3.092 N/A ARG 631.A NH2 ASP 297.A OD2 no hydrogen 3.370 N/A VAL 633.A N ILE 619.A O no hydrogen 2.784 N/A GLU 634.A N VAL 312.A O no hydrogen 2.989 N/A THR 635.A OG1 ASP 636.A OD1 no hydrogen 3.171 N/A LEU 640.A N SER 282.A O no hydrogen 2.776 N/A SER 642.A N ILE 280.A O no hydrogen 2.944 N/A SER 642.A OG GLU 647.A OE1 no hydrogen 2.861 N/A SER 643.A N GLU 646.A OE1 no hydrogen 3.022 N/A SER 643.A OG ASP 278.A OD1 no hydrogen 2.447 N/A SER 643.A OG ASP 278.A OD2 no hydrogen 3.389 N/A ILE 644.A N ASP 278.A O no hydrogen 2.819 N/A HIS 645.A N ASP 278.A OD2 no hydrogen 2.774 N/A HIS 645.A ND1 ASP 278.A OD2 no hydrogen 2.844 N/A GLU 646.A N SER 643.A OG no hydrogen 3.300 N/A GLU 647.A N SER 643.A O no hydrogen 2.932 N/A PHE 648.A N ILE 644.A O no hydrogen 2.787 N/A LEU 649.A N HIS 645.A O no hydrogen 3.099 N/A GLN 650.A N GLU 646.A O no hydrogen 3.050 N/A GLN 650.A NE2 GLU 654.A OE2 no hydrogen 3.104 N/A MET 651.A N GLU 647.A O no hydrogen 2.847 N/A TYR 652.A N PHE 648.A O no hydrogen 3.024 N/A TYR 652.A OH TYR 677.A O no hydrogen 2.799 N/A ASP 653.A N LEU 649.A O no hydrogen 3.062 N/A GLU 654.A N GLN 650.A O no hydrogen 3.016 N/A ALA 655.A N MET 651.A O no hydrogen 2.834 N/A TRP 656.A N TYR 652.A O no hydrogen 2.812 N/A TRP 656.A NE1 SER 673.A O no hydrogen 2.909 N/A LYS 657.A N ASP 653.A O no hydrogen 2.854 N/A LYS 657.A NZ ASP 661.A OD1 no hydrogen 2.919 N/A LEU 658.A N GLU 654.A O no hydrogen 2.771 N/A ALA 659.A N ALA 655.A O no hydrogen 3.006 N/A ARG 660.A N TRP 656.A O no hydrogen 3.074 N/A ARG 660.A NE ASP 661.A OD2 no hydrogen 3.140 N/A ARG 660.A NH1 ASP 661.A OD2 no hydrogen 3.085 N/A ASP 661.A N LYS 657.A O no hydrogen 2.870 N/A ASN 662.A N LEU 658.A O no hydrogen 2.982 N/A TYR 663.A N ALA 659.A O no hydrogen 3.231 N/A TYR 663.A OH THR 706.A OG1 no hydrogen 2.662 N/A TRP 664.A N PRO 971.A O no hydrogen 2.847 N/A ALA 669.A N ASN 665.A O no hydrogen 2.990 N/A LYS 670.A N GLU 666.A O no hydrogen 3.410 N/A ILE 672.A N VAL 668.A O no hydrogen 3.130 N/A SER 673.A N ALA 669.A O no hydrogen 3.085 N/A SER 673.A OG ALA 669.A O no hydrogen 2.934 N/A SER 673.A OG LYS 670.A O no hydrogen 3.167 N/A GLU 674.A N LYS 670.A O no hydrogen 3.271 N/A ARG 675.A N GLU 671.A O no hydrogen 3.199 N/A ARG 675.A NH2 GLU 671.A OE2 no hydrogen 2.922 N/A ILE 676.A N ILE 672.A O no hydrogen 3.009 N/A TYR 677.A N SER 673.A O no hydrogen 3.015 N/A TYR 677.A OH ASP 653.A OD2 no hydrogen 2.738 N/A LYS 679.A NZ THR 233.A O no hydrogen 3.552 N/A LYS 679.A NZ ASP 234.A O no hydrogen 3.081 N/A TYR 680.A N ILE 676.A O no hydrogen 3.480 N/A TYR 680.A OH GLU 703.A OE1 no hydrogen 2.604 N/A ARG 681.A N TYR 677.A O no hydrogen 2.935 N/A ARG 681.A NH2 ARG 681.A O no hydrogen 3.094 N/A ASN 682.A N GLU 678.A O no hydrogen 2.823 N/A ASN 682.A ND2 GLU 678.A OE1 no hydrogen 3.519 N/A LEU 683.A N TYR 680.A O no hydrogen 3.033 N/A VAL 684.A N ARG 681.A O no hydrogen 3.275 N/A LEU 686.A N LEU 683.A O no hydrogen 3.013 N/A CYS 687.A N VAL 684.A O no hydrogen 2.996 N/A CYS 687.A SG LEU 683.A O no hydrogen 3.578 N/A LYS 688.A N ASP 692.A OD1 no hydrogen 2.938 N/A LYS 688.A NZ PRO 2.A O no hydrogen 3.411 N/A LYS 688.A NZ PRO 685.A O no hydrogen 3.229 N/A THR 689.A N ASP 692.A OD1 no hydrogen 3.138 N/A THR 689.A OG1 ASP 21.A OD1 no hydrogen 3.304 N/A THR 689.A OG1 ASP 21.A OD2 no hydrogen 2.633 N/A ARG 690.A NE ASP 964.A OD2 no hydrogen 2.922 N/A ARG 690.A NH1 GLU 711.A OE1 no hydrogen 3.007 N/A ARG 690.A NH1 THR 966.A OG1 no hydrogen 2.894 N/A ARG 690.A NH2 ARG 690.A O no hydrogen 2.876 N/A ARG 690.A NH2 GLU 711.A OE1 no hydrogen 3.321 N/A ASP 692.A N THR 689.A OG1 no hydrogen 3.345 N/A LEU 693.A N THR 689.A O no hydrogen 3.097 N/A SER 694.A N ARG 690.A O no hydrogen 3.074 N/A SER 694.A OG GLU 711.A OE2 no hydrogen 2.261 N/A ASN 695.A N TYR 691.A O no hydrogen 3.118 N/A VAL 696.A N ASP 692.A O no hydrogen 3.323 N/A ILE 697.A N LEU 693.A O no hydrogen 2.856 N/A VAL 698.A N SER 694.A O no hydrogen 2.814 N/A GLU 699.A N ASN 695.A O no hydrogen 3.311 N/A MET 700.A N VAL 696.A O no hydrogen 3.124 N/A GLN 701.A N ILE 697.A O no hydrogen 2.809 N/A GLY 702.A N VAL 698.A O no hydrogen 2.890 N/A GLU 703.A N MET 700.A O no hydrogen 3.141 N/A TYR 704.A N GLN 701.A O no hydrogen 3.246 N/A ARG 705.A N GLY 702.A O no hydrogen 2.826 N/A ARG 705.A NH1 GLY 212.A O no hydrogen 2.966 N/A THR 706.A OG1 TYR 663.A OH no hydrogen 2.662 N/A THR 706.A OG1 TYR 704.A O no hydrogen 2.865 N/A SER 707.A N GLU 985.A OE1 no hydrogen 2.955 N/A SER 707.A OG HIS 708.A ND1 no hydrogen 2.913 N/A SER 707.A OG GLU 985.A OE1 no hydrogen 3.437 N/A SER 707.A OG GLU 985.A OE2 no hydrogen 2.873 N/A HIS 708.A ND1 SER 707.A OG no hydrogen 2.913 N/A HIS 708.A NE2 SER 927.A OG no hydrogen 2.834 N/A TYR 710.A N THR 969.A OG1 no hydrogen 2.836 N/A MET 712.A N VAL 967.A O no hydrogen 2.772 N/A PHE 716.A N SER 63.A O no hydrogen 2.693 N/A LYS 719.A N THR 717.A OG1 no hydrogen 3.098 N/A LYS 719.A NZ ASN 39.A O no hydrogen 3.005 N/A LYS 719.A NZ ASN 39.A OD1 no hydrogen 3.211 N/A PHE 722.A N THR 67.A OG1 no hydrogen 2.852 N/A ARG 723.A NH1 ALA 791.A O no hydrogen 2.899 N/A SER 724.A OG TYR 85.A O no hydrogen 2.919 N/A SER 724.A OG PHE 86.A O no hydrogen 3.223 N/A ARG 726.A N LEU 814.A O no hydrogen 2.701 N/A ARG 726.A NE SER 724.A OG no hydrogen 3.034 N/A ARG 726.A NH1 PHE 86.A O no hydrogen 3.091 N/A ARG 726.A NH1 ALA 114.A O no hydrogen 3.204 N/A ARG 726.A NH2 ALA 114.A O no hydrogen 2.992 N/A ARG 726.A NH2 ASP 817.A OD2 no hydrogen 2.955 N/A CYS 729.A SG ILE 727.A O no hydrogen 3.562 N/A ASP 730.A N LYS 742.A O no hydrogen 2.886 N/A LYS 732.A N VAL 739.A O no hydrogen 3.038 N/A LEU 733.A N ASN 133.A OD1 no hydrogen 3.181 N/A ASP 734.A N HIS 737.A O no hydrogen 2.742 N/A HIS 737.A N ASP 734.A O no hydrogen 3.401 N/A TYR 738.A OH ILE 132.A O no hydrogen 2.518 N/A VAL 739.A N LYS 732.A O no hydrogen 2.907 N/A VAL 740.A N TYR 767.A O no hydrogen 2.838 N/A ALA 741.A N ASP 730.A O no hydrogen 2.729 N/A LYS 742.A N ASP 730.A O no hydrogen 3.454 N/A TYR 744.A N ALA 728.A O no hydrogen 3.040 N/A TYR 744.A OH ASP 730.A OD1 no hydrogen 2.481 N/A GLY 746.A N GLU 753.A O no hydrogen 2.623 N/A ASP 747.A N GLU 753.A OE1 no hydrogen 2.799 N/A SER 749.A N ASP 747.A OD1 no hydrogen 2.827 N/A ASN 750.A N ASP 747.A O no hydrogen 3.008 N/A ASN 750.A ND2 GLU 753.A OE1 no hydrogen 3.422 N/A ASN 750.A ND2 GLU 753.A OE2 no hydrogen 3.140 N/A LYS 754.A NZ TYR 748.A O no hydrogen 3.092 N/A SER 755.A N TYR 744.A O no hydrogen 2.898 N/A SER 755.A OG ILE 727.A O no hydrogen 2.891 N/A ILE 757.A N SER 755.A OG no hydrogen 3.285 N/A PHE 758.A N SER 755.A O no hydrogen 3.068 N/A GLU 759.A N PRO 756.A O no hydrogen 3.437 N/A TYR 760.A N ILE 757.A O no hydrogen 3.001 N/A TYR 760.A OH MET 810.A O no hydrogen 2.917 N/A GLY 761.A N PHE 758.A O no hydrogen 3.065 N/A THR 765.A N ASP 763.A OD2 no hydrogen 2.963 N/A THR 765.A OG1 ASP 763.A OD2 no hydrogen 2.759 N/A GLY 766.A N VAL 740.A O no hydrogen 2.959 N/A TYR 767.A N PRO 764.A O no hydrogen 2.903 N/A TYR 767.A OH ASP 805.A OD1 no hydrogen 2.553 N/A LEU 768.A N SER 800.A O no hydrogen 2.792 N/A ILE 769.A N TYR 738.A O no hydrogen 2.945 N/A GLU 770.A N ARG 798.A O no hydrogen 2.929 N/A ILE 772.A N GLU 775.A O no hydrogen 2.912 N/A ASP 773.A N ARG 796.A O no hydrogen 2.773 N/A GLU 775.A N ILE 772.A O no hydrogen 2.926 N/A VAL 777.A N GLU 770.A O no hydrogen 3.460 N/A GLY 778.A N SER 781.A O no hydrogen 2.996 N/A ALA 779.A N ASP 736.A O no hydrogen 3.059 N/A SER 781.A N GLY 778.A O no hydrogen 2.805 N/A SER 781.A OG THR 776.A O no hydrogen 2.716 N/A ILE 783.A N TYR 738.A OH no hydrogen 3.303 N/A ARG 785.A N ASN 782.A OD1 no hydrogen 3.244 N/A VAL 786.A N ASN 782.A O no hydrogen 3.400 N/A LEU 787.A N ILE 783.A O no hydrogen 2.946 N/A SER 788.A N TYR 784.A O no hydrogen 2.967 N/A SER 788.A OG ARG 723.A O no hydrogen 3.087 N/A SER 788.A OG TYR 784.A O no hydrogen 3.065 N/A GLU 789.A N ARG 785.A O no hydrogen 2.991 N/A LYS 790.A N LEU 787.A O no hydrogen 2.773 N/A ALA 791.A N SER 788.A O no hydrogen 3.451 N/A GLY 792.A N ILE 813.A O no hydrogen 2.900 N/A THR 793.A N LYS 790.A O no hydrogen 3.097 N/A THR 793.A OG1 LYS 790.A O no hydrogen 2.829 N/A SER 794.A OG ASP 812.A OD2 no hydrogen 2.792 N/A ALA 795.A N ILE 811.A O no hydrogen 2.941 N/A ILE 797.A N LEU 809.A O no hydrogen 2.703 N/A ARG 798.A N ASP 771.A O no hydrogen 3.047 N/A LEU 799.A N ARG 807.A O no hydrogen 2.731 N/A SER 800.A N LEU 768.A O no hydrogen 2.815 N/A SER 800.A OG GLU 770.A OE1 no hydrogen 2.868 N/A GLY 801.A N ASP 805.A O no hydrogen 2.837 N/A ARG 807.A N LEU 799.A O no hydrogen 2.957 N/A ARG 807.A NE ASP 805.A OD1 no hydrogen 2.971 N/A ARG 807.A NH1 ASP 805.A OD1 no hydrogen 2.702 N/A LEU 809.A N ILE 797.A O no hydrogen 3.022 N/A ILE 811.A N ALA 795.A O no hydrogen 2.786 N/A ILE 813.A N THR 793.A O no hydrogen 2.940 N/A LEU 814.A N ARG 726.A O no hydrogen 2.734 N/A ARG 818.A N ASP 816.A OD1 no hydrogen 3.245 N/A ARG 818.A NH1 ASP 113.A OD2 no hydrogen 2.850 N/A ARG 818.A NH2 ASP 113.A OD2 no hydrogen 3.174 N/A ARG 818.A NH2 GLN 116.A O no hydrogen 3.019 N/A ARG 821.A N ASP 817.A O no hydrogen 3.080 N/A ARG 821.A NE ASP 817.A OD2 no hydrogen 2.982 N/A ARG 821.A NH1 ASP 730.A OD2 no hydrogen 3.132 N/A ARG 821.A NH1 ASP 817.A OD1 no hydrogen 3.448 N/A ARG 821.A NH2 ASP 730.A OD2 no hydrogen 2.842 N/A TYR 822.A N ARG 818.A O no hydrogen 2.852 N/A TYR 822.A OH HIS 845.A ND1 no hydrogen 2.736 N/A ARG 823.A N PHE 819.A O no hydrogen 2.893 N/A ARG 823.A NE GLU 753.A OE2 no hydrogen 2.578 N/A ARG 823.A NH1 GLU 827.A OE2 no hydrogen 2.988 N/A ARG 823.A NH2 GLU 827.A OE2 no hydrogen 3.084 N/A SER 824.A N ILE 820.A O no hydrogen 2.926 N/A TRP 825.A N ARG 821.A O no hydrogen 3.034 N/A VAL 826.A N TYR 822.A O no hydrogen 2.863 N/A GLU 827.A N ARG 823.A O no hydrogen 2.789 N/A ALA 828.A N SER 824.A O no hydrogen 2.942 N/A ASN 829.A N TRP 825.A O no hydrogen 3.012 N/A ARG 830.A N VAL 826.A O no hydrogen 2.885 N/A ARG 830.A NE GLU 864.A OE2 no hydrogen 2.790 N/A ARG 830.A NH1 GLU 864.A OE2 no hydrogen 3.071 N/A ARG 830.A NH2 GLU 827.A OE1 no hydrogen 2.895 N/A ARG 831.A N GLU 827.A O no hydrogen 2.939 N/A TYR 832.A N ALA 828.A O no hydrogen 2.885 N/A TYR 832.A OH ASP 1011.A OD2 no hydrogen 2.519 N/A VAL 833.A N ASN 829.A O no hydrogen 2.900 N/A HIS 834.A N ARG 830.A O no hydrogen 3.105 N/A HIS 834.A ND1 ILE 841.A O no hydrogen 3.235 N/A GLU 835.A N ARG 831.A O no hydrogen 2.926 N/A ARG 836.A N TYR 832.A O no hydrogen 2.915 N/A ARG 836.A NE ASP 1015.A OD2 no hydrogen 3.404 N/A ARG 836.A NH1 ASP 1015.A OD1 no hydrogen 3.110 N/A ARG 836.A NH1 ASP 1015.A OD2 no hydrogen 3.337 N/A SER 837.A N VAL 833.A O no hydrogen 2.988 N/A SER 837.A OG VAL 833.A O no hydrogen 2.720 N/A SER 837.A OG HIS 834.A O no hydrogen 3.298 N/A LYS 838.A N GLU 835.A O no hydrogen 3.077 N/A GLY 839.A N HIS 834.A O no hydrogen 2.705 N/A THR 840.A N SER 837.A O no hydrogen 3.359 N/A THR 840.A N SER 837.A OG no hydrogen 3.311 N/A THR 840.A OG1 SER 837.A O no hydrogen 2.638 N/A ILE 841.A N SER 837.A OG no hydrogen 2.944 N/A GLY 842.A N GLY 869.A O no hydrogen 2.963 N/A TYR 843.A N GLU 864.A OE1 no hydrogen 2.934 N/A TYR 843.A OH ASP 873.A OD1 no hydrogen 2.691 N/A ILE 844.A N ILE 871.A O no hydrogen 2.976 N/A HIS 845.A ND1 TYR 822.A OH no hydrogen 2.736 N/A HIS 845.A NE2 ARG 875.A O no hydrogen 2.798 N/A ILE 846.A N ASP 873.A O no hydrogen 2.957 N/A MET 849.A N GLY 879.A O no hydrogen 2.552 N/A GLY 850.A N ASP 848.A OD2 no hydrogen 2.678 N/A MET 852.A N TYR 572.A OH no hydrogen 2.865 N/A GLY 853.A N ASP 848.A OD2 no hydrogen 2.798 N/A LEU 854.A N GLY 850.A O no hydrogen 3.139 N/A ASN 855.A N MET 851.A O no hydrogen 2.949 N/A GLU 856.A N MET 852.A O no hydrogen 2.929 N/A PHE 857.A N GLY 853.A O no hydrogen 2.769 N/A TYR 858.A N LEU 854.A O no hydrogen 3.207 N/A ARG 859.A N ASN 855.A O no hydrogen 2.779 N/A ARG 859.A NH2 GLU 856.A OE2 no hydrogen 3.422 N/A PHE 861.A N PHE 857.A O no hydrogen 2.838 N/A ILE 862.A N TYR 858.A O no hydrogen 3.336 N/A ASN 863.A N LEU 860.A O no hydrogen 2.716 N/A ASN 863.A ND2 ARG 859.A O no hydrogen 3.577 N/A GLU 864.A N LEU 860.A O no hydrogen 2.806 N/A SER 865.A N PHE 861.A O no hydrogen 3.323 N/A SER 865.A OG PHE 861.A O no hydrogen 3.130 N/A GLY 869.A N THR 840.A O no hydrogen 3.023 N/A LEU 870.A N LYS 916.A O no hydrogen 2.791 N/A ILE 871.A N GLY 842.A O no hydrogen 2.941 N/A VAL 872.A N ILE 918.A O no hydrogen 2.755 N/A ASP 873.A N ILE 844.A O no hydrogen 2.821 N/A VAL 874.A N ILE 920.A O no hydrogen 2.673 N/A ARG 875.A N ASP 873.A OD2 no hydrogen 3.068 N/A ARG 875.A NE ASP 873.A OD1 no hydrogen 3.354 N/A ARG 875.A NE ASP 873.A OD2 no hydrogen 3.009 N/A ARG 875.A NH1 ASP 873.A OD1 no hydrogen 2.978 N/A ARG 875.A NH1 ASP 1007.A OD2 no hydrogen 3.159 N/A ARG 875.A NH2 ASP 1007.A OD1 no hydrogen 3.209 N/A ARG 875.A NH2 ASP 1007.A OD2 no hydrogen 2.899 N/A PHE 876.A N ASN 922.A OD1 no hydrogen 3.199 N/A ASN 877.A N VAL 874.A O no hydrogen 2.988 N/A ASN 877.A ND2 ILE 846.A O no hydrogen 2.934 N/A GLY 878.A N PRO 847.A O no hydrogen 2.999 N/A GLY 879.A N ASN 877.A OD1 no hydrogen 2.959 N/A PHE 881.A N MET 849.A O no hydrogen 2.695 N/A VAL 882.A N MET 849.A O no hydrogen 2.916 N/A SER 883.A N ASP 928.A OD2 no hydrogen 2.758 N/A SER 883.A OG ASP 928.A OD1 no hydrogen 2.725 N/A LEU 885.A N VAL 882.A O no hydrogen 2.885 N/A ILE 886.A N VAL 882.A O no hydrogen 3.203 N/A ILE 887.A N SER 883.A O no hydrogen 2.898 N/A GLU 888.A N GLN 884.A O no hydrogen 3.070 N/A LYS 889.A N LEU 885.A O no hydrogen 3.405 N/A LEU 890.A N ILE 886.A O no hydrogen 3.016 N/A MET 891.A N ILE 887.A O no hydrogen 2.766 N/A ASN 892.A N LYS 889.A O no hydrogen 3.137 N/A ARG 894.A NE SER 912.A OG no hydrogen 3.070 N/A ARG 894.A NH1 SER 866.A OG no hydrogen 3.042 N/A ARG 894.A NH1 SER 912.A O no hydrogen 2.864 N/A ILE 895.A N TYR 908.A O no hydrogen 2.947 N/A GLY 896.A N TYR 908.A O no hydrogen 3.268 N/A ASP 898.A N SER 906.A O no hydrogen 2.858 N/A SER 906.A N ASP 898.A O no hydrogen 3.279 N/A TYR 908.A N GLY 896.A O no hydrogen 2.932 N/A SER 912.A OG PRO 909.A O no hydrogen 2.732 N/A ARG 914.A N SER 865.A O no hydrogen 2.912 N/A ARG 914.A NH2 SER 866.A O no hydrogen 2.985 N/A LYS 916.A N GLN 868.A O no hydrogen 3.167 N/A ILE 918.A N LEU 870.A O no hydrogen 2.915 N/A ALA 919.A N LYS 943.A O no hydrogen 2.889 N/A ILE 920.A N VAL 872.A O no hydrogen 2.979 N/A THR 921.A N ILE 945.A O no hydrogen 2.870 N/A THR 921.A OG1 SER 933.A OG no hydrogen 3.111 N/A GLU 923.A N GLU 923.A OE2 no hydrogen 2.628 N/A TYR 924.A N ASN 922.A OD1 no hydrogen 2.702 N/A ALA 925.A N ASN 922.A O no hydrogen 3.188 N/A GLY 926.A N ASN 877.A O no hydrogen 3.115 N/A SER 927.A N ASP 930.A OD2 no hydrogen 2.565 N/A SER 927.A OG HIS 708.A NE2 no hydrogen 2.834 N/A SER 927.A OG GLY 952.A O no hydrogen 3.492 N/A GLY 929.A N GLY 926.A O no hydrogen 2.820 N/A ASP 930.A N SER 927.A O no hydrogen 2.742 N/A ILE 931.A N SER 927.A O no hydrogen 3.038 N/A PHE 932.A N ASP 928.A O no hydrogen 3.103 N/A SER 933.A N GLY 929.A O no hydrogen 3.123 N/A SER 933.A OG THR 921.A OG1 no hydrogen 3.111 N/A SER 933.A OG GLY 929.A O no hydrogen 2.952 N/A PHE 934.A N ASP 930.A O no hydrogen 2.931 N/A SER 935.A N ILE 931.A O no hydrogen 3.005 N/A SER 935.A OG ILE 931.A O no hydrogen 2.707 N/A PHE 936.A N PHE 932.A O no hydrogen 2.888 N/A LYS 937.A N SER 933.A O no hydrogen 3.496 N/A LYS 937.A NZ ASP 990.A O no hydrogen 2.762 N/A LYS 938.A N PHE 934.A O no hydrogen 2.873 N/A LYS 938.A NZ ARG 978.A O no hydrogen 3.032 N/A LYS 938.A NZ ASP 979.A OD1 no hydrogen 2.786 N/A LEU 939.A N SER 935.A O no hydrogen 2.745 N/A GLY 940.A N LYS 937.A O no hydrogen 2.846 N/A LEU 941.A N PHE 936.A O no hydrogen 3.062 N/A LEU 944.A N ASP 992.A OD2 no hydrogen 2.805 N/A ILE 945.A N ALA 919.A O no hydrogen 2.783 N/A GLY 946.A N VAL 993.A O no hydrogen 3.254 N/A THR 947.A N THR 921.A O no hydrogen 3.136 N/A THR 947.A OG1 GLU 923.A OE2 no hydrogen 2.741 N/A ARG 948.A NH2 ARG 168.A O no hydrogen 3.197 N/A ARG 948.A NH2 TYR 987.A O no hydrogen 2.772 N/A THR 949.A N VAL 989.A O no hydrogen 3.298 N/A THR 949.A OG1 ASP 930.A OD1 no hydrogen 2.496 N/A TRP 950.A N ALA 925.A O no hydrogen 2.888 N/A GLY 951.A N ASP 930.A OD1 no hydrogen 2.839 N/A GLY 952.A N ASP 930.A OD2 no hydrogen 2.927 N/A VAL 953.A N GLU 985.A OE2 no hydrogen 2.999 N/A GLY 955.A N PHE 973.A O no hydrogen 2.683 N/A THR 957.A OG1 ILE 956.A O no hydrogen 2.895 N/A ARG 960.A NH1 ASP 347.A OD1 no hydrogen 2.743 N/A ARG 960.A NH1 VAL 369.A O no hydrogen 2.949 N/A LEU 962.A N THR 966.A O no hydrogen 2.846 N/A GLY 965.A N LEU 962.A O no hydrogen 3.005 N/A THR 966.A N ASP 964.A OD1 no hydrogen 3.124 N/A THR 966.A OG1 ASP 964.A OD1 no hydrogen 2.627 N/A THR 966.A OG1 ASP 964.A OD2 no hydrogen 3.071 N/A VAL 967.A N MET 712.A O no hydrogen 2.630 N/A THR 969.A N TYR 710.A O no hydrogen 2.970 N/A THR 969.A OG1 HIS 708.A O no hydrogen 2.661 N/A GLU 972.A N GLY 955.A O no hydrogen 2.901 N/A PHE 973.A N GLY 955.A O no hydrogen 3.120 N/A PHE 975.A N VAL 953.A O no hydrogen 3.037 N/A PHE 977.A N GLY 981.A O no hydrogen 2.878 N/A ALA 980.A N PHE 977.A O no hydrogen 3.133 N/A GLY 981.A N PHE 977.A O no hydrogen 2.644 N/A GLY 983.A N ALA 980.A O no hydrogen 3.264 N/A GLU 985.A N PHE 982.A O no hydrogen 3.171 N/A ASN 986.A N GLY 951.A O no hydrogen 2.806 N/A TYR 987.A N VAL 984.A O no hydrogen 2.981 N/A TYR 987.A OH ASP 990.A OD1 no hydrogen 2.558 N/A TYR 987.A OH ASP 990.A OD2 no hydrogen 3.406 N/A GLY 988.A N VAL 984.A O no hydrogen 2.760 N/A VAL 989.A N THR 949.A OG1 no hydrogen 2.828 N/A ASP 992.A N LEU 944.A O no hydrogen 2.734 N/A VAL 993.A N LEU 944.A O no hydrogen 3.223 N/A ILE 995.A N GLY 946.A O no hydrogen 2.930 N/A ALA 998.A N ASP 1001.A OD1 no hydrogen 2.797 N/A ASP 1001.A N ALA 998.A O no hydrogen 2.852 N/A TYR 1002.A N ALA 998.A O no hydrogen 3.298 N/A LEU 1003.A N PRO 999.A O no hydrogen 2.941 N/A SER 1004.A N HIS 1000.A O no hydrogen 3.037 N/A SER 1004.A OG HIS 1000.A O no hydrogen 3.371 N/A SER 1004.A OG ASP 1001.A O no hydrogen 3.070 N/A GLY 1005.A N TYR 1002.A O no hydrogen 3.087 N/A LYS 1006.A N ASP 1001.A O no hydrogen 3.067 N/A ILE 1010.A N ASP 1007.A OD1 no hydrogen 2.873 N/A ASP 1011.A N ASP 1007.A O no hydrogen 3.132 N/A TYR 1012.A N PRO 1008.A O no hydrogen 3.036 N/A ALA 1013.A N GLN 1009.A O no hydrogen 3.119 N/A ILE 1014.A N ILE 1010.A O no hydrogen 2.925 N/A ASP 1015.A N ASP 1011.A O no hydrogen 2.862 N/A ALA 1016.A N TYR 1012.A O no hydrogen 2.706 N/A LEU 1017.A N ALA 1013.A O no hydrogen 3.124 N/A ILE 1018.A N ILE 1014.A O no hydrogen 2.949 N/A GLU 1019.A N ASP 1015.A O no hydrogen 3.033 N/A GLU 1020.A N ALA 1016.A O no hydrogen 2.990 N/A LEU 1021.A N LEU 1017.A O no hydrogen 2.718 N/A ARG 1022.A N GLU 1019.A O no hydrogen 2.868 N/A