Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3loy_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): HIS 2.A N ASP 5.A OD2 no hydrogen 3.133 N/A HIS 2.A NE2 GLU 51.A OE2 no hydrogen 2.839 N/A TYR 4.A N HIS 2.A ND1 no hydrogen 3.234 N/A TYR 4.A OH TYR 276.A OH no hydrogen 2.676 N/A ASP 5.A N HIS 2.A O no hydrogen 2.996 N/A SER 8.A N GLU 11.A OE1 no hydrogen 3.043 N/A GLU 11.A N SER 8.A OG no hydrogen 3.027 N/A LEU 12.A N SER 8.A O no hydrogen 2.936 N/A GLN 13.A N ASP 9.A O no hydrogen 2.833 N/A LEU 14.A N ALA 10.A O no hydrogen 2.898 N/A THR 15.A N GLU 11.A O no hydrogen 3.144 N/A THR 15.A OG1 GLU 11.A O no hydrogen 2.637 N/A THR 15.A OG1 THR 64.A OG1 no hydrogen 2.980 N/A SER 16.A N LEU 12.A O no hydrogen 3.191 N/A SER 16.A OG GLN 13.A O no hydrogen 3.169 N/A SER 16.A OG GLY 336.A O no hydrogen 2.536 N/A GLN 17.A N GLN 13.A O no hydrogen 2.713 N/A GLN 17.A NE2 ASP 21.A OD1 no hydrogen 2.790 N/A LEU 18.A N LEU 14.A O no hydrogen 2.867 N/A ILE 19.A N THR 15.A O no hydrogen 3.276 N/A LYS 20.A N SER 16.A O no hydrogen 2.798 N/A LYS 20.A NZ ASN 335.A O no hydrogen 2.816 N/A ASP 21.A N GLN 17.A O no hydrogen 2.872 N/A ALA 22.A N LEU 18.A O no hydrogen 2.905 N/A THR 23.A N LYS 20.A O no hydrogen 2.972 N/A THR 23.A OG1 ILE 19.A O no hydrogen 2.633 N/A LYS 24.A NZ ASP 21.A O no hydrogen 3.065 N/A ARG 28.A NH1 THR 23.A O no hydrogen 2.844 N/A ARG 28.A NH1 GLY 25.A O no hydrogen 3.126 N/A ARG 28.A NH2 LYS 20.A O no hydrogen 3.017 N/A ARG 28.A NH2 THR 23.A O no hydrogen 3.565 N/A HIS 30.A N TYR 69.A O no hydrogen 2.771 N/A HIS 30.A NE2 ASP 104.A OD2 no hydrogen 2.648 N/A PHE 31.A N THR 334.A O no hydrogen 2.906 N/A ILE 32.A N TYR 67.A O no hydrogen 2.855 N/A GLN 33.A N TYR 67.A O no hydrogen 3.242 N/A ARG 36.A N ASP 35.A OD1 no hydrogen 2.828 N/A ARG 36.A NE TYR 4.A O no hydrogen 3.242 N/A ARG 36.A NE ASP 5.A O no hydrogen 2.852 N/A ARG 36.A NH1 ARG 36.A O no hydrogen 2.967 N/A ARG 36.A NH1 ASP 38.A OD1 no hydrogen 2.909 N/A ARG 36.A NH2 TYR 4.A O no hydrogen 2.907 N/A ARG 36.A NH2 TYR 265.A OH no hydrogen 2.918 N/A LEU 37.A N MET 63.A O no hydrogen 2.758 N/A LYS 41.A N ASP 551.A OD1 no hydrogen 3.086 N/A LYS 41.A NZ ASP 443.A OD2 no hydrogen 2.736 N/A LYS 41.A NZ ASN 584.A OD1 no hydrogen 2.709 N/A MET 44.A N PRO 40.A O no hydrogen 2.844 N/A ILE 45.A N LYS 41.A O no hydrogen 2.671 N/A ARG 46.A N LYS 42.A O.A no hydrogen 3.088 N/A ARG 46.A N LYS 42.A O.B no hydrogen 3.344 N/A ARG 46.A NH2 ASP 43.A OD1 no hydrogen 2.731 N/A TYR 47.A N ASP 43.A O no hydrogen 2.720 N/A LEU 48.A N MET 44.A O no hydrogen 2.702 N/A GLU 49.A N ILE 45.A O no hydrogen 2.852 N/A ALA 50.A N ARG 46.A O no hydrogen 2.875 N/A GLU 51.A N TYR 47.A O no hydrogen 2.810 N/A ARG 52.A N LEU 48.A O no hydrogen 2.895 N/A ARG 52.A NH2 GLU 49.A OE1 no hydrogen 3.238 N/A THR 53.A N GLU 49.A O no hydrogen 2.946 N/A THR 53.A OG1 GLU 49.A O no hydrogen 3.079 N/A HIS 59.A NE2 TYR 83.A OH no hydrogen 2.586 N/A ARG 62.A N SER 82.A OG no hydrogen 2.644 N/A ARG 62.A NE GLU 11.A OE2 no hydrogen 2.817 N/A ARG 62.A NH1 PRO 3.A O no hydrogen 3.179 N/A ARG 62.A NH1 ASP 5.A O no hydrogen 2.762 N/A ARG 62.A NH2 ASP 5.A O no hydrogen 3.008 N/A ARG 62.A NH2 PRO 6.A O no hydrogen 3.086 N/A ARG 62.A NH2 GLU 11.A OE1 no hydrogen 2.847 N/A ARG 62.A NH2 GLU 11.A OE2 no hydrogen 3.415 N/A THR 64.A N VAL 79.A O no hydrogen 2.949 N/A THR 64.A OG1 THR 15.A OG1 no hydrogen 2.980 N/A TYR 65.A N ASP 35.A O no hydrogen 3.026 N/A TYR 65.A OH GLN 33.A OE1 no hydrogen 2.537 N/A VAL 66.A N ALA 77.A O no hydrogen 2.897 N/A TYR 67.A N GLN 33.A O no hydrogen 2.843 N/A TYR 67.A OH GLU 559.A OE1 no hydrogen 2.597 N/A TYR 68.A N TYR 75.A O no hydrogen 3.068 N/A TYR 69.A N HIS 30.A O no hydrogen 2.910 N/A ILE 70.A N ASP 73.A O no hydrogen 2.811 N/A ASP 73.A N ILE 70.A O no hydrogen 2.976 N/A TYR 75.A N TYR 68.A O no hydrogen 2.795 N/A LYS 76.A N GLN 90.A O no hydrogen 3.073 N/A LYS 76.A NZ GLU 559.A OE1 no hydrogen 3.060 N/A LYS 76.A NZ GLU 559.A OE2 no hydrogen 2.849 N/A ALA 77.A N VAL 66.A O no hydrogen 2.922 N/A LEU 78.A N THR 88.A O no hydrogen 2.820 N/A VAL 79.A N THR 64.A O no hydrogen 2.864 N/A ASN 80.A N HIS 85.A O no hydrogen 2.810 N/A ASN 80.A ND2 SER 61.A OG no hydrogen 2.956 N/A VAL 81.A N ARG 62.A O no hydrogen 2.827 N/A SER 82.A N ARG 62.A O no hydrogen 3.304 N/A TYR 83.A N ASN 80.A OD1 no hydrogen 2.921 N/A TYR 83.A OH HIS 59.A NE2 no hydrogen 2.586 N/A GLY 84.A N ASN 80.A O no hydrogen 2.784 N/A HIS 85.A N ASN 80.A O no hydrogen 3.098 N/A ILE 87.A N LEU 78.A O no hydrogen 2.777 N/A THR 88.A N LEU 78.A O no hydrogen 3.396 N/A ASN 89.A ND2 TYR 68.A OH no hydrogen 2.514 N/A GLN 90.A N LYS 76.A O no hydrogen 2.803 N/A GLN 90.A NE2 LYS 91.A O no hydrogen 2.801 N/A GLN 92.A N PHE 74.A O no hydrogen 2.802 N/A VAL 96.A N PRO 93.A O no hydrogen 2.999 N/A GLY 98.A N TYR 69.A OH no hydrogen 2.996 N/A LEU 100.A N ASP 304.A O no hydrogen 2.822 N/A ILE 105.A N ILE 101.A O no hydrogen 2.979 N/A GLN 106.A N ALA 102.A O no hydrogen 2.830 N/A GLU 107.A N GLU 103.A O no hydrogen 3.219 N/A ILE 108.A N ASP 104.A O no hydrogen 3.063 N/A GLU 109.A N ILE 105.A O no hydrogen 2.756 N/A GLU 110.A N GLN 106.A O no hydrogen 2.985 N/A LEU 111.A N GLU 107.A O no hydrogen 3.186 N/A ALA 112.A N ILE 108.A O no hydrogen 2.838 N/A THR 113.A N GLU 110.A O no hydrogen 3.324 N/A THR 113.A OG1 GLU 110.A O no hydrogen 3.420 N/A THR 114.A N LEU 111.A O no hydrogen 3.069 N/A THR 114.A OG1 GLU 110.A O no hydrogen 3.211 N/A HIS 115.A N LEU 111.A O no hydrogen 2.823 N/A ILE 117.A N HIS 115.A ND1 no hydrogen 3.047 N/A VAL 118.A N HIS 115.A O no hydrogen 2.969 N/A LYS 119.A N HIS 115.A O no hydrogen 2.823 N/A ALA 120.A N PRO 116.A O no hydrogen 3.018 N/A ILE 122.A N VAL 118.A O no hydrogen 2.931 N/A GLU 123.A N LYS 119.A O no hydrogen 2.952 N/A LYS 124.A N ALA 120.A O no hydrogen 3.392 N/A LYS 124.A NZ GLU 121.A OE2 no hydrogen 2.941 N/A LEU 125.A N ILE 122.A O no hydrogen 2.939 N/A LYS 126.A N GLU 123.A O no hydrogen 3.113 N/A LYS 126.A NZ GLU 123.A OE2 no hydrogen 2.973 N/A HIS 130.A N HIS 130.A ND1 no hydrogen 2.907 N/A ARG 132.A N ALA 158.A O no hydrogen 2.912 N/A ARG 132.A NE SER 159.A O no hydrogen 2.892 N/A ARG 132.A NH2 HIS 162.A O no hydrogen 2.779 N/A VAL 134.A N TYR 156.A O no hydrogen 2.811 N/A CYS 135.A SG TYR 154.A O no hydrogen 3.782 N/A ASP 136.A N TYR 154.A O no hydrogen 2.837 N/A TRP 138.A N GLN 152.A O no hydrogen 2.737 N/A THR 142.A OG1 SER 564.A O no hydrogen 2.938 N/A SER 144.A OG ASP 143.A OD1 no hydrogen 3.330 N/A ARG 148.A N GLU 146.A OE2 no hydrogen 2.997 N/A ARG 148.A NE GLU 146.A OE2 no hydrogen 2.651 N/A ARG 148.A NH2 GLU 146.A OE1 no hydrogen 3.071 N/A ARG 148.A NH2 GLU 146.A OE2 no hydrogen 3.495 N/A LEU 150.A N GLN 563.A OE1 no hydrogen 2.857 N/A ILE 151.A N PHE 178.A O no hydrogen 2.867 N/A GLN 152.A N TRP 138.A O no hydrogen 2.915 N/A GLN 152.A NE2 SER 175.A OG no hydrogen 2.783 N/A GLN 152.A NE2 ASP 189.A OD2 no hydrogen 2.971 N/A CYS 153.A N PRO 176.A O no hydrogen 2.943 N/A TYR 154.A N ASP 136.A O no hydrogen 2.966 N/A TYR 156.A N VAL 134.A O no hydrogen 2.800 N/A TYR 156.A OH THR 410.A O no hydrogen 3.111 N/A LEU 157.A N LEU 170.A O no hydrogen 2.849 N/A ALA 158.A N ARG 132.A O no hydrogen 2.895 N/A SER 159.A N SER 165.A OG no hydrogen 2.820 N/A ALA 160.A N HIS 130.A O no hydrogen 2.853 N/A ALA 161.A N SER 159.A OG no hydrogen 3.390 N/A HIS 162.A NE2 ASP 216.A OD2 no hydrogen 2.648 N/A GLU 164.A N HIS 162.A ND1 no hydrogen 2.911 N/A SER 165.A N HIS 162.A O no hydrogen 3.252 N/A SER 165.A OG GLU 212.A OE1 no hydrogen 2.625 N/A SER 165.A OG GLU 212.A OE2 no hydrogen 3.446 N/A ASN 166.A N GLU 212.A OE2 no hydrogen 2.631 N/A ASN 166.A ND2 VAL 211.A O no hydrogen 2.990 N/A HIS 167.A NE2 ASP 136.A OD1 no hydrogen 2.835 N/A TYR 168.A N ASN 166.A OD1 no hydrogen 3.193 N/A TYR 168.A OH ASP 136.A OD1 no hydrogen 3.300 N/A TYR 168.A OH ASP 136.A OD2 no hydrogen 2.452 N/A SER 169.A N ASN 166.A O no hydrogen 3.022 N/A SER 169.A OG ASN 166.A O no hydrogen 2.728 N/A LEU 170.A N HIS 167.A O no hydrogen 3.071 N/A LEU 172.A N MET 155.A O no hydrogen 2.887 N/A LYS 173.A NZ ASP 414.A OD1 no hydrogen 3.562 N/A LYS 173.A NZ ASP 414.A OD2 no hydrogen 2.874 N/A SER 175.A N ASP 189.A O no hydrogen 2.782 N/A SER 175.A OG CYS 153.A O no hydrogen 2.671 N/A VAL 177.A N ARG 187.A O no hydrogen 2.729 N/A PHE 178.A N ILE 151.A O no hydrogen 3.071 N/A GLU 179.A N LYS 184.A O no hydrogen 2.799 N/A CYS 180.A N MET 149.A O no hydrogen 2.864 N/A LYS 183.A N GLU 179.A O no hydrogen 2.910 N/A LYS 184.A N THR 182.A OG1 no hydrogen 3.123 N/A VAL 186.A N VAL 177.A O no hydrogen 2.729 N/A ARG 187.A N VAL 177.A O no hydrogen 3.331 N/A ARG 187.A NE ASP 189.A OD1 no hydrogen 2.825 N/A ARG 187.A NH2 ASP 189.A OD2 no hydrogen 2.799 N/A ASP 189.A N SER 175.A O no hydrogen 2.803 N/A TYR 190.A OH GLU 121.A OE1 no hydrogen 3.090 N/A LEU 191.A N LYS 173.A O no hydrogen 2.726 N/A GLU 197.A N GLU 197.A OE2 no hydrogen 2.693 N/A THR 198.A N ASP 196.A OD2 no hydrogen 3.158 N/A THR 198.A OG1 ASP 196.A OD2 no hydrogen 3.343 N/A THR 200.A OG1 GLU 201.A O no hydrogen 2.881 N/A THR 202.A OG1 GLU 121.A OE1 no hydrogen 2.526 N/A TRP 205.A N LEU 125.A O no hydrogen 2.749 N/A PHE 210.A N PHE 208.A O no hydrogen 2.974 N/A VAL 211.A N SER 169.A OG no hydrogen 2.908 N/A ASP 216.A N HIS 214.A ND1 no hydrogen 3.040 N/A LEU 217.A N HIS 214.A O no hydrogen 2.847 N/A ASN 218.A N HIS 214.A O no hydrogen 2.889 N/A ASN 218.A ND2 TYR 213.A O no hydrogen 2.886 N/A GLU 220.A N ASN 218.A OD1 no hydrogen 2.924 N/A GLN 232.A NE2 GLU 349.A OE2 no hydrogen 2.938 N/A GLY 235.A N GLN 232.A O no hydrogen 2.882 N/A SER 237.A N GLU 349.A OE2 no hydrogen 2.632 N/A SER 237.A OG GLU 349.A OE1 no hydrogen 3.285 N/A SER 237.A OG GLU 349.A OE2 no hydrogen 3.002 N/A ASN 239.A N SER 246.A O no hydrogen 2.884 N/A ASP 241.A N LYS 244.A O no hydrogen 2.737 N/A LYS 244.A N ASP 241.A O no hydrogen 3.081 N/A ILE 245.A N PHE 252.A O no hydrogen 2.694 N/A SER 246.A N ASN 239.A O no hydrogen 2.995 N/A SER 246.A OG GLU 251.A OE2 no hydrogen 3.382 N/A TRP 247.A N TRP 250.A O no hydrogen 3.133 N/A TRP 247.A NE1 GLU 349.A OE1 no hydrogen 2.907 N/A GLN 248.A NE2 GLN 394.A OE1 no hydrogen 2.858 N/A TRP 250.A N TRP 247.A O no hydrogen 2.754 N/A TRP 250.A NE1 ASP 393.A O no hydrogen 2.781 N/A GLU 251.A N HIS 268.A O no hydrogen 3.102 N/A PHE 252.A N ILE 245.A O no hydrogen 3.153 N/A PHE 253.A N TYR 265.A O no hydrogen 2.905 N/A VAL 254.A N HIS 243.A O no hydrogen 2.917 N/A ILE 255.A N ALA 263.A O no hydrogen 2.907 N/A THR 257.A N GLY 261.A O no hydrogen 3.157 N/A THR 257.A OG1 GLU 260.A OE1 no hydrogen 2.952 N/A VAL 258.A N ASP 35.A OD2 no hydrogen 2.853 N/A ARG 259.A NH1 GLU 559.A O no hydrogen 2.683 N/A ARG 259.A NH2 GLY 558.A O no hydrogen 2.829 N/A ARG 259.A NH2 GLU 559.A O no hydrogen 2.973 N/A GLU 260.A N THR 257.A OG1 no hydrogen 3.141 N/A GLY 261.A N THR 257.A O no hydrogen 2.965 N/A ALA 263.A N ILE 255.A O no hydrogen 2.852 N/A ILE 264.A N LEU 278.A O no hydrogen 3.064 N/A TYR 265.A N PHE 253.A O no hydrogen 2.878 N/A TYR 265.A OH ASP 38.A OD1 no hydrogen 2.651 N/A ASP 266.A N TYR 276.A O no hydrogen 2.669 N/A ILE 267.A N VAL 275.A O no hydrogen 2.898 N/A HIS 268.A N GLU 251.A O no hydrogen 2.995 N/A HIS 268.A ND1 ASP 266.A O no hydrogen 2.898 N/A PHE 269.A N ARG 272.A O no hydrogen 2.817 N/A LYS 270.A N GLY 249.A O no hydrogen 2.881 N/A LYS 270.A NZ PRO 624.A O no hydrogen 3.544 N/A LYS 270.A NZ SER 627.A OG no hydrogen 2.700 N/A ARG 272.A N PHE 269.A O no hydrogen 2.900 N/A ARG 272.A NE ASP 447.A OD1 no hydrogen 2.815 N/A ARG 272.A NH1 PHE 619.A O no hydrogen 3.084 N/A ARG 272.A NH2 ASP 447.A OD2 no hydrogen 2.966 N/A ARG 272.A NH2 PHE 619.A O no hydrogen 2.853 N/A SER 273.A OG ALA 445.A O no hydrogen 2.640 N/A VAL 274.A N ILE 267.A O no hydrogen 2.861 N/A VAL 275.A N ILE 267.A O no hydrogen 3.426 N/A TYR 276.A N ASP 443.A O no hydrogen 2.725 N/A TYR 276.A OH TYR 4.A OH no hydrogen 2.676 N/A ARG 277.A N ASP 443.A O no hydrogen 3.329 N/A ARG 277.A NE TYR 265.A OH no hydrogen 3.463 N/A ARG 277.A NH1 GLU 260.A OE2 no hydrogen 2.808 N/A ARG 277.A NH2 GLU 260.A OE1 no hydrogen 2.964 N/A ARG 277.A NH2 GLU 260.A OE2 no hydrogen 3.297 N/A LEU 278.A N ILE 264.A O no hydrogen 2.823 N/A SER 279.A N ARG 441.A O no hydrogen 3.072 N/A SER 279.A OG GLU 260.A OE2 no hydrogen 3.316 N/A SER 281.A N SER 439.A O no hydrogen 2.761 N/A SER 281.A OG LEU 554.A O no hydrogen 2.703 N/A GLU 282.A N SER 439.A O no hydrogen 3.327 N/A MET 283.A N GLU 282.A OE1 no hydrogen 2.707 N/A THR 284.A N MET 437.A O no hydrogen 2.882 N/A THR 284.A OG1 GLN 298.A OE1 no hydrogen 3.113 N/A THR 284.A OG1 ALA 299.A O no hydrogen 3.081 N/A VAL 285.A N ALA 299.A O no hydrogen 3.051 N/A TYR 287.A N LYS 297.A O no hydrogen 3.012 N/A GLY 288.A N TYR 433.A O no hydrogen 2.750 N/A ARG 291.A N ASP 289.A OD2 no hydrogen 2.955 N/A ARG 291.A NE ASP 289.A OD1 no hydrogen 3.474 N/A ARG 291.A NE ASP 289.A OD2 no hydrogen 2.933 N/A ARG 291.A NH1 GLY 194.A O no hydrogen 2.889 N/A ARG 291.A NH1 ASP 196.A O no hydrogen 2.881 N/A ARG 291.A NH2 ASP 289.A OD1 no hydrogen 2.867 N/A HIS 295.A N ARG 291.A O no hydrogen 2.999 N/A HIS 295.A NE2 ASP 143.A OD2 no hydrogen 2.755 N/A ARG 296.A N PRO 293.A O no hydrogen 2.940 N/A ARG 296.A NE ASP 143.A OD2 no hydrogen 3.315 N/A ARG 296.A NH1 ASN 140.A O no hydrogen 2.776 N/A ARG 296.A NH1 GLN 152.A OE1 no hydrogen 2.763 N/A ARG 296.A NH2 GLN 152.A OE1 no hydrogen 2.844 N/A LYS 297.A N PHE 294.A O no hydrogen 2.841 N/A LYS 297.A NZ SER 409.A OG no hydrogen 2.864 N/A PHE 300.A N ASP 304.A OD2 no hydrogen 2.924 N/A ASP 301.A N MET 283.A O no hydrogen 2.910 N/A LEU 302.A N GLU 282.A OE1 no hydrogen 3.025 N/A GLY 303.A N GLU 282.A OE1 no hydrogen 3.372 N/A GLY 303.A N GLU 282.A OE2 no hydrogen 2.991 N/A ASP 304.A N PHE 300.A O no hydrogen 2.627 N/A CYS 305.A N ASP 301.A O no hydrogen 3.161 N/A GLY 306.A N ASP 301.A O no hydrogen 2.901 N/A PHE 307.A N ARG 259.A O no hydrogen 2.971 N/A GLY 308.A N VAL 258.A O no hydrogen 2.861 N/A ALA 309.A N VAL 258.A O no hydrogen 3.061 N/A THR 310.A OG1 THR 381.A O no hydrogen 3.354 N/A GLY 311.A N GLY 308.A O no hydrogen 3.042 N/A ASN 312.A N ILE 379.A O no hydrogen 2.779 N/A ASN 312.A ND2 THR 381.A OG1 no hydrogen 2.808 N/A SER 313.A OG.C PRO 342.A O no hydrogen 2.594 N/A LEU 314.A N ASN 343.A O no hydrogen 2.799 N/A CYS 318.A SG ALA 315.A O no hydrogen 3.985 N/A LYS 325.A N LEU 347.A O no hydrogen 2.894 N/A MET 327.A N VAL 345.A O no hydrogen 2.896 N/A CYS 329.A N ILE 341.A O no hydrogen 2.980 N/A CYS 329.A SG ARG 330.A O no hydrogen 3.631 N/A ARG 330.A NE ASP 9.A OD1 no hydrogen 2.737 N/A ARG 331.A N VAL 339.A O no hydrogen 2.981 N/A ARG 331.A NH1 GLU 103.A OE1 no hydrogen 2.926 N/A ARG 331.A NH1 GLU 103.A OE2 no hydrogen 3.549 N/A ARG 331.A NH1 VAL 332.A O no hydrogen 3.196 N/A ARG 331.A NH2 GLU 103.A OE2 no hydrogen 2.974 N/A ASN 333.A N ASP 337.A O no hydrogen 3.114 N/A ASN 333.A ND2 ASP 337.A OD2 no hydrogen 3.383 N/A ASN 335.A ND2.B ASP 337.A OD1 no hydrogen 3.338 N/A ASN 335.A ND2.B ASP 337.A OD2 no hydrogen 3.084 N/A GLY 336.A N ASN 333.A O no hydrogen 2.900 N/A ASP 337.A N ASN 333.A OD1 no hydrogen 2.919 N/A SER 338.A N GLN 13.A OE1 no hydrogen 2.760 N/A SER 338.A OG ASP 9.A OD1 no hydrogen 2.575 N/A VAL 339.A N ARG 331.A O no hydrogen 2.701 N/A ILE 341.A N CYS 329.A O no hydrogen 2.794 N/A ASN 343.A N ASP 328.A OD1 no hydrogen 2.807 N/A VAL 345.A N MET 327.A O no hydrogen 3.150 N/A CYS 346.A N GLN 377.A O no hydrogen 2.964 N/A LEU 347.A N LYS 325.A O no hydrogen 2.740 N/A HIS 348.A N VAL 375.A O no hydrogen 3.142 N/A HIS 348.A ND1 GLU 349.A O no hydrogen 3.049 N/A GLN 350.A N GLU 373.A O no hydrogen 2.825 N/A GLY 352.A N ARG 371.A O no hydrogen 2.756 N/A GLY 353.A N ASP 351.A OD2 no hydrogen 2.867 N/A LEU 355.A N ALA 369.A O no hydrogen 2.835 N/A TYR 356.A N ALA 369.A O no hydrogen 3.495 N/A HIS 358.A N VAL 367.A O no hydrogen 2.956 N/A ASN 360.A N VAL 365.A O no hydrogen 3.301 N/A ARG 362.A N ASN 360.A OD1 no hydrogen 2.890 N/A ARG 362.A NH1 ASN 360.A OD1 no hydrogen 3.238 N/A THR 363.A N ASN 360.A O no hydrogen 3.226 N/A ASN 364.A N ASN 360.A O no hydrogen 2.651 N/A VAL 365.A N THR 363.A OG1 no hydrogen 3.343 N/A VAL 367.A N HIS 358.A O no hydrogen 2.826 N/A ILE 368.A N GLN 630.A OE1 no hydrogen 2.919 N/A ALA 369.A N TYR 356.A O no hydrogen 3.171 N/A ARG 370.A NE ASP 351.A OD1 no hydrogen 2.900 N/A ARG 370.A NH2 ASP 351.A OD2 no hydrogen 2.825 N/A ARG 371.A N GLY 353.A O no hydrogen 2.643 N/A ARG 371.A NE ASP 393.A OD2 no hydrogen 3.204 N/A ARG 371.A NH1 ASP 393.A OD2 no hydrogen 3.057 N/A ARG 372.A NH1 GLU 349.A OE1 no hydrogen 2.908 N/A ARG 372.A NH1 GLU 349.A OE2 no hydrogen 3.541 N/A GLU 373.A N GLN 350.A O no hydrogen 2.858 N/A PHE 374.A N PHE 392.A O no hydrogen 2.937 N/A VAL 375.A N HIS 348.A O no hydrogen 2.629 N/A VAL 376.A N ILE 390.A O no hydrogen 2.847 N/A GLN 377.A N CYS 346.A O no hydrogen 2.968 N/A THR 378.A N LEU 388.A O no hydrogen 2.893 N/A THR 378.A OG1 THR 344.A O no hydrogen 2.547 N/A ALA 380.A N TYR 386.A O no hydrogen 3.029 N/A THR 381.A N THR 310.A O no hydrogen 3.098 N/A THR 381.A OG1 GLU 385.A OE1 no hydrogen 2.657 N/A GLU 385.A N THR 405.A O no hydrogen 2.932 N/A TYR 386.A N ALA 380.A O no hydrogen 2.988 N/A TYR 386.A OH HIS 436.A ND1 no hydrogen 2.894 N/A MET 387.A N ARG 403.A O no hydrogen 2.811 N/A LEU 388.A N THR 378.A O no hydrogen 2.819 N/A ASN 389.A N HIS 401.A O no hydrogen 2.881 N/A ASN 389.A ND2 GLN 377.A OE1 no hydrogen 3.601 N/A ASN 389.A ND2 HIS 401.A O no hydrogen 3.200 N/A ILE 390.A N VAL 376.A O no hydrogen 2.906 N/A ILE 391.A N ARG 399.A O no hydrogen 2.842 N/A PHE 392.A N PHE 374.A O no hydrogen 2.929 N/A ASP 393.A N GLU 397.A O no hydrogen 3.077 N/A GLN 394.A NE2 ARG 370.A O no hydrogen 3.321 N/A ALA 395.A N ASP 393.A OD1 no hydrogen 2.836 N/A GLY 396.A N ASP 393.A O no hydrogen 3.186 N/A GLU 397.A N ASP 393.A OD1 no hydrogen 3.050 N/A ILE 398.A N LEU 614.A O no hydrogen 2.925 N/A ARG 399.A N ILE 391.A O no hydrogen 2.708 N/A ARG 399.A NH1 GLU 373.A OE2 no hydrogen 2.857 N/A ARG 399.A NH2 GLU 373.A OE2 no hydrogen 2.492 N/A ILE 400.A N ILE 612.A O no hydrogen 2.653 N/A HIS 401.A N ASN 389.A O no hydrogen 2.945 N/A HIS 401.A ND1 GLU 611.A OE2 no hydrogen 2.701 N/A VAL 402.A N HIS 610.A O no hydrogen 2.867 N/A ARG 403.A N MET 387.A O no hydrogen 2.874 N/A ARG 403.A NE HIS 401.A NE2 no hydrogen 2.885 N/A ALA 404.A N GLU 608.A O no hydrogen 3.030 N/A THR 405.A N GLU 385.A O no hydrogen 2.961 N/A THR 405.A OG1 MET 605.A O no hydrogen 2.690 N/A GLY 406.A N THR 405.A OG1 no hydrogen 2.705 N/A ILE 407.A N ASN 384.A O no hydrogen 2.852 N/A THR 410.A OG1 TYR 168.A O no hydrogen 2.604 N/A MET 411.A N MET 430.A O no hydrogen 2.729 N/A ASP 414.A N GLY 193.A O no hydrogen 2.770 N/A LYS 415.A NZ ASP 206.A OD2 no hydrogen 2.714 N/A THR 423.A N ALA 431.A O no hydrogen 3.022 N/A THR 423.A OG1 PRO 597.A O no hydrogen 2.673 N/A ASN 424.A ND2 VAL 417.A O no hydrogen 2.851 N/A VAL 425.A N VAL 429.A O no hydrogen 2.929 N/A GLY 426.A N VAL 429.A O no hydrogen 3.227 N/A ARG 428.A NE LEU 413.A O no hydrogen 2.866 N/A ARG 428.A NH1 ASP 206.A OD1 no hydrogen 2.928 N/A ARG 428.A NH1 GLU 207.A OE1 no hydrogen 2.884 N/A VAL 429.A N GLY 426.A O no hydrogen 3.495 N/A MET 430.A N MET 411.A O no hydrogen 2.955 N/A ALA 431.A N THR 423.A O no hydrogen 2.754 N/A TYR 433.A N TRP 421.A O no hydrogen 2.858 N/A HIS 434.A N HIS 595.A O no hydrogen 3.307 N/A HIS 434.A ND1 ALA 432.A O no hydrogen 3.083 N/A HIS 434.A NE2 HIS 436.A NE2 no hydrogen 3.076 N/A GLN 435.A N PRO 286.A O no hydrogen 2.887 N/A HIS 436.A N PHE 593.A O no hydrogen 2.829 N/A HIS 436.A NE2 HIS 434.A NE2 no hydrogen 3.076 N/A MET 437.A N THR 284.A O no hydrogen 2.858 N/A LEU 438.A N LEU 591.A O no hydrogen 2.938 N/A SER 439.A N GLU 282.A O no hydrogen 2.908 N/A PHE 440.A N ALA 589.A O no hydrogen 2.792 N/A ARG 441.A N SER 279.A O no hydrogen 2.913 N/A ARG 441.A NE GLU 553.A O no hydrogen 3.269 N/A ILE 442.A N VAL 587.A O no hydrogen 2.686 N/A ASP 443.A N ARG 277.A O no hydrogen 2.954 N/A ALA 445.A N VAL 274.A O no hydrogen 2.913 N/A VAL 446.A N ASN 451.A OD1 no hydrogen 2.610 N/A ASP 447.A N SER 273.A O no hydrogen 2.704 N/A GLY 448.A N ALA 445.A O no hydrogen 3.346 N/A ASN 451.A N ASP 583.A O no hydrogen 3.063 N/A ASN 451.A ND2 VAL 446.A O no hydrogen 3.361 N/A ASN 451.A ND2 GLY 448.A O no hydrogen 3.600 N/A THR 452.A N ILE 500.A O no hydrogen 2.723 N/A THR 452.A OG1 GLU 502.A OE2 no hydrogen 2.767 N/A VAL 454.A N LYS 498.A O no hydrogen 2.854 N/A PHE 455.A N THR 479.A O no hydrogen 3.099 N/A ASP 456.A N SER 496.A O no hydrogen 2.814 N/A ASP 457.A N GLU 477.A O no hydrogen 2.843 N/A VAL 458.A N THR 493.A O no hydrogen 2.758 N/A ILE 459.A N VAL 475.A O no hydrogen 2.871 N/A MET 461.A N GLY 473.A O no hydrogen 2.889 N/A ASN 464.A N ASN 471.A OD1 no hydrogen 2.824 N/A ASN 468.A N THR 465.A OG1 no hydrogen 2.802 N/A ASN 468.A ND2 GLU 462.A O no hydrogen 2.953 N/A ASN 471.A ND2 ASN 464.A OD1 no hydrogen 3.047 N/A VAL 472.A N ASN 468.A OD1 no hydrogen 3.167 N/A GLY 473.A N ASN 468.A OD1 no hydrogen 2.980 N/A VAL 475.A N ILE 459.A O no hydrogen 2.873 N/A GLU 477.A N ASP 457.A O no hydrogen 2.841 N/A ARG 478.A NE ASP 456.A OD1 no hydrogen 2.824 N/A ARG 478.A NH2 ASP 456.A OD1 no hydrogen 3.438 N/A ARG 478.A NH2 ASP 456.A OD2 no hydrogen 2.791 N/A THR 479.A N PHE 455.A O no hydrogen 3.045 N/A VAL 481.A N VAL 453.A O no hydrogen 2.797 N/A GLY 485.A N VAL 546.A O no hydrogen 3.001 N/A VAL 487.A N VAL 544.A O no hydrogen 2.876 N/A GLN 489.A NE2 ARG 522.A O no hydrogen 2.770 N/A SER 490.A OG THR 493.A OG1 no hydrogen 2.648 N/A THR 493.A N SER 490.A O no hydrogen 3.199 N/A THR 493.A OG1 ASP 457.A OD1 no hydrogen 2.601 N/A THR 493.A OG1 SER 490.A O no hydrogen 3.206 N/A THR 493.A OG1 SER 490.A OG no hydrogen 2.648 N/A ASN 494.A N PRO 491.A O no hydrogen 2.992 N/A ARG 495.A N SER 490.A O no hydrogen 3.187 N/A ARG 495.A NE ASP 457.A OD1 no hydrogen 2.792 N/A ARG 495.A NE ASP 457.A OD2 no hydrogen 3.370 N/A ARG 495.A NH1 GLU 488.A O no hydrogen 2.892 N/A ARG 495.A NH2 ASP 457.A OD1 no hydrogen 3.514 N/A ARG 495.A NH2 ASP 457.A OD2 no hydrogen 2.934 N/A SER 496.A N ASP 456.A O no hydrogen 2.845 N/A TYR 497.A OH GLN 543.A OE1 no hydrogen 2.699 N/A LYS 498.A N VAL 454.A O no hydrogen 2.802 N/A LYS 498.A NZ ASP 456.A OD2 no hydrogen 2.964 N/A LYS 498.A NZ SER 496.A OG no hydrogen 2.838 N/A ILE 499.A N TYR 515.A O no hydrogen 2.829 N/A ILE 500.A N THR 452.A O no hydrogen 2.782 N/A ASN 501.A N VAL 513.A O no hydrogen 3.032 N/A ASN 501.A ND2 ASN 503.A OD1 no hydrogen 2.812 N/A ASN 503.A ND2 ASN 582.A OD1 no hydrogen 3.681 N/A LYS 504.A N ASN 501.A O no hydrogen 3.112 N/A LYS 504.A NZ ASP 447.A O no hydrogen 2.755 N/A ASN 506.A N LYS 511.A O no hydrogen 2.759 N/A ASN 506.A ND2 GLY 618.A O no hydrogen 2.899 N/A ASN 506.A ND2 PHE 620.A O no hydrogen 2.652 N/A ILE 508.A N ASN 506.A OD1 no hydrogen 2.738 N/A SER 509.A N ASN 506.A OD1 no hydrogen 3.099 N/A LYS 510.A N ASN 506.A O no hydrogen 2.974 N/A LYS 511.A N SER 509.A OG no hydrogen 3.332 N/A VAL 513.A N LYS 504.A O no hydrogen 2.935 N/A TYR 515.A N ILE 499.A O no hydrogen 2.851 N/A TYR 515.A OH GLY 396.A O no hydrogen 2.768 N/A LYS 516.A N VAL 615.A O no hydrogen 2.702 N/A ILE 517.A N TYR 497.A O no hydrogen 2.842 N/A MET 518.A N ALA 613.A O no hydrogen 2.824 N/A ARG 522.A N GLN 489.A OE1 no hydrogen 2.924 N/A ARG 522.A NH1 GLY 592.A O no hydrogen 2.778 N/A ARG 522.A NH1 HIS 610.A ND1 no hydrogen 3.038 N/A ARG 522.A NH2 HIS 610.A ND1 no hydrogen 3.270 N/A GLN 523.A NE2 THR 594.A OG1 no hydrogen 2.613 N/A LEU 525.A N ALA 540.A O no hydrogen 2.845 N/A ASP 530.A N ASP 528.A OD2 no hydrogen 2.940 N/A SER 531.A N GLU 529.A O no hydrogen 3.068 N/A SER 531.A OG ASP 528.A O no hydrogen 2.659 N/A TYR 532.A OH GLN 565.A OE1 no hydrogen 2.840 N/A ASN 534.A N SER 531.A OG no hydrogen 3.137 N/A LYS 535.A N SER 531.A O no hydrogen 3.108 N/A LYS 535.A NZ GLU 529.A O no hydrogen 3.417 N/A ARG 536.A N TYR 532.A O no hydrogen 2.900 N/A ARG 536.A NE SER 564.A OG no hydrogen 2.900 N/A ARG 536.A NH2 THR 561.A O no hydrogen 2.723 N/A ALA 537.A N ASN 534.A O no hydrogen 3.212 N/A GLN 538.A N ASP 567.A OD2 no hydrogen 2.749 N/A ALA 540.A N ALA 537.A O no hydrogen 3.151 N/A THR 541.A N GLN 538.A O no hydrogen 2.970 N/A THR 541.A OG1 GLN 538.A O no hydrogen 2.674 N/A GLN 543.A NE2 PRO 520.A O no hydrogen 2.765 N/A TRP 545.A N TRP 588.A O no hydrogen 2.933 N/A TRP 545.A NE1 PHE 539.A O no hydrogen 3.149 N/A TRP 545.A NE1 GLN 542.A O no hydrogen 3.082 N/A VAL 546.A N GLY 485.A O no hydrogen 2.833 N/A THR 547.A N VAL 586.A O no hydrogen 2.993 N/A TYR 549.A N ASN 584.A O no hydrogen 2.909 N/A TYR 549.A OH ASP 551.A OD1 no hydrogen 2.732 N/A GLU 553.A N ARG 550.A O no hydrogen 3.328 N/A ALA 556.A N SER 281.A OG no hydrogen 2.868 N/A GLY 558.A N TYR 555.A O no hydrogen 2.933 N/A THR 561.A OG1 ASP 304.A OD1 no hydrogen 2.721 N/A ASN 562.A ND2 GLY 98.A O no hydrogen 2.853 N/A GLN 563.A NE2 ARG 148.A O no hydrogen 3.028 N/A SER 564.A N THR 561.A O no hydrogen 3.010 N/A SER 564.A OG THR 561.A O no hydrogen 3.211 N/A GLN 565.A NE2 SER 144.A O no hydrogen 2.951 N/A ASP 567.A N LYS 535.A O no hydrogen 2.787 N/A THR 568.A N ALA 557.A O no hydrogen 2.969 N/A GLY 569.A N ASP 567.A OD1 no hydrogen 2.708 N/A LEU 570.A N ALA 556.A O no hydrogen 2.745 N/A GLY 571.A N ASP 567.A OD1 no hydrogen 3.031 N/A VAL 572.A N GLY 569.A O no hydrogen 2.868 N/A TRP 573.A N GLY 569.A O no hydrogen 2.914 N/A ALA 574.A N LEU 570.A O no hydrogen 2.937 N/A ARG 575.A N VAL 572.A O no hydrogen 3.090 N/A ARG 576.A N TRP 573.A O no hydrogen 3.504 N/A ARG 576.A NH1 GLU 553.A OE1 no hydrogen 2.959 N/A ARG 576.A NH1 GLU 578.A OE2 no hydrogen 3.569 N/A ARG 576.A NH2 GLU 553.A OE1 no hydrogen 2.997 N/A ARG 576.A NH2 GLU 553.A OE2 no hydrogen 2.528 N/A VAL 580.A N GLU 482.A O no hydrogen 2.778 N/A ARG 581.A N ASN 579.A OD1 no hydrogen 2.843 N/A ARG 581.A NE GLU 482.A OE2 no hydrogen 3.206 N/A ARG 581.A NH1 GLU 502.A OE1 no hydrogen 2.629 N/A ARG 581.A NH1 GLU 502.A OE2 no hydrogen 3.248 N/A ARG 581.A NH2 GLU 482.A OE1 no hydrogen 3.375 N/A ASN 582.A N THR 452.A OG1 no hydrogen 2.825 N/A ASN 582.A ND2 ASN 503.A OD1 no hydrogen 2.690 N/A ASP 583.A N ASN 451.A O no hydrogen 2.954 N/A ASN 584.A ND2 ASP 443.A OD1 no hydrogen 3.015 N/A ASN 584.A ND2 PRO 585.A O no hydrogen 3.304 N/A VAL 586.A N THR 547.A O no hydrogen 2.699 N/A VAL 587.A N ILE 442.A O no hydrogen 2.874 N/A TRP 588.A N TRP 545.A O no hydrogen 2.865 N/A TRP 588.A NE1 THR 547.A OG1 no hydrogen 2.951 N/A ALA 589.A N PHE 440.A O no hydrogen 2.785 N/A THR 590.A N GLN 543.A O no hydrogen 2.828 N/A THR 590.A OG1 PHE 539.A O no hydrogen 2.692 N/A THR 590.A OG1 GLN 542.A O no hydrogen 3.159 N/A LEU 591.A N LEU 438.A O no hydrogen 2.821 N/A PHE 593.A N HIS 436.A O no hydrogen 2.969 N/A THR 594.A OG1 GLN 435.A OE1 no hydrogen 3.112 N/A HIS 595.A N HIS 434.A O no hydrogen 2.734 N/A HIS 595.A NE2 ASP 601.A OD2 no hydrogen 3.091 N/A ARG 598.A N ASP 601.A OD2 no hydrogen 3.062 N/A ARG 598.A NE ASP 601.A OD1 no hydrogen 3.123 N/A GLU 600.A N GLU 600.A OE1 no hydrogen 2.752 N/A ASP 601.A N ARG 598.A O no hydrogen 2.943 N/A PHE 602.A N VAL 599.A O no hydrogen 2.956 N/A MET 605.A N GLY 406.A O no hydrogen 2.809 N/A GLU 608.A N ALA 404.A O no hydrogen 3.074 N/A HIS 610.A N VAL 402.A O no hydrogen 2.903 N/A ILE 612.A N ILE 400.A O no hydrogen 2.861 N/A ALA 613.A N MET 518.A O no hydrogen 2.892 N/A LEU 614.A N ILE 398.A O no hydrogen 2.751 N/A VAL 615.A N LYS 516.A O no hydrogen 2.734 N/A PHE 617.A N ALA 514.A O no hydrogen 2.752 N/A LYS 622.A NZ ASP 621.A OD2 no hydrogen 2.915 N/A ALA 625.A N ASN 623.A OD1 no hydrogen 2.806 N/A LEU 626.A N ASN 623.A O no hydrogen 3.307 N/A SER 627.A OG PRO 624.A O no hydrogen 3.257 N/A VAL 628.A N ALA 625.A O no hydrogen 3.100 N/A GLN 630.A NE2 TYR 356.A OH no hydrogen 2.993 N/A SER 631.A N ILE 368.A O no hydrogen 2.824 N/A