Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3w5o_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): THR 2.A OG1 SER 5.A OG no hydrogen 3.159 N/A THR 2.A OG1 GLN 129.A OE1 no hydrogen 3.498 N/A VAL 3.A N ASP 53.A OD2 no hydrogen 2.949 N/A SER 5.A OG THR 2.A O no hydrogen 2.664 N/A SER 5.A OG THR 2.A OG1 no hydrogen 3.159 N/A HIS 6.A N VAL 3.A O no hydrogen 2.712 N/A HIS 6.A ND1 THR 2.A O no hydrogen 3.048 N/A VAL 7.A N VAL 3.A O no hydrogen 3.024 N/A PHE 9.A N LEU 126.A O no hydrogen 3.023 N/A ASP 11.A N PRO 8.A O no hydrogen 3.008 N/A CYS 13.A N PHE 9.A O no hydrogen 3.131 N/A CYS 13.A SG PHE 9.A O no hydrogen 3.619 N/A SER 14.A N ALA 10.A O no hydrogen 2.966 N/A THR 15.A N ASP 11.A O no hydrogen 3.276 N/A THR 15.A OG1 ASP 11.A O no hydrogen 2.930 N/A LEU 16.A N LEU 12.A O no hydrogen 2.904 N/A GLU 17.A N CYS 13.A O no hydrogen 2.658 N/A ARG 18.A N SER 14.A O no hydrogen 2.696 N/A ILE 19.A N THR 15.A O no hydrogen 2.783 N/A GLN 20.A N LEU 16.A O no hydrogen 2.903 N/A LYS 21.A N GLU 17.A O no hydrogen 3.181 N/A SER 22.A N ILE 19.A O no hydrogen 2.967 N/A SER 22.A OG ARG 18.A O no hydrogen 2.425 N/A SER 22.A OG ILE 19.A O no hydrogen 3.355 N/A LYS 28.A N GLY 24.A O no hydrogen 3.154 N/A LYS 28.A NZ ILE 19.A O no hydrogen 3.301 N/A LYS 28.A NZ GLN 20.A O no hydrogen 3.538 N/A LYS 28.A NZ LEU 179.A O no hydrogen 2.214 N/A ILE 29.A N ARG 25.A O no hydrogen 3.078 N/A ARG 30.A N ALA 26.A O no hydrogen 3.052 N/A ARG 30.A NH1 GLU 34.A OE2 no hydrogen 2.999 N/A HIS 31.A N GLU 27.A O no hydrogen 3.402 N/A ARG 33.A N ILE 29.A O no hydrogen 2.840 N/A GLU 34.A N ARG 30.A O no hydrogen 2.927 N/A PHE 35.A N HIS 31.A O no hydrogen 3.065 N/A LEU 36.A N PHE 32.A O no hydrogen 2.860 N/A ASP 37.A N ARG 33.A O no hydrogen 2.911 N/A SER 38.A N GLU 34.A O no hydrogen 3.285 N/A SER 38.A OG GLU 34.A O no hydrogen 3.268 N/A TRP 39.A N PHE 35.A O no hydrogen 3.169 N/A ARG 40.A N LEU 36.A O no hydrogen 3.020 N/A ARG 40.A NH2 PHE 190.A O no hydrogen 2.841 N/A LYS 41.A N ASP 37.A O no hydrogen 3.034 N/A PHE 42.A N SER 38.A O no hydrogen 3.045 N/A HIS 43.A N TRP 39.A O no hydrogen 2.877 N/A ASP 44.A N ARG 40.A O no hydrogen 3.099 N/A ALA 45.A N LYS 41.A O no hydrogen 2.955 N/A LEU 46.A N PHE 42.A O no hydrogen 2.561 N/A HIS 47.A N HIS 43.A O no hydrogen 2.667 N/A HIS 47.A NE2 ASP 53.A OD2 no hydrogen 2.911 N/A TYR 56.A N SER 54.A OG no hydrogen 3.213 N/A TYR 56.A OH GLU 69.A OE1 no hydrogen 2.698 N/A ALA 58.A N PHE 55.A O no hydrogen 2.828 N/A MET 59.A N PHE 55.A O no hydrogen 2.977 N/A ARG 60.A N TYR 56.A O no hydrogen 2.809 N/A ARG 60.A NE GLU 67.A OE1 no hydrogen 3.223 N/A ARG 60.A NH2 GLU 67.A OE1 no hydrogen 3.397 N/A ARG 60.A NH2 GLU 67.A OE2 no hydrogen 2.693 N/A LEU 61.A N ALA 58.A O no hydrogen 2.814 N/A ILE 62.A N ALA 58.A O no hydrogen 2.761 N/A LEU 63.A N MET 59.A O no hydrogen 2.889 N/A GLN 65.A N GLN 65.A OE1 no hydrogen 2.652 N/A GLN 65.A NE2 GLN 183.A OE1 no hydrogen 3.456 N/A LEU 66.A N LEU 63.A O no hydrogen 2.784 N/A GLU 67.A N PRO 64.A O no hydrogen 3.197 N/A ARG 68.A NE ASN 277.A O no hydrogen 2.746 N/A ARG 68.A NH1 GLN 65.A O no hydrogen 2.914 N/A ARG 68.A NH1 GLU 67.A O no hydrogen 3.110 N/A ARG 68.A NH2 ASN 277.A O no hydrogen 2.667 N/A ARG 70.A N GLU 67.A OE2 no hydrogen 2.749 N/A ARG 70.A NE TYR 73.A OH no hydrogen 2.842 N/A ARG 70.A NH1 ASN 132.A OD1 no hydrogen 2.626 N/A ARG 70.A NH1 ASP 136.A OD1 no hydrogen 3.066 N/A ARG 70.A NH2 ASN 132.A OD1 no hydrogen 3.301 N/A MET 79.A N LYS 76.A O no hydrogen 2.817 N/A LEU 80.A N LYS 76.A O no hydrogen 3.344 N/A ALA 81.A N GLU 77.A O no hydrogen 2.837 N/A LYS 82.A N THR 78.A O no hydrogen 2.825 N/A LEU 83.A N MET 79.A O no hydrogen 2.727 N/A TYR 84.A N LEU 80.A O no hydrogen 2.867 N/A TYR 84.A OH GLN 166.A OE1 no hydrogen 2.720 N/A ILE 85.A N ALA 81.A O no hydrogen 2.837 N/A GLU 86.A N LYS 82.A O no hydrogen 2.956 N/A LEU 87.A N LEU 83.A O no hydrogen 2.784 N/A LEU 88.A N TYR 84.A O no hydrogen 2.778 N/A LEU 90.A N ILE 85.A O no hydrogen 3.192 N/A GLY 94.A N PRO 91.A O no hydrogen 3.010 N/A LEU 98.A N GLY 94.A O no hydrogen 3.055 N/A LYS 99.A N LYS 95.A O no hydrogen 2.771 N/A LEU 100.A N ASP 96.A O no hydrogen 3.191 N/A LEU 101.A N ALA 97.A O no hydrogen 2.954 N/A ASN 102.A N LEU 98.A O no hydrogen 2.966 N/A TYR 103.A N LEU 100.A O no hydrogen 3.373 N/A THR 105.A OG1 ARG 104.A O no hydrogen 2.641 N/A MET 110.A N ASP 107.A OD2 no hydrogen 2.979 N/A ILE 111.A N ASP 107.A O no hydrogen 3.139 N/A ALA 112.A N PHE 108.A O no hydrogen 2.918 N/A TYR 113.A N ALA 109.A O no hydrogen 2.736 N/A PHE 114.A N MET 110.A O no hydrogen 2.947 N/A VAL 115.A N ILE 111.A O no hydrogen 3.155 N/A LEU 116.A N ALA 112.A O no hydrogen 2.832 N/A LYS 117.A N TYR 113.A O no hydrogen 2.599 N/A ARG 119.A N LEU 116.A O no hydrogen 2.933 N/A ARG 119.A NH1 VAL 115.A O no hydrogen 3.323 N/A CYS 120.A N LEU 116.A O no hydrogen 2.609 N/A CYS 120.A SG GLN 122.A OE1 no hydrogen 3.033 N/A CYS 120.A SG SER 161.A O no hydrogen 3.965 N/A SER 125.A N GLN 160.A O no hydrogen 2.839 N/A THR 127.A N GLN 130.A OE1 no hydrogen 2.798 N/A ILE 128.A N VAL 7.A O no hydrogen 2.989 N/A GLN 129.A N ALA 4.A O no hydrogen 3.022 N/A GLN 130.A N THR 127.A OG1 no hydrogen 2.899 N/A VAL 131.A N THR 127.A O no hydrogen 2.981 N/A ASN 132.A N ILE 128.A O no hydrogen 3.063 N/A ASN 132.A ND2 PRO 57.A O no hydrogen 2.854 N/A ASN 132.A ND2 ILE 128.A O no hydrogen 3.370 N/A ASP 133.A N GLN 129.A O no hydrogen 2.653 N/A LEU 134.A N GLN 130.A O no hydrogen 2.667 N/A LEU 135.A N VAL 131.A O no hydrogen 2.815 N/A ASP 136.A N ASN 132.A O no hydrogen 3.010 N/A SER 137.A N ASP 133.A O no hydrogen 3.179 N/A SER 137.A OG SER 153.A OG no hydrogen 3.155 N/A ILE 138.A N LEU 134.A O no hydrogen 3.065 N/A ALA 139.A N LEU 135.A O no hydrogen 2.990 N/A SER 140.A N ASP 136.A O no hydrogen 2.868 N/A ASN 141.A N SER 137.A O no hydrogen 3.029 N/A ASN 141.A ND2 SER 137.A O no hydrogen 2.693 N/A ASN 142.A N ILE 138.A O no hydrogen 3.037 N/A ASN 142.A ND2 ALA 72.A O no hydrogen 3.195 N/A SER 143.A N ALA 139.A O no hydrogen 3.102 N/A SER 143.A OG ALA 139.A O no hydrogen 3.289 N/A ALA 144.A N SER 140.A O no hydrogen 3.240 N/A LYS 145.A N ASN 142.A O no hydrogen 2.917 N/A ARG 146.A N ASN 141.A O no hydrogen 2.829 N/A ILE 150.A N LYS 147.A O no hydrogen 3.122 N/A LYS 151.A N LYS 147.A O no hydrogen 2.947 N/A LYS 152.A N ASP 148.A O no hydrogen 2.943 N/A SER 153.A N LEU 149.A O no hydrogen 3.177 N/A SER 153.A OG SER 137.A OG no hydrogen 3.155 N/A SER 153.A OG LEU 149.A O no hydrogen 2.896 N/A LEU 154.A N ILE 150.A O no hydrogen 2.814 N/A LEU 155.A N LYS 151.A O no hydrogen 2.914 N/A GLN 156.A N LYS 152.A O no hydrogen 3.102 N/A LEU 157.A N SER 153.A O no hydrogen 2.962 N/A ILE 158.A N LEU 154.A O no hydrogen 2.709 N/A THR 159.A N LEU 155.A O no hydrogen 3.063 N/A THR 159.A OG1 LEU 155.A O no hydrogen 2.941 N/A GLN 160.A NE2 THR 159.A OG1 no hydrogen 3.367 N/A SER 161.A N ILE 158.A O no hydrogen 3.177 N/A SER 161.A OG LEU 157.A O no hydrogen 2.706 N/A SER 162.A N GLU 165.A OE2 no hydrogen 2.711 N/A GLU 165.A N SER 162.A OG no hydrogen 3.185 N/A GLN 166.A N SER 162.A O no hydrogen 2.808 N/A GLN 166.A NE2 SER 161.A O no hydrogen 3.366 N/A GLN 166.A NE2 SER 162.A O no hydrogen 3.476 N/A LYS 167.A N ALA 163.A O no hydrogen 2.848 N/A LYS 167.A NZ GLU 17.A OE1 no hydrogen 2.711 N/A LYS 167.A NZ GLN 20.A OE1 no hydrogen 2.812 N/A TRP 168.A N LEU 164.A O no hydrogen 3.097 N/A TRP 168.A NE1 GLU 17.A OE1 no hydrogen 2.995 N/A LEU 169.A N GLU 165.A O no hydrogen 2.894 N/A ILE 170.A N GLN 166.A O no hydrogen 3.030 N/A ARG 171.A N LYS 167.A O no hydrogen 3.229 N/A ARG 171.A NE ASP 107.A OD1 no hydrogen 3.054 N/A ARG 171.A NH1 GLN 20.A OE1 no hydrogen 2.959 N/A ARG 171.A NH1 LEU 177.A O no hydrogen 3.091 N/A ARG 171.A NH2 ASP 107.A OD2 no hydrogen 3.210 N/A MET 172.A N TRP 168.A O no hydrogen 2.722 N/A ILE 173.A N LEU 169.A O no hydrogen 2.893 N/A ILE 173.A N ILE 170.A O no hydrogen 2.986 N/A ILE 174.A N ILE 170.A O no hydrogen 2.828 N/A ASP 176.A N ARG 171.A O no hydrogen 3.029 N/A LYS 178.A N ASP 176.A OD1 no hydrogen 3.137 N/A LYS 178.A NZ ASP 107.A OD1 no hydrogen 3.227 N/A SER 182.A OG THR 185.A OG1 no hydrogen 3.208 N/A THR 185.A N SER 182.A OG no hydrogen 3.025 N/A THR 185.A OG1 SER 182.A OG no hydrogen 3.208 N/A ILE 186.A N SER 182.A O no hydrogen 3.256 N/A PHE 187.A N GLN 183.A O no hydrogen 2.930 N/A SER 188.A N GLN 184.A O no hydrogen 3.170 N/A VAL 189.A N THR 185.A O no hydrogen 3.113 N/A PHE 190.A N ILE 186.A O no hydrogen 2.897 N/A HIS 191.A N PHE 187.A O no hydrogen 2.822 N/A HIS 191.A NE2 ASP 213.A O no hydrogen 3.112 N/A HIS 191.A NE2 VAL 216.A O no hydrogen 2.831 N/A ASP 193.A N HIS 191.A ND1 no hydrogen 2.851 N/A ALA 194.A N HIS 191.A O no hydrogen 3.277 N/A LEU 197.A N ASP 193.A O no hydrogen 3.054 N/A HIS 198.A N ALA 194.A O no hydrogen 2.910 N/A ASN 199.A N ALA 195.A O no hydrogen 2.984 N/A VAL 200.A N LEU 197.A O no hydrogen 3.193 N/A THR 201.A N HIS 198.A O no hydrogen 3.343 N/A THR 201.A OG1 LEU 197.A O no hydrogen 3.007 N/A THR 201.A OG1 THR 201.A O no hydrogen 2.175 N/A THR 202.A N ALA 228.A O no hydrogen 2.730 N/A THR 202.A OG1 ALA 228.A O no hydrogen 3.054 N/A ASP 203.A N THR 201.A O no hydrogen 2.359 N/A GLU 205.A N ASP 203.A OD1 no hydrogen 2.850 N/A VAL 207.A N ASP 203.A O no hydrogen 3.240 N/A CYS 208.A N LEU 204.A O no hydrogen 2.882 N/A CYS 208.A SG LEU 204.A O no hydrogen 3.491 N/A ARG 209.A N GLU 205.A O no hydrogen 2.774 N/A ARG 209.A NH1 GLU 205.A OE1 no hydrogen 2.692 N/A GLN 210.A N LYS 206.A O no hydrogen 2.699 N/A LEU 211.A N VAL 207.A O no hydrogen 3.052 N/A SER 215.A N ASP 213.A OD1 no hydrogen 2.917 N/A SER 215.A OG ASP 213.A OD1 no hydrogen 2.821 N/A SER 215.A OG ASP 213.A OD2 no hydrogen 3.524 N/A VAL 216.A N ASP 213.A O no hydrogen 3.284 N/A LEU 218.A N ASP 193.A OD2 no hydrogen 2.969 N/A PHE 226.A N HIS 265.A ND1 no hydrogen 2.745 N/A SER 227.A N THR 224.A O no hydrogen 3.079 N/A PHE 229.A N GLN 263.A OE1 no hydrogen 3.267 N/A LYS 230.A N ASN 199.A O no hydrogen 2.874 N/A LYS 230.A NZ HIS 198.A ND1 no hydrogen 3.199 N/A LYS 230.A NZ ASN 199.A OD1 no hydrogen 2.938 N/A MET 232.A N TYR 421.A OH no hydrogen 3.176 N/A LEU 233.A N LYS 425.A O no hydrogen 3.076 N/A ALA 235.A N TRP 430.A O no hydrogen 2.931 N/A ALA 237.A N LYS 432.A O no hydrogen 3.264 N/A HIS 241.A N ASP 238.A O no hydrogen 3.331 N/A ASP 245.A N HIS 241.A O no hydrogen 3.358 N/A MET 246.A N ILE 242.A O no hydrogen 2.959 N/A LYS 247.A N LYS 244.A O no hydrogen 2.609 N/A HIS 248.A N GLU 243.A O no hydrogen 2.952 N/A GLN 249.A N MET 246.A O no hydrogen 3.424 N/A SER 250.A OG ALA 391.A O no hydrogen 3.559 N/A PHE 251.A N ALA 391.A O no hydrogen 2.926 N/A TYR 252.A N LYS 415.A O no hydrogen 2.919 N/A ILE 253.A N THR 389.A O no hydrogen 3.028 N/A GLU 254.A N MET 413.A O no hydrogen 2.996 N/A THR 255.A N GLN 387.A O no hydrogen 2.993 N/A GLY 259.A N GLU 314.A OE2 no hydrogen 3.079 N/A GLU 260.A N MET 315.A O no hydrogen 3.124 N/A ARG 261.A NE ASP 312.A OD1 no hydrogen 2.761 N/A ARG 261.A NE ASP 312.A OD2 no hydrogen 3.213 N/A ARG 261.A NH1 MET 232.A O no hydrogen 3.508 N/A ARG 261.A NH2 MET 232.A O no hydrogen 3.122 N/A ARG 261.A NH2 ASP 312.A OD2 no hydrogen 2.499 N/A MET 262.A N GLY 313.A O no hydrogen 2.808 N/A GLN 263.A N PHE 274.A O no hydrogen 2.788 N/A GLN 263.A NE2 PHE 229.A O no hydrogen 2.563 N/A MET 264.A N LEU 311.A O no hydrogen 3.065 N/A HIS 265.A N LYS 272.A O no hydrogen 2.749 N/A HIS 265.A NE2 GLN 263.A OE1 no hydrogen 2.861 N/A LYS 266.A N CYS 309.A O no hydrogen 3.022 N/A LYS 266.A NZ GLY 268.A O no hydrogen 3.024 N/A LYS 266.A NZ TYR 271.A OH no hydrogen 3.360 N/A ASP 267.A N VAL 270.A O no hydrogen 2.886 N/A GLY 268.A N GLN 307.A O no hydrogen 2.910 N/A VAL 270.A N ASP 267.A O no hydrogen 2.919 N/A TYR 271.A N ALA 287.A O no hydrogen 2.727 N/A TYR 271.A OH HIS 299.A ND1 no hydrogen 2.801 N/A LYS 272.A N HIS 265.A O no hydrogen 2.914 N/A TYR 273.A N THR 282.A OG1 no hydrogen 3.074 N/A TYR 273.A OH THR 295.A OG1 no hydrogen 2.826 N/A PHE 274.A N GLN 263.A O no hydrogen 2.950 N/A SER 275.A N TYR 279.A O no hydrogen 3.074 N/A GLY 278.A N SER 275.A O no hydrogen 2.965 N/A TYR 279.A N SER 275.A OG no hydrogen 3.174 N/A TYR 281.A N TYR 273.A O no hydrogen 2.910 N/A THR 282.A N ASN 280.A OD1 no hydrogen 2.801 N/A THR 282.A OG1 ASN 280.A OD1 no hydrogen 2.485 N/A PHE 285.A N TYR 281.A O no hydrogen 3.266 N/A GLY 286.A N THR 282.A O no hydrogen 2.660 N/A SER 288.A OG THR 290.A OG1 no hydrogen 3.186 N/A THR 290.A OG1 SER 288.A OG no hydrogen 3.186 N/A GLU 291.A N SER 288.A O no hydrogen 3.035 N/A SER 293.A N GLN 284.A O no hydrogen 2.987 N/A SER 293.A OG GLN 284.A O no hydrogen 2.876 N/A LEU 294.A N PHE 285.A O no hydrogen 2.721 N/A THR 295.A N PHE 285.A O no hydrogen 2.858 N/A THR 295.A OG1 TYR 273.A OH no hydrogen 2.826 N/A THR 295.A OG1 PHE 285.A O no hydrogen 3.446 N/A THR 295.A OG1 GLY 286.A O no hydrogen 2.441 N/A PHE 297.A N LEU 294.A O no hydrogen 2.801 N/A ILE 298.A N THR 295.A O no hydrogen 3.156 N/A HIS 299.A N THR 295.A O no hydrogen 2.806 N/A ALA 301.A N ILE 298.A O no hydrogen 2.615 N/A LYS 303.A N ILE 375.A O no hydrogen 2.902 N/A LYS 303.A NZ SER 373.A O no hydrogen 3.085 N/A ILE 306.A N LYS 303.A O no hydrogen 3.225 N/A GLN 307.A N ASN 356.A OD1 no hydrogen 2.827 N/A GLN 307.A NE2 ASP 267.A OD1 no hydrogen 2.621 N/A ILE 308.A N ASN 356.A OD1 no hydrogen 3.286 N/A CYS 309.A N LYS 266.A O no hydrogen 3.004 N/A ILE 310.A N MET 354.A O no hydrogen 3.117 N/A LEU 311.A N MET 264.A O no hydrogen 3.059 N/A ASP 312.A N ASP 351.A O no hydrogen 2.737 N/A GLY 313.A N MET 262.A O no hydrogen 3.098 N/A GLU 314.A N CYS 348.A O no hydrogen 2.789 N/A MET 315.A N GLU 260.A O no hydrogen 2.755 N/A MET 316.A N CYS 346.A O no hydrogen 2.793 N/A TYR 318.A N GLN 344.A O no hydrogen 2.883 N/A ASN 319.A N THR 324.A O no hydrogen 2.765 N/A ASN 319.A ND2 ASP 342.A O no hydrogen 3.443 N/A THR 322.A N ASN 319.A OD1 no hydrogen 2.725 N/A THR 322.A OG1 ASN 319.A OD1 no hydrogen 2.557 N/A THR 322.A OG1 THR 324.A OG1 no hydrogen 3.295 N/A GLN 323.A N ASN 319.A O no hydrogen 2.689 N/A GLN 323.A N PRO 320.A O no hydrogen 3.280 N/A THR 324.A N ASN 319.A O no hydrogen 3.330 N/A THR 324.A OG1 THR 322.A O no hydrogen 3.159 N/A THR 324.A OG1 THR 322.A OG1 no hydrogen 3.295 N/A MET 326.A N ALA 317.A O no hydrogen 2.707 N/A GLN 327.A N THR 485.A O no hydrogen 2.964 N/A GLN 327.A NE2 GLY 329.A O no hydrogen 2.845 N/A THR 330.A OG1 GLU 488.A OE2 no hydrogen 2.360 N/A LYS 331.A N GLU 488.A OE2 no hydrogen 3.349 N/A PHE 332.A N THR 330.A OG1 no hydrogen 3.277 N/A ARG 336.A N ASP 333.A O no hydrogen 3.232 N/A ARG 336.A N ASP 333.A OD1 no hydrogen 2.963 N/A MET 337.A N ASP 333.A O no hydrogen 3.078 N/A VAL 338.A N ILE 334.A O no hydrogen 3.004 N/A ASP 340.A N ARG 336.A O no hydrogen 2.797 N/A ASP 342.A N MET 337.A O no hydrogen 3.098 N/A LEU 343.A N MET 337.A O no hydrogen 3.305 N/A GLN 344.A N TYR 318.A O no hydrogen 3.021 N/A GLN 344.A NE2 GLY 381.A O no hydrogen 3.217 N/A CYS 346.A N MET 316.A O no hydrogen 2.969 N/A TYR 347.A N ARG 382.A O no hydrogen 2.510 N/A TYR 347.A OH MET 262.A O no hydrogen 2.799 N/A CYS 348.A N GLU 314.A O no hydrogen 2.677 N/A VAL 349.A N GLU 384.A O no hydrogen 2.713 N/A PHE 350.A N ASP 312.A O no hydrogen 2.970 N/A ASP 351.A N ASP 312.A O no hydrogen 3.345 N/A VAL 352.A N ASP 351.A OD1 no hydrogen 2.834 N/A LEU 353.A N ILE 310.A O no hydrogen 2.709 N/A VAL 355.A N LYS 358.A O no hydrogen 3.000 N/A ASN 356.A N ILE 308.A O no hydrogen 2.544 N/A ASN 356.A ND2 ASP 305.A O no hydrogen 3.001 N/A LYS 358.A N VAL 355.A O no hydrogen 3.107 N/A LEU 360.A N LEU 353.A O no hydrogen 2.503 N/A GLU 363.A N LEU 360.A O no hydrogen 2.930 N/A ARG 366.A N PRO 417.A O no hydrogen 2.834 N/A LYS 367.A N THR 364.A OG1 no hydrogen 3.226 N/A ARG 368.A N THR 364.A O no hydrogen 3.154 N/A ARG 368.A NE ASP 351.A OD1 no hydrogen 2.663 N/A ARG 368.A NE ASP 351.A OD2 no hydrogen 3.330 N/A ARG 368.A NH1 ASP 351.A OD2 no hydrogen 2.987 N/A ARG 368.A NH2 SER 419.A O no hydrogen 3.437 N/A TYR 369.A N LEU 365.A O no hydrogen 3.002 N/A TYR 369.A OH GLU 254.A OE2 no hydrogen 2.300 N/A GLU 370.A N ARG 366.A O no hydrogen 3.018 N/A ILE 371.A N LYS 367.A O no hydrogen 2.779 N/A LEU 372.A N ARG 368.A O no hydrogen 2.717 N/A SER 373.A N TYR 369.A O no hydrogen 3.303 N/A SER 373.A OG GLU 370.A O no hydrogen 2.927 N/A SER 374.A N ILE 371.A O no hydrogen 2.646 N/A SER 374.A OG ILE 371.A O no hydrogen 2.738 N/A ILE 375.A N LEU 372.A O no hydrogen 3.223 N/A THR 377.A N ALA 301.A O no hydrogen 2.958 N/A THR 377.A OG1 ALA 301.A O no hydrogen 3.525 N/A ILE 379.A N ILE 383.A O no hydrogen 2.979 N/A GLY 381.A N GLU 384.A OE2 no hydrogen 2.927 N/A ARG 382.A N ILE 379.A O no hydrogen 3.001 N/A ILE 383.A N ILE 379.A O no hydrogen 3.125 N/A GLU 384.A N TYR 347.A O no hydrogen 2.911 N/A VAL 386.A N VAL 349.A O no hydrogen 2.958 N/A THR 389.A N ILE 253.A O no hydrogen 2.977 N/A ALA 391.A N PHE 251.A O no hydrogen 2.906 N/A HIS 392.A N GLU 396.A OE1 no hydrogen 2.991 N/A THR 393.A N GLU 396.A OE1 no hydrogen 3.005 N/A THR 393.A OG1 GLU 396.A OE1 no hydrogen 2.546 N/A LYS 394.A N GLU 243.A OE1 no hydrogen 2.677 N/A VAL 397.A N THR 393.A O no hydrogen 3.092 N/A ILE 398.A N LYS 394.A O no hydrogen 2.909 N/A ASP 399.A N ASN 395.A O no hydrogen 2.748 N/A ALA 400.A N GLU 396.A O no hydrogen 2.814 N/A LEU 401.A N VAL 397.A O no hydrogen 3.140 N/A ASN 402.A N ILE 398.A O no hydrogen 2.973 N/A GLU 403.A N ASP 399.A O no hydrogen 3.071 N/A ALA 404.A N ALA 400.A O no hydrogen 2.894 N/A ILE 405.A N LEU 401.A O no hydrogen 3.126 N/A ASP 406.A N ASN 402.A O no hydrogen 3.001 N/A LYS 407.A N GLU 403.A O no hydrogen 3.165 N/A ARG 408.A N ILE 405.A O no hydrogen 2.950 N/A ARG 408.A NE THR 485.A OG1 no hydrogen 2.497 N/A ARG 408.A NH1 GLN 327.A OE1 no hydrogen 2.800 N/A ARG 408.A NH1 THR 485.A OG1 no hydrogen 3.117 N/A ARG 408.A NH2 ILE 555.A O no hydrogen 2.998 N/A GLU 409.A N ALA 404.A O no hydrogen 2.753 N/A ILE 412.A N ILE 433.A O no hydrogen 3.127 N/A MET 413.A N GLU 254.A O no hydrogen 2.790 N/A VAL 414.A N LEU 431.A O no hydrogen 2.705 N/A LYS 415.A N TYR 252.A O no hydrogen 2.858 N/A LYS 415.A NZ GLU 254.A OE1 no hydrogen 2.683 N/A GLN 416.A N GLY 429.A O no hydrogen 2.803 N/A SER 419.A N GLN 416.A O no hydrogen 3.203 N/A SER 419.A OG GLN 416.A O no hydrogen 2.677 N/A TYR 421.A N GLY 361.A O no hydrogen 2.710 N/A TYR 421.A OH ASP 312.A OD2 no hydrogen 2.805 N/A ASP 424.A N PRO 231.A O no hydrogen 3.091 N/A LYS 425.A N LYS 422.A O no hydrogen 3.352 N/A ARG 426.A NH2 ALA 234.A O no hydrogen 2.882 N/A GLY 427.A N LEU 233.A O no hydrogen 3.027 N/A TRP 430.A N GLY 427.A O no hydrogen 2.926 N/A LEU 431.A N VAL 414.A O no hydrogen 2.721 N/A LYS 432.A N ALA 235.A O no hydrogen 2.653 N/A ILE 433.A N ILE 412.A O no hydrogen 2.846 N/A LEU 438.A N ILE 533.A O no hydrogen 3.152 N/A ILE 440.A N VAL 531.A O no hydrogen 3.119 N/A LEU 441.A N ALA 460.A O no hydrogen 3.263 N/A ILE 442.A N VAL 529.A O no hydrogen 3.177 N/A VAL 443.A N LEU 458.A O no hydrogen 2.804 N/A GLY 444.A N LEU 458.A O no hydrogen 3.177 N/A GLY 445.A N VAL 521.A O no hydrogen 2.847 N/A TYR 446.A N HIS 456.A O no hydrogen 3.007 N/A TYR 446.A OH GLU 517.A OE2 no hydrogen 2.454 N/A TRP 447.A N GLU 520.A OE2 no hydrogen 3.241 N/A SER 455.A N TYR 446.A O no hydrogen 2.780 N/A SER 455.A OG TYR 446.A O no hydrogen 3.305 N/A SER 455.A OG GLY 448.A O no hydrogen 2.996 N/A SER 455.A OG HIS 456.A ND1 no hydrogen 2.949 N/A HIS 456.A ND1 SER 455.A OG no hydrogen 2.949 N/A HIS 456.A NE2 ASP 406.A OD1 no hydrogen 2.623 N/A HIS 456.A NE2 ASP 406.A OD2 no hydrogen 2.814 N/A PHE 457.A N VAL 480.A O no hydrogen 2.902 N/A LEU 458.A N GLY 444.A O no hydrogen 2.889 N/A CYS 459.A N SER 478.A O no hydrogen 2.868 N/A ALA 460.A N LEU 441.A O no hydrogen 2.927 N/A VAL 461.A N HIS 475.A O no hydrogen 2.853 N/A ALA 462.A N MET 568.A O no hydrogen 2.876 N/A GLU 463.A N VAL 473.A O no hydrogen 3.114 N/A GLU 469.A N PRO 466.A O no hydrogen 2.914 N/A PHE 474.A N SER 511.A O no hydrogen 2.762 N/A HIS 475.A N VAL 461.A O no hydrogen 2.862 N/A THR 476.A N LEU 513.A O no hydrogen 2.998 N/A THR 476.A OG1 LEU 513.A O no hydrogen 3.475 N/A LEU 477.A N CYS 459.A O no hydrogen 2.835 N/A SER 478.A N CYS 459.A O no hydrogen 3.237 N/A SER 478.A OG ARG 479.A O no hydrogen 2.402 N/A ARG 479.A N TYR 544.A OH no hydrogen 3.175 N/A VAL 480.A N PHE 457.A O no hydrogen 3.035 N/A SER 482.A N SER 455.A O no hydrogen 2.862 N/A SER 482.A OG MET 454.A O no hydrogen 3.247 N/A CYS 484.A SG SER 482.A O no hydrogen 3.999 N/A THR 485.A N GLY 483.A O no hydrogen 2.582 N/A THR 485.A OG1 GLN 327.A OE1 no hydrogen 2.690 N/A LYS 487.A NZ ASP 491.A OD1 no hydrogen 3.244 N/A LEU 489.A N MET 486.A O no hydrogen 3.112 N/A TYR 490.A N MET 486.A O no hydrogen 3.461 N/A ASP 491.A N LYS 487.A O no hydrogen 2.719 N/A LEU 492.A N GLU 488.A O no hydrogen 2.929 N/A GLY 493.A N LEU 489.A O no hydrogen 3.022 N/A LEU 494.A N TYR 490.A O no hydrogen 3.282 N/A LYS 495.A N ASP 491.A O no hydrogen 3.010 N/A LEU 496.A N LEU 492.A O no hydrogen 2.804 N/A TYR 499.A N LEU 496.A O no hydrogen 2.835 N/A LYS 501.A N TYR 522.A O no hydrogen 2.918 N/A LYS 501.A NZ GLU 524.A OE2 no hydrogen 3.145 N/A PHE 503.A N GLU 520.A O no hydrogen 2.759 N/A ALA 507.A N HIS 504.A O no hydrogen 3.010 N/A SER 511.A OG GLU 524.A OE1 no hydrogen 3.457 N/A ILE 512.A N PRO 509.A O no hydrogen 3.394 N/A LEU 513.A N PHE 474.A O no hydrogen 2.681 N/A GLY 515.A N THR 476.A OG1 no hydrogen 3.352 N/A THR 516.A N ASP 542.A O no hydrogen 3.291 N/A THR 516.A OG1 ASP 542.A O no hydrogen 2.913 N/A GLU 517.A N MET 543.A O no hydrogen 2.671 N/A LYS 518.A NZ GLY 515.A O no hydrogen 2.658 N/A GLU 520.A N GLY 445.A O no hydrogen 3.270 N/A VAL 521.A N GLY 445.A O no hydrogen 3.426 N/A TYR 522.A N LYS 501.A O no hydrogen 2.926 N/A ILE 523.A N VAL 443.A O no hydrogen 3.198 N/A CYS 526.A SG ASN 527.A OD1 no hydrogen 3.788 N/A ASN 527.A N GLU 524.A O no hydrogen 2.881 N/A SER 528.A N PRO 525.A O no hydrogen 3.198 N/A SER 528.A OG ILE 442.A O no hydrogen 2.665 N/A SER 528.A OG VAL 529.A O no hydrogen 3.532 N/A VAL 529.A N SER 528.A OG no hydrogen 2.464 N/A VAL 531.A N ILE 440.A O no hydrogen 2.790 N/A GLN 532.A N LYS 557.A O no hydrogen 2.988 N/A ILE 533.A N LEU 438.A O no hydrogen 2.757 N/A LYS 534.A N ARG 554.A O no hydrogen 2.760 N/A LYS 534.A NZ GLU 556.A OE2 no hydrogen 2.459 N/A ALA 536.A N ARG 551.A O no hydrogen 2.925 N/A VAL 539.A N THR 549.A O no hydrogen 2.909 N/A SER 541.A N GLY 547.A O no hydrogen 3.101 N/A MET 543.A N SER 541.A OG no hydrogen 3.129 N/A LYS 545.A N THR 476.A OG1 no hydrogen 3.182 N/A THR 546.A N THR 476.A O no hydrogen 3.281 N/A THR 546.A OG1 THR 476.A O no hydrogen 3.546 N/A THR 546.A OG1 CYS 548.A O no hydrogen 2.684 N/A GLY 547.A N TYR 544.A O no hydrogen 3.045 N/A CYS 548.A N THR 546.A OG1 no hydrogen 3.426 N/A CYS 548.A SG THR 546.A O no hydrogen 4.012 N/A CYS 548.A SG THR 546.A OG1 no hydrogen 3.518 N/A THR 549.A N VAL 539.A O no hydrogen 2.623 N/A THR 549.A OG1 LEU 477.A O no hydrogen 2.820 N/A ARG 551.A N GLU 537.A O no hydrogen 3.136 N/A ARG 554.A N LYS 534.A O no hydrogen 2.833 N/A ARG 554.A NH1 ARG 408.A O no hydrogen 2.925 N/A GLU 556.A N GLN 532.A O no hydrogen 2.815 N/A ARG 559.A N ILE 530.A O no hydrogen 2.857 N/A ARG 559.A NE ASP 561.A OD1 no hydrogen 2.848 N/A ARG 559.A NE ASP 561.A OD2 no hydrogen 3.441 N/A ARG 559.A NH1 ASP 439.A OD1 no hydrogen 3.314 N/A ARG 559.A NH2 ASP 561.A OD2 no hydrogen 2.957 N/A ASP 560.A N ILE 558.A O no hydrogen 3.115 N/A GLU 563.A N GLU 566.A OE2 no hydrogen 2.858 N/A GLU 566.A N GLU 563.A O no hydrogen 2.890 N/A CYS 567.A N TRP 564.A O no hydrogen 3.372 N/A CYS 567.A SG ALA 460.A O no hydrogen 3.512 N/A CYS 567.A SG MET 568.A O no hydrogen 3.206 N/A MET 568.A N ASP 439.A O no hydrogen 3.212 N/A THR 569.A N ASP 572.A OD2 no hydrogen 3.093 N/A LEU 570.A N ALA 462.A O no hydrogen 2.915 N/A ASP 572.A N THR 569.A OG1 no hydrogen 2.885 N/A LEU 573.A N THR 569.A O no hydrogen 2.741 N/A GLU 574.A N LEU 570.A O no hydrogen 2.688 N/A GLN 575.A N ASP 571.A O no hydrogen 3.162 N/A GLN 575.A NE2 ASP 571.A O no hydrogen 3.348 N/A ARG 577.A N GLU 574.A O no hydrogen 3.136 N/A