Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4dsk_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): THR 5.A N ARG 46.A O no hydrogen 3.072 N/A ALA 7.A N PHE 48.A O no hydrogen 3.117 N/A MET 14.A N THR 11.A O no hydrogen 3.025 N/A LEU 15.A N GLU 12.A O no hydrogen 2.739 N/A LYS 18.A NZ GLU 161.A OE1 no hydrogen 3.206 N/A LYS 18.A NZ GLU 161.A OE2 no hydrogen 3.222 N/A ALA 19.A N LYS 70.A O no hydrogen 3.089 N/A ALA 20.A N VAL 41.A O no hydrogen 2.822 N/A LEU 21.A N SER 72.A O no hydrogen 2.842 N/A VAL 22.A N ALA 39.A O no hydrogen 2.882 N/A GLU 24.A N GLY 37.A O no hydrogen 3.127 N/A ASN 29.A ND2 GLU 319.A OE2 no hydrogen 3.417 N/A TYR 30.A OH GLU 192.A OE1 no hydrogen 3.320 N/A TYR 30.A OH GLU 192.A OE2 no hydrogen 2.517 N/A HIS 31.A N ASN 29.A OD1 no hydrogen 3.027 N/A HIS 31.A NE2 THR 303.A O no hydrogen 2.906 N/A ALA 33.A N TYR 30.A O no hydrogen 3.337 N/A VAL 36.A N GLU 24.A O no hydrogen 2.794 N/A ILE 38.A N LEU 49.A O no hydrogen 3.119 N/A ALA 39.A N VAL 22.A O no hydrogen 3.037 N/A VAL 40.A N PHE 47.A O no hydrogen 2.890 N/A VAL 41.A N ALA 20.A O no hydrogen 3.089 N/A ASN 42.A N GLY 45.A O no hydrogen 2.973 N/A ASN 42.A ND2 GLU 13.A O no hydrogen 3.079 N/A HIS 44.A N ASN 42.A OD1 no hydrogen 2.851 N/A GLY 45.A N ASN 42.A O no hydrogen 3.215 N/A ARG 46.A NH1 ALA 3.A O no hydrogen 2.822 N/A PHE 47.A N VAL 40.A O no hydrogen 2.680 N/A PHE 48.A N THR 5.A O no hydrogen 2.992 N/A LEU 49.A N ILE 38.A O no hydrogen 2.838 N/A ARG 50.A NE GLU 143.A OE2 no hydrogen 3.023 N/A ARG 50.A NH2 GLU 143.A OE1 no hydrogen 3.408 N/A ALA 54.A N ARG 50.A O no hydrogen 3.062 N/A LEU 55.A N PRO 51.A O no hydrogen 2.802 N/A ASP 57.A N ALA 54.A O no hydrogen 3.172 N/A PHE 60.A N ASP 57.A OD2 no hydrogen 3.012 N/A VAL 61.A N ASP 57.A O no hydrogen 2.997 N/A ALA 62.A N PRO 58.A O no hydrogen 2.955 N/A TRP 63.A N GLN 59.A O no hydrogen 2.753 N/A TRP 63.A NE1 ALA 16.A O no hydrogen 2.855 N/A LEU 64.A N PHE 60.A O no hydrogen 2.858 N/A GLY 65.A N VAL 61.A O no hydrogen 3.070 N/A ASP 66.A N TRP 63.A O no hydrogen 3.030 N/A THR 68.A N ASP 66.A OD1 no hydrogen 3.079 N/A THR 68.A OG1 ASP 66.A OD1 no hydrogen 2.966 N/A LYS 69.A N ASP 66.A O no hydrogen 2.924 N/A LYS 70.A N ASP 17.A O no hydrogen 3.096 N/A LYS 70.A NZ GLU 67.A O no hydrogen 2.728 N/A LYS 71.A N GLY 92.A O no hydrogen 2.863 N/A LYS 71.A NZ TRP 63.A O no hydrogen 2.876 N/A LYS 71.A NZ LEU 64.A O no hydrogen 3.353 N/A LYS 71.A NZ LYS 69.A O no hydrogen 2.599 N/A LYS 71.A NZ CYS 91.A O no hydrogen 2.855 N/A SER 72.A N ALA 19.A O no hydrogen 2.800 N/A SER 72.A OG GLU 161.A OE2 no hydrogen 2.585 N/A MET 73.A N PHE 95.A O no hydrogen 2.824 N/A ASP 75.A N ASP 96.A OD1 no hydrogen 3.060 N/A SER 76.A N ASP 96.A OD2 no hydrogen 2.804 N/A SER 76.A OG ASP 96.A OD2 no hydrogen 2.601 N/A LYS 77.A NZ TYR 30.A OH no hydrogen 2.979 N/A LYS 77.A NZ GLU 192.A OE1 no hydrogen 2.621 N/A LYS 77.A NZ PHE 305.A O no hydrogen 2.573 N/A ARG 78.A N ASP 75.A O no hydrogen 3.123 N/A ARG 78.A N ASP 75.A OD1 no hydrogen 3.378 N/A ARG 78.A NH1 VAL 25.A O no hydrogen 2.991 N/A ARG 78.A NH1 GLU 27.A O no hydrogen 2.838 N/A ARG 78.A NH2 GLU 28.A O no hydrogen 3.031 N/A ALA 80.A N SER 76.A O no hydrogen 2.774 N/A VAL 81.A N LYS 77.A O no hydrogen 2.909 N/A ALA 82.A N ARG 78.A O no hydrogen 3.131 N/A LEU 83.A N ALA 79.A O no hydrogen 2.866 N/A LYS 84.A N ALA 80.A O no hydrogen 2.828 N/A TRP 85.A N VAL 81.A O no hydrogen 3.032 N/A TRP 85.A NE1 HIS 31.A ND1 no hydrogen 3.156 N/A LYS 86.A N LEU 83.A O no hydrogen 2.835 N/A GLY 87.A N LYS 84.A O no hydrogen 2.872 N/A ILE 88.A N LEU 83.A O no hydrogen 2.950 N/A CYS 91.A N LEU 64.A O no hydrogen 2.783 N/A CYS 91.A SG GLY 65.A O no hydrogen 3.677 N/A CYS 91.A SG GLU 89.A OE2 no hydrogen 3.342 N/A SER 94.A N LYS 71.A O no hydrogen 2.898 N/A PHE 95.A N LYS 71.A O no hydrogen 3.432 N/A ASP 96.A N GLN 182.A OE1 no hydrogen 2.888 N/A LEU 97.A N MET 73.A O no hydrogen 2.677 N/A LEU 98.A N ASP 96.A OD1 no hydrogen 2.995 N/A LEU 99.A N ASP 96.A OD1 no hydrogen 3.438 N/A ALA 100.A N ASP 96.A O no hydrogen 2.987 N/A ALA 101.A N LEU 97.A O no hydrogen 2.901 N/A TYR 102.A N LEU 98.A O no hydrogen 2.996 N/A TYR 102.A OH THR 310.A O no hydrogen 2.651 N/A LEU 103.A N LEU 99.A O no hydrogen 3.148 N/A LEU 104.A N ALA 100.A O no hydrogen 3.097 N/A ASP 105.A N ALA 101.A O no hydrogen 2.864 N/A ALA 107.A N ASP 105.A OD1 no hydrogen 3.289 N/A GLN 108.A N ASP 105.A O no hydrogen 3.075 N/A GLN 108.A NE2 ASP 105.A OD2 no hydrogen 3.492 N/A GLY 109.A N PRO 106.A O no hydrogen 3.438 N/A ALA 115.A N ASP 112.A O no hydrogen 3.226 N/A ALA 115.A N ASP 112.A OD2 no hydrogen 3.142 N/A ALA 116.A N ASP 112.A O no hydrogen 3.225 N/A ALA 117.A N VAL 113.A O no hydrogen 2.660 N/A LYS 118.A N ALA 114.A O no hydrogen 3.009 N/A MET 119.A N ALA 116.A O no hydrogen 3.104 N/A LYS 120.A N ALA 117.A O no hydrogen 3.089 N/A LYS 120.A NZ GLU 167.A OE2 no hydrogen 2.774 N/A GLN 121.A N LYS 118.A O no hydrogen 2.812 N/A TYR 122.A N ALA 117.A O no hydrogen 3.070 N/A ASP 128.A N ASP 112.A OD1 no hydrogen 2.772 N/A ALA 130.A N PRO 127.A O no hydrogen 3.186 N/A VAL 131.A N PRO 127.A O no hydrogen 3.381 N/A TYR 132.A N ASP 128.A O no hydrogen 2.778 N/A TYR 132.A OH GLU 24.A OE2 no hydrogen 2.556 N/A GLY 133.A N GLU 129.A O no hydrogen 2.704 N/A ARG 138.A N GLY 135.A O no hydrogen 2.990 N/A ARG 138.A NE VAL 26.A O no hydrogen 3.088 N/A ARG 138.A NH2 VAL 26.A O no hydrogen 3.105 N/A ALA 139.A N TYR 132.A O no hydrogen 2.761 N/A LEU 146.A N ASP 142.A O no hydrogen 2.921 N/A ALA 147.A N GLU 143.A O no hydrogen 2.867 N/A GLU 148.A N PRO 144.A O no hydrogen 3.358 N/A HIS 149.A N VAL 145.A O no hydrogen 3.099 N/A HIS 149.A NE2 ASP 128.A OD1 no hydrogen 2.863 N/A LEU 150.A N LEU 146.A O no hydrogen 2.995 N/A VAL 151.A N ALA 147.A O no hydrogen 3.038 N/A ARG 152.A N GLU 148.A O no hydrogen 3.005 N/A ARG 152.A NE GLU 148.A OE2 no hydrogen 2.794 N/A ARG 152.A NH1 ALA 124.A O no hydrogen 2.907 N/A ARG 152.A NH2 GLU 148.A OE2 no hydrogen 3.381 N/A LYS 153.A N HIS 149.A O no hydrogen 3.039 N/A LYS 153.A NZ GLU 24.A OE1 no hydrogen 2.763 N/A LYS 153.A NZ GLU 24.A OE2 no hydrogen 2.667 N/A LYS 153.A NZ ASP 128.A OD1 no hydrogen 3.341 N/A ALA 154.A N LEU 150.A O no hydrogen 3.014 N/A ALA 155.A N VAL 151.A O no hydrogen 2.810 N/A ALA 156.A N ARG 152.A O no hydrogen 2.861 N/A ILE 157.A N LYS 153.A O no hydrogen 2.802 N/A TRP 158.A N ALA 154.A O no hydrogen 2.911 N/A GLU 159.A N ALA 155.A O no hydrogen 3.001 N/A LEU 160.A N ALA 156.A O no hydrogen 2.874 N/A GLU 161.A N ILE 157.A O no hydrogen 3.181 N/A ARG 162.A NH1 ASP 166.A OD1 no hydrogen 3.080 N/A PHE 164.A N LEU 160.A O no hydrogen 3.087 N/A LEU 165.A N GLU 161.A O no hydrogen 2.975 N/A ASP 166.A N ARG 162.A O no hydrogen 2.834 N/A GLU 167.A N PRO 163.A O no hydrogen 2.981 N/A LEU 168.A N PHE 164.A O no hydrogen 2.774 N/A ARG 169.A N LEU 165.A O no hydrogen 2.860 N/A ARG 169.A NH1 ASP 166.A OD1 no hydrogen 2.980 N/A ARG 170.A N ASP 166.A O no hydrogen 3.076 N/A ASN 171.A N GLU 167.A O no hydrogen 2.857 N/A ASN 171.A ND2 GLN 173.A OE1 no hydrogen 2.773 N/A GLU 172.A N ARG 169.A O no hydrogen 2.973 N/A GLN 173.A N LEU 168.A O no hydrogen 2.709 N/A GLN 173.A NE2 LEU 103.A O no hydrogen 3.005 N/A GLN 173.A NE2 HIS 467.A O no hydrogen 3.278 N/A LEU 177.A N GLN 173.A O no hydrogen 3.123 N/A VAL 178.A N ASP 174.A O no hydrogen 3.019 N/A GLU 179.A N ARG 175.A O no hydrogen 2.753 N/A LEU 180.A N LEU 176.A O no hydrogen 3.282 N/A GLU 181.A N LEU 176.A O no hydrogen 2.890 N/A GLN 182.A N LEU 177.A O no hydrogen 2.958 N/A GLN 182.A NE2 SER 94.A O no hydrogen 3.034 N/A LEU 184.A N LEU 180.A O no hydrogen 2.960 N/A SER 185.A N GLU 181.A O no hydrogen 3.084 N/A SER 186.A N GLN 182.A O no hydrogen 3.418 N/A ILE 187.A N PRO 183.A O no hydrogen 3.319 N/A LEU 188.A N LEU 184.A O no hydrogen 2.816 N/A ALA 189.A N SER 185.A O no hydrogen 3.014 N/A GLU 190.A N SER 186.A O no hydrogen 3.211 N/A MET 191.A N ILE 187.A O no hydrogen 2.970 N/A GLU 192.A N LEU 188.A O no hydrogen 2.924 N/A PHE 193.A N ALA 189.A O no hydrogen 3.101 N/A ALA 194.A N GLU 190.A O no hydrogen 2.843 N/A GLY 195.A N MET 191.A O no hydrogen 3.078 N/A VAL 196.A N VAL 301.A O no hydrogen 2.930 N/A VAL 198.A N LYS 299.A O no hydrogen 2.928 N/A ASP 199.A N ALA 338.A O no hydrogen 2.633 N/A ARG 202.A N ASP 199.A OD1 no hydrogen 3.334 N/A LEU 203.A N ASP 199.A O no hydrogen 3.032 N/A GLU 204.A N THR 200.A O no hydrogen 2.796 N/A GLN 205.A N LYS 201.A O no hydrogen 2.974 N/A MET 206.A N ARG 202.A O no hydrogen 3.002 N/A GLY 207.A N LEU 203.A O no hydrogen 2.856 N/A LYS 208.A N GLU 204.A O no hydrogen 3.104 N/A LYS 208.A N GLN 205.A O no hydrogen 3.084 N/A GLU 209.A N GLN 205.A O no hydrogen 3.029 N/A LEU 210.A N MET 206.A O no hydrogen 2.969 N/A ALA 211.A N GLY 207.A O no hydrogen 3.067 N/A GLU 212.A N LYS 208.A O no hydrogen 3.308 N/A GLU 212.A N GLU 209.A O no hydrogen 3.116 N/A GLN 213.A N GLU 209.A O no hydrogen 3.108 N/A LEU 214.A N LEU 210.A O no hydrogen 2.873 N/A GLY 215.A N ALA 211.A O no hydrogen 3.255 N/A THR 216.A N GLU 212.A O no hydrogen 3.171 N/A THR 216.A OG1 GLU 212.A O no hydrogen 3.160 N/A VAL 217.A N GLN 213.A O no hydrogen 2.881 N/A GLU 218.A N LEU 214.A O no hydrogen 2.830 N/A GLN 219.A N GLY 215.A O no hydrogen 2.999 N/A ARG 220.A N THR 216.A O no hydrogen 2.977 N/A ARG 220.A NH2 GLU 268.A OE1 no hydrogen 3.142 N/A ILE 221.A N VAL 217.A O no hydrogen 2.869 N/A TYR 222.A N GLU 218.A O no hydrogen 2.996 N/A TYR 222.A OH GLU 218.A OE1 no hydrogen 2.899 N/A TYR 222.A OH PHE 229.A O no hydrogen 3.007 N/A GLU 223.A N GLN 219.A O no hydrogen 3.002 N/A LEU 224.A N ARG 220.A O no hydrogen 2.963 N/A ALA 225.A N ILE 221.A O no hydrogen 3.035 N/A ALA 225.A N TYR 222.A O no hydrogen 3.193 N/A GLY 226.A N GLU 223.A O no hydrogen 3.242 N/A GLN 227.A N TYR 222.A O no hydrogen 3.196 N/A ASN 230.A N GLN 236.A OE1 no hydrogen 2.759 N/A ASN 232.A N ASN 230.A OD1 no hydrogen 3.012 N/A SER 233.A N ASN 230.A O no hydrogen 2.942 N/A GLN 236.A N SER 233.A OG no hydrogen 3.162 N/A LEU 237.A N SER 233.A O no hydrogen 3.016 N/A GLY 238.A N PRO 234.A O no hydrogen 3.247 N/A VAL 239.A N LYS 235.A O no hydrogen 3.250 N/A ILE 240.A N GLN 236.A O no hydrogen 3.148 N/A LEU 241.A N LEU 237.A O no hydrogen 2.958 N/A PHE 242.A N GLY 238.A O no hydrogen 3.015 N/A GLU 243.A N VAL 239.A O no hydrogen 3.151 N/A LYS 244.A N VAL 239.A O no hydrogen 3.016 N/A LYS 244.A NZ ALA 225.A O no hydrogen 3.213 N/A LEU 245.A N ILE 240.A O no hydrogen 3.074 N/A LEU 247.A N LEU 241.A O no hydrogen 2.859 N/A TYR 253.A OH GLU 243.A OE1 no hydrogen 3.012 N/A SER 256.A OG SER 254.A OG no hydrogen 3.153 N/A LEU 260.A N SER 256.A O no hydrogen 3.163 N/A GLU 261.A N ALA 257.A O no hydrogen 3.116 N/A LYS 262.A N ASP 258.A O no hydrogen 3.479 N/A LYS 262.A NZ ASP 258.A OD1 no hydrogen 3.221 N/A LYS 262.A NZ ASP 258.A OD2 no hydrogen 3.074 N/A LYS 262.A NZ ASN 425.A OD1 no hydrogen 2.985 N/A LEU 263.A N VAL 259.A O no hydrogen 3.231 N/A ALA 264.A N GLU 261.A O no hydrogen 3.147 N/A TYR 266.A N LEU 263.A O no hydrogen 3.135 N/A HIS 267.A N ALA 264.A O no hydrogen 3.472 N/A ILE 269.A N HIS 267.A ND1 no hydrogen 3.009 N/A VAL 270.A N HIS 267.A O no hydrogen 3.174 N/A ASN 272.A ND2 GLU 268.A O no hydrogen 3.504 N/A ILE 273.A N ILE 269.A O no hydrogen 3.051 N/A LEU 274.A N VAL 270.A O no hydrogen 3.033 N/A HIS 275.A N GLU 271.A O no hydrogen 2.968 N/A TYR 276.A N ASN 272.A O no hydrogen 2.796 N/A ARG 277.A N ILE 273.A O no hydrogen 3.019 N/A ARG 277.A NH1 THR 255.A O no hydrogen 2.922 N/A ARG 277.A NH2 THR 255.A O no hydrogen 3.055 N/A ARG 277.A NH2 THR 255.A OG1 no hydrogen 2.983 N/A GLN 278.A N LEU 274.A O no hydrogen 3.249 N/A LEU 279.A N HIS 275.A O no hydrogen 3.115 N/A GLY 280.A N TYR 276.A O no hydrogen 2.792 N/A LYS 281.A N ARG 277.A O no hydrogen 2.940 N/A LYS 281.A NZ THR 285.A OG1 no hydrogen 2.812 N/A LEU 282.A N GLN 278.A O no hydrogen 3.117 N/A GLN 283.A N LEU 279.A O no hydrogen 2.917 N/A SER 284.A N GLY 280.A O no hydrogen 3.065 N/A SER 284.A OG GLY 280.A O no hydrogen 3.161 N/A SER 284.A OG LYS 281.A O no hydrogen 3.448 N/A SER 284.A OG THR 285.A OG1 no hydrogen 3.235 N/A THR 285.A N LYS 281.A O no hydrogen 3.080 N/A THR 285.A OG1 LYS 281.A O no hydrogen 3.467 N/A THR 285.A OG1 SER 284.A OG no hydrogen 3.235 N/A TYR 286.A N LEU 282.A O no hydrogen 3.113 N/A TYR 286.A OH ASN 324.A O no hydrogen 2.643 N/A ILE 287.A N LEU 282.A O no hydrogen 2.948 N/A GLU 288.A N GLN 283.A O no hydrogen 2.946 N/A GLY 289.A N SER 284.A O no hydrogen 3.009 N/A LEU 291.A N ILE 287.A O no hydrogen 2.969 N/A LYS 292.A N GLU 288.A O no hydrogen 3.066 N/A VAL 293.A N LEU 290.A O no hydrogen 2.882 N/A VAL 294.A N LEU 290.A O no hydrogen 3.176 N/A ARG 295.A N LYS 300.A O no hydrogen 2.806 N/A ARG 295.A NH2 HIS 31.A O no hydrogen 3.263 N/A LYS 299.A N ARG 295.A O no hydrogen 2.799 N/A LYS 299.A NZ PRO 296.A O no hydrogen 3.327 N/A LYS 300.A N THR 298.A OG1 no hydrogen 3.245 N/A LYS 300.A NZ ALA 194.A O no hydrogen 2.903 N/A VAL 301.A N VAL 196.A O no hydrogen 2.860 N/A HIS 302.A ND1 GLU 192.A O no hydrogen 2.848 N/A THR 303.A OG1 SER 317.A OG no hydrogen 2.586 N/A THR 303.A OG1 THR 318.A O no hydrogen 3.159 N/A THR 303.A OG1 PRO 320.A O no hydrogen 2.693 N/A ILE 304.A N THR 318.A O no hydrogen 2.979 N/A PHE 305.A N GLU 192.A OE1 no hydrogen 2.751 N/A ASN 306.A N SER 316.A O no hydrogen 2.797 N/A GLN 307.A NE2 GLU 181.A O no hydrogen 2.749 N/A GLN 307.A NE2 GLU 181.A OE1 no hydrogen 2.956 N/A ALA 308.A N ASN 306.A OD1 no hydrogen 3.019 N/A THR 310.A OG1 TYR 102.A OH no hydrogen 3.426 N/A THR 310.A OG1 ARG 314.A O no hydrogen 2.722 N/A GLN 311.A NE2 PRO 106.A O no hydrogen 3.124 N/A GLN 311.A NE2 LEU 309.A O no hydrogen 3.147 N/A THR 312.A OG1 GLN 496.A OE1 no hydrogen 2.515 N/A GLY 313.A N THR 310.A OG1 no hydrogen 3.119 N/A SER 316.A N ASN 306.A O no hydrogen 3.155 N/A SER 317.A OG THR 303.A OG1 no hydrogen 2.586 N/A SER 317.A OG PRO 320.A O no hydrogen 3.221 N/A THR 318.A N ILE 304.A O no hydrogen 2.973 N/A THR 318.A OG1 ILE 304.A O no hydrogen 3.361 N/A LEU 322.A N SER 317.A OG no hydrogen 3.022 N/A GLN 323.A N ASN 321.A OD1 no hydrogen 2.784 N/A GLN 323.A NE2 GLN 526.A O no hydrogen 2.907 N/A ARG 333.A N LEU 329.A O no hydrogen 2.865 N/A LYS 334.A N GLU 330.A O no hydrogen 3.336 N/A LYS 334.A NZ GLU 330.A OE2 no hydrogen 2.519 N/A ILE 335.A N GLY 332.A O no hydrogen 2.967 N/A ARG 336.A N ARG 333.A O no hydrogen 2.940 N/A ARG 336.A NE PRO 326.A O no hydrogen 2.834 N/A ARG 336.A NH2 ILE 325.A O no hydrogen 2.806 N/A GLN 337.A N LYS 334.A O no hydrogen 2.941 N/A ALA 338.A N ILE 335.A O no hydrogen 2.882 N/A PHE 339.A N ARG 336.A O no hydrogen 3.284 N/A VAL 340.A N LYS 197.A O no hydrogen 3.105 N/A SER 342.A N GLU 534.A OE1 no hydrogen 2.722 N/A SER 342.A OG GLU 534.A OE1 no hydrogen 3.547 N/A SER 342.A OG GLU 534.A OE2 no hydrogen 2.644 N/A TRP 346.A N GLU 343.A O no hydrogen 3.306 N/A LEU 347.A N ALA 535.A O no hydrogen 2.677 N/A ILE 348.A N GLY 568.A O no hydrogen 3.034 N/A PHE 349.A N LEU 533.A O no hydrogen 2.856 N/A ALA 350.A N HIS 566.A O no hydrogen 2.884 N/A ALA 351.A N LEU 531.A O no hydrogen 2.906 N/A ASP 352.A N ASP 564.A O no hydrogen 2.872 N/A TYR 353.A N ASP 529.A O no hydrogen 2.938 N/A TYR 353.A OH MET 551.A O no hydrogen 2.763 N/A SER 354.A N LYS 562.A O no hydrogen 2.813 N/A ARG 359.A N GLN 355.A O no hydrogen 3.067 N/A ARG 359.A NE PRO 560.A O no hydrogen 2.899 N/A ARG 359.A NH2 PRO 560.A O no hydrogen 2.959 N/A VAL 360.A N ILE 356.A O no hydrogen 2.748 N/A LEU 361.A N GLU 357.A O no hydrogen 2.785 N/A ALA 362.A N LEU 358.A O no hydrogen 2.918 N/A HIS 363.A N ARG 359.A O no hydrogen 3.223 N/A ILE 364.A N VAL 360.A O no hydrogen 2.934 N/A ALA 365.A N LEU 361.A O no hydrogen 2.919 N/A ASN 369.A ND2 ASP 387.A OD2 no hydrogen 2.616 N/A ASN 369.A ND2 SER 441.A O no hydrogen 2.913 N/A LEU 370.A N ASP 367.A OD1 no hydrogen 2.702 N/A MET 371.A N ASP 367.A O no hydrogen 2.866 N/A GLU 372.A N ASP 368.A O no hydrogen 2.994 N/A ALA 373.A N ASN 369.A O no hydrogen 3.080 N/A PHE 374.A N LEU 370.A O no hydrogen 3.280 N/A ARG 375.A N MET 371.A O no hydrogen 2.976 N/A ARG 375.A NE ARG 558.A O no hydrogen 3.205 N/A ARG 375.A NH2 ARG 558.A O no hydrogen 2.710 N/A ARG 376.A N GLU 372.A O no hydrogen 2.899 N/A ARG 376.A NE GLU 372.A OE1 no hydrogen 2.763 N/A ARG 376.A NH2 GLU 372.A OE1 no hydrogen 3.021 N/A ASP 377.A N PHE 374.A O no hydrogen 2.847 N/A LEU 378.A N ALA 373.A O no hydrogen 2.974 N/A THR 382.A N ASP 379.A OD1 no hydrogen 2.982 N/A LYS 383.A N ASP 379.A O no hydrogen 2.986 N/A LYS 383.A NZ ASP 387.A OD1 no hydrogen 3.539 N/A THR 384.A N ILE 380.A O no hydrogen 2.974 N/A THR 384.A OG1 ILE 380.A O no hydrogen 2.793 N/A THR 384.A OG1 ASN 408.A OD1 no hydrogen 3.314 N/A ALA 385.A N HIS 381.A O no hydrogen 3.015 N/A MET 386.A N THR 382.A O no hydrogen 2.904 N/A ASP 387.A N LYS 383.A O no hydrogen 3.029 N/A ILE 388.A N THR 384.A O no hydrogen 2.816 N/A PHE 389.A N ALA 385.A O no hydrogen 2.854 N/A VAL 391.A N MET 386.A O no hydrogen 3.147 N/A SER 392.A N GLU 395.A OE1 no hydrogen 2.879 N/A SER 392.A OG ASP 394.A OD1.B no hydrogen 2.678 N/A SER 392.A OG GLU 395.A OE1 no hydrogen 2.805 N/A GLU 395.A N SER 392.A O no hydrogen 2.939 N/A GLU 395.A N SER 392.A OG no hydrogen 3.428 N/A VAL 396.A N GLU 393.A O no hydrogen 3.077 N/A MET 400.A N THR 397.A OG1 no hydrogen 3.379 N/A ARG 401.A N THR 397.A O no hydrogen 3.031 N/A ARG 401.A NE ASP 379.A OD1 no hydrogen 3.366 N/A ARG 401.A NE ASP 379.A OD2 no hydrogen 3.259 N/A ARG 401.A NH2 ASP 379.A OD1 no hydrogen 3.172 N/A ARG 401.A NH2 ASP 379.A OD2 no hydrogen 2.670 N/A ARG 402.A N PRO 398.A O no hydrogen 2.964 N/A GLN 403.A N ASN 399.A O no hydrogen 3.035 N/A ALA 404.A N MET 400.A O no hydrogen 2.950 N/A LYS 405.A N ARG 401.A O no hydrogen 2.932 N/A ALA 406.A N ARG 402.A O no hydrogen 3.181 N/A VAL 407.A N GLN 403.A O no hydrogen 3.064 N/A ASN 408.A N ALA 404.A O no hydrogen 2.896 N/A ASN 408.A ND2 HIS 381.A ND1 no hydrogen 2.937 N/A ASN 408.A ND2 THR 384.A OG1 no hydrogen 3.055 N/A PHE 409.A N LYS 405.A O no hydrogen 2.948 N/A GLY 410.A N ALA 406.A O no hydrogen 2.844 N/A ILE 411.A N VAL 407.A O no hydrogen 2.763 N/A VAL 412.A N ASN 408.A O no hydrogen 3.161 N/A TYR 413.A N PHE 409.A O no hydrogen 3.020 N/A GLY 414.A N ILE 411.A O no hydrogen 3.336 N/A GLY 419.A N SER 416.A OG no hydrogen 3.123 N/A LEU 420.A N SER 416.A O no hydrogen 3.196 N/A ALA 421.A N ASP 417.A O no hydrogen 2.878 N/A GLN 422.A N TYR 418.A O no hydrogen 2.955 N/A GLN 422.A NE2.B TYR 418.A O no hydrogen 3.350 N/A ASN 423.A N GLY 419.A O no hydrogen 2.936 N/A LEU 424.A N LEU 420.A O no hydrogen 2.740 N/A ILE 426.A N ALA 421.A O no hydrogen 3.171 N/A SER 427.A N GLU 430.A OE1 no hydrogen 2.756 N/A SER 427.A OG GLU 430.A OE1 no hydrogen 3.109 N/A GLU 430.A N SER 427.A OG no hydrogen 3.086 N/A ALA 431.A N SER 427.A O no hydrogen 2.865 N/A ALA 432.A N ARG 428.A O no hydrogen 2.794 N/A GLU 433.A N LYS 429.A O no hydrogen 3.082 N/A PHE 434.A N GLU 430.A O no hydrogen 3.211 N/A ILE 435.A N ALA 431.A O no hydrogen 3.071 N/A GLU 436.A N ALA 432.A O no hydrogen 2.840 N/A ARG 437.A N GLU 433.A O no hydrogen 2.941 N/A ARG 437.A NE.A GLU 433.A OE2.B no hydrogen 3.114 N/A ARG 437.A NH1.B ASP 387.A O no hydrogen 3.077 N/A TYR 438.A N PHE 434.A O no hydrogen 2.707 N/A PHE 439.A N ILE 435.A O no hydrogen 2.901 N/A GLU 440.A N GLU 436.A O no hydrogen 3.073 N/A SER 441.A N ARG 437.A O no hydrogen 3.177 N/A SER 441.A OG ARG 437.A O no hydrogen 3.265 N/A PHE 442.A N TYR 438.A O no hydrogen 2.877 N/A VAL 445.A N ASP 367.A OD2 no hydrogen 3.168 N/A LYS 446.A N PHE 442.A O no hydrogen 3.151 N/A ARG 447.A N PRO 443.A O no hydrogen 2.891 N/A TYR 448.A N GLY 444.A O no hydrogen 2.862 N/A MET 449.A N VAL 445.A O no hydrogen 2.881 N/A GLU 450.A N LYS 446.A O no hydrogen 2.999 N/A ASN 451.A N ARG 447.A O no hydrogen 2.868 N/A ILE 452.A N TYR 448.A O no hydrogen 2.880 N/A VAL 453.A N MET 449.A O no hydrogen 3.378 N/A GLN 454.A N GLU 450.A O no hydrogen 3.157 N/A GLU 455.A N ASN 451.A O no hydrogen 2.746 N/A ALA 456.A N ILE 452.A O no hydrogen 2.923 N/A LYS 457.A N VAL 453.A O no hydrogen 3.159 N/A GLN 458.A N GLN 454.A O no hydrogen 3.032 N/A LYS 459.A N GLU 455.A O no hydrogen 2.988 N/A GLY 460.A N ALA 456.A O no hydrogen 2.864 N/A VAL 462.A N ARG 470.A O no hydrogen 3.009 N/A THR 464.A N ARG 468.A O no hydrogen 2.974 N/A THR 464.A OG1 ASP 501.A OD1 no hydrogen 2.546 N/A LEU 465.A N SER 498.A OG no hydrogen 2.837 N/A LEU 466.A N ASP 501.A OD1 no hydrogen 2.921 N/A HIS 467.A N THR 464.A O no hydrogen 2.860 N/A HIS 467.A ND1 GLU 172.A O no hydrogen 3.051 N/A ARG 468.A N THR 464.A OG1 no hydrogen 3.094 N/A ARG 468.A NE ASP 501.A OD2 no hydrogen 2.981 N/A ARG 468.A NH1 GLU 181.A OE2 no hydrogen 2.684 N/A ARG 468.A NH2 GLU 181.A OE2 no hydrogen 2.764 N/A ARG 468.A NH2 ASP 501.A OD2 no hydrogen 2.823 N/A ARG 469.A NH1 TYR 471.A OH no hydrogen 3.141 N/A ARG 470.A N VAL 462.A O no hydrogen 3.039 N/A ARG 470.A NH1 THR 493.A OG1 no hydrogen 2.733 N/A LEU 472.A N GLY 460.A O no hydrogen 2.939 N/A ILE 475.A N LEU 472.A O no hydrogen 3.255 N/A THR 476.A OG1 PRO 473.A O no hydrogen 3.530 N/A SER 477.A N ASP 474.A O no hydrogen 3.099 N/A SER 477.A OG ASN 479.A O no hydrogen 3.530 N/A ASN 479.A N SER 477.A OG no hydrogen 3.006 N/A VAL 482.A N ASN 479.A OD1 no hydrogen 3.099 N/A ARG 483.A N ASN 479.A O no hydrogen 3.004 N/A ARG 483.A NH1 SER 477.A O no hydrogen 2.836 N/A SER 484.A N PHE 480.A O no hydrogen 2.963 N/A SER 484.A OG PHE 480.A O no hydrogen 2.772 N/A PHE 485.A N ASN 481.A O no hydrogen 3.094 N/A ALA 486.A N VAL 482.A O no hydrogen 3.156 N/A GLU 487.A N ARG 483.A O no hydrogen 3.008 N/A ARG 488.A N SER 484.A O no hydrogen 2.978 N/A MET 489.A N PHE 485.A O no hydrogen 3.006 N/A ALA 490.A N ALA 486.A O no hydrogen 2.867 N/A MET 491.A N GLU 487.A O no hydrogen 3.048 N/A ASN 492.A N ARG 488.A O no hydrogen 2.826 N/A ASN 492.A ND2 VAL 412.A O no hydrogen 2.792 N/A THR 493.A N MET 489.A O no hydrogen 2.897 N/A THR 493.A OG1 MET 489.A O no hydrogen 3.013 N/A ILE 495.A N ASN 492.A O no hydrogen 2.970 N/A GLN 496.A N ASN 492.A O no hydrogen 2.888 N/A GLY 497.A N THR 493.A O no hydrogen 2.813 N/A SER 498.A N PRO 494.A O no hydrogen 3.018 N/A SER 498.A OG PRO 494.A O no hydrogen 2.634 N/A ALA 499.A N ILE 495.A O no hydrogen 3.098 N/A ALA 500.A N GLN 496.A O no hydrogen 3.091 N/A ASP 501.A N GLY 497.A O no hydrogen 2.924 N/A ILE 502.A N SER 498.A O no hydrogen 3.001 N/A ILE 503.A N ALA 499.A O no hydrogen 3.180 N/A LYS 504.A N ALA 500.A O no hydrogen 3.072 N/A LYS 504.A NZ GLU 181.A OE1 no hydrogen 3.048 N/A LYS 504.A NZ GLU 181.A OE2 no hydrogen 2.929 N/A LYS 504.A NZ GLY 313.A O no hydrogen 2.816 N/A LYS 505.A N ASP 501.A O no hydrogen 3.105 N/A LYS 505.A NZ ASP 509.A OD2 no hydrogen 3.229 N/A LYS 505.A NZ ALA 554.A O no hydrogen 2.927 N/A ALA 506.A N ILE 502.A O no hydrogen 2.878 N/A MET 507.A N ILE 503.A O no hydrogen 2.914 N/A ILE 508.A N LYS 504.A O no hydrogen 3.155 N/A ASP 509.A N LYS 505.A O no hydrogen 2.883 N/A LEU 510.A N ALA 506.A O no hydrogen 2.660 N/A ASN 511.A N MET 507.A O no hydrogen 3.001 N/A ALA 512.A N ILE 508.A O no hydrogen 3.174 N/A ARG 513.A N ASP 509.A O no hydrogen 3.076 N/A ARG 513.A NE GLU 517.A OE1 no hydrogen 3.404 N/A ARG 513.A NH2 GLU 517.A OE1 no hydrogen 3.052 N/A LEU 514.A N LEU 510.A O no hydrogen 2.819 N/A LYS 515.A N ASN 511.A O no hydrogen 3.144 N/A GLU 516.A N ALA 512.A O no hydrogen 2.956 N/A GLU 517.A N ARG 513.A O no hydrogen 2.811 N/A ARG 518.A N LYS 515.A O no hydrogen 2.975 N/A ARG 518.A NE LYS 515.A O no hydrogen 3.181 N/A ARG 518.A NH2 LYS 515.A O no hydrogen 3.136 N/A LEU 519.A N LEU 514.A O no hydrogen 3.014 N/A GLN 520.A N GLU 539.A OE1 no hydrogen 2.652 N/A ALA 521.A N GLU 539.A OE2 no hydrogen 2.837 N/A HIS 522.A N GLU 534.A O no hydrogen 3.124 N/A LEU 524.A N ILE 532.A O no hydrogen 2.809 N/A LEU 525.A N ILE 532.A O no hydrogen 3.197 N/A VAL 527.A N GLU 530.A O no hydrogen 2.740 N/A HIS 528.A N GLN 526.A OE1 no hydrogen 2.743 N/A ASP 529.A N VAL 527.A O no hydrogen 2.671 N/A LEU 531.A N ALA 351.A O no hydrogen 2.931 N/A ILE 532.A N LEU 525.A O no hydrogen 2.929 N/A LEU 533.A N PHE 349.A O no hydrogen 2.806 N/A GLU 534.A N HIS 522.A O no hydrogen 3.169 N/A ALA 535.A N LEU 347.A O no hydrogen 3.090 N/A LYS 537.A N ASP 345.A O no hydrogen 2.837 N/A GLU 539.A N PRO 536.A O no hydrogen 2.911 N/A MET 540.A N LYS 537.A O no hydrogen 3.251 N/A ARG 542.A NH2 GLU 517.A OE2 no hydrogen 3.019 N/A LEU 543.A N GLU 539.A O no hydrogen 2.936 N/A CYS 544.A N MET 540.A O no hydrogen 2.961 N/A CYS 544.A SG MET 540.A O no hydrogen 3.375 N/A ARG 545.A N ARG 542.A O no hydrogen 3.208 N/A LEU 546.A N ARG 542.A O no hydrogen 2.878 N/A VAL 547.A N LEU 543.A O no hydrogen 2.820 N/A VAL 550.A N LEU 546.A O no hydrogen 2.970 N/A MET 551.A N VAL 547.A O no hydrogen 2.958 N/A GLU 552.A N PRO 548.A O no hydrogen 2.649 N/A GLN 553.A N GLU 549.A O no hydrogen 3.002 N/A GLN 553.A N VAL 550.A O no hydrogen 3.204 N/A ALA 554.A N MET 551.A O no hydrogen 3.386 N/A ARG 558.A N HIS 363.A ND1 no hydrogen 2.950 N/A ARG 558.A NH1 HIS 363.A O no hydrogen 2.696 N/A LYS 562.A NZ ASP 377.A OD1 no hydrogen 3.175 N/A LYS 562.A NZ ASP 377.A OD2 no hydrogen 3.354 N/A ASP 564.A N ASP 352.A O no hydrogen 2.924 N/A HIS 566.A N ALA 350.A O no hydrogen 2.912 N/A GLY 568.A N ILE 348.A O no hydrogen 3.042 N/A SER 569.A OG ASP 573.A OD1 no hydrogen 3.481 N/A THR 570.A OG1 ASP 573.A OD1 no hydrogen 3.059 N/A TRP 571.A N PHE 339.A O no hydrogen 2.863 N/A TYR 572.A N ARG 336.A O no hydrogen 3.186 N/A TYR 572.A OH GLU 330.A OE2 no hydrogen 2.970 N/A ASP 573.A N THR 570.A O no hydrogen 2.971 N/A ASP 573.A N THR 570.A OG1 no hydrogen 3.269 N/A ALA 574.A N THR 570.A O no hydrogen 3.226 N/A ALA 574.A N TRP 571.A O no hydrogen 3.235 N/A