Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3dwk_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ILE 3.A N GLN 232.A O no hydrogen 2.918 N/A LYS 6.A N ILE 235.A O no hydrogen 3.315 N/A ILE 7.A N LYS 16.A O no hydrogen 2.804 N/A TYR 8.A N ILE 237.A O no hydrogen 2.816 N/A ASP 9.A N GLU 13.A O no hydrogen 3.073 N/A LYS 10.A N MET 241.A O no hydrogen 2.920 N/A ASN 11.A N ASP 9.A OD1 no hydrogen 3.005 N/A GLY 12.A N ASP 9.A O no hydrogen 3.470 N/A GLU 13.A N ASP 9.A OD1 no hydrogen 3.054 N/A VAL 15.A N ILE 7.A O no hydrogen 2.927 N/A LYS 16.A N ILE 7.A O no hydrogen 3.313 N/A THR 17.A OG1 ASP 19.A OD2 no hydrogen 3.326 N/A LEU 18.A N ALA 5.A O no hydrogen 2.935 N/A ARG 23.A N GLY 111.A O no hydrogen 3.371 N/A ARG 23.A NH1 ASP 110.A O no hydrogen 3.047 N/A ARG 23.A NH1 ARG 199.A O no hydrogen 3.058 N/A ARG 23.A NH2 GLU 198.A O no hydrogen 2.670 N/A HIS 24.A ND1 THR 113.A OG1 no hydrogen 3.056 N/A HIS 26.A NE2 ASN 28.A OD1 no hydrogen 2.935 N/A VAL 27.A N ASN 104.A OD1 no hydrogen 3.038 N/A LEU 29.A N GLN 100.A OE1 no hydrogen 2.910 N/A ASP 31.A N ASN 28.A O no hydrogen 2.949 N/A LYS 34.A NZ ASP 38.A OD1 no hydrogen 2.874 N/A LYS 34.A NZ ASP 38.A OD2 no hydrogen 3.042 N/A SER 35.A OG GLU 135.A OE1 no hydrogen 3.433 N/A SER 35.A OG GLU 135.A OE2 no hydrogen 2.723 N/A MET 36.A N PRO 33.A O no hydrogen 2.956 N/A LYS 37.A N PRO 33.A O no hydrogen 3.182 N/A LYS 37.A NZ LEU 29.A O no hydrogen 3.123 N/A ASP 38.A N LYS 34.A O no hydrogen 2.783 N/A ALA 39.A N SER 35.A O no hydrogen 2.990 N/A VAL 40.A N MET 36.A O no hydrogen 3.001 N/A LEU 41.A N LYS 37.A O no hydrogen 2.978 N/A ALA 42.A N ASP 38.A O no hydrogen 2.939 N/A THR 43.A N ALA 39.A O no hydrogen 3.141 N/A THR 43.A N VAL 40.A O no hydrogen 3.017 N/A GLU 44.A N VAL 40.A O no hydrogen 2.806 N/A GLU 44.A N LEU 41.A O no hydrogen 3.050 N/A ASP 45.A N LEU 41.A O no hydrogen 2.907 N/A ARG 47.A NH1 GLU 50.A OE2 no hydrogen 2.668 N/A TYR 49.A OH ASP 96.A OD1 no hydrogen 2.714 N/A GLU 50.A N ARG 47.A O no hydrogen 3.307 N/A HIS 51.A N ARG 47.A O no hydrogen 3.111 N/A ARG 58.A N ASP 55.A OD2 no hydrogen 3.080 N/A ARG 58.A NE SER 62.A O no hydrogen 2.719 N/A ARG 58.A NH2 SER 62.A O no hydrogen 3.382 N/A LEU 59.A N ASP 55.A O no hydrogen 3.002 N/A PHE 60.A N TYR 56.A O no hydrogen 3.192 N/A THR 63.A OG1 ASP 45.A OD2 no hydrogen 3.223 N/A THR 63.A OG1 ALA 53.A O no hydrogen 3.381 N/A LEU 64.A N ASP 45.A OD2 no hydrogen 3.105 N/A THR 65.A OG1 GLU 90.A OE1 no hydrogen 2.813 N/A GLN 67.A N THR 63.A O no hydrogen 2.975 N/A GLN 67.A NE2 SER 62.A OG no hydrogen 3.425 N/A VAL 68.A N LEU 64.A O no hydrogen 3.073 N/A VAL 69.A N THR 65.A O no hydrogen 3.128 N/A LYS 70.A N GLN 66.A O no hydrogen 2.735 N/A LYS 70.A NZ GLU 82.A OE1 no hydrogen 2.938 N/A ASP 71.A N GLN 67.A O no hydrogen 2.869 N/A ALA 72.A N VAL 69.A O no hydrogen 2.767 N/A LYS 79.A NZ GLU 82.A OE1 no hydrogen 3.483 N/A LYS 79.A NZ GLU 82.A OE2 no hydrogen 3.114 N/A ALA 80.A N GLY 77.A O no hydrogen 2.729 N/A GLU 82.A N ARG 78.A O no hydrogen 3.441 N/A ALA 83.A N LYS 79.A O no hydrogen 2.956 N/A TYR 84.A N ALA 80.A O no hydrogen 2.688 N/A LEU 85.A N GLN 81.A O no hydrogen 2.835 N/A SER 86.A N GLU 82.A O no hydrogen 2.652 N/A SER 86.A OG GLU 82.A O no hydrogen 2.716 N/A TYR 87.A N ALA 83.A O no hydrogen 2.807 N/A ARG 88.A N TYR 84.A O no hydrogen 2.864 N/A LEU 89.A N LEU 85.A O no hydrogen 2.758 N/A GLU 90.A N SER 86.A O no hydrogen 2.880 N/A GLN 91.A N TYR 87.A O no hydrogen 2.924 N/A GLN 91.A N ARG 88.A O no hydrogen 2.850 N/A GLU 92.A N ARG 88.A O no hydrogen 2.940 N/A TYR 93.A N LEU 89.A O no hydrogen 2.923 N/A LYS 95.A NZ PHE 48.A O no hydrogen 2.705 N/A LYS 95.A NZ GLU 90.A OE1 no hydrogen 2.887 N/A ASP 97.A N SER 94.A OG no hydrogen 3.305 N/A ILE 98.A N SER 94.A O no hydrogen 3.004 N/A PHE 99.A N LYS 95.A O no hydrogen 2.861 N/A GLN 100.A N ASP 96.A O no hydrogen 2.861 N/A VAL 101.A N ASP 97.A O no hydrogen 2.977 N/A TYR 102.A N ILE 98.A O no hydrogen 2.941 N/A LEU 103.A N PHE 99.A O no hydrogen 3.114 N/A ASN 104.A N VAL 101.A O no hydrogen 3.205 N/A ASN 104.A ND2 VAL 27.A O no hydrogen 3.043 N/A LYS 105.A N TYR 102.A O no hydrogen 3.458 N/A ILE 106.A N TYR 102.A O no hydrogen 3.397 N/A TYR 108.A N VAL 112.A O no hydrogen 2.631 N/A SER 109.A OG ASP 110.A OD2 no hydrogen 3.404 N/A GLY 111.A N TYR 107.A OH no hydrogen 2.990 N/A VAL 112.A N SER 109.A O no hydrogen 2.744 N/A THR 113.A N ARG 23.A O no hydrogen 3.402 N/A THR 113.A OG1 HIS 24.A ND1 no hydrogen 3.056 N/A GLY 114.A N ILE 106.A O no hydrogen 3.174 N/A ILE 115.A N LEU 103.A O no hydrogen 3.068 N/A LYS 116.A NZ HIS 26.A O no hydrogen 3.021 N/A ALA 118.A N GLY 114.A O no hydrogen 2.804 N/A ALA 119.A N ILE 115.A O no hydrogen 3.017 N/A LYS 120.A N LYS 116.A O no hydrogen 3.508 N/A TYR 121.A N ALA 117.A O no hydrogen 2.941 N/A TYR 121.A OH ASP 110.A OD1 no hydrogen 2.815 N/A TYR 122.A N ALA 118.A O no hydrogen 3.368 N/A TYR 122.A OH TYR 108.A O no hydrogen 3.001 N/A PHE 123.A N ALA 119.A O no hydrogen 2.885 N/A LYS 125.A NZ GLU 134.A OE1 no hydrogen 2.778 N/A LYS 125.A NZ GLU 134.A OE2 no hydrogen 3.370 N/A ASN 131.A N GLU 134.A OE1 no hydrogen 3.060 N/A GLU 134.A N ASN 131.A OD1 no hydrogen 2.753 N/A GLU 135.A N ASN 131.A O no hydrogen 2.929 N/A ALA 136.A N LEU 132.A O no hydrogen 2.848 N/A TYR 137.A N ALA 133.A O no hydrogen 3.028 N/A TYR 137.A OH TYR 148.A O no hydrogen 2.808 N/A LEU 138.A N GLU 134.A O no hydrogen 3.023 N/A ALA 139.A N GLU 135.A O no hydrogen 2.885 N/A ALA 139.A N ALA 136.A O no hydrogen 3.205 N/A GLY 140.A N ALA 136.A O no hydrogen 3.068 N/A LEU 141.A N TYR 137.A O no hydrogen 2.902 N/A GLN 143.A N GLY 140.A O no hydrogen 3.441 N/A ASN 147.A N VAL 144.A O no hydrogen 3.000 N/A TYR 148.A N VAL 144.A O no hydrogen 3.272 N/A TYR 148.A OH GLN 143.A OE1 no hydrogen 2.933 N/A ASN 149.A N PRO 145.A O no hydrogen 3.246 N/A ASN 149.A ND2 SER 109.A OG no hydrogen 2.904 N/A ILE 150.A N TYR 137.A OH no hydrogen 2.983 N/A TYR 151.A OH VAL 192.A O no hydrogen 2.788 N/A ASP 152.A N ASN 149.A O no hydrogen 3.087 N/A HIS 153.A N ASN 149.A O no hydrogen 2.834 N/A ALA 157.A N HIS 153.A O no hydrogen 2.914 N/A GLU 158.A N PRO 154.A O no hydrogen 2.983 N/A ASP 159.A N LYS 155.A O no hydrogen 3.084 N/A ARG 160.A N ALA 156.A O no hydrogen 2.828 N/A ARG 160.A NE GLY 140.A O no hydrogen 2.913 N/A LYS 161.A N ALA 157.A O no hydrogen 3.163 N/A LYS 161.A NZ GLU 158.A OE2 no hydrogen 3.127 N/A LYS 161.A NZ ASN 162.A OD1 no hydrogen 2.759 N/A ASN 162.A N GLU 158.A O no hydrogen 2.958 N/A THR 163.A N ASP 159.A O no hydrogen 2.924 N/A THR 163.A OG1 ASP 159.A O no hydrogen 2.821 N/A VAL 164.A N ARG 160.A O no hydrogen 3.024 N/A LEU 165.A N LYS 161.A O no hydrogen 3.152 N/A TYR 166.A N ASN 162.A O no hydrogen 2.853 N/A LEU 167.A N THR 163.A O no hydrogen 2.796 N/A MET 168.A N VAL 164.A O no hydrogen 2.775 N/A HIS 169.A N LEU 165.A O no hydrogen 3.009 N/A TYR 170.A N TYR 166.A O no hydrogen 2.759 N/A HIS 171.A N LEU 167.A O no hydrogen 2.838 N/A LYS 172.A N HIS 169.A O no hydrogen 2.862 N/A ARG 173.A N MET 168.A O no hydrogen 2.838 N/A THR 175.A N GLN 178.A OE1 no hydrogen 2.868 N/A GLN 178.A N THR 175.A OG1 no hydrogen 2.899 N/A TRP 179.A N THR 175.A O no hydrogen 3.337 N/A GLU 180.A N ASP 176.A O no hydrogen 3.484 N/A ASP 181.A N LYS 177.A O no hydrogen 2.756 N/A ALA 182.A N GLN 178.A O no hydrogen 2.934 N/A LYS 183.A N TRP 179.A O no hydrogen 3.051 N/A LYS 184.A N ASP 181.A O no hydrogen 3.234 N/A ILE 185.A N ALA 182.A O no hydrogen 3.047 N/A LYS 188.A N ASP 186.A OD2 no hydrogen 3.283 N/A ALA 189.A N ASP 186.A O no hydrogen 3.368 N/A ASN 190.A ND2 GLU 134.A OE2 no hydrogen 2.841 N/A LEU 191.A N LYS 188.A O no hydrogen 2.788 N/A VAL 192.A N TYR 122.A O no hydrogen 2.969 N/A ARG 194.A NH2 TYR 121.A O no hydrogen 3.301 N/A THR 195.A N GLU 198.A OE2 no hydrogen 2.640 N/A THR 195.A OG1 GLU 198.A OE2 no hydrogen 2.625 N/A GLU 197.A N THR 195.A OG1 no hydrogen 3.263 N/A GLU 198.A N GLU 198.A OE2 no hydrogen 3.000 N/A ARG 199.A N THR 195.A O no hydrogen 3.365 N/A ARG 199.A NH1 ASP 110.A OD1 no hydrogen 3.015 N/A ARG 199.A NH1 ASP 110.A OD2 no hydrogen 2.955 N/A ARG 199.A NH1 ASP 152.A OD1 no hydrogen 3.031 N/A ARG 199.A NH2 ASP 152.A OD2 no hydrogen 2.438 N/A GLN 200.A N GLU 197.A O no hydrogen 3.101 N/A ASN 201.A N GLU 197.A O no hydrogen 2.907 N/A GLU 204.A N GLU 204.A OE1 no hydrogen 2.764 N/A ASN 206.A N SER 203.A O no hydrogen 3.023 N/A SER 207.A OG GLN 250.A OE1 no hydrogen 3.254 N/A TYR 208.A OH LEU 278.A O no hydrogen 2.551 N/A VAL 209.A N TYR 205.A O no hydrogen 2.761 N/A ASN 210.A N ASN 206.A O no hydrogen 2.839 N/A ASN 210.A ND2 ASP 289.A O no hydrogen 3.538 N/A ASN 210.A ND2 ASP 289.A OD1 no hydrogen 3.331 N/A PHE 211.A N SER 207.A O no hydrogen 2.961 N/A VAL 212.A N TYR 208.A O no hydrogen 2.823 N/A LYS 213.A N VAL 209.A O no hydrogen 2.840 N/A LYS 213.A NZ ASP 289.A OD1 no hydrogen 3.108 N/A LYS 213.A NZ ASP 289.A OD2 no hydrogen 3.038 N/A SER 214.A N PHE 211.A O no hydrogen 3.054 N/A GLU 215.A N PHE 211.A O no hydrogen 3.120 N/A LEU 216.A N VAL 212.A O no hydrogen 2.814 N/A ASN 218.A N GLU 215.A O no hydrogen 3.151 N/A ALA 221.A N ASN 219.A OD1 no hydrogen 3.191 N/A PHE 222.A N ASN 219.A O no hydrogen 3.235 N/A LYS 223.A N LYS 220.A O no hydrogen 3.247 N/A GLU 225.A N PHE 222.A O no hydrogen 3.030 N/A ASN 226.A ND2 GLU 225.A O no hydrogen 2.991 N/A VAL 230.A N LEU 227.A O no hydrogen 3.014 N/A LEU 231.A N LEU 227.A O no hydrogen 3.319 N/A SER 233.A OG VAL 230.A O no hydrogen 2.926 N/A GLY 234.A N ILE 3.A O no hydrogen 2.844 N/A LYS 236.A N VAL 437.A O no hydrogen 2.881 N/A ILE 237.A N LYS 6.A O no hydrogen 2.838 N/A TYR 238.A N LYS 435.A O no hydrogen 3.006 N/A THR 239.A N TYR 8.A O no hydrogen 2.899 N/A THR 239.A OG1 TYR 8.A O no hydrogen 2.764 N/A ASN 240.A N SER 432.A O no hydrogen 2.948 N/A MET 241.A N THR 239.A OG1 no hydrogen 3.290 N/A ASP 242.A N VAL 279.A O no hydrogen 2.928 N/A LYS 243.A NZ GLU 13.A OE2 no hydrogen 3.457 N/A ASP 244.A N ASP 242.A OD1 no hydrogen 2.995 N/A VAL 245.A N ASP 242.A OD1 no hydrogen 3.229 N/A GLN 246.A N ASP 242.A O no hydrogen 2.902 N/A GLN 246.A NE2 GLU 204.A O no hydrogen 2.734 N/A GLN 246.A NE2 ILE 281.A O no hydrogen 2.688 N/A LYS 247.A N LYS 243.A O no hydrogen 3.296 N/A THR 248.A N ASP 244.A O no hydrogen 2.993 N/A THR 248.A OG1 ASP 244.A O no hydrogen 3.063 N/A LEU 249.A N VAL 245.A O no hydrogen 2.830 N/A GLN 250.A N GLN 246.A O no hydrogen 3.182 N/A GLN 250.A NE2 ASP 254.A OD1 no hydrogen 3.488 N/A GLN 250.A NE2 ASP 254.A OD2 no hydrogen 2.942 N/A GLN 250.A NE2 GLY 284.A O no hydrogen 3.116 N/A ASN 251.A N LYS 247.A O no hydrogen 2.842 N/A ASP 252.A N THR 248.A O no hydrogen 2.941 N/A VAL 253.A N LEU 249.A O no hydrogen 3.126 N/A ASP 254.A N GLN 250.A O no hydrogen 2.987 N/A ASN 255.A N ASN 251.A O no hydrogen 2.757 N/A TYR 259.A OH VAL 253.A O no hydrogen 2.561 N/A LYS 260.A N GLN 264.A OE1 no hydrogen 2.653 N/A LYS 260.A NZ GLY 537.A O no hydrogen 3.198 N/A LYS 260.A NZ GLU 538.A O no hydrogen 3.506 N/A LYS 260.A NZ SER 540.A O no hydrogen 2.659 N/A LYS 260.A NZ GLN 546.A OE1 no hydrogen 3.272 N/A ASN 261.A ND2 GLU 538.A O no hydrogen 3.148 N/A ASN 261.A ND2 ASN 539.A OD1 no hydrogen 3.131 N/A ASP 263.A N ASN 261.A OD1 no hydrogen 2.890 N/A GLN 264.A NE2 PHE 258.A O no hydrogen 2.787 N/A GLN 265.A N GLY 529.A O no hydrogen 2.652 N/A GLY 267.A N TRP 527.A O no hydrogen 2.971 N/A ALA 268.A N SER 282.A O no hydrogen 2.959 N/A THR 269.A N SER 525.A O no hydrogen 2.972 N/A THR 269.A OG1 THR 412.A OG1 no hydrogen 2.890 N/A ILE 270.A N ALA 280.A O no hydrogen 2.849 N/A LEU 271.A N THR 523.A O no hydrogen 2.874 N/A ASP 272.A N GLY 277.A O no hydrogen 2.867 N/A SER 273.A N GLN 521.A O no hydrogen 2.785 N/A SER 273.A OG THR 519.A O no hydrogen 2.845 N/A SER 273.A OG THR 523.A OG1 no hydrogen 3.149 N/A LYS 274.A N ASP 272.A OD1 no hydrogen 2.894 N/A LYS 274.A NZ GLU 567.A OE2 no hydrogen 3.343 N/A THR 275.A N ASP 272.A OD1 no hydrogen 3.276 N/A GLY 276.A N ASP 272.A O no hydrogen 2.720 N/A GLY 277.A N THR 275.A OG1 no hydrogen 2.907 N/A LEU 278.A N HIS 431.A O no hydrogen 3.045 N/A VAL 279.A N ILE 270.A O no hydrogen 2.732 N/A ALA 280.A N ILE 270.A O no hydrogen 3.122 N/A ILE 281.A N GLN 246.A OE1 no hydrogen 2.673 N/A SER 282.A N ALA 268.A O no hydrogen 2.888 N/A SER 282.A OG GLN 250.A OE1 no hydrogen 2.594 N/A SER 282.A OG GLY 284.A O no hydrogen 3.407 N/A GLY 283.A N SER 207.A OG no hydrogen 3.197 N/A ARG 285.A NH1 ASN 261.A O no hydrogen 3.464 N/A ARG 285.A NH1 GLN 264.A O no hydrogen 2.778 N/A ASP 286.A N ASP 254.A OD2 no hydrogen 2.763 N/A LYS 288.A N ASN 292.A OD1 no hydrogen 2.803 N/A ASN 292.A N LYS 288.A O no hydrogen 3.005 N/A ASN 294.A ND2 ASN 210.A OD1 no hydrogen 2.902 N/A GLN 295.A N GLY 283.A O no hydrogen 2.839 N/A ALA 296.A N ASN 294.A OD1 no hydrogen 2.825 N/A THR 297.A N ASN 294.A O no hydrogen 3.001 N/A THR 297.A OG1 ASN 294.A O no hydrogen 3.190 N/A ASP 298.A N ASN 294.A O no hydrogen 3.133 N/A HIS 300.A N PHE 409.A O no hydrogen 3.103 N/A HIS 300.A NE2 GLN 295.A O no hydrogen 2.937 N/A THR 302.A N GLY 403.A O no hydrogen 3.328 N/A THR 302.A N SER 407.A O no hydrogen 3.191 N/A THR 302.A OG1 GLY 303.A O no hydrogen 3.558 N/A THR 302.A OG1 SER 407.A O no hydrogen 3.367 N/A SER 305.A N THR 302.A O no hydrogen 3.209 N/A SER 305.A OG THR 302.A O no hydrogen 3.026 N/A LYS 307.A NZ SER 360.A OG no hydrogen 2.809 N/A LYS 307.A NZ PHE 361.A O no hydrogen 3.191 N/A LYS 307.A NZ ASN 362.A OD1 no hydrogen 2.835 N/A PHE 309.A N LEU 306.A O no hydrogen 2.830 N/A LEU 310.A N LEU 306.A O no hydrogen 3.071 N/A LEU 310.A N LYS 307.A O no hydrogen 3.338 N/A ALA 311.A N LYS 307.A O no hydrogen 2.970 N/A TYR 312.A N LYS 307.A O no hydrogen 3.266 N/A ALA 315.A N ALA 311.A O no hydrogen 3.214 N/A ILE 316.A N TYR 312.A O no hydrogen 2.896 N/A GLU 317.A N GLY 313.A O no hydrogen 2.965 N/A ASN 318.A N PRO 314.A O no hydrogen 2.890 N/A MET 319.A N ALA 315.A O no hydrogen 3.272 N/A LYS 320.A NZ TYR 457.A OH no hydrogen 3.552 N/A ALA 322.A N ASP 589.A OD2 no hydrogen 2.871 N/A THR 323.A N ILE 582.A O no hydrogen 2.778 N/A THR 323.A OG1 PRO 580.A O no hydrogen 2.589 N/A ASN 324.A ND2 THR 593.A O no hydrogen 3.163 N/A HIS 325.A N ALA 322.A O no hydrogen 2.973 N/A HIS 325.A ND1 ASP 589.A OD2 no hydrogen 2.686 N/A ALA 326.A N ASN 591.A O no hydrogen 3.186 N/A ILE 327.A N VAL 351.A O no hydrogen 2.861 N/A ASP 329.A N GLY 349.A O no hydrogen 2.652 N/A TYR 333.A OH GLN 370.A OE1 no hydrogen 2.674 N/A GLN 334.A NE2 THR 339.A OG1 no hydrogen 2.978 N/A VAL 335.A N SER 338.A O no hydrogen 3.172 N/A PHE 340.A N TYR 333.A O no hydrogen 2.854 N/A ASN 342.A ND2 ASP 329.A OD1 no hydrogen 3.423 N/A ASN 342.A ND2 ASP 329.A OD2 no hydrogen 3.080 N/A ASN 342.A ND2 LYS 346.A O no hydrogen 3.024 N/A THR 345.A N ASN 342.A O no hydrogen 2.873 N/A HIS 348.A N ASP 329.A OD2 no hydrogen 2.899 N/A HIS 348.A ND1 ASP 329.A OD2 no hydrogen 2.816 N/A GLY 349.A N SER 347.A OG no hydrogen 3.312 N/A THR 350.A OG1 GLN 328.A OE1 no hydrogen 2.988 N/A VAL 351.A N ILE 327.A O no hydrogen 2.892 N/A SER 352.A OG ASP 355.A OD2 no hydrogen 3.025 N/A ILE 353.A N HIS 325.A O no hydrogen 2.851 N/A ASP 355.A N SER 352.A O no hydrogen 2.973 N/A ASP 355.A N SER 352.A OG no hydrogen 3.416 N/A ALA 356.A N SER 352.A O no hydrogen 2.983 N/A LEU 357.A N ILE 353.A O no hydrogen 2.917 N/A ARG 358.A N TYR 354.A O no hydrogen 3.245 N/A ARG 358.A NE ASP 355.A OD1 no hydrogen 2.685 N/A ARG 358.A NH1 GLY 468.A O no hydrogen 2.674 N/A ARG 358.A NH1 LYS 471.A O no hydrogen 3.106 N/A ARG 358.A NH1 PRO 472.A O no hydrogen 2.993 N/A ARG 358.A NH2 ASP 355.A OD1 no hydrogen 3.480 N/A ARG 358.A NH2 PRO 472.A O no hydrogen 2.927 N/A GLN 359.A N ASP 355.A O no hydrogen 2.882 N/A SER 360.A N LEU 357.A O no hydrogen 3.043 N/A PHE 361.A N ALA 356.A O no hydrogen 3.147 N/A ASN 362.A N ASN 342.A OD1 no hydrogen 3.215 N/A ASN 362.A ND2 ARG 341.A O no hydrogen 3.625 N/A ILE 363.A N ASN 342.A OD1 no hydrogen 2.989 N/A LEU 366.A N ASN 362.A O no hydrogen 3.085 N/A LYS 367.A N ILE 363.A O no hydrogen 2.813 N/A LYS 367.A NZ GLN 328.A O no hydrogen 2.709 N/A LYS 367.A NZ GLU 330.A OE2 no hydrogen 3.247 N/A ALA 368.A N PRO 364.A O no hydrogen 2.917 N/A TRP 369.A N ALA 365.A O no hydrogen 2.963 N/A GLN 370.A N LEU 366.A O no hydrogen 2.905 N/A SER 371.A N LYS 367.A O no hydrogen 2.788 N/A SER 371.A OG LYS 367.A O no hydrogen 3.064 N/A VAL 372.A N ALA 368.A O no hydrogen 2.910 N/A LYS 373.A N TRP 369.A O no hydrogen 3.113 N/A GLN 374.A N GLN 370.A O no hydrogen 3.174 N/A ASN 375.A N SER 371.A O no hydrogen 3.073 N/A ALA 376.A N VAL 372.A O no hydrogen 3.129 N/A ALA 380.A N GLY 377.A O no hydrogen 2.939 N/A LYS 383.A N ASP 379.A O no hydrogen 3.009 N/A PHE 384.A N ALA 380.A O no hydrogen 3.035 N/A ALA 385.A N PRO 381.A O no hydrogen 3.003 N/A ALA 386.A N LYS 382.A O no hydrogen 2.731 N/A LYS 387.A N LYS 383.A O no hydrogen 3.137 N/A LYS 387.A N PHE 384.A O no hydrogen 3.238 N/A LYS 387.A NZ LYS 452.A O no hydrogen 3.517 N/A LEU 388.A N ALA 385.A O no hydrogen 2.939 N/A LEU 390.A N ALA 385.A O no hydrogen 3.106 N/A TYR 392.A OH SER 407.A OG no hydrogen 2.755 N/A GLY 397.A N GLU 400.A OE2 no hydrogen 3.171 N/A SER 399.A OG SER 405.A OG no hydrogen 2.744 N/A VAL 401.A N GLY 397.A O no hydrogen 3.313 N/A LEU 402.A N PRO 398.A O no hydrogen 3.275 N/A GLY 403.A N GLU 400.A O no hydrogen 3.150 N/A GLY 404.A N SER 399.A O no hydrogen 2.865 N/A SER 405.A OG SER 399.A OG no hydrogen 2.744 N/A ALA 406.A N GLU 400.A OE1 no hydrogen 2.930 N/A SER 407.A N GLY 404.A O no hydrogen 2.889 N/A SER 407.A OG TYR 392.A OH no hydrogen 2.755 N/A SER 407.A OG GLU 400.A O no hydrogen 2.557 N/A GLU 408.A N ALA 406.A O no hydrogen 2.830 N/A PHE 409.A N HIS 300.A O no hydrogen 3.194 N/A SER 410.A N GLN 413.A OE1 no hydrogen 3.003 N/A THR 412.A N ALA 296.A O no hydrogen 3.159 N/A THR 412.A OG1 THR 269.A OG1 no hydrogen 2.890 N/A THR 412.A OG1 ALA 296.A O no hydrogen 3.053 N/A GLN 413.A N SER 410.A OG no hydrogen 3.112 N/A LEU 414.A N SER 410.A O no hydrogen 3.048 N/A ALA 415.A N PRO 411.A O no hydrogen 2.831 N/A SER 416.A N THR 412.A O no hydrogen 3.128 N/A SER 416.A OG THR 412.A O no hydrogen 3.343 N/A SER 416.A OG ASN 428.A O no hydrogen 3.416 N/A ALA 417.A N GLN 413.A O no hydrogen 3.043 N/A PHE 418.A N LEU 414.A O no hydrogen 2.784 N/A ALA 419.A N ALA 415.A O no hydrogen 2.846 N/A ALA 420.A N ALA 417.A O no hydrogen 3.125 N/A ALA 422.A N PHE 418.A O no hydrogen 3.020 N/A ASN 423.A N ALA 420.A O no hydrogen 2.965 N/A ASN 423.A ND2 SER 273.A O no hydrogen 2.863 N/A ASN 423.A ND2 LYS 274.A O no hydrogen 3.196 N/A ASN 423.A ND2 THR 426.A O no hydrogen 3.380 N/A GLY 425.A N ALA 420.A O no hydrogen 2.906 N/A THR 426.A N ASN 423.A OD1 no hydrogen 3.199 N/A TYR 427.A N HIS 451.A O no hydrogen 2.940 N/A ASN 429.A N THR 449.A O no hydrogen 2.997 N/A ALA 430.A N SER 416.A OG no hydrogen 3.193 N/A HIS 431.A N GLY 276.A O no hydrogen 3.428 N/A HIS 431.A NE2 THR 275.A O no hydrogen 3.232 N/A SER 432.A N GLU 215.A OE1 no hydrogen 2.699 N/A SER 432.A N GLU 215.A OE2 no hydrogen 3.212 N/A SER 432.A OG GLU 215.A OE1 no hydrogen 2.884 N/A ILE 433.A N GLU 215.A OE2 no hydrogen 3.026 N/A GLN 434.A N TYR 238.A O no hydrogen 2.648 N/A VAL 436.A N ILE 444.A O no hydrogen 3.149 N/A VAL 437.A N LYS 236.A O no hydrogen 2.802 N/A THR 438.A N GLU 442.A O no hydrogen 2.993 N/A THR 438.A OG1 ASP 440.A OD1 no hydrogen 3.171 N/A THR 438.A OG1 ASP 440.A OD2 no hydrogen 3.379 N/A THR 438.A OG1 GLU 442.A O no hydrogen 3.443 N/A GLU 442.A N THR 438.A OG1 no hydrogen 3.230 N/A ILE 444.A N VAL 436.A O no hydrogen 3.006 N/A TYR 446.A N GLN 434.A O no hydrogen 3.301 N/A TYR 446.A OH LEU 216.A O no hydrogen 3.070 N/A HIS 448.A NE2 ASN 428.A OD1 no hydrogen 3.128 N/A SER 450.A OG ASN 428.A OD1 no hydrogen 3.330 N/A HIS 451.A N TYR 427.A O no hydrogen 3.157 N/A HIS 451.A NE2 LYS 387.A O no hydrogen 2.899 N/A ALA 453.A N GLY 425.A O no hydrogen 2.862 N/A MET 454.A N GLY 425.A O no hydrogen 3.053 N/A SER 455.A N GLU 317.A OE1 no hydrogen 3.093 N/A SER 455.A OG GLU 317.A OE1 no hydrogen 2.714 N/A SER 455.A OG GLU 317.A OE2 no hydrogen 2.792 N/A TYR 457.A N ASP 456.A OD1 no hydrogen 2.764 N/A TYR 457.A OH GLU 317.A O no hydrogen 3.069 N/A THR 458.A OG1 GLU 317.A OE1 no hydrogen 3.117 N/A ALA 459.A N SER 455.A O no hydrogen 3.285 N/A TYR 460.A N ASP 456.A O no hydrogen 3.048 N/A MET 461.A N TYR 457.A O no hydrogen 2.808 N/A LEU 462.A N THR 458.A O no hydrogen 2.899 N/A ALA 463.A N ALA 459.A O no hydrogen 2.878 N/A GLU 464.A N TYR 460.A O no hydrogen 2.766 N/A MET 465.A N MET 461.A O no hydrogen 2.834 N/A LEU 466.A N LEU 462.A O no hydrogen 2.884 N/A LYS 467.A N GLU 464.A O no hydrogen 3.189 N/A LYS 467.A NZ ASN 485.A OD1 no hydrogen 3.497 N/A LYS 467.A NZ ASP 568.A OD1 no hydrogen 3.271 N/A LYS 467.A NZ ASP 568.A OD2 no hydrogen 3.432 N/A GLY 468.A N MET 465.A O no hydrogen 2.778 N/A THR 469.A N LEU 466.A O no hydrogen 3.231 N/A THR 469.A OG1 ALA 488.A O no hydrogen 3.123 N/A PHE 470.A N LYS 467.A O no hydrogen 3.225 N/A LYS 471.A N GLY 468.A O no hydrogen 3.417 N/A GLY 474.A N LYS 471.A O no hydrogen 2.731 N/A SER 475.A N ARG 358.A O no hydrogen 2.861 N/A SER 475.A OG ARG 358.A O no hydrogen 3.316 N/A SER 475.A OG THR 490.A OG1 no hydrogen 2.978 N/A ALA 476.A N THR 469.A O no hydrogen 3.101 N/A TYR 477.A N GLY 474.A O no hydrogen 2.770 N/A HIS 479.A N ALA 476.A O no hydrogen 3.181 N/A HIS 479.A ND1 GLU 555.A OE2 no hydrogen 2.852 N/A HIS 479.A NE2 GLU 548.A OE1 no hydrogen 2.689 N/A ASN 485.A ND2 GLU 567.A O no hydrogen 2.879 N/A GLY 487.A N PHE 518.A O no hydrogen 3.154 N/A ALA 488.A N LEU 466.A O no hydrogen 2.927 N/A LYS 489.A N ASN 516.A O no hydrogen 2.782 N/A LYS 489.A NZ LEU 357.A O no hydrogen 3.381 N/A LYS 489.A NZ SER 360.A OG no hydrogen 3.219 N/A LYS 489.A NZ THR 490.A O no hydrogen 3.285 N/A THR 490.A OG1 SER 475.A OG no hydrogen 2.978 N/A GLY 491.A N TRP 514.A O no hydrogen 2.853 N/A GLY 493.A N ASP 512.A O no hydrogen 2.648 N/A TYR 495.A OH SER 540.A OG no hydrogen 2.708 N/A TYR 500.A N GLY 496.A O no hydrogen 3.287 N/A TYR 500.A OH ALA 509.A O no hydrogen 2.929 N/A SER 501.A N GLU 498.A O no hydrogen 3.069 N/A GLN 502.A N GLU 498.A O no hydrogen 3.186 N/A TYR 503.A N THR 499.A O no hydrogen 3.370 N/A ASN 504.A N SER 501.A O no hydrogen 2.976 N/A LEU 505.A N TYR 500.A O no hydrogen 2.839 N/A ASN 508.A N ASN 508.A OD1 no hydrogen 2.574 N/A ALA 510.A N PHE 541.A O no hydrogen 2.658 N/A LYS 511.A N GLY 493.A O no hydrogen 2.883 N/A ASP 512.A N GLY 493.A O no hydrogen 3.165 N/A VAL 513.A N MET 528.A O no hydrogen 3.026 N/A TRP 514.A N GLY 491.A O no hydrogen 2.625 N/A TRP 514.A NE1 PRO 301.A O no hydrogen 2.696 N/A ILE 515.A N VAL 526.A O no hydrogen 2.933 N/A ASN 516.A N LYS 489.A O no hydrogen 2.958 N/A ASN 516.A ND2 SER 305.A OG no hydrogen 3.173 N/A ASN 516.A ND2 LYS 489.A O no hydrogen 2.857 N/A GLY 517.A N MET 524.A O no hydrogen 2.904 N/A PHE 518.A N GLY 487.A O no hydrogen 2.914 N/A THR 519.A N TYR 522.A O no hydrogen 2.666 N/A THR 519.A OG1 TYR 522.A O no hydrogen 3.275 N/A GLN 521.A N THR 519.A OG1 no hydrogen 3.265 N/A TYR 522.A N THR 519.A OG1 no hydrogen 3.011 N/A THR 523.A N LEU 271.A O no hydrogen 3.154 N/A THR 523.A OG1 SER 273.A OG no hydrogen 3.149 N/A MET 524.A N GLY 517.A O no hydrogen 2.732 N/A SER 525.A N THR 269.A O no hydrogen 2.926 N/A SER 525.A OG ASN 516.A OD1 no hydrogen 2.596 N/A VAL 526.A N ILE 515.A O no hydrogen 2.858 N/A TRP 527.A N GLY 267.A O no hydrogen 2.904 N/A MET 528.A N VAL 513.A O no hydrogen 2.899 N/A GLY 529.A N GLN 265.A O no hydrogen 3.241 N/A SER 531.A N ASP 263.A O no hydrogen 2.956 N/A LYS 532.A NZ TYR 503.A OH no hydrogen 3.048 N/A LYS 534.A NZ ASP 263.A OD2 no hydrogen 3.267 N/A LYS 534.A NZ GLU 538.A OE2 no hydrogen 3.443 N/A GLN 535.A NE2 GLN 502.A O no hydrogen 3.488 N/A TYR 536.A N TYR 503.A O no hydrogen 2.796 N/A GLU 538.A N GLN 535.A O no hydrogen 3.463 N/A ASN 539.A ND2 ASP 263.A OD2 no hydrogen 2.747 N/A ASN 539.A ND2 LYS 532.A O no hydrogen 2.788 N/A SER 540.A N GLY 537.A O no hydrogen 3.111 N/A SER 540.A OG TYR 495.A OH no hydrogen 2.708 N/A PHE 541.A N ALA 510.A O no hydrogen 2.902 N/A VAL 542.A N GLN 546.A OE1 no hydrogen 2.522 N/A GLY 543.A N ASN 508.A O no hydrogen 2.969 N/A GLN 546.A N GLY 543.A O no hydrogen 2.843 N/A GLN 547.A N GLY 543.A O no hydrogen 3.045 N/A GLN 547.A NE2 TYR 343.A OH no hydrogen 3.131 N/A GLN 547.A NE2 ASN 508.A O no hydrogen 3.344 N/A GLN 547.A NE2 PHE 541.A O no hydrogen 3.437 N/A TYR 549.A N GLN 546.A O no hydrogen 3.300 N/A GLN 551.A N GLU 548.A O no hydrogen 2.998 N/A GLN 551.A NE2 SER 475.A O no hydrogen 3.108 N/A PHE 552.A N TYR 549.A O no hydrogen 2.850 N/A TYR 554.A N PRO 550.A O no hydrogen 2.950 N/A GLU 555.A N GLN 551.A O no hydrogen 2.996 N/A ASN 556.A N PHE 552.A O no hydrogen 3.011 N/A ASN 556.A ND2 ASP 252.A OD1 no hydrogen 3.176 N/A VAL 557.A N LEU 553.A O no hydrogen 3.100 N/A MET 558.A N TYR 554.A O no hydrogen 2.820 N/A SER 559.A N GLU 555.A O no hydrogen 2.950 N/A LYS 560.A N ASN 556.A O no hydrogen 3.180 N/A LYS 560.A NZ ASP 252.A OD2 no hydrogen 2.909 N/A ILE 561.A N VAL 557.A O no hydrogen 2.970 N/A SER 562.A N MET 558.A O no hydrogen 3.023 N/A SER 563.A OG ASP 565.A OD2 no hydrogen 3.056 N/A ARG 564.A NH1 SER 559.A O no hydrogen 2.604 N/A ARG 564.A NH2 SER 559.A O no hydrogen 3.189 N/A ARG 564.A NH2 SER 559.A OG no hydrogen 3.156 N/A GLU 567.A N ASP 565.A OD1 no hydrogen 2.739 N/A PHE 569.A N ASP 568.A OD2 no hydrogen 2.579 N/A ARG 571.A NH1 VAL 575.A O no hydrogen 2.933 N/A SER 574.A OG ASP 456.A OD1 no hydrogen 3.106 N/A SER 574.A OG ASP 456.A OD2 no hydrogen 3.396 N/A SER 576.A N ASN 583.A O no hydrogen 2.869 N/A SER 581.A N SER 578.A O no hydrogen 2.682 N/A ILE 582.A N THR 323.A OG1 no hydrogen 3.113 N/A ASN 583.A N SER 576.A O no hydrogen 2.824 N/A SER 585.A N SER 574.A O no hydrogen 2.917 N/A ASN 591.A N ASP 589.A OD1 no hydrogen 3.250 N/A THR 593.A N ASN 324.A O no hydrogen 3.087 N/A