Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 6n2w_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): HIS 3.A N VAL 52.A O no hydrogen 3.034 N/A HIS 5.A N SER 54.A O no hydrogen 2.815 N/A HIS 6.A ND1 ASP 56.A OD2 no hydrogen 2.874 N/A SER 7.A OG SER 7.A O no hydrogen 2.550 N/A TYR 8.A N VAL 57.A O no hydrogen 2.462 N/A THR 9.A N LYS 90.A O no hydrogen 3.306 N/A THR 9.A OG1 ASP 56.A OD1 no hydrogen 3.440 N/A VAL 10.A N TYR 55.A O no hydrogen 2.548 N/A THR 11.A N THR 88.A O no hydrogen 2.874 N/A VAL 12.A N ASP 53.A O no hydrogen 2.778 N/A ALA 13.A N TYR 86.A O no hydrogen 3.152 N/A THR 14.A N ALA 51.A O no hydrogen 2.811 N/A GLY 15.A N TYR 83.A O no hydrogen 2.688 N/A GLN 17.A N GLN 17.A OE1 no hydrogen 2.821 N/A GLU 18.A N GLU 18.A OE1 no hydrogen 2.432 N/A ALA 20.A N GLN 17.A O no hydrogen 3.153 N/A THR 22.A N PHE 47.A O no hydrogen 2.713 N/A THR 22.A OG1 ASP 80.A O no hydrogen 2.752 N/A ASP 24.A N THR 22.A OG1 no hydrogen 3.329 N/A TYR 25.A N ARG 74.A O no hydrogen 2.788 N/A TYR 27.A N GLU 72.A O no hydrogen 2.902 N/A LEU 28.A N HIS 40.A O no hydrogen 3.118 N/A SER 29.A N ARG 70.A O no hydrogen 3.075 N/A LEU 30.A N SER 37.A OG no hydrogen 3.418 N/A VAL 31.A N LEU 68.A O no hydrogen 3.092 N/A GLY 32.A N GLY 35.A O no hydrogen 3.330 N/A SER 33.A N GLU 65.A O no hydrogen 2.845 N/A SER 33.A OG GLU 65.A O no hydrogen 3.568 N/A ALA 34.A N LEU 63.A O no hydrogen 3.312 N/A CYS 36.A SG.A LEU 30.A O no hydrogen 2.905 N/A CYS 36.A SG.A SER 37.A O no hydrogen 3.255 N/A SER 37.A N LEU 30.A O no hydrogen 2.800 N/A SER 37.A OG GLU 38.A O no hydrogen 3.037 N/A LYS 39.A NZ GLU 72.A OE1 no hydrogen 2.462 N/A HIS 40.A N LEU 28.A O no hydrogen 3.304 N/A HIS 40.A ND1 GLU 38.A O no hydrogen 3.302 N/A LEU 42.A N ILE 26.A O no hydrogen 2.927 N/A PHE 47.A N THR 22.A O no hydrogen 2.938 N/A ARG 49.A NE SER 16.A O no hydrogen 3.039 N/A ARG 49.A NH2 SER 16.A O no hydrogen 2.869 N/A GLY 50.A N GLY 15.A O no hydrogen 3.119 N/A ALA 51.A N GLU 48.A O no hydrogen 3.107 N/A ASP 53.A N VAL 12.A O no hydrogen 2.941 N/A SER 54.A N HIS 3.A O no hydrogen 2.818 N/A SER 54.A OG HIS 4.A ND1 no hydrogen 3.412 N/A TYR 55.A N VAL 10.A O no hydrogen 2.565 N/A VAL 57.A N TYR 8.A O no hydrogen 2.501 N/A GLN 67.A N VAL 31.A O no hydrogen 2.855 N/A LEU 68.A N VAL 31.A O no hydrogen 3.146 N/A VAL 69.A N LEU 113.A O no hydrogen 3.316 N/A ARG 70.A N SER 29.A O no hydrogen 3.054 N/A ILE 71.A N VAL 111.A O no hydrogen 2.932 N/A GLU 72.A N TYR 27.A O no hydrogen 3.014 N/A LYS 73.A NZ ASP 80.A O no hydrogen 2.957 N/A LYS 73.A NZ ILE 105.A O no hydrogen 3.480 N/A LYS 73.A NZ THR 106.A O no hydrogen 2.737 N/A ARG 74.A N TYR 25.A O no hydrogen 2.877 N/A TYR 76.A N ASP 24.A OD1 no hydrogen 2.886 N/A ASP 80.A N ASP 24.A OD2 no hydrogen 3.342 N/A TRP 82.A NE1 THR 14.A OG1 no hydrogen 3.208 N/A TYR 83.A N ALA 20.A O no hydrogen 2.941 N/A TYR 83.A OH GLU 557.A OE2 no hydrogen 2.953 N/A LEU 84.A N ARG 103.A O no hydrogen 3.420 N/A LYS 85.A N ALA 13.A O no hydrogen 3.011 N/A ILE 87.A N PHE 99.A O no hydrogen 3.073 N/A THR 88.A N THR 11.A O no hydrogen 3.075 N/A LEU 89.A N ILE 97.A O no hydrogen 2.927 N/A LYS 90.A N THR 9.A O no hydrogen 3.076 N/A LYS 90.A NZ GLY 94.A O no hydrogen 2.939 N/A THR 91.A N ASP 95.A O no hydrogen 2.875 N/A GLY 94.A N THR 91.A O no hydrogen 2.772 N/A ASP 95.A N THR 91.A OG1 no hydrogen 3.105 N/A ILE 97.A N LEU 89.A O no hydrogen 3.022 N/A PHE 99.A N ILE 87.A O no hydrogen 2.594 N/A CYS 101.A N LYS 85.A O no hydrogen 2.738 N/A TYR 102.A N LEU 84.A O no hydrogen 2.968 N/A TYR 102.A N LYS 85.A O no hydrogen 2.897 N/A ARG 103.A N LEU 84.A O no hydrogen 3.467 N/A ARG 103.A NE ASP 168.A OD2 no hydrogen 3.430 N/A ILE 105.A N TRP 82.A O no hydrogen 2.687 N/A ASP 108.A N THR 106.A OG1 no hydrogen 3.129 N/A VAL 111.A N ILE 71.A O no hydrogen 2.975 N/A LEU 113.A N VAL 69.A O no hydrogen 3.028 N/A ARG 114.A NH1 ASP 124.A OD2 no hydrogen 3.380 N/A ARG 114.A NH2 ASP 124.A OD2 no hydrogen 2.947 N/A ARG 117.A N ASP 115.A OD2 no hydrogen 3.083 N/A ARG 117.A NE ASP 115.A OD2 no hydrogen 2.583 N/A ALA 118.A N GLU 562.A OE1 no hydrogen 3.189 N/A LYS 119.A N VAL 338.A O no hydrogen 2.979 N/A LEU 120.A N ASP 123.A OD2 no hydrogen 3.067 N/A ARG 122.A NH2 GLU 429.A OE2 no hydrogen 2.120 N/A ASP 123.A N LEU 120.A O no hydrogen 3.134 N/A ASP 124.A N ALA 121.A O no hydrogen 3.414 N/A GLN 125.A NE2 ARG 122.A O no hydrogen 3.601 N/A LEU 129.A N ILE 126.A O no hydrogen 3.257 N/A LYS 130.A N ILE 126.A O no hydrogen 3.298 N/A GLN 131.A N HIS 127.A O no hydrogen 2.959 N/A HIS 132.A NE2 VAL 112.A O no hydrogen 3.076 N/A ARG 133.A N LEU 129.A O no hydrogen 2.950 N/A ARG 133.A NE GLU 439.A OE1 no hydrogen 3.252 N/A ARG 133.A NE GLU 439.A OE2 no hydrogen 2.585 N/A ARG 133.A NH1 LYS 119.A O no hydrogen 3.274 N/A ARG 133.A NH1 ASP 124.A OD2 no hydrogen 3.021 N/A ARG 133.A NH2 LYS 119.A O no hydrogen 3.057 N/A ARG 133.A NH2 GLU 439.A OE1 no hydrogen 2.735 N/A ARG 134.A N LYS 130.A O no hydrogen 2.972 N/A ARG 134.A NE GLU 138.A OE2 no hydrogen 3.044 N/A LYS 135.A N GLN 131.A O no hydrogen 2.850 N/A GLU 136.A N HIS 132.A O no hydrogen 2.779 N/A LEU 137.A N ARG 133.A O no hydrogen 3.134 N/A GLU 138.A N ARG 134.A O no hydrogen 3.175 N/A THR 139.A N LYS 135.A O no hydrogen 3.190 N/A THR 139.A OG1 LYS 135.A O no hydrogen 2.997 N/A ARG 140.A N GLU 136.A O no hydrogen 2.824 N/A ARG 140.A NH1 TYR 332.A O no hydrogen 2.710 N/A ARG 140.A NH1 LEU 335.A O no hydrogen 2.734 N/A GLN 141.A N LEU 137.A O no hydrogen 2.607 N/A GLN 141.A NE2 ARG 333.A O no hydrogen 3.599 N/A LYS 142.A NZ GLU 138.A O no hydrogen 3.029 N/A GLN 143.A N THR 139.A O no hydrogen 3.119 N/A GLN 143.A N ARG 140.A O no hydrogen 2.978 N/A TYR 144.A N ARG 140.A O no hydrogen 2.920 N/A TRP 146.A NE1 ASP 446.A OD2 no hydrogen 3.387 N/A PHE 153.A N ASN 150.A O no hydrogen 3.028 N/A SER 156.A N MET 147.A O no hydrogen 2.827 N/A SER 156.A OG MET 147.A O no hydrogen 3.345 N/A ILE 157.A N GLU 325.A OE2 no hydrogen 2.988 N/A ASP 158.A N ARG 145.A O no hydrogen 2.881 N/A LYS 160.A NZ ASP 164.A OD2 no hydrogen 2.599 N/A CYS 161.A SG ASP 164.A OD2 no hydrogen 3.758 N/A HIS 162.A N GLU 361.A OE1 no hydrogen 3.021 N/A LYS 163.A NZ HIS 162.A ND1 no hydrogen 3.008 N/A ASP 164.A N CYS 161.A O no hydrogen 3.219 N/A LEU 165.A N HIS 162.A O no hydrogen 2.985 N/A ARG 167.A NE ASP 81.A OD2 no hydrogen 3.464 N/A ARG 167.A NH1 ARG 167.A O no hydrogen 3.265 N/A ILE 169.A N PRO 166.A O no hydrogen 3.330 N/A GLN 170.A NE2 LEU 165.A O no hydrogen 2.856 N/A PHE 171.A N HIS 162.A NE2 no hydrogen 2.958 N/A SER 173.A OG TYR 493.A OH no hydrogen 2.876 N/A ASN 174.A N SER 177.A OG no hydrogen 3.010 N/A THR 175.A N ASN 174.A OD1 no hydrogen 2.513 N/A SER 177.A OG ASN 174.A O no hydrogen 3.445 N/A GLU 178.A N ASN 174.A O no hydrogen 2.975 N/A VAL 180.A N ILE 176.A O no hydrogen 3.027 N/A MET 181.A N GLU 178.A O no hydrogen 2.715 N/A ASN 182.A N GLU 178.A O no hydrogen 3.238 N/A HIS 183.A ND1 GLU 186.A OE2 no hydrogen 2.481 N/A GLU 186.A N HIS 183.A O no hydrogen 2.829 N/A PHE 190.A N GLU 186.A O no hydrogen 3.004 N/A GLY 191.A N ASP 187.A O no hydrogen 2.945 N/A TYR 192.A N LEU 188.A O no hydrogen 2.808 N/A GLN 193.A N MET 189.A O no hydrogen 3.287 N/A PHE 194.A N GLY 191.A O no hydrogen 3.055 N/A LEU 195.A N TYR 192.A O no hydrogen 3.023 N/A ASN 196.A N TYR 192.A O no hydrogen 3.075 N/A ASN 196.A ND2 TYR 402.A O no hydrogen 3.222 N/A GLY 197.A N GLN 193.A O no hydrogen 3.260 N/A ASN 199.A ND2 ASP 307.A OD1 no hydrogen 2.520 N/A ARG 204.A N ILE 241.A O no hydrogen 3.217 N/A ARG 205.A N ARG 392.A O no hydrogen 2.845 N/A ARG 205.A NE GLY 393.A O no hydrogen 2.985 N/A ARG 205.A NH2 GLU 395.A OE2 no hydrogen 3.515 N/A CYS 206.A N ILE 239.A O no hydrogen 3.118 N/A CYS 206.A SG GLU 208.A O no hydrogen 3.273 N/A LYS 212.A NZ ASP 243.A OD2 no hydrogen 2.773 N/A LYS 212.A NZ GLN 278.A OE1 no hydrogen 2.920 N/A LEU 213.A N PRO 210.A O no hydrogen 3.314 N/A VAL 215.A N LEU 213.A O no hydrogen 2.564 N/A THR 217.A OG1 GLU 231.A OE1 no hydrogen 3.109 N/A THR 217.A OG1 GLU 231.A OE2 no hydrogen 2.774 N/A MET 219.A N THR 216.A O no hydrogen 3.287 N/A VAL 220.A N THR 217.A O no hydrogen 3.246 N/A GLU 221.A N GLU 218.A O no hydrogen 3.424 N/A SER 223.A N VAL 220.A O no hydrogen 3.245 N/A LEU 224.A N VAL 220.A O no hydrogen 3.243 N/A GLU 225.A N TYR 262.A OH no hydrogen 3.145 N/A ARG 226.A NH1 GLU 233.A OE2 no hydrogen 3.253 N/A ARG 226.A NH1 LYS 263.A O no hydrogen 2.470 N/A ARG 226.A NH2 LYS 263.A O no hydrogen 3.143 N/A ARG 226.A NH2 ASN 264.A O no hydrogen 3.194 N/A SER 229.A N GLN 232.A OE1 no hydrogen 3.475 N/A SER 229.A OG GLU 231.A OE1 no hydrogen 2.934 N/A GLN 232.A N SER 229.A O no hydrogen 2.728 N/A GLU 233.A N SER 229.A O no hydrogen 2.772 N/A VAL 234.A N LEU 230.A O no hydrogen 3.105 N/A GLN 236.A N GLN 232.A O no hydrogen 3.294 N/A GLY 237.A N VAL 234.A O no hydrogen 2.972 N/A ASN 238.A N GLU 233.A O no hydrogen 3.062 N/A ASN 238.A ND2 GLU 233.A OE2 no hydrogen 3.037 N/A PHE 240.A N LEU 261.A O no hydrogen 2.858 N/A ILE 241.A N ARG 204.A O no hydrogen 3.037 N/A VAL 242.A N CYS 259.A O no hydrogen 2.899 N/A PHE 244.A N PRO 257.A O no hydrogen 3.060 N/A LEU 247.A N PHE 244.A O no hydrogen 2.873 N/A ASP 248.A N GLU 245.A O no hydrogen 3.309 N/A ILE 250.A N LEU 247.A O no hydrogen 3.200 N/A PHE 253.A N MET 506.A O no hydrogen 3.373 N/A ALA 256.A N LEU 276.A O no hydrogen 2.893 N/A ALA 256.A N ASN 277.A OD1 no hydrogen 3.349 N/A ILE 258.A N GLN 275.A O no hydrogen 2.560 N/A CYS 259.A N VAL 242.A O no hydrogen 2.879 N/A CYS 259.A SG LEU 260.A O no hydrogen 3.954 N/A CYS 259.A SG ALA 273.A O no hydrogen 3.778 N/A LEU 260.A N ALA 273.A O no hydrogen 2.992 N/A LEU 261.A N PHE 240.A O no hydrogen 2.578 N/A TYR 262.A N VAL 270.A O no hydrogen 3.088 N/A TYR 262.A OH GLU 233.A OE2 no hydrogen 3.079 N/A LYS 263.A N ASN 238.A O no hydrogen 2.944 N/A LYS 263.A NZ ASN 238.A OD1 no hydrogen 3.343 N/A ASN 264.A N LYS 268.A O no hydrogen 3.117 N/A LEU 265.A N GLU 225.A OE1 no hydrogen 2.858 N/A ALA 266.A N ASN 264.A OD1 no hydrogen 2.898 N/A ASN 267.A N ASN 264.A O no hydrogen 2.961 N/A VAL 270.A N TYR 262.A O no hydrogen 3.141 N/A ILE 272.A N LEU 260.A O no hydrogen 3.101 N/A ILE 274.A N PHE 287.A O no hydrogen 3.075 N/A GLN 275.A N ILE 258.A O no hydrogen 2.813 N/A GLN 275.A NE2 LYS 212.A O no hydrogen 2.883 N/A GLN 275.A NE2 ASN 277.A O no hydrogen 2.892 N/A ASN 277.A N ASN 284.A OD1 no hydrogen 3.137 N/A GLN 278.A NE2 ASP 243.A OD1 no hydrogen 2.588 N/A GLN 278.A NE2 ALA 256.A O no hydrogen 2.982 N/A ASN 284.A N GLY 281.A O no hydrogen 3.274 N/A ASN 284.A ND2 ASN 277.A O no hydrogen 2.980 N/A ASN 284.A ND2 ILE 279.A O no hydrogen 3.262 N/A PHE 287.A N ILE 274.A O no hydrogen 2.817 N/A LEU 288.A N ASP 291.A OD2 no hydrogen 2.686 N/A ASP 291.A N LEU 288.A O no hydrogen 2.995 N/A ASP 295.A N ALA 292.A O no hydrogen 2.969 N/A TRP 296.A N ALA 292.A O no hydrogen 3.326 N/A TRP 296.A NE1 ASP 187.A OD1 no hydrogen 2.764 N/A TRP 296.A NE1 ASP 187.A OD2 no hydrogen 3.182 N/A LEU 298.A N TYR 294.A O no hydrogen 3.457 N/A ALA 299.A N ASP 295.A O no hydrogen 2.839 N/A LYS 300.A N TRP 296.A O no hydrogen 3.293 N/A LYS 300.A NZ GLN 185.A O no hydrogen 3.193 N/A LYS 300.A NZ ASP 187.A OD1 no hydrogen 2.830 N/A ILE 301.A N LEU 297.A O no hydrogen 2.880 N/A TRP 302.A N LEU 298.A O no hydrogen 3.256 N/A VAL 303.A N ALA 299.A O no hydrogen 3.387 N/A ARG 304.A N LYS 300.A O no hydrogen 2.898 N/A ARG 304.A NE ASN 501.A O no hydrogen 2.364 N/A ARG 304.A NH1 ASP 307.A OD2 no hydrogen 3.068 N/A ARG 304.A NH2 ASN 501.A O no hydrogen 3.016 N/A SER 305.A N ILE 301.A O no hydrogen 2.847 N/A SER 306.A N TRP 302.A O no hydrogen 2.894 N/A SER 306.A OG TRP 302.A O no hydrogen 3.186 N/A ASP 307.A N VAL 303.A O no hydrogen 2.877 N/A PHE 308.A N ARG 304.A O no hydrogen 3.004 N/A PHE 308.A N SER 305.A O no hydrogen 3.087 N/A HIS 309.A N SER 305.A O no hydrogen 3.383 N/A HIS 309.A NE2 PRO 504.A O no hydrogen 2.608 N/A VAL 310.A N SER 306.A O no hydrogen 3.196 N/A HIS 311.A N ASP 307.A O no hydrogen 3.022 N/A HIS 311.A NE2 VAL 488.A O no hydrogen 2.755 N/A GLN 312.A N PHE 308.A O no hydrogen 3.004 N/A GLN 312.A NE2 HIS 311.A ND1 no hydrogen 3.236 N/A GLN 312.A NE2 GLN 492.A OE1 no hydrogen 3.155 N/A THR 313.A N HIS 309.A O no hydrogen 2.839 N/A THR 313.A OG1 HIS 309.A O no hydrogen 3.268 N/A ILE 314.A N VAL 310.A O no hydrogen 2.917 N/A THR 315.A N VAL 310.A O no hydrogen 2.914 N/A THR 315.A OG1 ASN 199.A OD1 no hydrogen 2.800 N/A HIS 316.A N HIS 311.A O no hydrogen 2.579 N/A LEU 317.A N GLN 312.A O no hydrogen 2.773 N/A LEU 318.A N THR 313.A O no hydrogen 2.859 N/A ARG 319.A N ILE 314.A O no hydrogen 2.928 N/A ARG 319.A NH2 SER 382.A O no hydrogen 3.154 N/A ARG 319.A NH2 SER 382.A OG no hydrogen 2.479 N/A THR 320.A OG1 HIS 316.A O no hydrogen 2.196 N/A HIS 321.A N HIS 316.A O no hydrogen 3.474 N/A HIS 321.A ND1 ASN 356.A OD1 no hydrogen 3.085 N/A LEU 322.A N LEU 317.A O no hydrogen 2.903 N/A SER 324.A N THR 320.A O no hydrogen 2.830 N/A SER 324.A OG THR 320.A O no hydrogen 3.097 N/A GLU 325.A N HIS 321.A O no hydrogen 3.007 N/A VAL 326.A N LEU 322.A O no hydrogen 3.186 N/A PHE 327.A N VAL 323.A O no hydrogen 3.226 N/A GLY 328.A N SER 324.A O no hydrogen 2.670 N/A ILE 329.A N GLU 325.A O no hydrogen 2.864 N/A ALA 330.A N VAL 326.A O no hydrogen 3.103 N/A MET 331.A N PHE 327.A O no hydrogen 2.946 N/A TYR 332.A N GLY 328.A O no hydrogen 3.167 N/A ARG 333.A N ILE 329.A O no hydrogen 2.877 N/A ARG 333.A NE TYR 144.A O no hydrogen 2.870 N/A ARG 333.A NH1 ASP 446.A OD2 no hydrogen 2.780 N/A ARG 333.A NH2 GLN 141.A O no hydrogen 3.248 N/A GLN 334.A N ALA 330.A O no hydrogen 3.033 N/A GLN 334.A NE2 ASP 446.A OD2 no hydrogen 2.671 N/A LEU 335.A N MET 331.A O no hydrogen 2.997 N/A ALA 337.A N GLU 136.A OE1 no hydrogen 2.869 N/A HIS 339.A N PRO 336.A O no hydrogen 2.911 N/A HIS 339.A NE2 ASP 437.A OD2 no hydrogen 2.806 N/A ILE 341.A N HIS 339.A ND1 no hydrogen 3.050 N/A LYS 343.A N HIS 339.A O no hydrogen 3.036 N/A LYS 343.A NZ GLY 116.A O no hydrogen 3.205 N/A LYS 343.A NZ HIS 559.A O no hydrogen 2.836 N/A LEU 344.A N PRO 340.A O no hydrogen 3.261 N/A LEU 344.A N ILE 341.A O no hydrogen 3.269 N/A LEU 345.A N ILE 341.A O no hydrogen 3.046 N/A VAL 346.A N PHE 342.A O no hydrogen 2.808 N/A HIS 348.A N LEU 345.A O no hydrogen 2.921 N/A HIS 348.A ND1 ASN 604.A O no hydrogen 2.825 N/A VAL 349.A N LEU 345.A O no hydrogen 3.153 N/A ARG 350.A NH2 GLU 557.A OE1 no hydrogen 2.948 N/A THR 352.A N VAL 349.A O no hydrogen 3.191 N/A THR 352.A OG1 VAL 606.A O no hydrogen 3.004 N/A ILE 355.A N PHE 351.A O no hydrogen 2.672 N/A ASN 356.A N THR 352.A O no hydrogen 2.970 N/A ASN 356.A ND2 HIS 321.A O no hydrogen 3.125 N/A ASN 356.A ND2 GLU 325.A OE1 no hydrogen 2.735 N/A THR 357.A N ILE 353.A O no hydrogen 2.967 N/A THR 357.A OG1 ILE 353.A O no hydrogen 2.648 N/A LYS 358.A N ALA 354.A O no hydrogen 2.983 N/A ALA 359.A N ILE 355.A O no hydrogen 3.055 N/A ARG 360.A N ASN 356.A O no hydrogen 2.894 N/A ARG 360.A NH1 GLU 325.A OE1 no hydrogen 2.919 N/A ARG 360.A NH1 GLU 325.A OE2 no hydrogen 3.450 N/A ARG 360.A NH2 GLU 325.A OE1 no hydrogen 3.508 N/A ARG 360.A NH2 GLU 325.A OE2 no hydrogen 3.008 N/A ARG 360.A NH2 THR 357.A OG1 no hydrogen 3.277 N/A GLU 361.A N THR 357.A O no hydrogen 3.263 N/A GLN 362.A N LYS 358.A O no hydrogen 3.296 N/A LEU 363.A N ALA 359.A O no hydrogen 2.966 N/A GLN 369.A NE2 GLY 249.A O no hydrogen 3.685 N/A GLN 372.A N VAL 368.A O no hydrogen 3.401 N/A GLN 372.A NE2 PRO 151.A O no hydrogen 3.043 N/A ARG 373.A N GLN 369.A O no hydrogen 3.471 N/A ARG 373.A NH1 ASP 248.A O no hydrogen 2.844 N/A ARG 373.A NH2 ASP 248.A O no hydrogen 2.571 N/A ALA 374.A N MET 370.A O no hydrogen 2.645 N/A MET 375.A N VAL 371.A O no hydrogen 2.527 N/A MET 375.A N GLN 372.A O no hydrogen 3.245 N/A ASP 377.A N ALA 374.A O no hydrogen 2.734 N/A LEU 378.A N ALA 374.A O no hydrogen 2.985 N/A LEU 378.A N MET 375.A O no hydrogen 3.282 N/A THR 379.A N SER 382.A OG no hydrogen 3.078 N/A TYR 380.A N SER 458.A O no hydrogen 2.700 N/A TYR 380.A OH GLU 472.A OE1 no hydrogen 3.277 N/A SER 382.A N THR 379.A O no hydrogen 2.956 N/A SER 382.A N THR 379.A OG1 no hydrogen 3.147 N/A SER 382.A OG THR 379.A O no hydrogen 2.407 N/A SER 382.A OG THR 379.A OG1 no hydrogen 3.149 N/A LEU 383.A N TYR 380.A O no hydrogen 3.109 N/A CYS 384.A SG TYR 380.A O no hydrogen 3.555 N/A GLU 387.A N GLU 387.A OE1 no hydrogen 2.610 N/A ALA 388.A N CYS 384.A O no hydrogen 2.902 N/A ILE 389.A N PHE 385.A O no hydrogen 2.958 N/A LYS 390.A N PRO 386.A O no hydrogen 2.942 N/A ALA 391.A N GLU 387.A O no hydrogen 2.661 N/A ARG 392.A N ILE 389.A O no hydrogen 3.200 N/A ARG 392.A NE ILE 203.A O no hydrogen 2.928 N/A ARG 392.A NH2 TYR 403.A OH no hydrogen 2.204 N/A GLY 393.A N LYS 390.A O no hydrogen 2.890 N/A MET 394.A N ILE 389.A O no hydrogen 3.422 N/A GLU 395.A N GLU 395.A OE1 no hydrogen 2.429 N/A SER 396.A OG ASP 399.A OD2 no hydrogen 3.467 N/A LYS 397.A NZ PRO 401.A O no hydrogen 3.149 N/A LYS 397.A NZ ASP 407.A OD2 no hydrogen 2.761 N/A ASP 399.A N SER 396.A OG no hydrogen 3.255 N/A ILE 400.A N SER 396.A O no hydrogen 3.048 N/A TYR 403.A OH PRO 200.A O no hydrogen 2.542 N/A PHE 404.A N ASN 196.A OD1 no hydrogen 2.774 N/A TYR 405.A N ASN 196.A OD1 no hydrogen 3.403 N/A TYR 405.A OH GLN 484.A OE1 no hydrogen 2.291 N/A ARG 406.A NE ASP 407.A OD1 no hydrogen 2.923 N/A ARG 406.A NH1 MET 394.A O no hydrogen 3.298 N/A ARG 406.A NH1 ILE 400.A O no hydrogen 2.735 N/A ARG 406.A NH2 ILE 400.A O no hydrogen 2.969 N/A ARG 406.A NH2 PRO 401.A O no hydrogen 3.511 N/A ARG 406.A NH2 ASP 407.A OD1 no hydrogen 3.023 N/A ARG 406.A NH2 ASP 407.A OD2 no hydrogen 3.358 N/A ASP 407.A N TYR 403.A O no hydrogen 2.985 N/A ASP 408.A N PHE 404.A O no hydrogen 2.752 N/A GLY 409.A N TYR 405.A O no hydrogen 2.784 N/A LEU 410.A N ARG 406.A O no hydrogen 2.999 N/A VAL 412.A N ASP 408.A O no hydrogen 3.013 N/A TRP 413.A N GLY 409.A O no hydrogen 2.747 N/A GLU 414.A N LEU 410.A O no hydrogen 3.227 N/A ALA 415.A N LEU 411.A O no hydrogen 2.977 N/A ILE 416.A N VAL 412.A O no hydrogen 3.142 N/A ARG 417.A N TRP 413.A O no hydrogen 2.819 N/A THR 418.A N GLU 414.A O no hydrogen 3.063 N/A THR 418.A OG1 GLU 414.A O no hydrogen 2.900 N/A PHE 419.A N ALA 415.A O no hydrogen 3.172 N/A THR 420.A N ILE 416.A O no hydrogen 2.983 N/A THR 420.A OG1 ILE 416.A O no hydrogen 3.344 N/A THR 420.A OG1 ARG 417.A O no hydrogen 3.199 N/A THR 420.A OG1 SER 471.A O no hydrogen 3.348 N/A THR 420.A OG1 SER 471.A OG no hydrogen 2.931 N/A THR 420.A OG1 THR 475.A OG1 no hydrogen 2.966 N/A ALA 421.A N ARG 417.A O no hydrogen 3.103 N/A GLU 422.A N THR 418.A O no hydrogen 3.077 N/A VAL 423.A N PHE 419.A O no hydrogen 2.877 N/A VAL 424.A N THR 420.A O no hydrogen 2.674 N/A ASP 425.A N ALA 421.A O no hydrogen 3.006 N/A ILE 426.A N GLU 422.A O no hydrogen 2.999 N/A TYR 427.A N VAL 424.A O no hydrogen 3.382 N/A TYR 427.A OH GLU 562.A OE1 no hydrogen 2.882 N/A TYR 428.A N VAL 424.A O no hydrogen 2.816 N/A TYR 428.A OH ASP 437.A OD2 no hydrogen 2.743 N/A VAL 433.A N GLY 430.A O no hydrogen 3.041 N/A GLU 435.A N ASP 431.A O no hydrogen 3.154 N/A GLU 436.A N GLN 432.A O no hydrogen 3.176 N/A ASP 437.A N VAL 434.A O no hydrogen 3.028 N/A GLU 439.A N ASP 437.A OD1 no hydrogen 3.170 N/A LEU 440.A N ASP 437.A OD1 no hydrogen 3.214 N/A GLN 441.A N ASP 437.A O no hydrogen 3.143 N/A GLN 441.A NE2 VAL 434.A O no hydrogen 2.996 N/A GLN 441.A NE2 VAL 464.A O no hydrogen 2.766 N/A ASP 442.A N PRO 438.A O no hydrogen 3.190 N/A PHE 443.A N GLU 439.A O no hydrogen 2.931 N/A VAL 444.A N LEU 440.A O no hydrogen 2.954 N/A ASN 445.A N GLN 441.A O no hydrogen 2.814 N/A ASP 446.A N ASP 442.A O no hydrogen 3.046 N/A ASP 446.A N PHE 443.A O no hydrogen 3.231 N/A VAL 447.A N PHE 443.A O no hydrogen 3.242 N/A TYR 448.A N VAL 444.A O no hydrogen 3.136 N/A VAL 449.A N ASN 445.A O no hydrogen 3.122 N/A TYR 450.A N ASP 446.A O no hydrogen 2.923 N/A GLY 451.A N ASP 446.A O no hydrogen 3.181 N/A MET 452.A N VAL 447.A O no hydrogen 2.804 N/A ARG 453.A N TYR 450.A O no hydrogen 3.373 N/A ARG 453.A NH1 GLU 148.A OE1 no hydrogen 3.232 N/A ARG 453.A NH1 PHE 153.A O no hydrogen 2.994 N/A ARG 453.A NH2 GLU 148.A OE1 no hydrogen 2.982 N/A GLY 454.A N TYR 448.A O no hydrogen 2.676 N/A ARG 455.A N MET 452.A O no hydrogen 2.972 N/A SER 458.A N ARG 455.A O no hydrogen 3.202 N/A SER 458.A OG ARG 455.A O no hydrogen 2.984 N/A VAL 464.A N GLN 441.A OE1 no hydrogen 3.350 N/A LYS 465.A N GLN 469.A OE1 no hydrogen 3.011 N/A ARG 467.A N ASP 431.A OD1 no hydrogen 2.820 N/A ARG 467.A NH1 TYR 428.A O no hydrogen 3.114 N/A GLN 469.A N SER 466.A OG no hydrogen 2.814 N/A LEU 470.A N SER 466.A O no hydrogen 2.885 N/A SER 471.A N ARG 467.A O no hydrogen 2.850 N/A SER 471.A OG THR 420.A OG1 no hydrogen 2.931 N/A GLU 472.A N GLU 468.A O no hydrogen 3.017 N/A TYR 473.A N GLN 469.A O no hydrogen 2.869 N/A LEU 474.A N LEU 470.A O no hydrogen 2.984 N/A THR 475.A N SER 471.A O no hydrogen 2.941 N/A THR 475.A OG1 THR 420.A OG1 no hydrogen 2.966 N/A THR 475.A OG1 SER 471.A O no hydrogen 2.846 N/A VAL 476.A N GLU 472.A O no hydrogen 3.011 N/A VAL 477.A N TYR 473.A O no hydrogen 3.290 N/A VAL 477.A N LEU 474.A O no hydrogen 2.992 N/A ILE 478.A N LEU 474.A O no hydrogen 2.912 N/A PHE 479.A N THR 475.A O no hydrogen 2.719 N/A THR 480.A N VAL 476.A O no hydrogen 3.202 N/A THR 480.A OG1 VAL 476.A O no hydrogen 2.816 N/A ALA 481.A N VAL 477.A O no hydrogen 3.185 N/A SER 482.A N PHE 479.A O no hydrogen 3.083 N/A SER 482.A OG ILE 478.A O no hydrogen 2.722 N/A ALA 483.A N SER 482.A OG no hydrogen 2.490 N/A GLN 484.A N PHE 479.A O no hydrogen 2.991 N/A ALA 486.A N SER 482.A O no hydrogen 2.754 N/A ALA 487.A N ALA 483.A O no hydrogen 2.856 N/A VAL 488.A N GLN 484.A O no hydrogen 3.282 N/A ASN 489.A N HIS 485.A O no hydrogen 2.838 N/A ASN 489.A ND2 LEU 542.A O no hydrogen 2.720 N/A PHE 490.A N ALA 486.A O no hydrogen 3.145 N/A GLN 492.A N ASN 489.A O no hydrogen 3.277 N/A GLN 492.A NE2 ASN 489.A O no hydrogen 2.713 N/A TYR 493.A N SER 543.A OG no hydrogen 3.215 N/A TYR 493.A OH SER 173.A OG no hydrogen 2.876 N/A TRP 495.A N GLY 491.A O no hydrogen 3.097 N/A ALA 496.A N GLN 492.A O no hydrogen 3.165 N/A SER 497.A OG TYR 493.A O no hydrogen 2.839 N/A ASN 501.A N TRP 498.A O no hydrogen 2.944 N/A ASN 501.A ND2 GLN 193.A OE1 no hydrogen 2.642 N/A ALA 502.A N ILE 499.A O no hydrogen 2.885 N/A ARG 507.A N THR 525.A O no hydrogen 2.648 N/A ARG 507.A NE LEU 526.A O no hydrogen 2.983 N/A ARG 507.A NH2 LEU 526.A O no hydrogen 3.471 N/A LYS 514.A NZ ILE 286.A O no hydrogen 3.078 N/A LYS 514.A NZ ASP 291.A OD1 no hydrogen 2.916 N/A LYS 514.A NZ ASP 291.A OD2 no hydrogen 2.675 N/A GLY 515.A N ASP 295.A OD2 no hydrogen 2.871 N/A THR 518.A OG1 GLU 520.A OE1 no hydrogen 3.354 N/A ILE 522.A N THR 518.A O no hydrogen 3.136 N/A VAL 523.A N ILE 519.A O no hydrogen 3.009 N/A ASP 524.A N GLU 520.A O no hydrogen 2.975 N/A THR 525.A OG1 GLN 521.A O no hydrogen 2.543 N/A LEU 526.A N ILE 522.A O no hydrogen 3.085 N/A LEU 526.A N VAL 523.A O no hydrogen 3.171 N/A SER 532.A N ASP 528.A O no hydrogen 2.714 N/A SER 532.A OG ASP 528.A O no hydrogen 2.538 N/A CYS 533.A N ARG 529.A O no hydrogen 2.581 N/A CYS 533.A SG ARG 529.A O no hydrogen 2.818 N/A TRP 534.A N GLY 530.A O no hydrogen 3.244 N/A HIS 535.A N ARG 531.A O no hydrogen 2.928 N/A HIS 535.A NE2 ALA 496.A O no hydrogen 2.647 N/A LEU 536.A N SER 532.A O no hydrogen 2.782 N/A GLY 537.A N CYS 533.A O no hydrogen 2.979 N/A ALA 538.A N TRP 534.A O no hydrogen 2.973 N/A VAL 539.A N HIS 535.A O no hydrogen 3.042 N/A TRP 540.A N LEU 536.A O no hydrogen 3.154 N/A ALA 541.A N GLY 537.A O no hydrogen 2.964 N/A LEU 542.A N ALA 538.A O no hydrogen 3.108 N/A SER 543.A N TRP 540.A O no hydrogen 3.343 N/A SER 543.A OG VAL 539.A O no hydrogen 3.029 N/A GLN 544.A NE2 TRP 540.A O no hydrogen 3.219 N/A GLN 546.A N GLU 549.A OE1 no hydrogen 3.059 N/A GLU 547.A N GLN 546.A OE1 no hydrogen 2.282 N/A ASN 548.A N GLN 546.A OE1 no hydrogen 3.357 N/A GLU 549.A N GLN 546.A O no hydrogen 3.286 N/A LEU 552.A N ILE 602.A O no hydrogen 2.706 N/A MET 554.A N PHE 551.A O no hydrogen 2.884 N/A TYR 555.A OH HIS 348.A NE2 no hydrogen 3.112 N/A GLU 558.A N TYR 102.A OH no hydrogen 2.789 N/A HIS 559.A N GLU 557.A O no hydrogen 3.024 N/A LYS 563.A NZ GLU 567.A OE2 no hydrogen 3.470 N/A LYS 566.A N GLU 562.A O no hydrogen 3.207 N/A LYS 566.A NZ GLU 558.A OE2 no hydrogen 3.444 N/A LYS 566.A NZ ILE 561.A O no hydrogen 3.358 N/A GLU 567.A N LYS 563.A O no hydrogen 2.829 N/A ALA 568.A N PRO 564.A O no hydrogen 3.200 N/A MET 569.A N VAL 565.A O no hydrogen 2.843 N/A ALA 570.A N LYS 566.A O no hydrogen 2.744 N/A ARG 571.A N GLU 567.A O no hydrogen 2.903 N/A ARG 571.A NE GLU 422.A OE1 no hydrogen 2.671 N/A ARG 571.A NE GLU 422.A OE2 no hydrogen 3.451 N/A ARG 571.A NH2 GLU 422.A OE1 no hydrogen 2.266 N/A PHE 572.A N ALA 568.A O no hydrogen 3.050 N/A ARG 573.A N MET 569.A O no hydrogen 2.891 N/A ARG 573.A NE GLY 553.A O no hydrogen 2.762 N/A LYS 574.A N ALA 570.A O no hydrogen 2.932 N/A ASN 575.A N ARG 571.A O no hydrogen 2.773 N/A LEU 576.A N PHE 572.A O no hydrogen 2.911 N/A GLU 577.A N ARG 573.A O no hydrogen 2.891 N/A ALA 578.A N LYS 574.A O no hydrogen 3.033 N/A ILE 579.A N ASN 575.A O no hydrogen 3.391 N/A VAL 580.A N LEU 576.A O no hydrogen 2.947 N/A SER 581.A N GLU 577.A O no hydrogen 3.224 N/A SER 581.A OG GLU 577.A O no hydrogen 3.195 N/A VAL 582.A N ALA 578.A O no hydrogen 3.046 N/A ILE 583.A N ILE 579.A O no hydrogen 2.889 N/A ALA 584.A N VAL 580.A O no hydrogen 2.870 N/A GLU 585.A N SER 581.A O no hydrogen 2.934 N/A ARG 586.A N VAL 582.A O no hydrogen 3.018 N/A ARG 586.A NE ASN 587.A OD1 no hydrogen 3.258 N/A ARG 586.A NH1 ASP 408.A OD1 no hydrogen 3.306 N/A ARG 586.A NH2 ASP 408.A OD1 no hydrogen 2.948 N/A ARG 586.A NH2 ASP 408.A OD2 no hydrogen 2.491 N/A ARG 586.A NH2 TYR 594.A O no hydrogen 3.564 N/A ASN 587.A N ILE 583.A O no hydrogen 3.156 N/A ASN 587.A ND2 TYR 594.A O no hydrogen 2.685 N/A GLU 588.A N GLU 585.A O no hydrogen 2.920 N/A ASN 589.A N ARG 586.A O no hydrogen 3.136 N/A TYR 594.A N ASN 587.A OD1 no hydrogen 2.986 N/A TYR 596.A OH ASP 494.A OD2 no hydrogen 2.613 N/A SER 598.A N TYR 595.A O no hydrogen 3.046 N/A SER 598.A OG ASP 600.A OD1 no hydrogen 2.657 N/A ARG 601.A N SER 598.A O no hydrogen 2.675 N/A ILE 602.A N PRO 599.A O no hydrogen 3.337 N/A ASN 604.A N LEU 550.A O no hydrogen 2.805 N/A ASN 604.A ND2 MET 554.A O no hydrogen 2.850 N/A SER 605.A OG ARG 350.A O no hydrogen 2.791 N/A