Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 7m3g_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLN 5.A NE2 GLU 327.A OE1 no hydrogen 3.288 N/A ARG 6.A NE PRO 3.A O no hydrogen 3.088 N/A ARG 6.A NH2 PRO 3.A O no hydrogen 2.493 N/A ALA 7.A N ILE 78.A O no hydrogen 2.971 N/A GLN 8.A N HIS 321.A O no hydrogen 3.131 N/A LYS 9.A N TYR 76.A O no hydrogen 2.925 N/A ASP 12.A N THR 73.A O no hydrogen 2.986 N/A ILE 13.A N THR 73.A O no hydrogen 3.411 N/A LEU 15.A N GLY 75.A O no hydrogen 3.105 N/A GLY 16.A N ALA 117.A O no hydrogen 2.996 N/A GLY 17.A N ARG 77.A O no hydrogen 3.072 N/A LEU 18.A N VAL 119.A O no hydrogen 3.088 N/A PHE 19.A N PHE 79.A O no hydrogen 3.360 N/A ILE 21.A N PHE 19.A O no hydrogen 3.224 N/A ILE 21.A N ASP 80.A OD1 no hydrogen 2.773 N/A HIS 22.A ND1 ASP 80.A OD2 no hydrogen 3.256 N/A HIS 22.A NE2 GLU 327.A OE2 no hydrogen 3.189 N/A PHE 23.A N ARG 43.A O no hydrogen 2.816 N/A ALA 26.A N GLU 40.A O no hydrogen 2.761 N/A ILE 42.A N GLY 24.A O no hydrogen 3.225 N/A ARG 43.A NH1 GLU 254.A OE1 no hydrogen 2.832 N/A ASN 45.A N ILE 21.A O no hydrogen 2.979 N/A ASN 45.A ND2 PRO 20.A O no hydrogen 3.170 N/A ARG 50.A N PHE 46.A O no hydrogen 3.020 N/A TRP 51.A N ARG 47.A O no hydrogen 2.986 N/A LEU 52.A N GLY 48.A O no hydrogen 2.988 N/A GLN 53.A N PHE 49.A O no hydrogen 2.954 N/A ALA 54.A N ARG 50.A O no hydrogen 2.963 N/A MET 55.A N TRP 51.A O no hydrogen 3.175 N/A ILE 56.A N LEU 52.A O no hydrogen 3.062 N/A PHE 57.A N GLN 53.A O no hydrogen 2.891 N/A ALA 58.A N ALA 54.A O no hydrogen 3.004 N/A ILE 59.A N MET 55.A O no hydrogen 3.056 N/A GLU 60.A N ILE 56.A O no hydrogen 3.011 N/A GLU 61.A N PHE 57.A O no hydrogen 2.942 N/A ILE 62.A N ALA 58.A O no hydrogen 2.959 N/A ASN 63.A N ILE 59.A O no hydrogen 2.945 N/A ASN 63.A ND2 LEU 74.A O no hydrogen 3.260 N/A SER 64.A N GLU 60.A O no hydrogen 2.999 N/A SER 64.A OG GLU 60.A O no hydrogen 3.345 N/A SER 65.A N ILE 62.A O no hydrogen 3.224 N/A ALA 67.A N SER 65.A OG no hydrogen 3.399 N/A LEU 69.A N GLN 381.A OE1 no hydrogen 3.082 N/A THR 73.A N ASP 12.A OD2 no hydrogen 3.215 N/A LEU 74.A N ASN 63.A OD1 no hydrogen 3.143 N/A GLY 75.A N ILE 13.A O no hydrogen 2.796 N/A TYR 76.A N LYS 9.A O no hydrogen 2.974 N/A ARG 77.A N LEU 15.A O no hydrogen 3.033 N/A ILE 78.A N ALA 7.A O no hydrogen 2.870 N/A PHE 79.A N GLY 17.A O no hydrogen 3.200 N/A THR 81.A N PHE 19.A O no hydrogen 3.090 N/A CYS 82.A N ASP 80.A OD1 no hydrogen 3.032 N/A CYS 82.A SG HIS 22.A ND1 no hydrogen 4.044 N/A CYS 82.A SG ASP 80.A OD2 no hydrogen 3.215 N/A ASN 83.A N THR 81.A OG1 no hydrogen 3.202 N/A ASN 83.A ND2 PHE 23.A O no hydrogen 3.493 N/A THR 84.A N THR 81.A O no hydrogen 3.154 N/A THR 84.A OG1 CYS 82.A O no hydrogen 3.068 N/A LYS 87.A NZ VAL 39.A O no hydrogen 3.335 N/A ALA 88.A N THR 84.A O no hydrogen 3.502 N/A LEU 89.A N VAL 85.A O no hydrogen 2.933 N/A GLU 90.A N SER 86.A O no hydrogen 2.956 N/A ALA 91.A N LYS 87.A O no hydrogen 3.015 N/A THR 92.A N ALA 88.A O no hydrogen 2.887 N/A THR 92.A OG1 ALA 88.A O no hydrogen 2.636 N/A LEU 93.A N LEU 89.A O no hydrogen 2.951 N/A SER 94.A N ALA 91.A O no hydrogen 3.151 N/A SER 94.A OG ALA 91.A O no hydrogen 2.639 N/A PHE 95.A N ALA 91.A O no hydrogen 3.039 N/A VAL 96.A N THR 92.A O no hydrogen 3.244 N/A LYS 100.A N VAL 96.A O no hydrogen 2.984 N/A SER 103.A N ASN 99.A O no hydrogen 3.227 N/A SER 103.A OG LYS 100.A O no hydrogen 2.971 N/A LEU 104.A N LYS 100.A O no hydrogen 2.918 N/A LEU 106.A N ILE 101.A O no hydrogen 3.082 N/A ILE 116.A N ILE 14.A O no hydrogen 3.010 N/A VAL 118.A N PRO 140.A O no hydrogen 3.099 N/A VAL 119.A N GLY 16.A O no hydrogen 2.872 N/A GLY 120.A N VAL 142.A O no hydrogen 3.257 N/A THR 122.A OG1 TYR 144.A OH no hydrogen 2.953 N/A SER 127.A N GLY 123.A O no hydrogen 2.781 N/A SER 127.A OG ALA 121.A O no hydrogen 2.759 N/A SER 127.A OG GLY 123.A O no hydrogen 3.450 N/A SER 127.A OG SER 146.A OG no hydrogen 2.561 N/A THR 128.A N SER 124.A O no hydrogen 2.895 N/A THR 128.A OG1 SER 124.A O no hydrogen 3.246 N/A THR 128.A OG1 GLY 125.A O no hydrogen 2.700 N/A ALA 129.A N GLY 125.A O no hydrogen 3.030 N/A VAL 130.A N VAL 126.A O no hydrogen 2.961 N/A ALA 131.A N SER 127.A O no hydrogen 2.848 N/A ASN 132.A N THR 128.A O no hydrogen 2.994 N/A LEU 134.A N VAL 130.A O no hydrogen 2.942 N/A GLY 135.A N ALA 131.A O no hydrogen 2.919 N/A PHE 137.A N LEU 134.A O no hydrogen 3.342 N/A ILE 139.A N LEU 134.A O no hydrogen 3.329 N/A GLN 141.A N SER 159.A O no hydrogen 3.033 N/A VAL 142.A N VAL 118.A O no hydrogen 3.039 N/A SER 143.A N LEU 161.A O no hydrogen 2.918 N/A SER 143.A OG ALA 121.A O no hydrogen 3.492 N/A TYR 144.A OH LEU 18.A O no hydrogen 2.772 N/A TYR 144.A OH THR 122.A OG1 no hydrogen 2.953 N/A ALA 145.A N SER 143.A OG no hydrogen 3.289 N/A SER 146.A N SER 143.A OG no hydrogen 3.043 N/A SER 146.A OG ALA 121.A O no hydrogen 2.760 N/A SER 146.A OG THR 122.A O no hydrogen 2.809 N/A SER 146.A OG SER 127.A OG no hydrogen 2.561 N/A SER 147.A OG ASP 167.A OD1 no hydrogen 3.082 N/A SER 147.A OG ASP 167.A OD2 no hydrogen 2.687 N/A SER 148.A OG ASP 194.A O no hydrogen 2.487 N/A LEU 151.A N SER 148.A O no hydrogen 3.457 N/A SER 152.A N ARG 149.A O no hydrogen 2.975 N/A SER 152.A OG ARG 149.A O no hydrogen 3.387 N/A SER 152.A OG ASP 433.A OD2 no hydrogen 3.239 N/A LYS 154.A NZ LEU 151.A O no hydrogen 3.355 N/A LYS 154.A NZ PHE 157.A O no hydrogen 2.933 N/A LYS 154.A NZ PHE 160.A O no hydrogen 3.128 N/A PHE 157.A N ASN 153.A O no hydrogen 3.102 N/A LYS 158.A NZ ASN 155.A O no hydrogen 3.425 N/A SER 159.A OG ILE 139.A O no hydrogen 2.683 N/A LEU 161.A N GLN 141.A O no hydrogen 2.876 N/A ARG 162.A N GLY 432.A O no hydrogen 3.339 N/A ARG 162.A NE ASP 433.A OD1 no hydrogen 2.858 N/A ARG 162.A NH1 SER 146.A O no hydrogen 3.177 N/A ARG 162.A NH1 SER 148.A O no hydrogen 2.684 N/A ARG 162.A NH2 SER 148.A O no hydrogen 2.770 N/A ARG 162.A NH2 SER 152.A OG no hydrogen 2.768 N/A ARG 162.A NH2 ASP 433.A OD1 no hydrogen 3.471 N/A THR 163.A N SER 143.A O no hydrogen 3.079 N/A THR 163.A OG1 SER 143.A O no hydrogen 3.303 N/A THR 163.A OG1 ASN 368.A O no hydrogen 3.449 N/A ALA 171.A N ASP 167.A O no hydrogen 3.225 N/A THR 172.A N GLU 168.A O no hydrogen 3.038 N/A THR 172.A OG1 GLU 168.A O no hydrogen 2.690 N/A ALA 173.A N HIS 169.A O no hydrogen 2.847 N/A MET 174.A N GLN 170.A O no hydrogen 2.931 N/A ALA 175.A N ALA 171.A O no hydrogen 3.052 N/A ASP 176.A N THR 172.A O no hydrogen 2.926 N/A ILE 177.A N ALA 173.A O no hydrogen 2.894 N/A ILE 178.A N MET 174.A O no hydrogen 3.053 N/A GLU 179.A N ALA 175.A O no hydrogen 2.954 N/A TYR 180.A N ASP 176.A O no hydrogen 2.944 N/A PHE 181.A N ILE 177.A O no hydrogen 3.448 N/A ARG 182.A N GLU 179.A O no hydrogen 3.372 N/A TRP 183.A N ILE 178.A O no hydrogen 3.483 N/A TRP 183.A NE1 PRO 487.A O no hydrogen 3.140 N/A ASN 184.A N ASN 490.A OD1 no hydrogen 3.177 N/A VAL 186.A N CYS 213.A O no hydrogen 3.268 N/A GLY 187.A N VAL 243.A O no hydrogen 2.912 N/A THR 188.A N PHE 216.A O no hydrogen 2.995 N/A THR 188.A OG1 PHE 216.A O no hydrogen 3.320 N/A ILE 189.A N VAL 245.A O no hydrogen 2.902 N/A ALA 190.A N GLU 218.A O no hydrogen 3.184 N/A ALA 191.A N PHE 247.A O no hydrogen 2.919 N/A ASP 192.A N ILE 220.A O no hydrogen 3.110 N/A ASP 193.A N ALA 191.A O no hydrogen 2.873 N/A TYR 195.A N ASP 193.A OD1 no hydrogen 3.358 N/A TYR 195.A OH SER 273.A OG no hydrogen 2.957 N/A GLY 196.A N ASP 193.A OD1 no hydrogen 3.040 N/A ARG 197.A NH1 ASP 192.A OD1 no hydrogen 2.636 N/A ILE 200.A N GLY 196.A O no hydrogen 2.960 N/A GLU 201.A N ARG 197.A O no hydrogen 3.003 N/A LYS 202.A N PRO 198.A O no hydrogen 2.968 N/A LYS 202.A NZ GLU 206.A OE2 no hydrogen 2.914 N/A PHE 203.A N GLY 199.A O no hydrogen 2.968 N/A ARG 204.A N ILE 200.A O no hydrogen 2.951 N/A GLU 205.A N GLU 201.A O no hydrogen 3.020 N/A GLU 206.A N LYS 202.A O no hydrogen 2.950 N/A ALA 207.A N PHE 203.A O no hydrogen 2.856 N/A GLU 208.A N ARG 204.A O no hydrogen 3.019 N/A ARG 210.A NE GLU 179.A OE1 no hydrogen 3.241 N/A ARG 210.A NH1 GLU 206.A OE1 no hydrogen 2.655 N/A ARG 210.A NH2 ASP 176.A OD1 no hydrogen 3.170 N/A ILE 212.A N ALA 207.A O no hydrogen 3.183 N/A CYS 213.A N ASN 184.A O no hydrogen 3.039 N/A ASP 215.A N VAL 186.A O no hydrogen 2.845 N/A SER 217.A OG THR 188.A OG1 no hydrogen 3.326 N/A GLU 218.A N THR 188.A O no hydrogen 3.244 N/A ILE 220.A N ALA 190.A O no hydrogen 3.281 N/A TYR 223.A N SER 221.A OG no hydrogen 3.057 N/A SER 224.A OG GLU 228.A OE1 no hydrogen 3.133 N/A ASP 225.A N GLU 228.A OE1 no hydrogen 3.382 N/A GLU 228.A N ASP 225.A OD1 no hydrogen 3.355 N/A GLN 230.A N GLU 226.A O no hydrogen 2.953 N/A GLN 230.A NE2 GLU 226.A OE1 no hydrogen 3.324 N/A HIS 231.A N GLU 227.A O no hydrogen 2.949 N/A VAL 232.A N GLU 228.A O no hydrogen 2.985 N/A VAL 233.A N ILE 229.A O no hydrogen 2.920 N/A GLU 234.A N GLN 230.A O no hydrogen 2.957 N/A VAL 235.A N HIS 231.A O no hydrogen 2.949 N/A ILE 236.A N VAL 232.A O no hydrogen 2.926 N/A GLN 237.A N VAL 233.A O no hydrogen 2.945 N/A SER 239.A N ILE 236.A O no hydrogen 3.374 N/A SER 239.A OG ASP 215.A OD2 no hydrogen 2.312 N/A ALA 241.A N SER 239.A OG no hydrogen 3.334 N/A LYS 242.A N SER 489.A OG no hydrogen 3.334 N/A LYS 242.A NZ PHE 488.A O no hydrogen 2.943 N/A ILE 244.A N ILE 269.A O no hydrogen 2.925 N/A VAL 245.A N GLY 187.A O no hydrogen 2.903 N/A VAL 246.A N LEU 271.A O no hydrogen 2.987 N/A PHE 247.A N ILE 189.A O no hydrogen 2.896 N/A SER 248.A OG SER 249.A O no hydrogen 2.794 N/A LEU 253.A N GLY 250.A O no hydrogen 3.039 N/A GLU 254.A N GLY 250.A O no hydrogen 3.013 N/A ILE 257.A N LEU 253.A O no hydrogen 3.258 N/A LYS 258.A N GLU 254.A O no hydrogen 2.995 N/A GLU 259.A N PRO 255.A O no hydrogen 2.996 N/A ILE 260.A N LEU 256.A O no hydrogen 2.934 N/A VAL 261.A N ILE 257.A O no hydrogen 2.899 N/A ARG 262.A N LYS 258.A O no hydrogen 3.007 N/A ARG 262.A NE GLU 259.A OE1 no hydrogen 3.445 N/A ARG 262.A NE GLU 259.A OE2 no hydrogen 3.266 N/A ARG 262.A NH2 GLU 259.A OE2 no hydrogen 2.853 N/A ARG 263.A N GLU 259.A O no hydrogen 3.282 N/A ARG 263.A NE GLU 259.A OE2 no hydrogen 3.136 N/A ARG 263.A NH1 GLU 234.A OE1 no hydrogen 3.079 N/A ARG 263.A NH2 GLU 234.A OE1 no hydrogen 3.449 N/A ASN 264.A N VAL 261.A O no hydrogen 3.311 N/A ILE 265.A N ILE 260.A O no hydrogen 3.502 N/A LYS 268.A NZ ALA 241.A O no hydrogen 3.410 N/A ILE 269.A N LYS 242.A O no hydrogen 2.924 N/A LEU 271.A N ILE 244.A O no hydrogen 2.924 N/A ALA 272.A N ILE 295.A O no hydrogen 2.957 N/A SER 273.A N VAL 246.A O no hydrogen 3.252 N/A SER 273.A OG TYR 195.A OH no hydrogen 2.957 N/A GLU 274.A N GLN 170.A OE1 no hydrogen 3.072 N/A ALA 277.A N SER 273.A O no hydrogen 3.225 N/A SER 279.A N TRP 276.A O no hydrogen 3.372 N/A LEU 281.A N SER 279.A OG no hydrogen 3.327 N/A ALA 283.A N SER 279.A O no hydrogen 3.231 N/A MET 284.A N ILE 282.A O no hydrogen 2.998 N/A TYR 287.A N MET 284.A O no hydrogen 3.278 N/A PHE 288.A N PRO 285.A O no hydrogen 2.966 N/A VAL 290.A N TYR 287.A O no hydrogen 2.936 N/A VAL 291.A N TYR 287.A O no hydrogen 3.044 N/A GLY 292.A N PHE 288.A O no hydrogen 2.599 N/A THR 294.A OG1 VAL 291.A O no hydrogen 2.513 N/A ILE 295.A N TRP 270.A O no hydrogen 3.195 N/A GLY 296.A N ILE 441.A O no hydrogen 2.949 N/A ALA 298.A N SER 439.A O no hydrogen 2.895 N/A GLY 302.A N LEU 363.A O no hydrogen 3.020 N/A ARG 308.A NH1 ILE 358.A O no hydrogen 3.091 N/A ARG 308.A NH2 ILE 358.A O no hydrogen 2.852 N/A GLU 309.A N GLU 309.A OE1 no hydrogen 2.768 N/A PHE 310.A N GLY 306.A O no hydrogen 3.392 N/A LEU 311.A N PHE 307.A O no hydrogen 2.910 N/A LYS 312.A N ARG 308.A O no hydrogen 3.002 N/A LYS 313.A N PHE 310.A O no hydrogen 3.328 N/A HIS 315.A NE2 GLY 346.A O no hydrogen 3.013 N/A SER 319.A N HIS 315.A O no hydrogen 3.209 N/A SER 319.A OG HIS 315.A O no hydrogen 3.018 N/A GLY 323.A N ARG 6.A O no hydrogen 3.142 N/A PHE 324.A N ASN 322.A OD1 no hydrogen 3.088 N/A PHE 328.A N PHE 324.A O no hydrogen 3.341 N/A TRP 329.A N ALA 325.A O no hydrogen 2.963 N/A TRP 329.A NE1 GLU 348.A OE1 no hydrogen 3.198 N/A GLU 330.A N LYS 326.A O no hydrogen 2.998 N/A GLU 331.A N GLU 327.A O no hydrogen 2.904 N/A THR 332.A N PHE 328.A O no hydrogen 2.999 N/A THR 332.A OG1 PHE 328.A O no hydrogen 2.626 N/A PHE 333.A N TRP 329.A O no hydrogen 3.292 N/A HIS 336.A N PRO 342.A O no hydrogen 2.869 N/A LEU 337.A N GLU 330.A OE2 no hydrogen 3.111 N/A CYS 344.A N HIS 336.A O no hydrogen 2.883 N/A THR 345.A OG1 ASP 347.A OD2 no hydrogen 2.844 N/A SER 352.A N ASN 349.A O no hydrogen 3.169 N/A SER 352.A OG ASN 349.A O no hydrogen 3.481 N/A VAL 353.A N ILE 350.A O no hydrogen 3.513 N/A TYR 357.A N THR 355.A OG1 no hydrogen 3.182 N/A TYR 357.A OH LEU 311.A O no hydrogen 2.956 N/A ARG 364.A NH1 LEU 299.A O no hydrogen 2.431 N/A TYR 367.A OH ASN 421.A OD1 no hydrogen 2.985 N/A ASN 368.A N ARG 364.A O no hydrogen 3.373 N/A ASN 368.A ND2 TYR 144.A O no hydrogen 3.156 N/A VAL 369.A N ILE 365.A O no hydrogen 2.967 N/A TYR 370.A N SER 366.A O no hydrogen 3.037 N/A TYR 370.A OH GLU 61.A OE1 no hydrogen 2.358 N/A LEU 371.A N TYR 367.A O no hydrogen 2.905 N/A ALA 372.A N ASN 368.A O no hydrogen 2.955 N/A VAL 373.A N VAL 369.A O no hydrogen 3.129 N/A TYR 374.A N TYR 370.A O no hydrogen 3.020 N/A TYR 374.A OH GLU 61.A OE1 no hydrogen 2.742 N/A SER 375.A N LEU 371.A O no hydrogen 2.893 N/A SER 375.A OG LEU 371.A O no hydrogen 2.767 N/A ILE 376.A N ALA 372.A O no hydrogen 3.131 N/A ALA 377.A N VAL 373.A O no hydrogen 3.021 N/A HIS 378.A N TYR 374.A O no hydrogen 2.920 N/A HIS 378.A ND1 TYR 374.A O no hydrogen 3.080 N/A ALA 379.A N SER 375.A O no hydrogen 3.029 N/A LEU 380.A N ILE 376.A O no hydrogen 3.049 N/A GLN 381.A N ALA 377.A O no hydrogen 2.919 N/A ASP 382.A N HIS 378.A O no hydrogen 2.925 N/A ILE 383.A N ALA 379.A O no hydrogen 3.036 N/A TYR 384.A N LEU 380.A O no hydrogen 2.985 N/A THR 385.A N GLN 381.A O no hydrogen 3.099 N/A CYS 386.A SG LEU 387.A O no hydrogen 3.907 N/A CYS 386.A SG ARG 390.A O no hydrogen 3.734 N/A ARG 390.A N LEU 387.A O no hydrogen 3.174 N/A PHE 393.A N SER 397.A O no hydrogen 3.375 N/A GLY 396.A N PHE 393.A O no hydrogen 3.095 N/A SER 397.A OG THR 394.A O no hydrogen 2.657 N/A CYS 398.A SG LEU 387.A O no hydrogen 3.275 N/A LYS 403.A NZ ASP 400.A OD2 no hydrogen 3.505 N/A GLU 405.A N GLN 408.A OE1 no hydrogen 3.226 N/A GLN 408.A N GLU 405.A O no hydrogen 3.287 N/A VAL 409.A N GLU 405.A O no hydrogen 3.445 N/A LEU 410.A N ALA 406.A O no hydrogen 2.956 N/A LYS 411.A N TRP 407.A O no hydrogen 2.961 N/A LYS 411.A NZ HIS 415.A NE2 no hydrogen 3.353 N/A HIS 412.A N GLN 408.A O no hydrogen 2.972 N/A LEU 413.A N VAL 409.A O no hydrogen 2.875 N/A ARG 414.A N LEU 410.A O no hydrogen 3.036 N/A ARG 414.A N LYS 411.A O no hydrogen 3.282 N/A ARG 414.A NH2 LYS 158.A O no hydrogen 3.360 N/A PHE 418.A N VAL 426.A O no hydrogen 3.054 N/A THR 419.A OG1 GLN 425.A OE1 no hydrogen 2.428 N/A ASN 420.A N GLU 424.A O no hydrogen 3.068 N/A ASN 421.A ND2 GLN 303.A O no hydrogen 2.764 N/A GLY 423.A N ASN 420.A O no hydrogen 3.021 N/A GLU 424.A N ASN 420.A OD1 no hydrogen 2.745 N/A GLN 425.A NE2 ASN 417.A OD1 no hydrogen 2.888 N/A VAL 426.A N PHE 418.A O no hydrogen 2.841 N/A ASP 429.A N ASP 433.A O no hydrogen 3.393 N/A GLY 432.A N ASP 429.A O no hydrogen 3.140 N/A ASP 433.A N ASP 429.A OD1 no hydrogen 2.290 N/A TYR 438.A N TYR 460.A O no hydrogen 2.996 N/A SER 439.A N ALA 298.A O no hydrogen 2.899 N/A SER 439.A OG GLU 456.A OE2 no hydrogen 3.226 N/A ILE 440.A N GLY 458.A O no hydrogen 2.848 N/A ILE 441.A N GLY 296.A O no hydrogen 2.939 N/A ASN 442.A N LYS 455.A O no hydrogen 2.861 N/A ASN 442.A ND2 GLY 293.A O no hydrogen 3.405 N/A ASN 442.A ND2 THR 294.A O no hydrogen 3.335 N/A TRP 443.A N THR 294.A O no hydrogen 3.065 N/A TRP 443.A NE1 ALA 277.A O no hydrogen 3.184 N/A HIS 444.A N VAL 453.A O no hydrogen 2.828 N/A SER 446.A N SER 451.A O no hydrogen 2.729 N/A GLY 450.A N SER 446.A O no hydrogen 3.266 N/A VAL 453.A N HIS 444.A O no hydrogen 2.971 N/A LYS 455.A N ASN 442.A O no hydrogen 2.984 N/A LYS 455.A NZ HIS 444.A ND1 no hydrogen 3.286 N/A VAL 457.A N ILE 440.A O no hydrogen 2.717 N/A GLY 458.A N ILE 440.A O no hydrogen 3.022 N/A TYR 459.A N PHE 471.A O no hydrogen 2.934 N/A TYR 460.A N TYR 438.A O no hydrogen 2.885 N/A TYR 460.A OH ASP 176.A OD2 no hydrogen 3.325 N/A ASN 461.A N ARG 469.A O no hydrogen 2.860 N/A VAL 462.A N ASN 437.A OD1 no hydrogen 3.233 N/A TYR 463.A N ASN 461.A OD1 no hydrogen 3.185 N/A LYS 465.A NZ GLU 468.A OE1 no hydrogen 2.799 N/A LYS 465.A NZ GLU 468.A OE2 no hydrogen 3.289 N/A GLU 468.A N LYS 465.A O no hydrogen 3.122 N/A ARG 469.A NE ALA 464.A O no hydrogen 3.097 N/A ARG 469.A NH2 ALA 464.A O no hydrogen 3.320 N/A PHE 471.A N TYR 459.A O no hydrogen 2.948 N/A ASN 473.A N VAL 457.A O no hydrogen 2.992 N/A LYS 476.A N ASN 473.A O no hydrogen 3.477 N/A ILE 477.A N GLU 474.A O no hydrogen 3.412 N/A TRP 479.A N SER 483.A O no hydrogen 2.863 N/A SER 483.A OG GLU 485.A O no hydrogen 3.560 N/A ARG 484.A NH1 GLU 474.A O no hydrogen 3.404 N/A ARG 484.A NH1 ILE 477.A O no hydrogen 2.791 N/A GLU 485.A N SER 483.A OG no hydrogen 3.134 N/A SER 489.A OG TRP 185.A O no hydrogen 3.103 N/A SER 492.A OG PHE 512.A O no hydrogen 3.522 N/A CYS 495.A N ASP 527.A OD1 no hydrogen 3.243 N/A CYS 495.A SG ARG 500.A O no hydrogen 3.399 N/A CYS 495.A SG GLU 513.A O no hydrogen 3.909 N/A THR 499.A OG1 LEU 496.A O no hydrogen 3.360 N/A ARG 500.A N VAL 515.A O no hydrogen 2.883 N/A ARG 500.A NH2 LYS 501.A O no hydrogen 2.449 N/A GLY 502.A N GLU 513.A O no hydrogen 2.871 N/A GLU 507.A N ILE 504.A O no hydrogen 3.362 N/A CYS 510.A SG ASN 184.A O no hydrogen 3.693 N/A CYS 511.A N PRO 508.A O no hydrogen 3.322 N/A PHE 512.A N SER 492.A OG no hydrogen 3.367 N/A GLU 513.A N GLY 502.A O no hydrogen 2.915 N/A VAL 515.A N ARG 500.A O no hydrogen 2.908 N/A CYS 517.A SG GLY 498.A O no hydrogen 3.732 N/A GLU 521.A N PRO 518.A O no hydrogen 3.484 N/A TYR 522.A N ASN 532.A O no hydrogen 3.209 N/A SER 523.A OG ALA 497.A O no hydrogen 2.281 N/A SER 523.A OG THR 499.A O no hydrogen 3.207 N/A ASN 532.A N TYR 522.A O no hydrogen 3.041 N/A TRP 539.A N ILE 548.A O no hydrogen 2.748 N/A SER 540.A OG ASP 519.A O no hydrogen 2.331 N/A SER 540.A OG ASN 541.A O no hydrogen 3.523 N/A SER 546.A OG THR 545.A O no hydrogen 2.797 N/A ILE 548.A N TRP 539.A O no hydrogen 2.649 N/A LYS 550.A N ASP 537.A O no hydrogen 3.191 N/A GLU 551.A N GLU 693.A O no hydrogen 3.401 N/A GLU 553.A N ILE 695.A O no hydrogen 2.870 N/A ILE 563.A N GLU 559.A O no hydrogen 3.126 N/A ALA 564.A N PRO 560.A O no hydrogen 2.967 N/A LEU 565.A N PHE 561.A O no hydrogen 2.983 N/A THR 566.A N GLY 562.A O no hydrogen 2.920 N/A THR 566.A OG1 GLY 562.A O no hydrogen 2.322 N/A LEU 567.A N ILE 563.A O no hydrogen 2.901 N/A PHE 568.A N ALA 564.A O no hydrogen 3.029 N/A ALA 569.A N LEU 565.A O no hydrogen 2.978 N/A VAL 570.A N THR 566.A O no hydrogen 2.934 N/A LEU 571.A N LEU 567.A O no hydrogen 2.938 N/A GLY 572.A N PHE 568.A O no hydrogen 2.985 N/A ILE 573.A N ALA 569.A O no hydrogen 2.978 N/A PHE 574.A N VAL 570.A O no hydrogen 2.911 N/A LEU 575.A N LEU 571.A O no hydrogen 2.968 N/A THR 576.A N GLY 572.A O no hydrogen 2.991 N/A THR 576.A OG1 GLY 572.A O no hydrogen 3.133 N/A ALA 577.A N ILE 573.A O no hydrogen 2.944 N/A PHE 578.A N PHE 574.A O no hydrogen 2.908 N/A VAL 579.A N LEU 575.A O no hydrogen 3.011 N/A LEU 580.A N THR 576.A O no hydrogen 2.954 N/A GLY 581.A N ALA 577.A O no hydrogen 2.907 N/A VAL 582.A N PHE 578.A O no hydrogen 2.981 N/A PHE 583.A N VAL 579.A O no hydrogen 3.005 N/A ILE 584.A N LEU 580.A O no hydrogen 2.940 N/A LYS 585.A N GLY 581.A O no hydrogen 2.910 N/A PHE 586.A N VAL 582.A O no hydrogen 2.966 N/A THR 589.A OG1 PHE 586.A O no hydrogen 3.266 N/A LYS 593.A N THR 589.A O no hydrogen 2.927 N/A ALA 594.A N PRO 590.A O no hydrogen 2.910 N/A THR 595.A N VAL 592.A O no hydrogen 3.131 N/A THR 595.A OG1 ILE 591.A O no hydrogen 3.359 N/A THR 595.A OG1 VAL 592.A O no hydrogen 2.749 N/A ASN 596.A ND2 ASN 596.A O no hydrogen 2.399 N/A LEU 602.A N GLU 598.A O no hydrogen 3.491 N/A LEU 603.A N LEU 599.A O no hydrogen 2.919 N/A LEU 604.A N SER 600.A O no hydrogen 2.920 N/A PHE 605.A N TYR 601.A O no hydrogen 2.980 N/A SER 606.A N LEU 602.A O no hydrogen 2.890 N/A SER 606.A OG LEU 602.A O no hydrogen 2.599 N/A LEU 607.A N LEU 603.A O no hydrogen 2.927 N/A LEU 608.A N LEU 604.A O no hydrogen 2.926 N/A CYS 609.A N PHE 605.A O no hydrogen 2.964 N/A CYS 610.A N SER 606.A O no hydrogen 2.879 N/A CYS 610.A SG SER 779.A OG no hydrogen 2.646 N/A PHE 611.A N LEU 607.A O no hydrogen 2.913 N/A SER 612.A N LEU 608.A O no hydrogen 2.944 N/A SER 612.A OG CYS 609.A O no hydrogen 3.551 N/A SER 613.A OG CYS 610.A O no hydrogen 3.234 N/A SER 614.A OG PHE 611.A O no hydrogen 3.059 N/A GLY 619.A N LEU 555.A O no hydrogen 2.910 N/A GLN 622.A N THR 625.A OG1 no hydrogen 3.131 N/A TRP 624.A NE1 GLN 622.A OE1 no hydrogen 2.380 N/A THR 625.A OG1 GLN 622.A O no hydrogen 3.433 N/A ARG 627.A N TRP 624.A O no hydrogen 3.226 N/A LEU 628.A N THR 625.A O no hydrogen 3.208 N/A GLY 634.A N GLN 630.A O no hydrogen 2.964 N/A ILE 635.A N PRO 631.A O no hydrogen 2.912 N/A SER 636.A N ALA 632.A O no hydrogen 2.984 N/A PHE 637.A N PHE 633.A O no hydrogen 2.949 N/A LEU 639.A N ILE 635.A O no hydrogen 2.980 N/A CYS 640.A N SER 636.A O no hydrogen 3.015 N/A ILE 641.A N PHE 637.A O no hydrogen 2.891 N/A SER 642.A N VAL 638.A O no hydrogen 2.950 N/A SER 642.A OG VAL 638.A O no hydrogen 2.721 N/A SER 642.A OG LEU 639.A O no hydrogen 2.806 N/A CYS 643.A N LEU 639.A O no hydrogen 2.990 N/A CYS 643.A SG LEU 639.A O no hydrogen 3.377 N/A ILE 644.A N CYS 640.A O no hydrogen 2.963 N/A LEU 645.A N ILE 641.A O no hydrogen 2.863 N/A VAL 646.A N SER 642.A O no hydrogen 2.964 N/A LYS 647.A N ILE 644.A O no hydrogen 3.469 N/A LEU 652.A N ASN 649.A O no hydrogen 3.293 N/A LEU 653.A N ARG 650.A O no hydrogen 2.908 N/A VAL 654.A N VAL 651.A O no hydrogen 2.936 N/A PHE 655.A N LEU 652.A O no hydrogen 3.460 N/A GLN 658.A NE2 ASN 596.A OD1 no hydrogen 2.899 N/A PHE 663.A N PHE 659.A O no hydrogen 2.914 N/A LEU 664.A N LEU 660.A O no hydrogen 2.956 N/A CYS 665.A N LEU 661.A O no hydrogen 2.978 N/A CYS 665.A SG LEU 661.A O no hydrogen 3.243 N/A THR 666.A N VAL 662.A O no hydrogen 2.971 N/A PHE 667.A N PHE 663.A O no hydrogen 2.892 N/A MET 668.A N LEU 664.A O no hydrogen 3.036 N/A GLN 669.A NE2 GLY 634.A O no hydrogen 2.701 N/A ILE 670.A N THR 666.A O no hydrogen 2.966 N/A VAL 671.A N PHE 667.A O no hydrogen 2.954 N/A ILE 672.A N MET 668.A O no hydrogen 3.066 N/A CYS 673.A N GLN 669.A O no hydrogen 3.000 N/A CYS 673.A SG GLN 669.A O no hydrogen 3.273 N/A VAL 674.A N ILE 670.A O no hydrogen 2.976 N/A ILE 675.A N VAL 671.A O no hydrogen 3.031 N/A TRP 676.A N ILE 672.A O no hydrogen 2.954 N/A LEU 677.A N CYS 673.A O no hydrogen 2.933 N/A TYR 678.A N VAL 674.A O no hydrogen 2.933 N/A THR 679.A N ILE 675.A O no hydrogen 2.949 N/A THR 679.A OG1 ILE 675.A O no hydrogen 3.100 N/A ALA 680.A N TRP 676.A O no hydrogen 3.313 N/A SER 683.A N HIS 700.A O no hydrogen 2.924 N/A SER 684.A OG PRO 621.A O no hydrogen 3.276 N/A TYR 685.A N THR 698.A O no hydrogen 2.916 N/A ASN 687.A N PHE 696.A O no hydrogen 2.867 N/A GLN 688.A N GLU 689.A OE2 no hydrogen 2.952 N/A GLU 689.A N ASN 687.A OD1 no hydrogen 3.201 N/A ILE 695.A N GLU 551.A O no hydrogen 2.899 N/A PHE 696.A N ASN 687.A O no hydrogen 2.930 N/A ILE 697.A N GLU 553.A O no hydrogen 3.000 N/A THR 698.A N TYR 685.A O no hydrogen 2.919 N/A THR 698.A OG1 TYR 685.A O no hydrogen 3.492 N/A HIS 700.A N SER 683.A O no hydrogen 2.893 N/A GLY 708.A N LEU 704.A O no hydrogen 2.981 N/A PHE 709.A N MET 705.A O no hydrogen 2.856 N/A LEU 710.A N ALA 706.A O no hydrogen 2.940 N/A ILE 711.A N LEU 707.A O no hydrogen 3.016 N/A GLY 712.A N GLY 708.A O no hydrogen 2.913 N/A TYR 713.A N PHE 709.A O no hydrogen 2.917 N/A TYR 713.A OH CYS 665.A O no hydrogen 3.070 N/A THR 714.A N LEU 710.A O no hydrogen 3.063 N/A THR 714.A OG1 LEU 710.A O no hydrogen 3.097 N/A CYS 715.A N ILE 711.A O no hydrogen 2.965 N/A CYS 715.A SG ILE 711.A O no hydrogen 3.279 N/A LEU 716.A N GLY 712.A O no hydrogen 2.874 N/A LEU 717.A N TYR 713.A O no hydrogen 3.052 N/A ALA 718.A N THR 714.A O no hydrogen 2.985 N/A ALA 719.A N CYS 715.A O no hydrogen 2.905 N/A ILE 720.A N LEU 716.A O no hydrogen 2.977 N/A CYS 721.A N LEU 717.A O no hydrogen 2.990 N/A PHE 722.A N ALA 718.A O no hydrogen 2.940 N/A PHE 723.A N ALA 719.A O no hydrogen 2.934 N/A PHE 724.A N ILE 720.A O no hydrogen 3.000 N/A ALA 725.A N CYS 721.A O no hydrogen 2.942 N/A PHE 726.A N PHE 723.A O no hydrogen 3.005 N/A LYS 727.A N PHE 723.A O no hydrogen 3.204 N/A SER 728.A OG ASN 649.A OD1 no hydrogen 2.508 N/A ASN 734.A N VAL 806.A O no hydrogen 2.986 N/A ASN 736.A N GLU 733.A O no hydrogen 3.085 N/A ILE 741.A N GLU 737.A O no hydrogen 2.962 N/A THR 742.A N ALA 738.A O no hydrogen 2.977 N/A THR 742.A OG1 ALA 738.A O no hydrogen 3.368 N/A THR 742.A OG1 LYS 739.A O no hydrogen 2.599 N/A PHE 743.A N LYS 739.A O no hydrogen 2.942 N/A SER 744.A N PHE 740.A O no hydrogen 2.909 N/A SER 744.A OG ILE 741.A O no hydrogen 2.734 N/A MET 745.A N ILE 741.A O no hydrogen 2.986 N/A LEU 746.A N THR 742.A O no hydrogen 2.929 N/A ILE 747.A N PHE 743.A O no hydrogen 2.917 N/A PHE 748.A N SER 744.A O no hydrogen 2.981 N/A PHE 749.A N MET 745.A O no hydrogen 3.015 N/A ILE 750.A N LEU 746.A O no hydrogen 2.892 N/A VAL 751.A N ILE 747.A O no hydrogen 2.973 N/A TRP 752.A N PHE 748.A O no hydrogen 3.041 N/A ILE 753.A N PHE 749.A O no hydrogen 2.907 N/A SER 754.A N ILE 750.A O no hydrogen 2.878 N/A PHE 755.A N VAL 751.A O no hydrogen 3.017 N/A ILE 756.A N ILE 753.A O no hydrogen 3.223 N/A TYR 759.A N PHE 755.A O no hydrogen 3.196 N/A TYR 759.A N ILE 756.A O no hydrogen 3.110 N/A TYR 759.A OH GLU 771.A OE2 no hydrogen 2.727 N/A ALA 760.A N ILE 756.A O no hydrogen 3.354 N/A SER 761.A OG PRO 757.A O no hydrogen 3.287 N/A THR 762.A OG1 THR 762.A O no hydrogen 2.660 N/A THR 762.A OG1 LYS 765.A O no hydrogen 2.673 N/A LYS 765.A N THR 762.A O no hydrogen 2.966 N/A ALA 769.A N PHE 766.A O no hydrogen 3.096 N/A GLU 771.A N VAL 767.A O no hydrogen 2.989 N/A VAL 772.A N SER 768.A O no hydrogen 2.909 N/A ILE 773.A N ALA 769.A O no hydrogen 2.963 N/A ALA 774.A N VAL 770.A O no hydrogen 2.996 N/A LEU 776.A N VAL 772.A O no hydrogen 2.989 N/A ALA 777.A N ILE 773.A O no hydrogen 2.919 N/A ALA 778.A N ALA 774.A O no hydrogen 2.992 N/A SER 779.A N ILE 775.A O no hydrogen 2.985 N/A SER 779.A OG ILE 775.A O no hydrogen 2.896 N/A PHE 780.A N LEU 776.A O no hydrogen 2.939 N/A GLY 781.A N ALA 777.A O no hydrogen 2.952 N/A LEU 782.A N ALA 778.A O no hydrogen 3.004 N/A LEU 783.A N SER 779.A O no hydrogen 2.996 N/A ALA 784.A N PHE 780.A O no hydrogen 2.951 N/A CYS 785.A N GLY 781.A O no hydrogen 2.919 N/A ILE 786.A N LEU 782.A O no hydrogen 3.001 N/A PHE 787.A N LEU 783.A O no hydrogen 2.993 N/A ILE 791.A N PHE 787.A O no hydrogen 3.001 N/A TYR 792.A N PHE 788.A O no hydrogen 3.025 N/A TYR 792.A N ASN 789.A O no hydrogen 3.216 N/A ILE 794.A N LYS 790.A O no hydrogen 3.014 N/A LEU 795.A N ILE 791.A O no hydrogen 2.908 N/A PHE 796.A N TYR 792.A O no hydrogen 3.219 N/A GLU 805.A N THR 802.A O no hydrogen 3.222 N/A ARG 807.A N ILE 803.A O no hydrogen 3.478 N/A CYS 808.A SG SER 809.A O no hydrogen 3.840 N/A SER 809.A N PRO 732.A O no hydrogen 3.351 N/A THR 810.A OG1 GLU 805.A OE1 no hydrogen 2.962 N/A THR 810.A OG1 GLU 805.A OE2 no hydrogen 3.174 N/A THR 810.A OG1 CYS 808.A O no hydrogen 3.551 N/A ALA 818.A N ALA 814.A O no hydrogen 2.896 N/A ALA 819.A N PHE 815.A O no hydrogen 2.885 N/A