Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 8szi_B.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLN 5.A NE2 GLU 317.A OE1 no hydrogen 2.826 N/A ARG 6.A NE PRO 3.A O no hydrogen 2.959 N/A ARG 6.A NH2 PRO 3.A O no hydrogen 2.820 N/A ALA 7.A N ILE 78.A O no hydrogen 3.422 N/A GLN 8.A N HIS 311.A O no hydrogen 3.230 N/A LYS 9.A N TYR 76.A O no hydrogen 3.111 N/A ASP 12.A N THR 73.A OG1 no hydrogen 3.221 N/A ILE 13.A N THR 73.A O no hydrogen 3.352 N/A LEU 15.A N GLY 75.A O no hydrogen 3.229 N/A GLY 16.A N ALA 107.A O no hydrogen 2.947 N/A GLY 17.A N ARG 77.A O no hydrogen 3.217 N/A PHE 19.A N PHE 79.A O no hydrogen 3.357 N/A ILE 21.A N PHE 19.A O no hydrogen 3.216 N/A ILE 21.A N ASP 80.A OD1 no hydrogen 2.883 N/A PHE 23.A N ARG 43.A O no hydrogen 2.835 N/A ALA 26.A N GLU 40.A O no hydrogen 2.946 N/A ILE 42.A N GLY 24.A O no hydrogen 3.151 N/A ARG 43.A NH1 GLU 244.A OE1 no hydrogen 3.101 N/A ASN 45.A N ILE 21.A O no hydrogen 2.846 N/A ASN 45.A ND2 PRO 20.A O no hydrogen 3.294 N/A PHE 49.A N ASN 45.A O no hydrogen 3.320 N/A ARG 50.A N ARG 47.A O no hydrogen 3.349 N/A GLN 53.A NE2 TYR 346.A OH no hydrogen 2.787 N/A ALA 54.A N ARG 50.A O no hydrogen 3.374 N/A ALA 54.A N TRP 51.A O no hydrogen 3.181 N/A MET 55.A N TRP 51.A O no hydrogen 3.428 N/A ILE 56.A N LEU 52.A O no hydrogen 3.038 N/A PHE 57.A N GLN 53.A O no hydrogen 2.861 N/A ALA 58.A N ALA 54.A O no hydrogen 2.922 N/A ILE 59.A N MET 55.A O no hydrogen 2.979 N/A GLU 60.A N ILE 56.A O no hydrogen 2.955 N/A GLU 61.A N PHE 57.A O no hydrogen 2.881 N/A ILE 62.A N ALA 58.A O no hydrogen 2.950 N/A ASN 63.A N ILE 59.A O no hydrogen 2.949 N/A ASN 63.A ND2 LEU 74.A O no hydrogen 3.455 N/A SER 64.A N GLU 61.A O no hydrogen 3.245 N/A SER 64.A OG GLU 60.A O no hydrogen 3.353 N/A SER 65.A N ILE 62.A O no hydrogen 3.190 N/A SER 65.A OG ILE 62.A O no hydrogen 3.089 N/A LEU 68.A N SER 65.A O no hydrogen 3.456 N/A LEU 74.A N ASN 63.A OD1 no hydrogen 3.209 N/A GLY 75.A N ILE 13.A O no hydrogen 2.757 N/A ARG 77.A N LEU 15.A O no hydrogen 2.715 N/A ARG 77.A NH2 THR 105.A OG1 no hydrogen 2.668 N/A ILE 78.A N ALA 7.A O no hydrogen 3.040 N/A PHE 79.A N GLY 17.A O no hydrogen 3.188 N/A THR 81.A N PHE 19.A O no hydrogen 3.221 N/A CYS 82.A N ASP 80.A OD1 no hydrogen 3.019 N/A CYS 82.A SG HIS 22.A ND1 no hydrogen 3.943 N/A CYS 82.A SG ASP 80.A OD2 no hydrogen 3.205 N/A ASN 83.A N THR 81.A OG1 no hydrogen 3.256 N/A THR 84.A N THR 81.A O no hydrogen 3.121 N/A THR 84.A OG1 CYS 82.A O no hydrogen 2.957 N/A LYS 87.A NZ VAL 39.A O no hydrogen 3.117 N/A ALA 88.A N THR 84.A O no hydrogen 3.383 N/A LEU 89.A N VAL 85.A O no hydrogen 2.905 N/A GLU 90.A N SER 86.A O no hydrogen 2.920 N/A ALA 91.A N LYS 87.A O no hydrogen 2.937 N/A THR 92.A N ALA 88.A O no hydrogen 2.861 N/A THR 92.A OG1 ALA 88.A O no hydrogen 2.655 N/A LEU 93.A N LEU 89.A O no hydrogen 2.940 N/A SER 94.A N ALA 91.A O no hydrogen 3.293 N/A SER 94.A OG ALA 91.A O no hydrogen 2.873 N/A PHE 95.A N THR 92.A O no hydrogen 2.806 N/A ILE 106.A N ILE 14.A O no hydrogen 3.172 N/A VAL 108.A N PRO 130.A O no hydrogen 3.397 N/A VAL 109.A N GLY 16.A O no hydrogen 3.252 N/A GLY 110.A N VAL 132.A O no hydrogen 2.502 N/A SER 117.A N GLY 113.A O no hydrogen 3.054 N/A SER 117.A OG GLY 113.A O no hydrogen 3.212 N/A SER 117.A OG SER 136.A OG no hydrogen 2.548 N/A THR 118.A N SER 114.A O no hydrogen 3.127 N/A THR 118.A OG1 SER 114.A O no hydrogen 3.510 N/A THR 118.A OG1 GLY 115.A O no hydrogen 2.836 N/A ALA 119.A N GLY 115.A O no hydrogen 3.473 N/A VAL 120.A N VAL 116.A O no hydrogen 2.941 N/A ALA 121.A N SER 117.A O no hydrogen 2.862 N/A ASN 122.A N THR 118.A O no hydrogen 2.930 N/A LEU 123.A N VAL 120.A O no hydrogen 3.178 N/A LEU 124.A N VAL 120.A O no hydrogen 2.921 N/A GLY 125.A N ALA 121.A O no hydrogen 2.895 N/A ILE 129.A N LEU 124.A O no hydrogen 3.350 N/A GLN 131.A N SER 149.A O no hydrogen 2.951 N/A VAL 132.A N VAL 108.A O no hydrogen 3.107 N/A SER 133.A N LEU 151.A O no hydrogen 3.013 N/A SER 133.A OG ALA 111.A O no hydrogen 3.144 N/A TYR 134.A OH LEU 18.A O no hydrogen 3.254 N/A SER 136.A N SER 133.A OG no hydrogen 3.246 N/A SER 136.A OG ALA 111.A O no hydrogen 3.555 N/A SER 136.A OG THR 112.A O no hydrogen 3.048 N/A SER 136.A OG GLY 113.A O no hydrogen 3.323 N/A SER 136.A OG SER 117.A OG no hydrogen 2.548 N/A SER 136.A OG SER 133.A OG no hydrogen 3.313 N/A SER 137.A OG ASP 157.A OD1 no hydrogen 3.108 N/A SER 137.A OG ASP 157.A OD2 no hydrogen 3.351 N/A SER 138.A OG ASP 184.A O no hydrogen 2.947 N/A LEU 140.A N SER 138.A OG no hydrogen 3.274 N/A LEU 141.A N SER 138.A O no hydrogen 2.974 N/A SER 142.A N ARG 139.A O no hydrogen 3.375 N/A SER 142.A OG ASP 422.A OD2 no hydrogen 3.021 N/A LYS 144.A NZ PHE 147.A O no hydrogen 3.083 N/A ASN 145.A ND2 ASN 143.A OD1 no hydrogen 3.323 N/A PHE 147.A N ASN 143.A O no hydrogen 3.023 N/A SER 149.A OG ILE 129.A O no hydrogen 2.636 N/A LEU 151.A N GLN 131.A O no hydrogen 2.819 N/A ARG 152.A N GLY 421.A O no hydrogen 2.879 N/A ARG 152.A NH2 SER 138.A O no hydrogen 2.526 N/A THR 153.A N SER 133.A O no hydrogen 3.221 N/A THR 153.A OG1 SER 133.A O no hydrogen 3.450 N/A ALA 161.A N ASP 157.A O no hydrogen 2.917 N/A THR 162.A N GLU 158.A O no hydrogen 2.979 N/A THR 162.A OG1 GLU 158.A O no hydrogen 2.838 N/A ALA 163.A N HIS 159.A O no hydrogen 2.867 N/A MET 164.A N GLN 160.A O no hydrogen 2.928 N/A ALA 165.A N ALA 161.A O no hydrogen 3.016 N/A ASP 166.A N THR 162.A O no hydrogen 2.890 N/A ILE 167.A N ALA 163.A O no hydrogen 2.881 N/A ILE 168.A N MET 164.A O no hydrogen 2.976 N/A GLU 169.A N ALA 165.A O no hydrogen 2.931 N/A TYR 170.A N ASP 166.A O no hydrogen 2.885 N/A TYR 170.A N ILE 167.A O no hydrogen 3.194 N/A PHE 171.A N ILE 167.A O no hydrogen 3.322 N/A ASN 174.A N SER 478.A O no hydrogen 3.460 N/A TRP 175.A NE1 THR 230.A OG1 no hydrogen 3.073 N/A VAL 176.A N CYS 203.A O no hydrogen 3.258 N/A GLY 177.A N VAL 233.A O no hydrogen 2.891 N/A THR 178.A N PHE 206.A O no hydrogen 3.286 N/A THR 178.A OG1 PHE 206.A O no hydrogen 3.232 N/A ILE 179.A N VAL 235.A O no hydrogen 2.849 N/A ALA 180.A N GLU 208.A O no hydrogen 3.255 N/A ALA 181.A N PHE 237.A O no hydrogen 2.907 N/A ASP 182.A N ILE 210.A O no hydrogen 3.047 N/A ASP 183.A N ALA 181.A O no hydrogen 2.976 N/A TYR 185.A N ASP 183.A OD1 no hydrogen 3.072 N/A TYR 185.A OH SER 263.A OG no hydrogen 3.102 N/A GLY 186.A N ASP 183.A OD1 no hydrogen 2.865 N/A ARG 187.A NH1 ASP 182.A OD1 no hydrogen 2.438 N/A ILE 190.A N GLY 186.A O no hydrogen 3.073 N/A GLU 191.A N ARG 187.A O no hydrogen 2.947 N/A LYS 192.A N PRO 188.A O no hydrogen 2.935 N/A PHE 193.A N GLY 189.A O no hydrogen 2.924 N/A ARG 194.A N ILE 190.A O no hydrogen 2.912 N/A ARG 194.A NH1 GLU 198.A OE2 no hydrogen 3.417 N/A ARG 194.A NH2 GLU 191.A OE2 no hydrogen 3.170 N/A GLU 195.A N GLU 191.A O no hydrogen 2.965 N/A GLU 196.A N LYS 192.A O no hydrogen 2.918 N/A ALA 197.A N PHE 193.A O no hydrogen 2.857 N/A GLU 198.A N ARG 194.A O no hydrogen 3.019 N/A GLU 199.A N GLU 196.A O no hydrogen 3.213 N/A ARG 200.A NH1 GLU 196.A OE1 no hydrogen 2.491 N/A ARG 200.A NH2 ASP 166.A OD1 no hydrogen 2.592 N/A ASP 201.A N GLU 198.A O no hydrogen 3.311 N/A ILE 202.A N ALA 197.A O no hydrogen 3.253 N/A CYS 203.A N ASN 174.A O no hydrogen 3.219 N/A ASP 205.A N VAL 176.A O no hydrogen 2.853 N/A GLU 208.A N THR 178.A O no hydrogen 3.335 N/A ILE 210.A N ALA 180.A O no hydrogen 3.052 N/A TYR 213.A N SER 211.A OG no hydrogen 3.398 N/A SER 214.A OG SER 211.A O no hydrogen 3.491 N/A SER 214.A OG GLU 218.A OE2 no hydrogen 2.969 N/A ILE 219.A N ASP 215.A O no hydrogen 3.476 N/A GLN 220.A N GLU 216.A O no hydrogen 2.918 N/A HIS 221.A N GLU 217.A O no hydrogen 2.907 N/A VAL 222.A N GLU 218.A O no hydrogen 2.896 N/A VAL 223.A N ILE 219.A O no hydrogen 2.939 N/A GLU 224.A N GLN 220.A O no hydrogen 3.138 N/A VAL 225.A N VAL 222.A O no hydrogen 3.246 N/A GLN 227.A N VAL 223.A O no hydrogen 3.299 N/A SER 229.A N ILE 226.A O no hydrogen 3.346 N/A SER 229.A OG ILE 226.A O no hydrogen 2.886 N/A LYS 232.A NZ PHE 477.A O no hydrogen 3.507 N/A ILE 234.A N ILE 259.A O no hydrogen 2.865 N/A VAL 235.A N GLY 177.A O no hydrogen 2.897 N/A VAL 236.A N LEU 261.A O no hydrogen 3.237 N/A PHE 237.A N ILE 179.A O no hydrogen 3.098 N/A SER 238.A OG SER 239.A O no hydrogen 3.317 N/A LEU 243.A N GLY 240.A O no hydrogen 3.126 N/A GLU 244.A N GLY 240.A O no hydrogen 2.926 N/A ILE 247.A N LEU 243.A O no hydrogen 3.238 N/A LYS 248.A N GLU 244.A O no hydrogen 2.946 N/A LYS 248.A NZ TYR 277.A OH no hydrogen 3.036 N/A GLU 249.A N PRO 245.A O no hydrogen 2.932 N/A ILE 250.A N LEU 246.A O no hydrogen 2.913 N/A VAL 251.A N ILE 247.A O no hydrogen 2.915 N/A ARG 252.A N LYS 248.A O no hydrogen 2.938 N/A ARG 252.A NE GLU 249.A OE2 no hydrogen 3.475 N/A ARG 252.A NH2 GLU 249.A OE2 no hydrogen 3.499 N/A ARG 253.A N GLU 249.A O no hydrogen 3.151 N/A ARG 253.A N ILE 250.A O no hydrogen 3.221 N/A ARG 253.A NE GLU 249.A OE2 no hydrogen 3.447 N/A ARG 253.A NH1 GLN 227.A OE1 no hydrogen 3.570 N/A ARG 253.A NH2 GLN 220.A OE1 no hydrogen 2.316 N/A ASN 254.A N VAL 251.A O no hydrogen 3.041 N/A ILE 255.A N ILE 250.A O no hydrogen 3.454 N/A LYS 258.A NZ ALA 231.A O no hydrogen 3.050 N/A ILE 259.A N LYS 232.A O no hydrogen 2.761 N/A TRP 260.A NE1 VAL 280.A O no hydrogen 2.905 N/A LEU 261.A N ILE 234.A O no hydrogen 2.970 N/A ALA 262.A N ILE 285.A O no hydrogen 3.055 N/A SER 263.A OG TYR 185.A OH no hydrogen 3.102 N/A GLU 264.A N GLN 160.A OE1 no hydrogen 2.928 N/A TRP 266.A N SER 263.A O no hydrogen 3.267 N/A ALA 273.A N SER 269.A O no hydrogen 3.148 N/A MET 274.A N ILE 272.A O no hydrogen 2.925 N/A TYR 277.A N MET 274.A O no hydrogen 3.095 N/A PHE 278.A N PRO 275.A O no hydrogen 3.389 N/A VAL 280.A N TYR 277.A O no hydrogen 2.914 N/A VAL 281.A N TYR 277.A O no hydrogen 2.905 N/A GLY 282.A N PHE 278.A O no hydrogen 2.862 N/A THR 284.A OG1 VAL 281.A O no hydrogen 2.513 N/A ILE 285.A N TRP 260.A O no hydrogen 3.253 N/A GLY 286.A N ILE 430.A O no hydrogen 3.124 N/A ALA 288.A N SER 428.A O no hydrogen 2.681 N/A GLY 292.A N LEU 352.A O no hydrogen 3.242 N/A PHE 297.A N ILE 294.A O no hydrogen 3.367 N/A ARG 298.A NH2 ILE 347.A O no hydrogen 2.888 N/A GLU 299.A N GLU 299.A OE1 no hydrogen 2.781 N/A PHE 300.A N GLY 296.A O no hydrogen 3.445 N/A LEU 301.A N PHE 297.A O no hydrogen 2.917 N/A LYS 302.A N ARG 298.A O no hydrogen 2.923 N/A HIS 305.A NE2 GLY 335.A O no hydrogen 3.074 N/A ARG 307.A N HIS 305.A ND1 no hydrogen 3.145 N/A LYS 308.A N HIS 305.A ND1 no hydrogen 3.366 N/A SER 309.A N HIS 305.A O no hydrogen 3.242 N/A SER 309.A OG HIS 305.A O no hydrogen 3.338 N/A PHE 318.A N PHE 314.A O no hydrogen 3.154 N/A TRP 319.A N ALA 315.A O no hydrogen 2.905 N/A TRP 319.A NE1 GLU 337.A OE1 no hydrogen 2.909 N/A GLU 320.A N LYS 316.A O no hydrogen 2.934 N/A GLU 321.A N GLU 317.A O no hydrogen 2.876 N/A THR 322.A N PHE 318.A O no hydrogen 2.930 N/A THR 322.A N TRP 319.A O no hydrogen 3.208 N/A THR 322.A OG1 PHE 318.A O no hydrogen 2.548 N/A PHE 323.A N TRP 319.A O no hydrogen 2.946 N/A ASN 324.A N GLU 320.A O no hydrogen 2.894 N/A HIS 326.A N PRO 331.A O no hydrogen 2.775 N/A LEU 327.A N GLU 320.A OE2 no hydrogen 3.390 N/A ARG 330.A NH2 HIS 326.A ND1 no hydrogen 3.118 N/A CYS 333.A N HIS 326.A O no hydrogen 3.301 N/A THR 334.A N GLU 337.A OE2 no hydrogen 3.070 N/A THR 334.A OG1 GLU 337.A OE2 no hydrogen 3.028 N/A GLU 337.A N GLU 337.A OE1 no hydrogen 2.853 N/A SER 341.A N ASN 338.A O no hydrogen 3.425 N/A SER 341.A OG ASN 338.A O no hydrogen 2.721 N/A VAL 342.A N ILE 339.A O no hydrogen 3.224 N/A THR 350.A OG1 HIS 351.A ND1 no hydrogen 3.044 N/A ARG 353.A NE LEU 289.A O no hydrogen 3.099 N/A TYR 356.A OH ASN 410.A OD1 no hydrogen 2.714 N/A ASN 357.A N ILE 354.A O no hydrogen 2.925 N/A ASN 357.A ND2 TYR 134.A O no hydrogen 3.008 N/A TYR 359.A OH GLU 61.A OE1 no hydrogen 2.731 N/A LEU 360.A N TYR 356.A O no hydrogen 3.325 N/A ALA 361.A N ASN 357.A O no hydrogen 2.908 N/A VAL 362.A N VAL 358.A O no hydrogen 2.970 N/A TYR 363.A N TYR 359.A O no hydrogen 2.996 N/A TYR 363.A OH TYR 359.A OH no hydrogen 2.586 N/A SER 364.A N LEU 360.A O no hydrogen 2.876 N/A SER 364.A OG LEU 360.A O no hydrogen 2.800 N/A ILE 365.A N ALA 361.A O no hydrogen 3.020 N/A ALA 366.A N VAL 362.A O no hydrogen 2.928 N/A HIS 367.A N TYR 363.A O no hydrogen 2.857 N/A HIS 367.A ND1 TYR 363.A O no hydrogen 3.174 N/A ALA 368.A N SER 364.A O no hydrogen 2.978 N/A LEU 369.A N ILE 365.A O no hydrogen 2.983 N/A GLN 370.A N ALA 366.A O no hydrogen 2.875 N/A GLN 370.A NE2 GLN 370.A O no hydrogen 2.625 N/A ASP 371.A N HIS 367.A O no hydrogen 2.901 N/A ILE 372.A N ALA 368.A O no hydrogen 2.963 N/A TYR 373.A N LEU 369.A O no hydrogen 2.931 N/A THR 374.A N GLN 370.A O no hydrogen 3.183 N/A THR 374.A OG1 GLN 370.A O no hydrogen 3.305 N/A CYS 375.A SG LEU 376.A O no hydrogen 3.794 N/A ARG 379.A N LEU 376.A O no hydrogen 3.130 N/A GLY 380.A N GLY 385.A O no hydrogen 2.921 N/A GLY 385.A N PHE 382.A O no hydrogen 3.159 N/A SER 386.A N THR 383.A O no hydrogen 3.085 N/A SER 386.A OG THR 383.A O no hydrogen 2.888 N/A CYS 387.A SG LEU 376.A O no hydrogen 3.185 N/A LYS 391.A N ASP 389.A OD1 no hydrogen 3.435 N/A LYS 392.A N ASP 389.A O no hydrogen 3.045 N/A LYS 392.A NZ ASP 389.A OD2 no hydrogen 3.103 N/A GLU 394.A N GLN 397.A OE1 no hydrogen 3.302 N/A TRP 396.A NE1 GLU 394.A OE1 no hydrogen 2.823 N/A VAL 398.A N GLU 394.A O no hydrogen 3.284 N/A LEU 399.A N ALA 395.A O no hydrogen 2.981 N/A LYS 400.A N TRP 396.A O no hydrogen 3.091 N/A HIS 401.A N GLN 397.A O no hydrogen 3.126 N/A LEU 402.A N VAL 398.A O no hydrogen 2.920 N/A ARG 403.A N LEU 399.A O no hydrogen 2.814 N/A HIS 404.A N HIS 401.A O no hydrogen 3.280 N/A PHE 407.A N VAL 415.A O no hydrogen 3.151 N/A ASN 409.A N GLU 413.A O no hydrogen 3.063 N/A ASN 409.A ND2 GLU 413.A OE1 no hydrogen 3.505 N/A ASN 410.A ND2 GLN 293.A O no hydrogen 2.887 N/A MET 411.A N ASN 409.A OD1 no hydrogen 2.886 N/A GLY 412.A N ASN 409.A O no hydrogen 3.425 N/A GLU 413.A N ASN 409.A OD1 no hydrogen 2.968 N/A VAL 415.A N PHE 407.A O no hydrogen 2.787 N/A THR 416.A OG1 LEU 405.A O no hydrogen 2.873 N/A GLU 419.A N GLU 419.A OE1 no hydrogen 2.877 N/A CYS 420.A SG SER 142.A O no hydrogen 3.526 N/A GLY 421.A N ASP 418.A O no hydrogen 3.210 N/A ASP 422.A N ASP 418.A OD1 no hydrogen 2.605 N/A TYR 427.A N TYR 449.A O no hydrogen 3.403 N/A SER 428.A N ALA 288.A O no hydrogen 2.720 N/A ILE 429.A N GLY 447.A O no hydrogen 3.206 N/A ILE 430.A N GLY 286.A O no hydrogen 2.991 N/A ASN 431.A N LYS 444.A O no hydrogen 2.656 N/A ASN 431.A ND2 HIS 433.A NE2 no hydrogen 2.971 N/A ASN 431.A ND2 LEU 467.A O no hydrogen 3.589 N/A TRP 432.A N THR 284.A O no hydrogen 3.112 N/A TRP 432.A NE1 ALA 267.A O no hydrogen 3.190 N/A HIS 433.A N VAL 442.A O no hydrogen 2.759 N/A SER 435.A N SER 440.A O no hydrogen 2.850 N/A ASP 438.A N SER 435.A OG no hydrogen 3.327 N/A GLY 439.A N SER 435.A O no hydrogen 2.956 N/A SER 440.A OG ILE 441.A O no hydrogen 3.359 N/A VAL 442.A N HIS 433.A O no hydrogen 3.261 N/A LYS 444.A N ASN 431.A O no hydrogen 2.768 N/A VAL 446.A N ILE 429.A O no hydrogen 2.894 N/A TYR 448.A N PHE 460.A O no hydrogen 3.205 N/A TYR 449.A N TYR 427.A O no hydrogen 3.050 N/A ASN 450.A N ARG 458.A O no hydrogen 2.859 N/A TYR 452.A N ASN 450.A OD1 no hydrogen 2.930 N/A GLU 457.A N LYS 454.A O no hydrogen 3.114 N/A PHE 460.A N TYR 448.A O no hydrogen 3.340 N/A ASN 462.A N VAL 446.A O no hydrogen 3.113 N/A LYS 465.A N ASN 462.A O no hydrogen 3.373 N/A ILE 466.A N GLU 463.A O no hydrogen 3.291 N/A TRP 468.A N SER 472.A O no hydrogen 2.640 N/A TRP 468.A NE1 GLU 463.A OE2 no hydrogen 3.195 N/A PHE 471.A N TRP 468.A O no hydrogen 3.372 N/A SER 472.A N TRP 468.A O no hydrogen 2.983 N/A ARG 473.A NH1 GLU 463.A OE2 no hydrogen 2.954 N/A ARG 473.A NH1 ILE 466.A O no hydrogen 3.005 N/A ARG 473.A NH2 GLU 463.A OE1 no hydrogen 3.238 N/A SER 478.A OG TRP 175.A O no hydrogen 2.643 N/A CYS 480.A SG CYS 480.A O no hydrogen 2.908 N/A SER 481.A OG CYS 480.A O no hydrogen 2.619 N/A CYS 484.A N ASP 516.A OD1 no hydrogen 3.075 N/A THR 488.A N LEU 485.A O no hydrogen 3.254 N/A THR 488.A OG1 LEU 485.A O no hydrogen 2.329 N/A ARG 489.A NH1 LYS 490.A O no hydrogen 3.020 N/A LYS 490.A N ALA 517.A O no hydrogen 2.982 N/A CYS 499.A SG ASN 174.A O no hydrogen 3.738 N/A CYS 500.A N PRO 497.A O no hydrogen 3.160 N/A PHE 501.A N SER 481.A OG no hydrogen 3.219 N/A GLU 502.A N GLY 491.A O no hydrogen 3.138 N/A VAL 504.A N ARG 489.A O no hydrogen 2.703 N/A CYS 506.A SG GLY 487.A O no hydrogen 3.768 N/A CYS 506.A SG THR 488.A O no hydrogen 3.789 N/A TYR 511.A N ASN 521.A O no hydrogen 2.797 N/A SER 512.A N HIS 533.A O no hydrogen 2.961 N/A ASP 516.A N CYS 484.A O no hydrogen 3.242 N/A PHE 527.A N PRO 524.A O no hydrogen 3.413 N/A TRP 528.A N ILE 537.A O no hydrogen 2.926 N/A SER 529.A OG ASP 508.A O no hydrogen 2.474 N/A ASN 530.A N SER 535.A O no hydrogen 3.311 N/A THR 534.A N ASN 532.A O no hydrogen 2.481 N/A THR 534.A OG1 ASN 532.A O no hydrogen 3.328 N/A SER 535.A N ASN 530.A OD1 no hydrogen 3.127 N/A SER 535.A OG CYS 536.A O no hydrogen 3.527 N/A ILE 537.A N TRP 528.A O no hydrogen 2.658 N/A LYS 539.A NZ GLN 680.A OE1 no hydrogen 3.367 N/A GLU 542.A N ILE 687.A O no hydrogen 3.089 N/A SER 545.A N GLU 548.A OE2 no hydrogen 3.302 N/A ILE 552.A N GLU 548.A O no hydrogen 3.102 N/A LEU 554.A N PHE 550.A O no hydrogen 3.405 N/A THR 555.A N GLY 551.A O no hydrogen 3.222 N/A THR 555.A OG1 GLY 551.A O no hydrogen 3.366 N/A LEU 556.A N ILE 552.A O no hydrogen 3.483 N/A ALA 558.A N LEU 554.A O no hydrogen 3.315 N/A VAL 559.A N THR 555.A O no hydrogen 2.979 N/A LEU 560.A N LEU 556.A O no hydrogen 2.903 N/A GLY 561.A N PHE 557.A O no hydrogen 2.943 N/A ILE 562.A N ALA 558.A O no hydrogen 2.951 N/A PHE 563.A N VAL 559.A O no hydrogen 2.903 N/A LEU 564.A N LEU 560.A O no hydrogen 2.925 N/A THR 565.A N GLY 561.A O no hydrogen 2.970 N/A THR 565.A OG1 GLY 561.A O no hydrogen 2.993 N/A ALA 566.A N ILE 562.A O no hydrogen 2.924 N/A PHE 567.A N PHE 563.A O no hydrogen 2.899 N/A VAL 568.A N LEU 564.A O no hydrogen 2.973 N/A LEU 569.A N THR 565.A O no hydrogen 2.950 N/A GLY 570.A N ALA 566.A O no hydrogen 2.882 N/A VAL 571.A N PHE 567.A O no hydrogen 3.015 N/A PHE 572.A N VAL 568.A O no hydrogen 3.101 N/A ILE 573.A N LEU 569.A O no hydrogen 3.067 N/A LYS 574.A N GLY 570.A O no hydrogen 2.895 N/A PHE 575.A N VAL 571.A O no hydrogen 2.853 N/A THR 578.A OG1 PHE 575.A O no hydrogen 3.238 N/A LYS 582.A N THR 578.A O no hydrogen 3.416 N/A LYS 582.A NZ ASN 577.A O no hydrogen 2.715 N/A ALA 583.A N PRO 579.A O no hydrogen 2.906 N/A THR 584.A N ILE 580.A O no hydrogen 3.425 N/A THR 584.A OG1 VAL 581.A O no hydrogen 2.720 N/A ASN 585.A ND2 GLN 650.A OE1 no hydrogen 3.093 N/A SER 589.A N ASN 585.A O no hydrogen 3.382 N/A SER 589.A OG ASN 585.A O no hydrogen 2.816 N/A LEU 591.A N GLU 587.A O no hydrogen 2.945 N/A LEU 592.A N LEU 588.A O no hydrogen 2.855 N/A LEU 593.A N SER 589.A O no hydrogen 2.925 N/A PHE 594.A N TYR 590.A O no hydrogen 2.949 N/A SER 595.A N LEU 591.A O no hydrogen 2.897 N/A LEU 596.A N LEU 592.A O no hydrogen 2.884 N/A LEU 597.A N LEU 593.A O no hydrogen 2.927 N/A CYS 598.A N PHE 594.A O no hydrogen 2.953 N/A CYS 598.A SG PHE 594.A O no hydrogen 3.253 N/A CYS 599.A N SER 595.A O no hydrogen 2.890 N/A PHE 600.A N LEU 596.A O no hydrogen 2.902 N/A SER 601.A N LEU 597.A O no hydrogen 2.937 N/A SER 601.A OG LEU 597.A O no hydrogen 2.949 N/A SER 602.A N CYS 598.A O no hydrogen 2.898 N/A SER 602.A OG CYS 599.A O no hydrogen 2.840 N/A SER 603.A OG PHE 600.A O no hydrogen 3.260 N/A LEU 604.A N SER 601.A O no hydrogen 3.289 N/A PHE 605.A N SER 602.A O no hydrogen 3.331 N/A PHE 606.A N SER 603.A O no hydrogen 3.318 N/A GLY 608.A N LEU 544.A O no hydrogen 3.219 N/A TRP 613.A NE1 GLN 611.A OE1 no hydrogen 3.148 N/A CYS 615.A N GLN 611.A O no hydrogen 3.221 N/A CYS 615.A SG GLN 611.A O no hydrogen 3.116 N/A LEU 617.A N THR 614.A O no hydrogen 3.027 N/A GLN 619.A NE2 GLU 763.A OE2 no hydrogen 3.534 N/A GLY 623.A N GLN 619.A O no hydrogen 3.018 N/A ILE 624.A N PRO 620.A O no hydrogen 2.903 N/A SER 625.A N ALA 621.A O no hydrogen 2.935 N/A SER 625.A OG ALA 621.A O no hydrogen 2.865 N/A PHE 626.A N PHE 622.A O no hydrogen 2.883 N/A VAL 627.A N GLY 623.A O no hydrogen 2.960 N/A LEU 628.A N ILE 624.A O no hydrogen 2.906 N/A CYS 629.A N SER 625.A O no hydrogen 2.970 N/A CYS 629.A SG SER 595.A OG no hydrogen 2.652 N/A CYS 629.A SG SER 625.A O no hydrogen 3.094 N/A ILE 630.A N PHE 626.A O no hydrogen 2.891 N/A SER 631.A N VAL 627.A O no hydrogen 2.906 N/A SER 631.A OG VAL 627.A O no hydrogen 2.825 N/A CYS 632.A N LEU 628.A O no hydrogen 3.409 N/A CYS 632.A SG LEU 628.A O no hydrogen 3.349 N/A ILE 633.A N CYS 629.A O no hydrogen 3.288 N/A LEU 634.A N ILE 630.A O no hydrogen 3.032 N/A VAL 635.A N SER 631.A O no hydrogen 3.107 N/A LYS 636.A N CYS 632.A O no hydrogen 3.294 N/A THR 637.A OG1 ILE 633.A O no hydrogen 2.989 N/A THR 637.A OG1 LEU 634.A O no hydrogen 2.969 N/A GLU 645.A N LEU 641.A O no hydrogen 3.326 N/A LEU 652.A N ASN 648.A O no hydrogen 3.292 N/A LEU 653.A N LEU 649.A O no hydrogen 2.945 N/A VAL 654.A N GLN 650.A O no hydrogen 2.943 N/A PHE 655.A N PHE 651.A O no hydrogen 2.909 N/A LEU 656.A N LEU 652.A O no hydrogen 2.968 N/A CYS 657.A SG LEU 653.A O no hydrogen 3.483 N/A THR 658.A OG1 VAL 654.A O no hydrogen 2.778 N/A PHE 659.A N PHE 655.A O no hydrogen 2.947 N/A MET 660.A N LEU 656.A O no hydrogen 2.941 N/A GLN 661.A N CYS 657.A O no hydrogen 2.952 N/A ILE 662.A N THR 658.A O no hydrogen 2.884 N/A VAL 663.A N PHE 659.A O no hydrogen 2.995 N/A CYS 665.A N GLN 661.A O no hydrogen 3.477 N/A CYS 665.A SG GLN 661.A O no hydrogen 3.408 N/A VAL 666.A N ILE 662.A O no hydrogen 3.187 N/A ILE 667.A N VAL 663.A O no hydrogen 2.935 N/A TRP 668.A N ILE 664.A O no hydrogen 2.922 N/A LEU 669.A N CYS 665.A O no hydrogen 2.920 N/A TYR 670.A N VAL 666.A O no hydrogen 2.940 N/A THR 671.A N ILE 667.A O no hydrogen 3.098 N/A THR 671.A N TRP 668.A O no hydrogen 3.134 N/A THR 671.A OG1 ILE 667.A O no hydrogen 3.140 N/A ALA 672.A N TRP 668.A O no hydrogen 2.972 N/A SER 675.A N HIS 692.A O no hydrogen 3.213 N/A ASN 679.A N PHE 688.A O no hydrogen 3.305 N/A ILE 687.A N GLU 540.A O no hydrogen 3.249 N/A THR 690.A N TYR 677.A O no hydrogen 3.218 N/A THR 690.A OG1 TYR 677.A O no hydrogen 3.244 N/A CYS 691.A SG THR 690.A O no hydrogen 3.470 N/A MET 697.A N SER 695.A OG no hydrogen 3.270 N/A ALA 698.A N SER 695.A O no hydrogen 3.117 N/A GLY 700.A N LEU 696.A O no hydrogen 3.105 N/A PHE 701.A N MET 697.A O no hydrogen 3.093 N/A LEU 702.A N ALA 698.A O no hydrogen 3.010 N/A ILE 703.A N LEU 699.A O no hydrogen 3.258 N/A GLY 704.A N GLY 700.A O no hydrogen 2.638 N/A TYR 705.A N PHE 701.A O no hydrogen 2.949 N/A THR 706.A N LEU 702.A O no hydrogen 2.952 N/A THR 706.A OG1 LEU 702.A O no hydrogen 3.451 N/A CYS 707.A N ILE 703.A O no hydrogen 2.908 N/A CYS 707.A SG ILE 703.A O no hydrogen 3.415 N/A LEU 708.A N GLY 704.A O no hydrogen 2.929 N/A LEU 709.A N TYR 705.A O no hydrogen 3.315 N/A ALA 710.A N THR 706.A O no hydrogen 3.176 N/A ALA 711.A N CYS 707.A O no hydrogen 2.803 N/A ILE 712.A N LEU 708.A O no hydrogen 3.194 N/A CYS 713.A N LEU 709.A O no hydrogen 3.014 N/A PHE 714.A N ALA 710.A O no hydrogen 2.868 N/A PHE 715.A N ALA 711.A O no hydrogen 2.898 N/A PHE 716.A N ILE 712.A O no hydrogen 3.167 N/A ALA 717.A N CYS 713.A O no hydrogen 3.118 N/A PHE 718.A N PHE 714.A O no hydrogen 2.967 N/A LYS 719.A N PHE 715.A O no hydrogen 2.991 N/A SER 720.A N ALA 717.A O no hydrogen 3.116 N/A SER 720.A OG SER 720.A O no hydrogen 2.643 N/A ARG 721.A N PHE 718.A O no hydrogen 3.335 N/A ARG 721.A NH1 PHE 718.A O no hydrogen 2.882 N/A PHE 732.A N ASN 728.A O no hydrogen 3.059 N/A ILE 733.A N GLU 729.A O no hydrogen 2.924 N/A THR 734.A N ALA 730.A O no hydrogen 2.931 N/A THR 734.A OG1 ALA 730.A O no hydrogen 2.777 N/A PHE 735.A N LYS 731.A O no hydrogen 2.995 N/A SER 736.A N PHE 732.A O no hydrogen 2.933 N/A SER 736.A OG ILE 733.A O no hydrogen 2.831 N/A MET 737.A N ILE 733.A O no hydrogen 2.957 N/A LEU 738.A N THR 734.A O no hydrogen 3.316 N/A ILE 739.A N PHE 735.A O no hydrogen 3.443 N/A PHE 740.A N SER 736.A O no hydrogen 3.419 N/A PHE 741.A N MET 737.A O no hydrogen 3.158 N/A ILE 742.A N LEU 738.A O no hydrogen 2.950 N/A VAL 743.A N ILE 739.A O no hydrogen 2.891 N/A TRP 744.A N PHE 740.A O no hydrogen 3.048 N/A ILE 745.A N PHE 741.A O no hydrogen 3.118 N/A SER 746.A N ILE 742.A O no hydrogen 3.336 N/A PHE 747.A N TRP 744.A O no hydrogen 2.984 N/A TYR 751.A N PHE 747.A O no hydrogen 2.922 N/A ALA 752.A N ILE 748.A O no hydrogen 3.321 N/A SER 753.A N PRO 749.A O no hydrogen 3.341 N/A THR 754.A N ALA 750.A O no hydrogen 3.248 N/A THR 754.A N TYR 751.A O no hydrogen 3.318 N/A THR 754.A OG1 TYR 751.A O no hydrogen 3.009 N/A VAL 759.A N GLY 756.A O no hydrogen 3.298 N/A GLU 763.A N SER 760.A O no hydrogen 3.024 N/A VAL 764.A N ALA 761.A O no hydrogen 3.032 N/A ILE 765.A N ALA 761.A O no hydrogen 3.278 N/A ILE 767.A N GLU 763.A O no hydrogen 3.206 N/A LEU 768.A N VAL 764.A O no hydrogen 2.908 N/A ALA 769.A N ILE 765.A O no hydrogen 2.937 N/A ALA 770.A N ALA 766.A O no hydrogen 3.014 N/A SER 771.A N ILE 767.A O no hydrogen 2.962 N/A PHE 772.A N LEU 768.A O no hydrogen 2.926 N/A GLY 773.A N ALA 769.A O no hydrogen 3.008 N/A LEU 774.A N ALA 770.A O no hydrogen 3.169 N/A LEU 775.A N SER 771.A O no hydrogen 3.325 N/A ALA 776.A N PHE 772.A O no hydrogen 3.187 N/A CYS 777.A N GLY 773.A O no hydrogen 2.938 N/A CYS 777.A SG GLY 773.A O no hydrogen 3.683 N/A ILE 778.A N LEU 774.A O no hydrogen 3.091 N/A PHE 779.A N LEU 775.A O no hydrogen 2.932 N/A PHE 780.A N ALA 776.A O no hydrogen 2.940 N/A LYS 782.A NZ GLU 729.A OE1 no hydrogen 2.942 N/A LYS 782.A NZ GLU 729.A OE2 no hydrogen 3.183 N/A ILE 783.A N PHE 779.A O no hydrogen 3.208 N/A TYR 784.A N PHE 780.A O no hydrogen 3.268 N/A ILE 785.A N ASN 781.A O no hydrogen 3.212 N/A ILE 786.A N LYS 782.A O no hydrogen 2.933 N/A LEU 787.A N ILE 783.A O no hydrogen 2.757 N/A THR 794.A OG1 ASN 793.A O no hydrogen 2.603 N/A ARG 799.A N GLU 796.A O no hydrogen 2.946 N/A CYS 800.A N GLU 796.A O no hydrogen 3.462 N/A CYS 800.A SG ILE 795.A O no hydrogen 3.648 N/A CYS 800.A SG GLU 796.A O no hydrogen 3.533 N/A SER 801.A N GLU 797.A O no hydrogen 2.791 N/A SER 801.A OG GLU 797.A O no hydrogen 3.140 N/A THR 802.A N VAL 798.A O no hydrogen 3.310 N/A