Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3sy2_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): SER 2.A N SER 1.A OG no hydrogen 2.693 N/A ASP 5.A N SER 2.A O no hydrogen 3.316 N/A ALA 7.A N PRO 3.A O no hydrogen 2.746 N/A LYS 8.A N ALA 4.A O no hydrogen 3.108 N/A LEU 10.A N ALA 7.A O no hydrogen 3.139 N/A THR 11.A N ALA 7.A O no hydrogen 3.265 N/A ALA 13.A N LEU 10.A O no hydrogen 3.126 N/A GLN 17.A NE2 LYS 57.A O no hydrogen 3.491 N/A LYS 18.A N VAL 14.A O no hydrogen 3.209 N/A ALA 19.A N ARG 16.A O no hydrogen 2.975 N/A ARG 28.A N THR 24.A O no hydrogen 3.469 N/A ASP 29.A N ASP 27.A O no hydrogen 2.921 N/A SER 31.A OG ASP 29.A OD2 no hydrogen 3.527 N/A SER 31.A OG ASN 60.A O no hydrogen 2.861 N/A ASN 32.A N SER 62.A O no hydrogen 2.618 N/A ARG 36.A N ASP 34.A OD2 no hydrogen 3.017 N/A LYS 42.A N THR 39.A O no hydrogen 3.273 N/A LEU 44.A N SER 41.A O no hydrogen 3.275 N/A SER 47.A OG ASP 54.A OD1 no hydrogen 3.540 N/A GLU 50.A N SER 47.A O no hydrogen 3.182 N/A GLY 58.A N ASP 77.A O no hydrogen 3.346 N/A SER 62.A OG ASN 60.A OD1 no hydrogen 2.900 N/A ASN 63.A N THR 82.A O no hydrogen 3.288 N/A ASN 63.A ND2 ASN 32.A OD1 no hydrogen 3.377 N/A SER 64.A OG PHE 61.A O no hydrogen 2.890 N/A LYS 65.A N ALA 33.A O no hydrogen 3.179 N/A SER 69.A N PHE 66.A O no hydrogen 2.669 N/A SER 69.A OG PHE 66.A O no hydrogen 2.674 N/A ILE 71.A N VAL 90.A O no hydrogen 2.742 N/A HIS 73.A N SER 92.A O no hydrogen 3.025 N/A PHE 76.A N LYS 95.A O no hydrogen 3.024 N/A ASP 77.A N ILE 56.A O no hydrogen 3.242 N/A GLU 78.A N SER 97.A O no hydrogen 2.783 N/A CYS 79.A SG ILE 56.A O no hydrogen 2.927 N/A CYS 79.A SG ASP 77.A O no hydrogen 2.919 N/A ARG 80.A NE THR 82.A OG1 no hydrogen 3.165 N/A PHE 81.A N ASP 100.A O no hydrogen 2.831 N/A TYR 83.A N ASN 102.A O no hydrogen 3.251 N/A SER 84.A N PHE 81.A O no hydrogen 3.016 N/A SER 84.A OG PHE 81.A O no hydrogen 2.455 N/A THR 85.A N SER 64.A O no hydrogen 3.056 N/A LEU 86.A N PHE 105.A O no hydrogen 2.750 N/A VAL 89.A N LEU 86.A O no hydrogen 2.925 N/A VAL 90.A N SER 69.A O no hydrogen 3.226 N/A CYS 91.A N THR 112.A OG1 no hydrogen 3.272 N/A ASN 93.A N GLN 114.A O no hydrogen 3.201 N/A THR 94.A N CYS 91.A O no hydrogen 2.772 N/A THR 94.A OG1 ILE 71.A O no hydrogen 2.741 N/A THR 94.A OG1 CYS 91.A O no hydrogen 2.533 N/A LYS 95.A N LEU 74.A O no hydrogen 2.878 N/A SER 97.A N PHE 76.A O no hydrogen 2.637 N/A ASN 98.A N ILE 119.A O no hydrogen 3.023 N/A MET 101.A N THR 122.A O no hydrogen 2.976 N/A ASN 102.A N ASP 100.A OD1 no hydrogen 2.834 N/A GLU 103.A N LYS 124.A O no hydrogen 3.153 N/A VAL 104.A N THR 126.A OG1 no hydrogen 3.249 N/A PHE 105.A N SER 84.A O no hydrogen 3.481 N/A LEU 106.A N LEU 127.A O no hydrogen 2.938 N/A TYR 108.A N LEU 106.A O no hydrogen 2.473 N/A TYR 108.A OH LYS 131.A O no hydrogen 2.672 N/A SER 109.A N VAL 89.A O no hydrogen 3.115 N/A THR 111.A N SER 109.A OG no hydrogen 2.950 N/A THR 112.A N SER 109.A O no hydrogen 3.014 N/A THR 112.A OG1 SER 109.A O no hydrogen 3.466 N/A GLN 113.A N SER 92.A OG no hydrogen 3.282 N/A SER 117.A N THR 94.A O no hydrogen 2.913 N/A THR 121.A OG1 PHE 96.A O no hydrogen 3.045 N/A THR 121.A OG1 SER 99.A O no hydrogen 3.045 N/A ASN 125.A N ASP 161.A O no hydrogen 3.005 N/A THR 126.A OG1 MET 101.A O no hydrogen 3.068 N/A THR 126.A OG1 LEU 123.A O no hydrogen 3.219 N/A LEU 127.A N VAL 104.A O no hydrogen 3.212 N/A ILE 128.A N TRP 163.A O no hydrogen 3.037 N/A ALA 132.A N THR 192.A OG1 no hydrogen 2.789 N/A LEU 134.A N SER 195.A OG no hydrogen 3.075 N/A SER 135.A N ASN 133.A OD1 no hydrogen 3.266 N/A SER 135.A OG ASN 133.A OD1 no hydrogen 2.557 N/A ILE 138.A N THR 121.A O no hydrogen 3.030 N/A SER 145.A OG ASP 143.A O no hydrogen 3.126 N/A SER 151.A OG SER 151.A O no hydrogen 2.648 N/A ILE 157.A N LEU 164.A O no hydrogen 2.944 N/A LEU 159.A N ILE 162.A O no hydrogen 3.419 N/A ILE 162.A N LEU 159.A O no hydrogen 3.183 N/A TRP 163.A N THR 126.A O no hydrogen 3.005 N/A LEU 164.A N ILE 157.A O no hydrogen 3.131 N/A MET 166.A N ASN 155.A O no hydrogen 3.039 N/A THR 171.A N LEU 169.A O no hydrogen 2.543 N/A ALA 174.A N THR 171.A OG1 no hydrogen 3.313 N/A VAL 175.A N THR 171.A O no hydrogen 2.983 N/A ASP 176.A N GLU 172.A O no hydrogen 3.079 N/A GLY 177.A N ALA 174.A O no hydrogen 3.380 N/A PHE 178.A N ALA 174.A O no hydrogen 3.177 N/A LEU 179.A N VAL 175.A O no hydrogen 3.028 N/A ASN 180.A ND2 ASP 176.A OD1 no hydrogen 3.492 N/A GLU 182.A N ASN 180.A OD1 no hydrogen 3.003 N/A HIS 183.A N ASN 180.A OD1 no hydrogen 3.032 N/A HIS 183.A ND1 ASP 176.A OD1 no hydrogen 3.252 N/A LYS 187.A N ASN 184.A O no hydrogen 3.128 N/A LYS 187.A NZ GLN 113.A O no hydrogen 3.271 N/A LYS 187.A NZ GLU 538.A OE1 no hydrogen 2.878 N/A LYS 187.A NZ GLU 538.A OE2 no hydrogen 3.102 N/A SER 188.A OG HIS 181.A ND1 no hydrogen 2.962 N/A ILE 189.A N PHE 178.A O no hydrogen 2.917 N/A MET 191.A N SER 188.A OG no hydrogen 3.149 N/A THR 192.A N SER 188.A O no hydrogen 2.768 N/A THR 192.A OG1 HIS 130.A O no hydrogen 2.755 N/A THR 192.A OG1 ALA 132.A O no hydrogen 3.426 N/A THR 192.A OG1 SER 188.A O no hydrogen 2.969 N/A ILE 193.A N ILE 189.A O no hydrogen 2.799 N/A ASP 194.A N LEU 190.A O no hydrogen 3.134 N/A SER 195.A N THR 192.A O no hydrogen 3.270 N/A SER 195.A OG THR 192.A O no hydrogen 2.582 N/A LYS 199.A N PRO 197.A O no hydrogen 2.825 N/A LYS 204.A N TYR 200.A O no hydrogen 2.883 N/A LYS 204.A NZ ASP 194.A O no hydrogen 3.469 N/A LYS 204.A NZ LEU 196.A O no hydrogen 3.068 N/A VAL 205.A N SER 201.A O no hydrogen 3.172 N/A GLN 206.A N GLN 202.A O no hydrogen 3.154 N/A ALA 207.A N GLU 203.A O no hydrogen 2.859 N/A MET 208.A N LYS 204.A O no hydrogen 3.254 N/A GLU 209.A N VAL 205.A O no hydrogen 2.788 N/A ASP 210.A N GLN 206.A O no hydrogen 2.926 N/A LEU 211.A N MET 208.A O no hydrogen 3.093 N/A VAL 212.A N MET 208.A O no hydrogen 2.953 N/A LYS 213.A N GLU 209.A O no hydrogen 3.043 N/A LEU 215.A N LEU 211.A O no hydrogen 3.152 N/A ARG 216.A N VAL 212.A O no hydrogen 2.563 N/A GLY 217.A N SER 214.A O no hydrogen 3.052 N/A GLY 218.A N LEU 215.A O no hydrogen 2.757 N/A CYS 224.A N THR 221.A O no hydrogen 2.675 N/A CYS 224.A SG CYS 224.A O no hydrogen 2.818 N/A ILE 225.A N GLU 222.A O no hydrogen 3.314 N/A VAL 228.A N ILE 225.A O no hydrogen 3.245 N/A GLU 229.A N ARG 226.A O no hydrogen 3.136 N/A SER 230.A OG GLU 182.A OE2 no hydrogen 3.010 N/A SER 231.A OG ASN 180.A OD1 no hydrogen 3.215 N/A LEU 232.A N VAL 228.A O no hydrogen 2.982 N/A LEU 232.A N GLU 229.A O no hydrogen 3.308 N/A VAL 233.A N GLU 229.A O no hydrogen 3.224 N/A SER 234.A N SER 230.A O no hydrogen 3.297 N/A SER 234.A OG HIS 181.A NE2 no hydrogen 3.331 N/A SER 234.A OG SER 231.A O no hydrogen 3.347 N/A SER 234.A OG TYR 277.A OH no hydrogen 3.176 N/A VAL 235.A N LEU 232.A O no hydrogen 3.371 N/A LEU 236.A N LEU 232.A O no hydrogen 2.797 N/A ALA 237.A N VAL 233.A O no hydrogen 2.792 N/A TYR 241.A N HIS 238.A O no hydrogen 3.202 N/A TYR 241.A OH ASP 194.A OD1 no hydrogen 2.589 N/A GLN 243.A N PRO 240.A O no hydrogen 2.964 N/A SER 244.A OG GLU 209.A OE2 no hydrogen 3.353 N/A ILE 247.A N SER 244.A OG no hydrogen 3.034 N/A SER 248.A N SER 244.A O no hydrogen 3.103 N/A SER 248.A OG THR 242.A O no hydrogen 3.392 N/A SER 248.A OG SER 244.A O no hydrogen 2.328 N/A GLU 249.A N ALA 245.A O no hydrogen 3.134 N/A LEU 251.A N ILE 247.A O no hydrogen 3.216 N/A GLY 252.A N SER 248.A O no hydrogen 3.049 N/A GLN 255.A N LEU 251.A O no hydrogen 2.879 N/A GLN 255.A N GLY 252.A O no hydrogen 2.905 N/A GLN 255.A NE2 SER 289.A OG no hydrogen 2.919 N/A GLU 256.A N GLY 252.A O no hydrogen 3.012 N/A ARG 257.A N PRO 253.A O no hydrogen 3.120 N/A ARG 257.A NH1 GLU 222.A OE1 no hydrogen 3.321 N/A PHE 258.A N VAL 254.A O no hydrogen 3.190 N/A PHE 259.A N GLN 255.A O no hydrogen 3.058 N/A ALA 260.A N GLU 256.A O no hydrogen 3.173 N/A HIS 261.A N ARG 257.A O no hydrogen 3.034 N/A HIS 261.A ND1 GLU 229.A OE1 no hydrogen 2.905 N/A GLN 262.A N PHE 258.A O no hydrogen 2.906 N/A CYS 263.A N PHE 259.A O no hydrogen 2.862 N/A CYS 263.A N ALA 260.A O no hydrogen 2.987 N/A CYS 263.A SG PHE 259.A O no hydrogen 3.061 N/A GLN 264.A N ALA 260.A O no hydrogen 3.194 N/A THR 265.A N HIS 261.A O no hydrogen 3.333 N/A THR 265.A OG1 HIS 261.A O no hydrogen 2.757 N/A TYR 266.A N GLN 262.A O no hydrogen 3.065 N/A TYR 266.A OH ALA 609.A O no hydrogen 3.029 N/A LEU 271.A N GLN 306.A OE1 no hydrogen 2.675 N/A TYR 277.A OH GLU 182.A OE2 no hydrogen 2.937 N/A TYR 278.A N ASP 275.A OD2 no hydrogen 2.842 N/A GLN 279.A N ASP 275.A O no hydrogen 3.411 N/A GLN 279.A NE2 PRO 274.A O no hydrogen 3.409 N/A GLN 280.A N THR 276.A O no hydrogen 2.865 N/A ARG 281.A N TYR 277.A O no hydrogen 2.689 N/A ARG 281.A NH1 SER 234.A O no hydrogen 3.029 N/A ARG 281.A NH2 ASP 194.A OD2 no hydrogen 3.260 N/A ILE 282.A N TYR 278.A O no hydrogen 2.906 N/A LEU 283.A N TYR 278.A O no hydrogen 3.195 N/A VAL 285.A N ILE 282.A O no hydrogen 2.619 N/A LEU 286.A N ILE 282.A O no hydrogen 3.199 N/A LEU 287.A N LEU 283.A O no hydrogen 2.738 N/A ASP 288.A N PRO 284.A O no hydrogen 3.016 N/A SER 289.A N VAL 285.A O no hydrogen 2.812 N/A SER 289.A OG VAL 285.A O no hydrogen 3.072 N/A PHE 290.A N LEU 286.A O no hydrogen 3.014 N/A ASP 291.A N LEU 287.A O no hydrogen 3.094 N/A ARG 292.A N ASP 288.A O no hydrogen 3.143 N/A ARG 292.A N SER 289.A O no hydrogen 3.291 N/A ASN 293.A N SER 289.A O no hydrogen 2.991 N/A ASN 293.A ND2 SER 289.A O no hydrogen 2.758 N/A ALA 296.A N ASN 293.A O no hydrogen 2.632 N/A MET 297.A N SER 294.A O no hydrogen 2.891 N/A THR 298.A N ALA 295.A O no hydrogen 3.068 N/A THR 298.A OG1 ALA 295.A O no hydrogen 2.998 N/A THR 299.A N ALA 295.A O no hydrogen 3.327 N/A THR 299.A OG1 HIS 300.A ND1 no hydrogen 2.968 N/A HIS 300.A N ALA 296.A O no hydrogen 2.938 N/A HIS 300.A ND1 THR 299.A OG1 no hydrogen 2.968 N/A SER 301.A N THR 298.A O no hydrogen 3.247 N/A LEU 303.A N ASN 267.A OD1 no hydrogen 3.346 N/A LEU 303.A N HIS 300.A O no hydrogen 3.261 N/A PHE 304.A N HIS 300.A O no hydrogen 3.110 N/A ASN 305.A N SER 301.A O no hydrogen 2.904 N/A ASN 305.A ND2 SER 301.A O no hydrogen 3.115 N/A ASN 305.A ND2 TYR 332.A OH no hydrogen 3.352 N/A ASN 305.A ND2 LEU 365.A O no hydrogen 3.471 N/A GLN 306.A NE2 VAL 269.A O no hydrogen 3.239 N/A GLN 306.A NE2 GLY 302.A O no hydrogen 3.324 N/A VAL 307.A N LEU 303.A O no hydrogen 2.842 N/A ILE 308.A N PHE 304.A O no hydrogen 2.882 N/A LEU 309.A N ASN 305.A O no hydrogen 3.098 N/A HIS 310.A N GLN 306.A O no hydrogen 2.959 N/A CYS 311.A SG VAL 307.A O no hydrogen 3.144 N/A MET 312.A N ILE 308.A O no hydrogen 2.948 N/A THR 313.A OG1 LEU 309.A O no hydrogen 3.053 N/A ASP 316.A N GLN 279.A OE1 no hydrogen 2.707 N/A CYS 317.A N GLY 314.A O no hydrogen 3.146 N/A CYS 317.A SG GLN 279.A OE1 no hydrogen 3.978 N/A CYS 317.A SG CYS 311.A O no hydrogen 3.784 N/A THR 318.A OG1 THR 321.A OG1 no hydrogen 3.212 N/A THR 321.A OG1 THR 318.A OG1 no hydrogen 3.212 N/A ARG 322.A N THR 318.A O no hydrogen 3.010 N/A GLN 323.A N ASP 319.A O no hydrogen 3.158 N/A LYS 324.A N GLY 320.A O no hydrogen 2.904 N/A LYS 324.A NZ ASP 291.A OD2 no hydrogen 3.085 N/A ALA 325.A N THR 321.A O no hydrogen 3.278 N/A ALA 326.A N ARG 322.A O no hydrogen 2.874 N/A ALA 327.A N GLN 323.A O no hydrogen 2.762 N/A LEU 328.A N LYS 324.A O no hydrogen 2.573 N/A TYR 329.A N ALA 325.A O no hydrogen 2.853 N/A TYR 329.A N ALA 326.A O no hydrogen 2.957 N/A TYR 329.A OH ASN 305.A OD1 no hydrogen 2.895 N/A GLU 330.A N ALA 326.A O no hydrogen 3.114 N/A TYR 332.A OH LEU 365.A O no hydrogen 2.712 N/A LEU 333.A N TYR 329.A O no hydrogen 3.047 N/A ALA 334.A N GLN 331.A O no hydrogen 3.261 N/A HIS 335.A N GLN 331.A O no hydrogen 3.273 N/A HIS 335.A N TYR 332.A O no hydrogen 3.300 N/A ALA 337.A N HIS 335.A ND1 no hydrogen 3.292 N/A VAL 338.A N HIS 335.A O no hydrogen 3.111 N/A SER 339.A N HIS 335.A O no hydrogen 2.969 N/A SER 339.A OG HIS 335.A O no hydrogen 3.399 N/A HIS 341.A N VAL 338.A O no hydrogen 3.073 N/A HIS 341.A NE2 ASP 373.A O no hydrogen 2.841 N/A ILE 342.A N SER 339.A O no hydrogen 3.227 N/A PHE 347.A N HIS 343.A O no hydrogen 3.514 N/A GLY 348.A N ASP 362.A O no hydrogen 2.654 N/A ASN 349.A N SER 353.A O no hydrogen 2.824 N/A TYR 350.A N PHE 347.A O no hydrogen 2.958 N/A ASP 351.A N ASN 349.A OD1 no hydrogen 2.915 N/A ASP 355.A N ASN 363.A OD1 no hydrogen 2.945 N/A THR 357.A N ASP 355.A OD1 no hydrogen 3.365 N/A THR 357.A OG1 ASP 355.A OD1 no hydrogen 2.500 N/A THR 358.A N ASP 355.A O no hydrogen 3.247 N/A ARG 359.A NH2 THR 313.A O no hydrogen 3.347 N/A ASN 363.A N ALA 361.A O no hydrogen 2.879 N/A ASN 363.A ND2 ASP 355.A O no hydrogen 3.693 N/A ASN 363.A ND2 THR 358.A O no hydrogen 3.617 N/A PHE 364.A N LEU 378.A O no hydrogen 3.344 N/A LEU 365.A N TYR 329.A OH no hydrogen 3.484 N/A LEU 366.A N MET 376.A O no hydrogen 2.735 N/A SER 368.A N THR 374.A O no hydrogen 3.138 N/A SER 368.A OG ASP 421.A OD1 no hydrogen 2.606 N/A SER 369.A N ASP 421.A O no hydrogen 2.537 N/A GLN 370.A N SER 368.A OG no hydrogen 3.165 N/A ASP 371.A N SER 368.A OG no hydrogen 2.924 N/A SER 372.A N ASP 371.A OD1 no hydrogen 2.765 N/A ASP 373.A N ASP 371.A OD1 no hydrogen 3.480 N/A ALA 375.A N LEU 401.A O no hydrogen 2.814 N/A MET 376.A N LEU 366.A O no hydrogen 2.789 N/A MET 377.A N TYR 399.A O no hydrogen 3.073 N/A LEU 378.A N PHE 364.A O no hydrogen 3.277 N/A SER 379.A OG THR 382.A OG1 no hydrogen 3.212 N/A ASP 381.A N ARG 359.A O no hydrogen 2.663 N/A THR 382.A N SER 379.A OG no hydrogen 3.098 N/A THR 382.A OG1 SER 379.A OG no hydrogen 3.212 N/A LEU 383.A N SER 379.A O no hydrogen 2.666 N/A LEU 384.A N THR 380.A O no hydrogen 2.960 N/A THR 385.A N ASP 381.A O no hydrogen 3.490 N/A THR 385.A OG1 ASP 381.A O no hydrogen 3.029 N/A THR 385.A OG1 THR 382.A O no hydrogen 3.303 N/A MET 386.A N THR 382.A O no hydrogen 2.965 N/A LEU 387.A N LEU 383.A O no hydrogen 3.043 N/A ASN 388.A N LEU 384.A O no hydrogen 2.903 N/A THR 390.A N THR 393.A OG1 no hydrogen 2.650 N/A THR 393.A N THR 390.A O no hydrogen 3.046 N/A THR 393.A OG1 THR 390.A O no hydrogen 3.277 N/A PHE 398.A N ASP 396.A O no hydrogen 2.693 N/A TYR 399.A N MET 377.A O no hydrogen 2.871 N/A LEU 401.A N ALA 375.A O no hydrogen 2.751 N/A ARG 402.A N GLU 405.A O no hydrogen 2.713 N/A ALA 403.A N ASP 373.A O no hydrogen 2.953 N/A GLU 405.A N ALA 403.A O no hydrogen 2.533 N/A VAL 407.A N LEU 400.A O no hydrogen 2.975 N/A ALA 410.A N SER 408.A OG no hydrogen 3.366 N/A ILE 412.A N THR 409.A O no hydrogen 2.934 N/A LEU 417.A N SER 413.A O no hydrogen 3.117 N/A PHE 418.A N PRO 414.A O no hydrogen 2.805 N/A ARG 419.A N VAL 415.A O no hydrogen 3.050 N/A HIS 420.A N GLU 416.A O no hydrogen 3.192 N/A ASP 421.A N LEU 417.A O no hydrogen 3.013 N/A PHE 422.A N LEU 417.A O no hydrogen 3.451 N/A LEU 426.A N PRO 423.A O no hydrogen 3.224 N/A ALA 428.A N PHE 425.A O no hydrogen 2.666 N/A PHE 429.A N PHE 425.A O no hydrogen 2.619 N/A GLN 431.A N ALA 428.A O no hydrogen 3.050 N/A GLN 431.A NE2 ALA 427.A O no hydrogen 2.994 N/A GLN 431.A NE2 SER 601.A O no hydrogen 3.286 N/A ALA 433.A N ASN 430.A O no hydrogen 2.843 N/A THR 434.A N ASN 430.A O no hydrogen 3.091 N/A THR 434.A OG1 SER 602.A O no hydrogen 3.288 N/A GLN 435.A N GLN 431.A O no hydrogen 3.074 N/A ARG 437.A NH1 HIS 506.A ND1 no hydrogen 3.203 N/A PHE 438.A N THR 434.A O no hydrogen 3.027 N/A GLY 439.A N GLN 435.A O no hydrogen 2.611 N/A GLU 440.A N ARG 436.A O no hydrogen 2.731 N/A LEU 441.A N PHE 438.A O no hydrogen 2.962 N/A ILE 442.A N PHE 438.A O no hydrogen 3.185 N/A ILE 442.A N GLY 439.A O no hydrogen 3.021 N/A ASP 443.A N GLY 439.A O no hydrogen 2.896 N/A ILE 445.A N LEU 441.A O no hydrogen 3.092 N/A LEU 446.A N ILE 442.A O no hydrogen 2.847 N/A HIS 451.A N SER 447.A O no hydrogen 2.903 N/A ASN 455.A ND2 ASP 443.A OD1 no hydrogen 2.933 N/A ASN 455.A ND2 LEU 446.A O no hydrogen 3.561 N/A GLN 456.A N GLY 452.A O no hydrogen 3.240 N/A GLN 457.A N GLU 453.A O no hydrogen 3.223 N/A PHE 458.A N LEU 454.A O no hydrogen 2.676 N/A LEU 459.A N ASN 455.A O no hydrogen 2.837 N/A ALA 460.A N GLN 456.A O no hydrogen 2.735 N/A ALA 461.A N GLN 457.A O no hydrogen 2.995 N/A THR 462.A N LEU 459.A O no hydrogen 3.181 N/A THR 462.A OG1 LEU 459.A O no hydrogen 2.709 N/A ASN 463.A N ALA 460.A O no hydrogen 3.357 N/A SER 467.A N ALA 533.A O no hydrogen 3.060 N/A SER 467.A OG GLN 464.A OE1 no hydrogen 3.548 N/A LYS 470.A NZ SER 467.A O no hydrogen 2.931 N/A LYS 470.A NZ SER 532.A O no hydrogen 2.889 N/A LYS 470.A NZ ILE 534.A O no hydrogen 3.497 N/A LEU 471.A N PHE 535.A O no hydrogen 2.953 N/A ALA 475.A N ASP 473.A OD2 no hydrogen 2.937 N/A SER 476.A N ASP 473.A O no hydrogen 3.011 N/A SER 476.A OG ASP 473.A OD1 no hydrogen 2.982 N/A VAL 477.A N ASP 474.A O no hydrogen 3.303 N/A SER 478.A N ASP 474.A O no hydrogen 3.469 N/A ARG 479.A N ALA 475.A O no hydrogen 3.326 N/A LEU 480.A N SER 476.A O no hydrogen 3.377 N/A ALA 481.A N VAL 477.A O no hydrogen 2.958 N/A THR 482.A N SER 478.A O no hydrogen 3.370 N/A THR 482.A N ARG 479.A O no hydrogen 3.264 N/A THR 482.A OG1 SER 478.A O no hydrogen 2.521 N/A ILE 483.A N LEU 480.A O no hydrogen 2.575 N/A PHE 484.A N LEU 480.A O no hydrogen 3.143 N/A ASP 485.A N ALA 481.A O no hydrogen 2.994 N/A LEU 487.A N PHE 484.A O no hydrogen 2.958 N/A GLY 491.A N LEU 488.A O no hydrogen 3.329 N/A LYS 492.A N PRO 489.A O no hydrogen 3.068 N/A SER 494.A N LEU 487.A O no hydrogen 2.882 N/A HIS 497.A NE2 TYR 548.A OH no hydrogen 2.594 N/A TYR 498.A N SER 494.A O no hydrogen 2.933 N/A GLN 499.A N PRO 495.A O no hydrogen 3.433 N/A HIS 500.A N ALA 496.A O no hydrogen 3.289 N/A HIS 500.A ND1 ALA 496.A O no hydrogen 3.020 N/A ILE 501.A N HIS 497.A O no hydrogen 2.878 N/A LEU 502.A N TYR 498.A O no hydrogen 2.986 N/A SER 503.A N GLN 499.A O no hydrogen 3.183 N/A SER 503.A OG GLN 499.A O no hydrogen 3.287 N/A SER 503.A OG HIS 500.A O no hydrogen 3.094 N/A ALA 504.A N HIS 500.A O no hydrogen 2.937 N/A TYR 505.A N ILE 501.A O no hydrogen 3.304 N/A TYR 505.A N LEU 502.A O no hydrogen 2.815 N/A HIS 506.A N SER 503.A O no hydrogen 3.384 N/A LEU 507.A N LEU 502.A O no hydrogen 3.230 N/A ALA 510.A N LEU 507.A O no hydrogen 3.022 N/A GLN 513.A NE2 GLU 517.A OE1 no hydrogen 3.074 N/A GLN 515.A N THR 511.A O no hydrogen 3.183 N/A GLN 515.A NE2 LEU 507.A O no hydrogen 2.971 N/A ALA 516.A N PRO 512.A O no hydrogen 2.841 N/A GLU 517.A N GLN 513.A O no hydrogen 2.833 N/A THR 518.A N GLN 515.A O no hydrogen 3.119 N/A THR 518.A OG1 LYS 514.A O no hydrogen 2.620 N/A LEU 519.A N GLN 515.A O no hydrogen 2.997 N/A PHE 520.A N ALA 516.A O no hydrogen 2.795 N/A CYS 521.A N GLU 517.A O no hydrogen 3.292 N/A CYS 521.A SG GLU 517.A O no hydrogen 3.117 N/A CYS 521.A SG VAL 599.A O no hydrogen 3.855 N/A LEU 522.A N THR 518.A O no hydrogen 2.934 N/A SER 523.A N LEU 519.A O no hydrogen 2.811 N/A SER 523.A OG ALA 549.A O no hydrogen 2.558 N/A THR 524.A N PHE 520.A O no hydrogen 2.954 N/A THR 524.A OG1 PHE 520.A O no hydrogen 3.207 N/A ALA 525.A N CYS 521.A O no hydrogen 2.805 N/A PHE 526.A N LEU 522.A O no hydrogen 2.918 N/A ALA 527.A N THR 524.A O no hydrogen 3.241 N/A ARG 528.A N THR 524.A O no hydrogen 3.064 N/A ARG 528.A NH2 ASP 586.A OD1 no hydrogen 2.713 N/A TYR 529.A N ALA 525.A O no hydrogen 2.942 N/A TYR 529.A OH PHE 458.A O no hydrogen 2.853 N/A SER 530.A N ALA 527.A O no hydrogen 3.007 N/A SER 530.A OG PHE 526.A O no hydrogen 3.262 N/A SER 530.A OG ALA 527.A O no hydrogen 3.264 N/A SER 531.A OG ARG 528.A O no hydrogen 2.713 N/A SER 532.A OG HIS 183.A O no hydrogen 2.698 N/A ILE 534.A N SER 531.A O no hydrogen 2.703 N/A PHE 535.A N TYR 529.A O no hydrogen 3.130 N/A GLY 536.A N SER 531.A O no hydrogen 3.152 N/A THR 537.A N ASP 540.A O no hydrogen 3.244 N/A SER 541.A OG SER 530.A O no hydrogen 3.020 N/A ARG 546.A N PRO 542.A O no hydrogen 3.277 N/A ARG 546.A NE SER 541.A O no hydrogen 3.347 N/A ARG 546.A NH1 PHE 577.A O no hydrogen 2.488 N/A GLY 547.A N PRO 543.A O no hydrogen 2.951 N/A TYR 548.A N ALA 544.A O no hydrogen 2.723 N/A TYR 548.A OH HIS 497.A NE2 no hydrogen 2.594 N/A ALA 549.A N LEU 545.A O no hydrogen 3.086 N/A GLU 550.A N ARG 546.A O no hydrogen 3.132 N/A ALA 551.A N GLY 547.A O no hydrogen 3.296 N/A LEU 552.A N TYR 548.A O no hydrogen 2.911 N/A MET 553.A N ALA 549.A O no hydrogen 3.264 N/A GLN 554.A N GLU 550.A O no hydrogen 2.963 N/A LYS 555.A N ALA 551.A O no hydrogen 3.435 N/A LYS 555.A NZ GLU 558.A OE2 no hydrogen 3.471 N/A ALA 556.A N LEU 552.A O no hydrogen 3.210 N/A TRP 557.A N MET 553.A O no hydrogen 2.980 N/A GLU 558.A N GLN 554.A O no hydrogen 2.714 N/A LEU 559.A N LYS 555.A O no hydrogen 2.777 N/A LEU 559.A N ALA 556.A O no hydrogen 2.916 N/A SER 560.A N ALA 556.A O no hydrogen 2.933 N/A ILE 563.A N SER 560.A O no hydrogen 3.225 N/A PHE 564.A N PRO 561.A O no hydrogen 3.339 N/A SER 567.A OG GLU 568.A OE2 no hydrogen 3.560 N/A GLN 569.A N SER 566.A OG no hydrogen 2.933 N/A PHE 570.A N SER 566.A O no hydrogen 3.298 N/A THR 571.A N SER 567.A O no hydrogen 3.450 N/A THR 571.A OG1 SER 567.A O no hydrogen 3.483 N/A GLU 572.A N GLU 568.A O no hydrogen 3.104 N/A TRP 573.A N GLN 569.A O no hydrogen 3.058 N/A SER 574.A N PHE 570.A O no hydrogen 2.936 N/A SER 574.A OG GLU 550.A OE2 no hydrogen 3.178 N/A ASP 575.A N THR 571.A O no hydrogen 2.897 N/A ARG 576.A N GLU 572.A O no hydrogen 3.092 N/A ARG 576.A NH1 GLU 572.A OE1 no hydrogen 3.284 N/A PHE 577.A N TRP 573.A O no hydrogen 3.072 N/A PHE 577.A N SER 574.A O no hydrogen 3.151 N/A HIS 578.A N ASP 575.A O no hydrogen 2.759 N/A THR 581.A OG1 SER 530.A O no hydrogen 2.949 N/A SER 582.A N THR 579.A O no hydrogen 3.116 N/A ALA 585.A N THR 581.A O no hydrogen 3.314 N/A MET 588.A N VAL 584.A O no hydrogen 2.796 N/A GLN 589.A N ALA 585.A O no hydrogen 3.372 N/A ARG 590.A N ASP 586.A O no hydrogen 2.584 N/A HIS 591.A N SER 587.A O no hydrogen 3.011 N/A ALA 592.A N MET 588.A O no hydrogen 2.779 N/A ARG 593.A N GLN 589.A O no hydrogen 2.995 N/A LYS 594.A N ARG 590.A O no hydrogen 3.454 N/A TYR 595.A N HIS 591.A O no hydrogen 3.377 N/A PHE 596.A N ALA 592.A O no hydrogen 3.108 N/A VAL 599.A N PHE 596.A O no hydrogen 3.299 N/A SER 601.A N PRO 597.A O no hydrogen 3.274 N/A SER 601.A OG PRO 597.A O no hydrogen 3.178 N/A SER 602.A OG SER 598.A O no hydrogen 3.268 N/A SER 602.A OG VAL 599.A O no hydrogen 2.673 N/A ILE 603.A N LEU 600.A O no hydrogen 2.889 N/A LEU 604.A N LEU 600.A O no hydrogen 2.727 N/A TRP 608.A N PRO 605.A O no hydrogen 2.612 N/A ALA 609.A N PRO 605.A O no hydrogen 3.371 N/A