Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 5fsw_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): SER 2.A OG VAL 5.A O no hydrogen 1.909 N/A GLU 4.A N SER 2.A OG no hydrogen 3.011 N/A ARG 8.A NE GLY 114.A O no hydrogen 2.963 N/A LEU 9.A N PRO 115.A O no hydrogen 3.326 N/A LYS 15.A NZ ASN 11.A OD1 no hydrogen 2.706 N/A LEU 20.A N PRO 17.A O no hydrogen 2.869 N/A HIS 21.A NE2 PHE 16.A O no hydrogen 3.016 N/A TRP 29.A N LEU 25.A O no hydrogen 2.768 N/A GLU 30.A N ALA 26.A O no hydrogen 3.127 N/A LEU 31.A N LEU 27.A O no hydrogen 2.607 N/A THR 32.A N ALA 28.A O no hydrogen 3.150 N/A THR 32.A OG1 ALA 28.A O no hydrogen 2.563 N/A ARG 33.A N TRP 29.A O no hydrogen 3.053 N/A ARG 33.A NE MET 121.A O no hydrogen 2.772 N/A ARG 33.A NH1 GLU 30.A OE1 no hydrogen 2.634 N/A ILE 34.A N GLU 30.A O no hydrogen 3.144 N/A CYS 35.A N LEU 31.A O no hydrogen 3.055 N/A CYS 35.A SG LEU 31.A O no hydrogen 3.653 N/A LEU 36.A N THR 32.A O no hydrogen 3.344 N/A HIS 37.A N ARG 33.A O no hydrogen 2.909 N/A CYS 38.A N ILE 34.A O no hydrogen 2.771 N/A CYS 38.A SG ILE 34.A O no hydrogen 3.183 N/A LYS 39.A NZ LEU 36.A O no hydrogen 3.059 N/A VAL 40.A N CYS 35.A O no hydrogen 2.594 N/A GLU 43.A N ASP 41.A OD1 no hydrogen 3.294 N/A ASP 44.A N ASP 41.A O no hydrogen 3.419 N/A THR 46.A OG1 ASP 44.A OD1 no hydrogen 2.520 N/A THR 46.A OG1 PRO 45.A O no hydrogen 2.139 N/A TYR 49.A OH ALA 23.A O no hydrogen 3.075 N/A SER 52.A OG ASP 50.A OD1 no hydrogen 3.287 N/A TRP 53.A NE1 SER 64.A OG no hydrogen 3.067 N/A ALA 54.A N PRO 51.A O no hydrogen 3.185 N/A THR 55.A N SER 52.A O no hydrogen 3.057 N/A THR 55.A OG1 SER 52.A O no hydrogen 2.138 N/A ALA 60.A N ASP 57.A O no hydrogen 2.360 N/A ALA 60.A N ASP 57.A OD1 no hydrogen 3.380 N/A TRP 62.A N MET 58.A O no hydrogen 2.360 N/A ARG 63.A N ALA 60.A O no hydrogen 3.076 N/A SER 64.A N LEU 61.A O no hydrogen 3.255 N/A SER 64.A OG LEU 61.A O no hydrogen 3.005 N/A THR 66.A OG1 TRP 62.A O no hydrogen 2.262 N/A THR 66.A OG1 THR 66.A O no hydrogen 2.044 N/A ASP 69.A N GLN 67.A O no hydrogen 2.506 N/A VAL 70.A N LEU 68.A O no hydrogen 2.691 N/A ARG 79.A NH2 ASP 57.A OD2 no hydrogen 3.154 N/A ALA 84.A N SER 81.A O no hydrogen 3.266 N/A PHE 85.A N SER 81.A O no hydrogen 3.205 N/A ALA 88.A N ALA 84.A O no hydrogen 2.838 N/A LEU 89.A N ALA 86.A O no hydrogen 3.383 N/A THR 90.A N ALA 86.A O no hydrogen 3.019 N/A GLY 91.A N ALA 87.A O no hydrogen 3.076 N/A PHE 93.A N ALA 87.A O no hydrogen 2.953 N/A GLU 94.A N GLY 91.A O no hydrogen 3.199 N/A SER 95.A N ASN 98.A O no hydrogen 2.968 N/A ASN 98.A N SER 95.A O no hydrogen 2.797 N/A THR 99.A OG1 PHE 93.A O no hydrogen 3.432 N/A VAL 100.A N PHE 93.A O no hydrogen 2.743 N/A VAL 101.A N ARG 125.A O no hydrogen 2.928 N/A ALA 104.A N GLU 143.A O no hydrogen 3.274 N/A SER 105.A N ASP 120.A O no hydrogen 2.818 N/A SER 105.A OG ASP 120.A OD2 no hydrogen 2.907 N/A LEU 106.A N LEU 145.A O no hydrogen 2.724 N/A GLU 107.A N LEU 118.A O no hydrogen 3.501 N/A ASN 109.A N LEU 116.A O no hydrogen 2.535 N/A THR 113.A OG1 THR 113.A O no hydrogen 2.477 N/A LEU 118.A N GLU 107.A O no hydrogen 2.842 N/A LYS 122.A N SER 103.A O no hydrogen 3.042 N/A LEU 124.A N GLU 30.A OE2 no hydrogen 3.105 N/A ARG 125.A NE ASP 127.A OD1 no hydrogen 3.045 N/A ARG 125.A NH2 ASP 127.A OD1 no hydrogen 3.208 N/A ASP 127.A N THR 99.A O no hydrogen 3.066 N/A GLY 129.A N GLY 97.A O no hydrogen 3.136 N/A CYS 130.A N THR 133.A OG1 no hydrogen 3.130 N/A CYS 130.A SG THR 133.A OG1 no hydrogen 3.755 N/A CYS 130.A SG GLY 250.A O no hydrogen 3.378 N/A ARG 131.A NE GLU 354.A OE1 no hydrogen 2.966 N/A ARG 131.A NE GLU 354.A OE2 no hydrogen 3.300 N/A ARG 131.A NH1 GLY 313.A O no hydrogen 3.141 N/A ARG 131.A NH2 GLY 313.A O no hydrogen 3.071 N/A ARG 131.A NH2 GLU 354.A OE1 no hydrogen 2.681 N/A LEU 132.A N GLY 250.A O no hydrogen 3.262 N/A THR 133.A OG1 CYS 130.A O no hydrogen 3.251 N/A ARG 134.A N CYS 130.A O no hydrogen 3.245 N/A ARG 134.A NH2 GLU 354.A OE2 no hydrogen 2.564 N/A ARG 135.A N LEU 132.A O no hydrogen 2.968 N/A ARG 135.A NH1 ARG 135.A O no hydrogen 2.764 N/A PHE 136.A N LEU 132.A O no hydrogen 2.952 N/A ARG 140.A N GLY 137.A O no hydrogen 3.099 N/A ARG 140.A NE ALA 204.A O no hydrogen 3.138 N/A ARG 140.A NH1 THR 218.A O no hydrogen 2.645 N/A ARG 140.A NH2 ALA 204.A O no hydrogen 2.936 N/A ARG 140.A NH2 THR 218.A O no hydrogen 3.257 N/A LEU 142.A N PHE 202.A O no hydrogen 2.902 N/A GLU 143.A N LEU 102.A O no hydrogen 3.425 N/A VAL 144.A N VAL 200.A O no hydrogen 2.913 N/A LEU 145.A N ALA 104.A O no hydrogen 3.399 N/A VAL 146.A N GLU 198.A O no hydrogen 2.760 N/A SER 148.A N PHE 196.A O no hydrogen 3.291 N/A THR 150.A OG1 MET 649.A O no hydrogen 3.028 N/A ALA 151.A N SER 148.A O no hydrogen 3.444 N/A LEU 152.A N THR 150.A O no hydrogen 3.099 N/A LEU 158.A N PRO 155.A O no hydrogen 2.994 N/A ASP 160.A N SER 156.A O no hydrogen 3.134 N/A ASP 160.A N ILE 157.A O no hydrogen 3.288 N/A GLN 165.A NE2 GLN 1.A O no hydrogen 2.776 N/A ARG 168.A N ALA 164.A O no hydrogen 3.474 N/A TRP 169.A N GLN 165.A O no hydrogen 2.759 N/A TRP 169.A N VAL 166.A O no hydrogen 3.009 N/A LEU 170.A N VAL 166.A O no hydrogen 3.136 N/A THR 171.A N ILE 167.A O no hydrogen 3.163 N/A THR 171.A OG1 ILE 167.A O no hydrogen 3.078 N/A THR 171.A OG1 ASN 642.A OD1 no hydrogen 2.482 N/A GLU 172.A N ARG 168.A O no hydrogen 3.294 N/A HIS 175.A N TRP 182.A O no hydrogen 2.737 N/A LEU 177.A N ARG 180.A O no hydrogen 3.073 N/A ARG 180.A N LEU 177.A O no hydrogen 2.485 N/A ARG 180.A NH1 ASP 139.A O no hydrogen 3.415 N/A ARG 180.A NH1 ASP 139.A OD2 no hydrogen 3.046 N/A GLN 181.A N ARG 206.A O no hydrogen 3.200 N/A TRP 182.A N HIS 175.A O no hydrogen 3.077 N/A GLN 183.A N PHE 203.A O no hydrogen 3.056 N/A GLN 183.A NE2 GLU 172.A O no hydrogen 3.375 N/A PHE 185.A N HIS 201.A O no hydrogen 3.024 N/A LYS 188.A N ARG 199.A O no hydrogen 3.069 N/A LYS 197.A NZ LEU 106.A O no hydrogen 3.005 N/A GLU 198.A N VAL 146.A O no hydrogen 2.554 N/A ARG 199.A N LYS 188.A O no hydrogen 3.064 N/A VAL 200.A N VAL 144.A O no hydrogen 2.921 N/A HIS 201.A N TYR 186.A O no hydrogen 3.107 N/A PHE 202.A N LEU 142.A O no hydrogen 2.677 N/A PHE 203.A N GLN 183.A O no hydrogen 3.027 N/A ALA 204.A N ARG 140.A O no hydrogen 2.685 N/A GLU 205.A N GLN 181.A O no hydrogen 2.683 N/A HIS 208.A N GLY 179.A O no hydrogen 3.056 N/A ASP 209.A N GLY 207.A O no hydrogen 3.179 N/A ARG 211.A NH2 ARG 216.A O no hydrogen 3.503 N/A GLU 219.A N ARG 211.A O no hydrogen 2.881 N/A ILE 220.A N GLU 205.A O no hydrogen 3.127 N/A VAL 222.A N GLU 205.A OE2 no hydrogen 2.825 N/A GLU 224.A N ARG 221.A O no hydrogen 2.972 N/A MET 225.A N ARG 221.A O no hydrogen 3.078 N/A LEU 226.A N VAL 222.A O no hydrogen 3.134 N/A TRP 228.A N GLU 224.A O no hydrogen 3.014 N/A LEU 229.A N MET 225.A O no hydrogen 3.003 N/A LEU 230.A N LEU 226.A O no hydrogen 2.595 N/A GLN 231.A N ASP 227.A O no hydrogen 3.113 N/A GLN 231.A NE2 ASP 344.A OD1 no hydrogen 2.939 N/A LEU 232.A N ASP 227.A OD1 no hydrogen 3.173 N/A GLN 234.A N GLN 234.A OE1 no hydrogen 2.644 N/A ASN 235.A N LEU 232.A O no hydrogen 3.319 N/A ASN 235.A ND2 GLN 231.A O no hydrogen 2.631 N/A ASN 235.A ND2 LYS 342.A O no hydrogen 3.245 N/A TYR 237.A OH ASN 235.A OD1 no hydrogen 2.547 N/A GLN 238.A N ASN 235.A O no hydrogen 3.269 N/A GLN 238.A NE2 ASN 235.A OD1 no hydrogen 3.683 N/A GLN 238.A NE2 LYS 340.A O no hydrogen 3.626 N/A HIS 240.A N THR 617.A O no hydrogen 3.182 N/A HIS 240.A ND1 THR 617.A O no hydrogen 2.821 N/A LEU 243.A N PRO 239.A O no hydrogen 2.969 N/A PHE 244.A N HIS 240.A O no hydrogen 2.653 N/A SER 245.A N LEU 241.A O no hydrogen 2.965 N/A SER 245.A OG LYS 242.A O no hydrogen 2.881 N/A ARG 246.A N LEU 243.A O no hydrogen 3.277 N/A ILE 247.A N PHE 244.A O no hydrogen 3.038 N/A GLN 248.A N SER 245.A O no hydrogen 3.177 N/A LEU 249.A N ARG 246.A O no hydrogen 3.136 N/A GLY 250.A N ILE 247.A O no hydrogen 2.784 N/A LEU 251.A N GLN 248.A O no hydrogen 3.455 N/A SER 252.A N GLN 248.A O no hydrogen 3.028 N/A THR 254.A N GLY 129.A O no hydrogen 3.223 N/A THR 254.A OG1 SER 252.A O no hydrogen 3.330 N/A PHE 255.A N ILE 355.A O no hydrogen 2.856 N/A THR 257.A N LEU 353.A O no hydrogen 2.880 N/A THR 259.A OG1 THR 352.A OG1 no hydrogen 2.458 N/A PHE 260.A N ARG 351.A O no hydrogen 3.142 N/A GLU 261.A N GLN 264.A OE1 no hydrogen 3.054 N/A GLN 264.A N GLU 261.A O no hydrogen 2.906 N/A ILE 265.A N GLU 261.A O no hydrogen 3.246 N/A ARG 266.A N ILE 332.A O no hydrogen 2.821 N/A HIS 267.A ND1 THR 334.A OG1 no hydrogen 2.613 N/A ARG 268.A N THR 334.A O no hydrogen 2.681 N/A ILE 272.A N ASN 281.A OD1 no hydrogen 3.092 N/A SER 274.A OG GLY 567.A O no hydrogen 3.131 N/A SER 274.A OG ASP 568.A O no hydrogen 2.944 N/A MET 280.A N ILE 272.A O no hydrogen 2.806 N/A ASN 281.A ND2 ILE 284.A O no hydrogen 3.108 N/A GLY 283.A N SER 337.A OG no hydrogen 2.781 N/A ILE 284.A N ASN 281.A O no hydrogen 3.141 N/A ARG 286.A N GLU 333.A OE2 no hydrogen 3.421 N/A ARG 286.A NH1 ASP 322.A OD2 no hydrogen 3.428 N/A ARG 286.A NH2 TYR 335.A OH no hydrogen 3.209 N/A MET 287.A N LEU 320.A O no hydrogen 2.640 N/A SER 288.A N TRP 331.A O no hydrogen 3.301 N/A SER 288.A OG SER 290.A OG no hydrogen 3.305 N/A ARG 289.A N ASP 325.A OD2 no hydrogen 3.137 N/A SER 290.A OG SER 288.A OG no hydrogen 3.305 N/A SER 290.A OG ASP 330.A OD1 no hydrogen 2.996 N/A VAL 291.A N SER 288.A OG no hydrogen 2.888 N/A ALA 292.A N SER 288.A O no hydrogen 3.236 N/A ARG 293.A N ARG 289.A O no hydrogen 2.966 N/A LYS 294.A N SER 290.A O no hydrogen 2.781 N/A ILE 295.A N VAL 291.A O no hydrogen 2.840 N/A ARG 296.A N ALA 292.A O no hydrogen 3.255 N/A ASP 297.A N ARG 293.A O no hydrogen 2.918 N/A ALA 298.A N LYS 294.A O no hydrogen 2.723 N/A LEU 299.A N ILE 295.A O no hydrogen 3.040 N/A GLY 300.A N ARG 296.A O no hydrogen 2.766 N/A LEU 301.A N ARG 296.A O no hydrogen 3.355 N/A ILE 304.A N ASP 303.A OD1 no hydrogen 2.984 N/A SER 306.A OG ALA 556.A O no hydrogen 3.066 N/A SER 306.A OG LYS 558.A O no hydrogen 3.422 N/A ILE 308.A N TRP 319.A O no hydrogen 2.856 N/A GLN 309.A N SER 357.A O no hydrogen 2.784 N/A GLY 310.A N GLY 317.A O no hydrogen 3.088 N/A ARG 311.A N GLU 354.A O no hydrogen 2.502 N/A ARG 311.A NE SER 252.A OG no hydrogen 2.922 N/A ARG 311.A NH2 SER 252.A OG no hydrogen 3.086 N/A MET 312.A N ALA 315.A O no hydrogen 2.997 N/A SER 314.A OG TRP 341.A O no hydrogen 2.816 N/A ALA 315.A N MET 312.A O no hydrogen 3.023 N/A LYS 316.A N GLN 338.A O no hydrogen 3.199 N/A GLY 317.A N GLY 310.A O no hydrogen 3.449 N/A MET 318.A N GLY 283.A O no hydrogen 3.061 N/A TRP 319.A N ILE 308.A O no hydrogen 2.944 N/A TRP 319.A NE1 GLU 333.A O no hydrogen 2.676 N/A LEU 320.A N GLY 285.A O no hydrogen 3.225 N/A MET 321.A N SER 306.A O no hydrogen 2.732 N/A ASP 322.A N MET 287.A O no hydrogen 2.910 N/A ALA 324.A N ASP 322.A OD1 no hydrogen 3.142 N/A GLY 327.A N ASP 325.A OD1 no hydrogen 2.394 N/A ILE 332.A N GLN 264.A O no hydrogen 2.907 N/A GLU 333.A N ARG 286.A O no hydrogen 3.175 N/A THR 334.A N ARG 266.A O no hydrogen 3.230 N/A THR 334.A OG1 HIS 267.A ND1 no hydrogen 2.613 N/A TYR 335.A N GLN 338.A OE1 no hydrogen 3.049 N/A TYR 335.A OH GLU 333.A OE2 no hydrogen 2.858 N/A SER 337.A N ASP 271.A OD1 no hydrogen 3.435 N/A SER 337.A OG ASP 271.A OD1 no hydrogen 3.162 N/A GLN 338.A N TYR 335.A O no hydrogen 2.933 N/A GLN 338.A NE2 GLY 283.A O no hydrogen 3.149 N/A ARG 339.A N TYR 335.A O no hydrogen 3.179 N/A ARG 339.A NH1 ARG 268.A O no hydrogen 3.064 N/A ARG 339.A NH1 THR 334.A OG1 no hydrogen 2.924 N/A ARG 339.A NH2 ARG 268.A O no hydrogen 2.895 N/A LYS 340.A N SER 314.A O no hydrogen 2.757 N/A LYS 340.A NZ SER 337.A O no hydrogen 3.079 N/A LYS 342.A N ASN 235.A OD1 no hydrogen 2.901 N/A CYS 343.A SG GLN 231.A OE1 no hydrogen 3.330 N/A CYS 343.A SG ASP 345.A OD1 no hydrogen 3.695 N/A ASP 344.A N GLN 231.A OE1 no hydrogen 2.921 N/A ALA 346.A N ASP 344.A OD1 no hydrogen 3.009 N/A LEU 349.A N ASP 347.A OD2 no hydrogen 2.928 N/A HIS 350.A N ASP 347.A O no hydrogen 3.383 N/A ARG 351.A N ALA 348.A O no hydrogen 2.893 N/A ARG 351.A NE PHE 260.A O no hydrogen 3.241 N/A ARG 351.A NH1 ALA 346.A O no hydrogen 2.758 N/A THR 352.A OG1 THR 259.A OG1 no hydrogen 2.458 N/A THR 352.A OG1 ALA 348.A O no hydrogen 2.846 N/A LEU 353.A N VAL 258.A O no hydrogen 2.538 N/A GLU 354.A N ARG 311.A O no hydrogen 2.811 N/A ILE 355.A N PHE 255.A O no hydrogen 2.775 N/A ARG 356.A N GLN 309.A O no hydrogen 2.715 N/A ARG 356.A NH1 SER 252.A OG no hydrogen 2.150 N/A SER 357.A N GLN 309.A O no hydrogen 3.147 N/A SER 357.A OG GLN 309.A OE1 no hydrogen 2.610 N/A SER 359.A N ALA 307.A O no hydrogen 2.929 N/A SER 359.A OG LYS 558.A O no hydrogen 3.435 N/A ALA 365.A N SER 489.A O no hydrogen 3.068 N/A ALA 366.A N SER 489.A OG no hydrogen 2.959 N/A LEU 367.A N ILE 484.A O no hydrogen 2.969 N/A GLN 370.A N ASN 368.A OD1 no hydrogen 2.745 N/A GLN 370.A NE2 GLN 370.A O no hydrogen 2.638 N/A PHE 371.A N ASN 368.A O no hydrogen 3.010 N/A LEU 372.A N LEU 369.A O no hydrogen 3.045 N/A LEU 375.A N PHE 371.A O no hydrogen 3.164 N/A GLU 376.A N LEU 372.A O no hydrogen 3.007 N/A ASP 377.A N PRO 373.A O no hydrogen 3.035 N/A ARG 378.A N VAL 374.A O no hydrogen 3.072 N/A ARG 378.A NE ASP 377.A OD1 no hydrogen 2.988 N/A ALA 379.A N GLU 376.A O no hydrogen 3.430 N/A LYS 380.A N ASN 596.A O no hydrogen 2.468 N/A LYS 380.A NZ GLU 595.A O no hydrogen 3.146 N/A ALA 383.A N ASP 381.A OD1 no hydrogen 2.778 N/A ARG 384.A N ASP 381.A OD1 no hydrogen 3.056 N/A MET 385.A N ASP 381.A O no hydrogen 3.054 N/A ARG 386.A N LYS 382.A O no hydrogen 3.091 N/A ARG 386.A NH2 ARG 732.A O no hydrogen 2.222 N/A ARG 387.A N ALA 383.A O no hydrogen 2.929 N/A ALA 388.A N ARG 384.A O no hydrogen 2.648 N/A ILE 389.A N MET 385.A O no hydrogen 2.936 N/A ALA 390.A N ARG 386.A O no hydrogen 3.064 N/A ALA 391.A N ARG 387.A O no hydrogen 3.269 N/A ARG 392.A N ALA 388.A O no hydrogen 3.393 N/A ARG 392.A NH1 ASP 590.A OD2 no hydrogen 2.201 N/A ARG 392.A NH2 ASP 590.A OD1 no hydrogen 2.329 N/A LEU 393.A N ILE 389.A O no hydrogen 3.325 N/A MET 394.A N ALA 390.A O no hydrogen 3.271 N/A ASN 395.A N ALA 391.A O no hydrogen 3.039 N/A ASP 396.A N ARG 392.A O no hydrogen 3.259 N/A LEU 397.A N LEU 393.A O no hydrogen 3.272 N/A LYS 398.A N MET 394.A O no hydrogen 2.690 N/A LYS 399.A N ASN 395.A O no hydrogen 2.627 N/A LYS 399.A NZ ASP 396.A O no hydrogen 3.265 N/A LYS 399.A NZ ASP 396.A OD1 no hydrogen 3.070 N/A GLN 400.A N LEU 397.A O no hydrogen 3.224 N/A GLN 400.A NE2 GLN 471.A OE1 no hydrogen 3.078 N/A PHE 401.A N LEU 397.A O no hydrogen 3.209 N/A PHE 401.A N LYS 398.A O no hydrogen 3.015 N/A ASP 402.A N LYS 398.A O no hydrogen 2.870 N/A SER 403.A N LYS 399.A O no hydrogen 3.347 N/A SER 403.A OG LYS 399.A O no hydrogen 2.832 N/A GLN 404.A N PHE 401.A O no hydrogen 2.922 N/A LYS 405.A N PHE 401.A O no hydrogen 2.825 N/A LYS 405.A NZ ASP 402.A OD1 no hydrogen 3.158 N/A ALA 406.A N ASP 402.A O no hydrogen 3.121 N/A ALA 407.A N SER 403.A O no hydrogen 3.221 N/A VAL 408.A N GLN 404.A O no hydrogen 3.229 N/A GLU 409.A N ALA 406.A O no hydrogen 3.274 N/A ARG 410.A N ALA 407.A O no hydrogen 3.066 N/A ARG 410.A NH1 GLN 413.A OE1 no hydrogen 3.415 N/A ARG 410.A NH1 GLU 923.A OE2 no hydrogen 3.021 N/A ARG 410.A NH2 GLU 923.A OE2 no hydrogen 2.747 N/A PHE 414.A N ARG 410.A O no hydrogen 2.716 N/A ARG 415.A N PRO 411.A O no hydrogen 2.706 N/A ARG 415.A NH1 ASN 453.A OD1 no hydrogen 3.217 N/A GLN 416.A N LEU 412.A O no hydrogen 3.014 N/A TRP 417.A N GLN 413.A O no hydrogen 2.792 N/A VAL 418.A N PHE 414.A O no hydrogen 3.477 N/A ASN 419.A N ARG 415.A O no hydrogen 3.342 N/A GLU 420.A N TRP 417.A O no hydrogen 3.076 N/A CYS 421.A N VAL 418.A O no hydrogen 3.404 N/A CYS 421.A SG VAL 418.A O no hydrogen 3.420 N/A CYS 421.A SG THR 422.A OG1 no hydrogen 3.443 N/A ARG 425.A N ASN 423.A OD1 no hydrogen 2.693 N/A GLU 427.A N SER 424.A O no hydrogen 2.872 N/A ARG 428.A N SER 424.A O no hydrogen 2.805 N/A ARG 428.A N ARG 425.A O no hydrogen 2.935 N/A ARG 428.A NE GLU 446.A OE2 no hydrogen 3.102 N/A ARG 428.A NH1 ALA 906.A O no hydrogen 2.838 N/A ARG 428.A NH1 LEU 908.A O no hydrogen 3.462 N/A ARG 428.A NH2 GLU 446.A OE1 no hydrogen 2.681 N/A VAL 429.A N ARG 425.A O no hydrogen 3.087 N/A HIS 431.A N GLU 427.A O no hydrogen 3.325 N/A GLY 432.A N VAL 429.A O no hydrogen 3.366 N/A LEU 437.A N LEU 440.A O no hydrogen 2.746 N/A GLY 439.A N GLN 875.A O no hydrogen 2.746 N/A LEU 440.A N LEU 437.A O no hydrogen 3.365 N/A GLU 442.A N PRO 435.A O no hydrogen 3.202 N/A GLY 445.A N ASN 443.A OD1 no hydrogen 2.523 N/A GLU 446.A N ASN 443.A O no hydrogen 3.084 N/A GLU 446.A N ASN 443.A OD1 no hydrogen 3.275 N/A VAL 447.A N ASN 443.A O no hydrogen 3.046 N/A LEU 448.A N LYS 444.A O no hydrogen 3.112 N/A SER 449.A OG GLY 445.A O no hydrogen 3.564 N/A PHE 450.A N GLU 446.A O no hydrogen 3.230 N/A LEU 451.A N VAL 447.A O no hydrogen 3.197 N/A LEU 452.A N LEU 448.A O no hydrogen 2.801 N/A ASN 453.A N SER 449.A O no hydrogen 2.640 N/A ASN 453.A ND2 TYR 905.A OH no hydrogen 2.925 N/A SER 454.A N PHE 450.A O no hydrogen 2.924 N/A SER 454.A OG PHE 450.A O no hydrogen 3.199 N/A GLY 455.A N LEU 452.A O no hydrogen 3.039 N/A PHE 456.A N LEU 451.A O no hydrogen 2.921 N/A ARG 458.A N ASP 457.A OD1 no hydrogen 2.770 N/A GLN 460.A NE2 SER 770.A O no hydrogen 3.210 N/A LYS 461.A N HIS 769.A O no hydrogen 3.331 N/A LYS 461.A NZ ASP 465.A OD1 no hydrogen 3.185 N/A TYR 462.A N GLN 460.A OE1 no hydrogen 2.916 N/A GLN 464.A N GLN 460.A O no hydrogen 3.134 N/A GLN 464.A NE2 MET 758.A O no hydrogen 3.409 N/A ASP 465.A N LYS 461.A O no hydrogen 2.837 N/A LEU 466.A N TYR 462.A O no hydrogen 3.067 N/A ALA 467.A N ILE 463.A O no hydrogen 3.243 N/A PHE 468.A N GLN 464.A O no hydrogen 3.208 N/A ASP 469.A N ASP 465.A O no hydrogen 3.127 N/A LEU 470.A N LEU 466.A O no hydrogen 3.026 N/A GLN 471.A NE2 GLN 404.A OE1 no hydrogen 3.629 N/A LYS 472.A N PHE 468.A O no hydrogen 3.039 N/A GLN 473.A N ASP 469.A O no hydrogen 2.848 N/A ARG 474.A N LEU 470.A O no hydrogen 3.171 N/A CYS 475.A N GLN 471.A O no hydrogen 2.984 N/A CYS 475.A SG GLN 471.A O no hydrogen 3.104 N/A GLU 476.A N LYS 472.A O no hydrogen 2.875 N/A VAL 477.A N GLN 473.A O no hydrogen 3.351 N/A LEU 478.A N CYS 475.A O no hydrogen 2.732 N/A ARG 479.A N CYS 475.A O no hydrogen 3.021 N/A ARG 479.A N GLU 476.A O no hydrogen 2.967 N/A ARG 479.A NE GLU 476.A OE1 no hydrogen 2.920 N/A ARG 479.A NH1 ASP 723.A OD1 no hydrogen 3.505 N/A THR 480.A N GLU 476.A O no hydrogen 3.166 N/A THR 480.A OG1 GLU 476.A O no hydrogen 3.328 N/A THR 480.A OG1 VAL 477.A O no hydrogen 3.155 N/A LYS 481.A N VAL 477.A O no hydrogen 3.150 N/A ASN 483.A N ASN 483.A OD1 no hydrogen 2.458 N/A SER 489.A OG ALA 366.A O no hydrogen 3.388 N/A SER 489.A OG VAL 486.A O no hydrogen 3.244 N/A ALA 490.A N VAL 587.A O no hydrogen 3.114 N/A TYR 491.A OH SER 535.A OG no hydrogen 2.652 N/A MET 492.A N ALA 585.A O no hydrogen 2.894 N/A VAL 495.A N ILE 561.A O no hydrogen 2.940 N/A TRP 499.A N ASP 497.A OD1 no hydrogen 3.203 N/A TRP 499.A NE1 ASP 322.A OD1 no hydrogen 2.775 N/A VAL 501.A N ASP 497.A OD2 no hydrogen 3.029 N/A LEU 502.A N ASP 497.A OD2 no hydrogen 3.240 N/A GLU 503.A N GLU 506.A OE1 no hydrogen 3.127 N/A GLU 506.A N GLU 503.A O no hydrogen 2.902 N/A VAL 507.A N ARG 547.A O no hydrogen 2.991 N/A HIS 508.A N VAL 562.A O no hydrogen 3.258 N/A PHE 511.A N MET 523.A O no hydrogen 3.040 N/A SER 512.A N ASP 559.A OD1 no hydrogen 2.685 N/A SER 512.A OG ASP 559.A OD1 no hydrogen 3.377 N/A SER 512.A OG ASP 559.A OD2 no hydrogen 2.664 N/A SER 513.A OG GLU 361.A OE2 no hydrogen 3.360 N/A PHE 515.A N TYR 522.A O no hydrogen 2.664 N/A ASP 517.A N THR 520.A O no hydrogen 2.822 N/A THR 520.A N ASP 517.A O no hydrogen 3.050 N/A TYR 522.A N PHE 515.A O no hydrogen 2.869 N/A LEU 525.A N VAL 509.A O no hydrogen 3.040 N/A CYS 528.A SG ASP 529.A O no hydrogen 3.783 N/A VAL 530.A N VAL 546.A O no hydrogen 2.828 N/A LEU 531.A N CYS 588.A O no hydrogen 2.712 N/A VAL 532.A N GLN 544.A O no hydrogen 3.013 N/A ARG 534.A NE LEU 575.A O no hydrogen 3.182 N/A ARG 534.A NH2 SER 576.A O no hydrogen 3.044 N/A SER 535.A OG TYR 491.A OH no hydrogen 2.652 N/A HIS 538.A N ASP 542.A OD2 no hydrogen 2.632 N/A PHE 539.A N ASP 542.A OD2 no hydrogen 2.878 N/A ASP 542.A N PHE 539.A O no hydrogen 3.449 N/A GLN 544.A N VAL 532.A O no hydrogen 3.068 N/A GLN 544.A NE2 SER 541.A O no hydrogen 2.860 N/A GLN 544.A NE2 ILE 543.A O no hydrogen 3.405 N/A GLN 544.A NE2 ALA 600.A O no hydrogen 3.609 N/A LYS 545.A N ASN 599.A OD1 no hydrogen 2.886 N/A LYS 545.A NZ VAL 594.A O no hydrogen 3.386 N/A LYS 545.A NZ PHE 597.A O no hydrogen 2.597 N/A VAL 546.A N VAL 530.A O no hydrogen 3.155 N/A ARG 547.A N ASN 505.A O no hydrogen 3.023 N/A ARG 547.A NH1 ASP 529.A OD1 no hydrogen 3.416 N/A ALA 548.A N CYS 528.A O no hydrogen 2.788 N/A VAL 549.A N VAL 507.A O no hydrogen 2.786 N/A LYS 551.A N HIS 508.A ND1 no hydrogen 3.270 N/A LYS 551.A NZ VAL 501.A O no hydrogen 3.306 N/A GLN 553.A N GLN 553.A OE1 no hydrogen 2.641 N/A LEU 554.A N LYS 551.A O no hydrogen 3.183 N/A HIS 555.A N PRO 552.A O no hydrogen 3.008 N/A LEU 557.A N LEU 554.A O no hydrogen 2.841 N/A LYS 558.A N SER 306.A OG no hydrogen 2.905 N/A ASP 559.A N GLY 510.A O no hydrogen 2.989 N/A ILE 561.A N PHE 493.A O no hydrogen 2.840 N/A VAL 562.A N HIS 508.A O no hydrogen 3.116 N/A PHE 563.A N VAL 495.A O no hydrogen 2.702 N/A LYS 566.A NZ GLU 503.A OE1 no hydrogen 3.491 N/A LYS 566.A NZ GLU 503.A OE2 no hydrogen 2.950 N/A ALA 572.A N TYR 580.A OH no hydrogen 3.242 N/A ASP 573.A N PRO 570.A O no hydrogen 2.925 N/A LYS 574.A N PRO 570.A O no hydrogen 3.394 N/A LEU 575.A N LEU 571.A O no hydrogen 3.268 N/A LEU 575.A N ALA 572.A O no hydrogen 3.237 N/A SER 576.A OG PRO 536.A O no hydrogen 2.892 N/A GLY 577.A N ASP 573.A O no hydrogen 3.088 N/A GLY 578.A N LEU 575.A O no hydrogen 3.202 N/A ASP 579.A N ASP 583.A OD2 no hydrogen 2.806 N/A TYR 580.A N ASP 282.A O no hydrogen 2.844 N/A ALA 585.A N MET 492.A O no hydrogen 2.609 N/A TRP 586.A N ALA 533.A O no hydrogen 2.791 N/A TRP 586.A NE1 ALA 366.A O no hydrogen 2.263 N/A VAL 587.A N ALA 490.A O no hydrogen 2.856 N/A CYS 588.A N LEU 531.A O no hydrogen 2.762 N/A CYS 588.A SG ARG 488.A O no hydrogen 3.403 N/A TRP 589.A N ARG 488.A O no hydrogen 2.878 N/A ILE 593.A N ASP 590.A O no hydrogen 3.089 N/A ILE 593.A N ASP 590.A OD1 no hydrogen 3.254 N/A VAL 594.A N ASP 590.A O no hydrogen 3.000 N/A GLU 595.A N PRO 591.A O no hydrogen 3.311 N/A ASN 596.A ND2 ASP 592.A O no hydrogen 2.831 N/A PHE 597.A N VAL 594.A O no hydrogen 3.079 N/A THR 598.A N ARG 378.A O no hydrogen 2.835 N/A THR 598.A OG1 ASN 599.A O no hydrogen 3.472 N/A ASN 599.A ND2 LYS 545.A O no hydrogen 3.486 N/A SER 609.A OG ASP 607.A OD1 no hydrogen 2.548 N/A SER 609.A OG ASP 607.A OD2 no hydrogen 3.050 N/A TYR 611.A N LEU 608.A O no hydrogen 3.230 N/A TYR 611.A OH GLU 707.A OE1 no hydrogen 2.949 N/A LEU 612.A N LEU 608.A O no hydrogen 3.184 N/A LEU 612.A N SER 609.A O no hydrogen 3.295 N/A GLY 613.A N LEU 695.A O no hydrogen 3.356 N/A ASP 615.A N GLY 693.A O no hydrogen 2.959 N/A THR 617.A N ASP 615.A OD1 no hydrogen 3.094 N/A THR 617.A OG1 ASP 615.A OD1 no hydrogen 3.319 N/A THR 618.A N GLU 621.A OE1 no hydrogen 2.704 N/A THR 618.A OG1 GLU 621.A OE1 no hydrogen 2.889 N/A PHE 619.A N GLN 238.A O no hydrogen 2.801 N/A GLY 620.A N GLU 236.A O no hydrogen 2.807 N/A GLU 621.A N THR 618.A OG1 no hydrogen 2.951 N/A LEU 622.A N THR 618.A O no hydrogen 3.334 N/A VAL 623.A N PHE 619.A O no hydrogen 3.105 N/A ARG 624.A N GLY 620.A O no hydrogen 3.176 N/A ASP 625.A N GLU 621.A O no hydrogen 3.262 N/A THR 626.A N VAL 623.A O no hydrogen 2.664 N/A GLY 627.A N ARG 624.A O no hydrogen 3.252 N/A ARG 633.A N GLY 629.A O no hydrogen 3.403 N/A ARG 633.A NH2 ASP 227.A OD2 no hydrogen 3.022 N/A HIS 634.A N ALA 630.A O no hydrogen 2.830 N/A GLU 635.A N ALA 631.A O no hydrogen 3.191 N/A ALA 636.A N ALA 632.A O no hydrogen 3.063 N/A TYR 638.A OH GLU 205.A OE2 no hydrogen 2.437 N/A ASP 639.A N GLU 635.A O no hydrogen 2.752 N/A MET 640.A N ALA 636.A O no hydrogen 2.827 N/A ILE 641.A N VAL 637.A O no hydrogen 2.929 N/A ASN 642.A N TYR 638.A O no hydrogen 2.836 N/A LYS 643.A N ASP 639.A O no hydrogen 2.712 N/A SER 644.A N MET 640.A O no hydrogen 2.701 N/A SER 644.A OG MET 640.A O no hydrogen 2.725 N/A PHE 645.A N ILE 641.A O no hydrogen 3.019 N/A GLN 646.A N ASN 642.A O no hydrogen 3.432 N/A PHE 647.A N LYS 643.A O no hydrogen 3.367 N/A ALA 648.A N SER 644.A O no hydrogen 2.703 N/A MET 649.A N PHE 645.A O no hydrogen 2.978 N/A GLN 650.A N PHE 647.A O no hydrogen 3.095 N/A GLN 650.A NE2 GLN 646.A O no hydrogen 2.732 N/A ILE 656.A N TYR 653.A O no hydrogen 2.873 N/A CYS 657.A N TYR 653.A O no hydrogen 2.787 N/A CYS 657.A SG TYR 653.A O no hydrogen 3.332 N/A THR 658.A N LEU 654.A O no hydrogen 3.154 N/A THR 658.A OG1 LEU 654.A O no hydrogen 2.922 N/A ASN 659.A N GLY 655.A O no hydrogen 3.218 N/A TYR 660.A N ILE 656.A O no hydrogen 3.046 N/A TYR 660.A OH GLY 711.A O no hydrogen 2.649 N/A LYS 661.A N CYS 657.A O no hydrogen 2.905 N/A LYS 661.A NZ HIS 538.A ND1 no hydrogen 3.500 N/A GLU 662.A N THR 658.A O no hydrogen 3.014 N/A ARG 663.A N ASN 659.A O no hydrogen 3.111 N/A ARG 663.A NH1 ASN 659.A O no hydrogen 3.188 N/A ARG 663.A NH2 ASP 717.A OD1 no hydrogen 3.258 N/A VAL 664.A N TYR 660.A O no hydrogen 2.624 N/A CYS 665.A N LYS 661.A O no hydrogen 2.929 N/A CYS 665.A SG LYS 661.A O no hydrogen 2.927 N/A TYR 666.A OH ASP 736.A OD2 no hydrogen 2.877 N/A HIS 667.A N ARG 663.A O no hydrogen 3.199 N/A ASN 668.A N VAL 664.A O no hydrogen 3.226 N/A ASN 669.A N TYR 666.A O no hydrogen 3.387 N/A SER 670.A N CYS 665.A O no hydrogen 3.113 N/A SER 672.A N SER 670.A OG no hydrogen 3.057 N/A SER 672.A OG ASP 377.A OD2 no hydrogen 3.153 N/A ASP 673.A N SER 670.A OG no hydrogen 2.911 N/A LEU 677.A N ASP 673.A O no hydrogen 3.367 N/A LEU 679.A N VAL 675.A O no hydrogen 3.389 N/A SER 680.A N ALA 676.A O no hydrogen 2.975 N/A SER 680.A OG HIS 538.A O no hydrogen 3.084 N/A SER 680.A OG ALA 676.A O no hydrogen 2.992 N/A THR 681.A N LEU 677.A O no hydrogen 3.222 N/A THR 681.A OG1 GLU 605.A OE1 no hydrogen 3.569 N/A THR 681.A OG1 LEU 677.A O no hydrogen 2.757 N/A LEU 682.A N LEU 678.A O no hydrogen 3.037 N/A VAL 683.A N LEU 679.A O no hydrogen 2.723 N/A GLY 684.A N SER 680.A O no hydrogen 3.097 N/A LYS 685.A N THR 681.A O no hydrogen 3.130 N/A LEU 686.A N LEU 682.A O no hydrogen 3.140 N/A VAL 687.A N GLY 684.A O no hydrogen 3.340 N/A GLN 689.A N LEU 686.A O no hydrogen 2.956 N/A GLN 689.A NE2 ILE 694.A O no hydrogen 3.364 N/A GLN 689.A NE2 PHE 696.A O no hydrogen 3.698 N/A GLN 692.A N ASP 688.A O no hydrogen 3.001 N/A GLY 693.A N SER 690.A O no hydrogen 3.236 N/A ILE 694.A N GLN 689.A O no hydrogen 3.400 N/A LEU 695.A N GLY 613.A O no hydrogen 2.928 N/A ASP 697.A N SER 700.A OG no hydrogen 2.656 N/A SER 700.A N ASP 697.A OD1 no hydrogen 3.250 N/A SER 700.A OG ASP 697.A O no hydrogen 2.710 N/A SER 700.A OG ASP 697.A OD1 no hydrogen 3.146 N/A TRP 701.A N ASP 697.A O no hydrogen 2.983 N/A ASP 702.A N ALA 698.A O no hydrogen 3.188 N/A ARG 703.A N ALA 699.A O no hydrogen 2.951 N/A LEU 704.A N SER 700.A O no hydrogen 2.868 N/A ARG 705.A N TRP 701.A O no hydrogen 3.270 N/A ARG 705.A NE TRP 701.A O no hydrogen 3.113 N/A ARG 706.A N ASP 702.A O no hydrogen 2.994 N/A GLU 707.A N ARG 703.A O no hydrogen 3.097 N/A ARG 708.A N LEU 704.A O no hydrogen 2.710 N/A LEU 709.A N ARG 705.A O no hydrogen 3.303 N/A SER 714.A OG VAL 715.A O no hydrogen 3.508 N/A GLU 716.A N GLU 716.A OE1 no hydrogen 2.448 N/A ALA 719.A N TYR 666.A OH no hydrogen 3.173 N/A TYR 720.A OH GLU 662.A OE2 no hydrogen 2.688 N/A LYS 721.A N PRO 718.A O no hydrogen 2.774 N/A GLY 722.A N ALA 719.A O no hydrogen 3.097 N/A TRP 725.A NE1 GLY 729.A O no hydrogen 2.785 N/A VAL 735.A N HIS 733.A ND1 no hydrogen 3.129 N/A TYR 737.A N HIS 733.A O no hydrogen 2.858 N/A LEU 738.A N ILE 734.A O no hydrogen 2.789 N/A LYS 739.A N VAL 735.A O no hydrogen 2.861 N/A LYS 739.A NZ TYR 720.A O no hydrogen 2.472 N/A LYS 739.A NZ GLY 722.A O no hydrogen 3.293 N/A PHE 740.A N ASP 736.A O no hydrogen 2.647 N/A ALA 741.A N TYR 737.A O no hydrogen 2.948 N/A VAL 742.A N TYR 737.A O no hydrogen 3.032 N/A ALA 743.A N LEU 738.A O no hydrogen 2.925 N/A LYS 744.A N LYS 739.A O no hydrogen 2.999 N/A THR 746.A N VAL 742.A O no hydrogen 2.815 N/A THR 746.A OG1 VAL 742.A O no hydrogen 2.849 N/A ILE 747.A N ALA 743.A O no hydrogen 3.015 N/A ASP 748.A N LYS 744.A O no hydrogen 2.887 N/A ARG 749.A N PRO 745.A O no hydrogen 2.990 N/A GLU 750.A N THR 746.A O no hydrogen 3.288 N/A LEU 751.A N ILE 747.A O no hydrogen 2.813 N/A GLU 753.A N ARG 749.A O no hydrogen 3.334 N/A HIS 755.A N GLU 752.A O no hydrogen 2.585 N/A SER 761.A OG MET 758.A O no hydrogen 2.480 N/A SER 761.A OG ALA 768.A O no hydrogen 3.490 N/A ASP 764.A N SER 761.A O no hydrogen 3.480 N/A ALA 768.A N SER 761.A OG no hydrogen 2.834 N/A HIS 769.A N ARG 459.A O no hydrogen 3.007 N/A ASP 774.A N ASP 772.A OD1 no hydrogen 3.380 N/A LEU 775.A N ASP 772.A O no hydrogen 2.935 N/A VAL 777.A N ASP 774.A O no hydrogen 3.170 N/A TYR 778.A OH GLN 887.A OE1 no hydrogen 3.269 N/A GLU 780.A N ALA 776.A O no hydrogen 3.248 N/A ASN 781.A N VAL 777.A O no hydrogen 3.433 N/A PHE 782.A N TYR 778.A O no hydrogen 3.261 N/A LYS 783.A N GLU 780.A O no hydrogen 3.136 N/A THR 786.A OG1 SER 789.A OG no hydrogen 3.336 N/A SER 789.A OG THR 786.A OG1 no hydrogen 3.336 N/A LEU 792.A N SER 789.A OG no hydrogen 3.307 N/A ARG 793.A N THR 786.A OG1 no hydrogen 2.767 N/A GLU 797.A N ARG 793.A O no hydrogen 2.986 N/A LEU 799.A N VAL 795.A O no hydrogen 3.216 N/A GLN 800.A N LEU 796.A O no hydrogen 2.901 N/A ASN 801.A N GLU 797.A O no hydrogen 3.001 N/A ALA 802.A N ALA 798.A O no hydrogen 2.773 N/A LEU 803.A N LEU 799.A O no hydrogen 2.811 N/A GLY 804.A N GLN 800.A O no hydrogen 3.176 N/A ALA 805.A N ASN 801.A O no hydrogen 3.381 N/A VAL 806.A N ALA 802.A O no hydrogen 3.123 N/A GLU 807.A N LEU 803.A O no hydrogen 2.924 N/A HIS 808.A N GLY 804.A O no hydrogen 2.913 N/A GLU 809.A N ALA 805.A O no hydrogen 3.035 N/A TRP 810.A N VAL 806.A O no hydrogen 3.075 N/A LYS 811.A N GLU 807.A O no hydrogen 3.079 N/A THR 816.A OG1 GLU 819.A OE1 no hydrogen 3.024 N/A LYS 820.A N THR 816.A O no hydrogen 2.920 N/A VAL 821.A N TYR 817.A O no hydrogen 2.880 N/A ARG 822.A N PRO 818.A O no hydrogen 2.706 N/A ARG 822.A NH2 GLU 442.A OE2 no hydrogen 3.136 N/A GLN 823.A N GLU 819.A O no hydrogen 2.691 N/A LEU 824.A N LYS 820.A O no hydrogen 2.988 N/A HIS 825.A N VAL 821.A O no hydrogen 3.238 N/A ALA 826.A N ARG 822.A O no hydrogen 3.044 N/A LYS 827.A N GLN 823.A O no hydrogen 3.464 N/A TRP 828.A N LEU 824.A O no hydrogen 2.857 N/A CYS 829.A N HIS 825.A O no hydrogen 2.421 N/A CYS 829.A SG HIS 825.A NE2 no hydrogen 2.788 N/A CYS 829.A SG HIS 825.A O no hydrogen 3.617 N/A ALA 830.A N LYS 827.A O no hydrogen 3.330 N/A ILE 831.A N TRP 828.A O no hydrogen 3.314 N/A ALA 838.A N LYS 835.A O no hydrogen 3.135 N/A LEU 840.A N THR 836.A O no hydrogen 2.784 N/A LEU 845.A N GLN 842.A O no hydrogen 2.830 N/A ARG 848.A NH1 GLU 832.A OE1 no hydrogen 3.285 N/A SER 851.A OG LEU 840.A O no hydrogen 3.548 N/A TRP 853.A N LEU 840.A O no hydrogen 3.152 N/A TRP 853.A NE1 ILE 831.A O no hydrogen 2.738 N/A ALA 854.A N SER 851.A OG no hydrogen 3.270 N/A LEU 856.A N TYR 852.A O no hydrogen 3.341 N/A ARG 857.A N TRP 853.A O no hydrogen 2.665 N/A ARG 857.A NH1 ILE 831.A O no hydrogen 3.217 N/A ALA 858.A N ALA 854.A O no hydrogen 2.927 N/A SER 859.A N LEU 855.A O no hydrogen 2.576 N/A THR 860.A N LEU 856.A O no hydrogen 2.998 N/A THR 860.A OG1 LEU 856.A O no hydrogen 2.942 N/A ALA 861.A N ARG 857.A O no hydrogen 2.817 N/A PHE 862.A N ALA 858.A O no hydrogen 2.871 N/A LYS 863.A N SER 859.A O no hydrogen 3.339 N/A ALA 864.A N THR 860.A O no hydrogen 3.216 N/A ALA 864.A N ALA 861.A O no hydrogen 3.051 N/A TYR 865.A N ALA 861.A O no hydrogen 2.977 N/A TYR 865.A N PHE 862.A O no hydrogen 3.246 N/A LYS 867.A NZ LYS 863.A O no hydrogen 2.618 N/A LYS 867.A NZ ALA 864.A O no hydrogen 3.025 N/A PHE 872.A N ASN 869.A O no hydrogen 3.091 N/A VAL 873.A N PRO 870.A O no hydrogen 3.218 N/A TRP 874.A N PRO 870.A O no hydrogen 3.368 N/A GLN 875.A N LYS 871.A O no hydrogen 3.106 N/A MET 876.A N PHE 872.A O no hydrogen 3.396 N/A ALA 877.A N VAL 873.A O no hydrogen 2.754 N/A GLY 878.A N VAL 873.A O no hydrogen 3.309 N/A ALA 879.A N GLY 439.A O no hydrogen 2.721 N/A GLN 880.A N ALA 877.A O no hydrogen 2.367 N/A GLN 880.A NE2 GLY 849.A O no hydrogen 3.583 N/A ALA 882.A N GLY 878.A O no hydrogen 3.118 N/A PHE 883.A N ALA 879.A O no hydrogen 3.336 N/A ILE 884.A N GLN 880.A O no hydrogen 3.134 N/A LYS 885.A N LEU 881.A O no hydrogen 2.702 N/A LYS 885.A NZ ASP 772.A OD1 no hydrogen 3.118 N/A LYS 885.A NZ ASP 772.A OD2 no hydrogen 2.843 N/A LYS 885.A NZ ASP 774.A OD2 no hydrogen 2.903 N/A ALA 886.A N ALA 882.A O no hydrogen 2.862 N/A GLN 887.A N PHE 883.A O no hydrogen 2.816 N/A GLN 887.A NE2 TYR 778.A OH no hydrogen 2.955 N/A MET 888.A N ILE 884.A O no hydrogen 2.920 N/A SER 889.A N LYS 885.A O no hydrogen 3.372 N/A SER 889.A OG LYS 885.A O no hydrogen 2.694 N/A SER 893.A OG GLY 892.A O no hydrogen 2.244 N/A ASP 894.A N GLY 891.A O no hydrogen 2.846 N/A TYR 905.A N THR 901.A O no hydrogen 2.795 N/A ALA 906.A N PRO 902.A O no hydrogen 3.070 N/A GLY 907.A N LEU 903.A O no hydrogen 2.791 N/A LEU 908.A N TYR 905.A O no hydrogen 3.085 N/A GLY 912.A N PRO 910.A O no hydrogen 3.230 N/A VAL 915.A N ASP 911.A O no hydrogen 2.900 N/A LYS 916.A N GLY 912.A O no hydrogen 2.892 N/A GLN 917.A N ARG 913.A O no hydrogen 3.103 N/A TYR 918.A N PHE 914.A O no hydrogen 2.650 N/A LEU 919.A N VAL 915.A O no hydrogen 3.124 N/A ALA 920.A N LYS 916.A O no hydrogen 3.252 N/A ARG 921.A NH1 ARG 921.A O no hydrogen 3.512 N/A LEU 922.A N TYR 918.A O no hydrogen 3.266 N/A GLU 923.A N LEU 919.A O no hydrogen 2.879 N/A