Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 6upy_B.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLU 9.A N THR 7.A OG1 no hydrogen 3.215 N/A SER 11.A N ALA 8.A O no hydrogen 3.229 N/A SER 11.A OG ALA 8.A O no hydrogen 2.614 N/A ILE 15.A N SER 11.A O no hydrogen 3.077 N/A SER 16.A N TRP 12.A O no hydrogen 2.710 N/A SER 16.A OG TRP 12.A O no hydrogen 2.876 N/A SER 16.A OG TYR 709.A OH no hydrogen 2.472 N/A ALA 17.A N ALA 13.A O no hydrogen 3.235 N/A PHE 18.A N VAL 14.A O no hydrogen 2.977 N/A PHE 19.A N ILE 15.A O no hydrogen 3.090 N/A PHE 19.A N SER 16.A O no hydrogen 3.253 N/A ARG 20.A N SER 16.A O no hydrogen 3.196 N/A LYS 22.A N PHE 18.A O no hydrogen 3.280 N/A GLY 23.A N PHE 19.A O no hydrogen 2.603 N/A GLN 27.A NE2 LEU 417.A O no hydrogen 3.393 N/A GLN 28.A NE2 LEU 150.A O no hydrogen 3.012 N/A LEU 29.A N VAL 25.A O no hydrogen 3.040 N/A ASP 30.A N SER 26.A O no hydrogen 2.771 N/A SER 31.A N GLN 27.A O no hydrogen 3.265 N/A PHE 32.A N LEU 29.A O no hydrogen 2.879 N/A ASN 33.A N LEU 29.A O no hydrogen 2.873 N/A GLN 34.A N ASP 30.A O no hydrogen 3.372 N/A VAL 36.A N PHE 32.A O no hydrogen 2.992 N/A ASP 37.A N ASN 33.A O no hydrogen 2.863 N/A TYR 38.A N GLN 34.A O no hydrogen 3.234 N/A THR 39.A N GLN 34.A O no hydrogen 2.752 N/A THR 39.A OG1 GLN 34.A O no hydrogen 2.783 N/A GLN 41.A N TYR 38.A O no hydrogen 3.204 N/A CYS 45.A N GLN 41.A O no hydrogen 2.895 N/A SER 48.A OG ILE 44.A O no hydrogen 2.351 N/A SER 48.A OG GLU 46.A O no hydrogen 2.993 N/A LEU 50.A N ILE 55.A O no hydrogen 2.991 N/A LEU 52.A N TYR 53.A O no hydrogen 2.627 N/A GLU 54.A N ARG 100.A O no hydrogen 2.396 N/A ILE 55.A N LEU 50.A O no hydrogen 2.962 N/A SER 56.A N LYS 98.A O no hydrogen 2.776 N/A SER 56.A OG LYS 98.A O no hydrogen 3.214 N/A ILE 60.A N GLN 41.A OE1 no hydrogen 2.986 N/A TYR 61.A N PHE 94.A O no hydrogen 2.352 N/A THR 63.A N GLY 92.A O no hydrogen 3.220 N/A THR 63.A OG1 LYS 64.A O no hydrogen 2.497 N/A LYS 64.A NZ LYS 115.A O no hydrogen 3.487 N/A MET 66.A N SER 90.A O no hydrogen 3.112 N/A VAL 67.A N HIS 75.A O no hydrogen 3.310 N/A GLY 72.A N GLU 69.A O no hydrogen 2.820 N/A THR 74.A OG1 ASN 68.A OD1 no hydrogen 2.475 N/A HIS 75.A N VAL 67.A O no hydrogen 3.208 N/A HIS 75.A NE2 GLU 69.A OE1 no hydrogen 2.708 N/A LEU 77.A N PRO 65.A O no hydrogen 3.343 N/A ALA 82.A N TYR 78.A O no hydrogen 3.324 N/A ARG 83.A N PRO 79.A O no hydrogen 2.989 N/A ARG 83.A NH1 GLU 132.A OE1 no hydrogen 2.517 N/A LEU 84.A N GLN 80.A O no hydrogen 3.149 N/A ARG 85.A N GLU 81.A O no hydrogen 2.895 N/A ARG 85.A NE THR 844.A O no hydrogen 2.544 N/A ARG 85.A NH1 GLU 69.A OE1 no hydrogen 2.796 N/A ARG 85.A NH1 GLU 69.A OE2 no hydrogen 3.312 N/A ARG 85.A NH1 GLU 81.A OE2 no hydrogen 3.043 N/A ARG 85.A NH2 GLU 69.A OE2 no hydrogen 2.764 N/A ARG 85.A NH2 THR 844.A O no hydrogen 2.757 N/A ARG 85.A NH2 ASN 845.A O no hydrogen 3.074 N/A LEU 87.A N ALA 82.A O no hydrogen 2.851 N/A TYR 89.A N ILE 142.A O no hydrogen 2.891 N/A SER 90.A OG THR 88.A O no hydrogen 2.969 N/A SER 91.A N LEU 108.A O no hydrogen 2.990 N/A SER 91.A OG THR 63.A O no hydrogen 3.294 N/A GLY 92.A N THR 63.A OG1 no hydrogen 3.330 N/A PHE 94.A N TYR 61.A O no hydrogen 2.568 N/A VAL 95.A N VAL 103.A O no hydrogen 3.215 N/A ASP 96.A N LYS 59.A O no hydrogen 3.380 N/A LYS 98.A N SER 56.A O no hydrogen 2.723 N/A ARG 100.A N GLU 54.A O no hydrogen 2.554 N/A VAL 103.A N VAL 95.A O no hydrogen 3.270 N/A ILE 105.A N LEU 93.A O no hydrogen 2.684 N/A ARG 107.A N THR 376.A OG1 no hydrogen 3.069 N/A LEU 108.A N SER 91.A O no hydrogen 2.839 N/A ILE 110.A N TYR 89.A O no hydrogen 3.295 N/A LEU 112.A N TYR 140.A O no hydrogen 3.153 N/A SER 114.A N MET 111.A O no hydrogen 3.386 N/A SER 114.A OG ASN 33.A OD1 no hydrogen 3.011 N/A LYS 115.A NZ ASP 37.A OD2 no hydrogen 2.968 N/A CYS 117.A SG TYR 89.A OH no hydrogen 2.893 N/A TYR 118.A OH PRO 65.A O no hydrogen 2.190 N/A SER 120.A N CYS 117.A O no hydrogen 3.196 N/A SER 120.A OG SER 114.A O no hydrogen 2.220 N/A SER 120.A OG LYS 115.A O no hydrogen 2.953 N/A SER 120.A OG CYS 117.A O no hydrogen 2.333 N/A GLU 121.A N GLU 121.A OE1 no hydrogen 2.634 N/A THR 123.A OG1 ASP 126.A OD1 no hydrogen 2.122 N/A SER 125.A OG ASP 126.A OD1 no hydrogen 3.216 N/A LEU 127.A N THR 123.A O no hydrogen 3.114 N/A TYR 128.A N GLU 124.A O no hydrogen 3.305 N/A LYS 129.A N SER 125.A O no hydrogen 3.168 N/A LEU 130.A N ASP 126.A O no hydrogen 2.991 N/A LYS 131.A N TYR 128.A O no hydrogen 3.166 N/A GLU 132.A N LEU 127.A O no hydrogen 2.868 N/A CYS 133.A SG THR 681.A OG1 no hydrogen 2.601 N/A ASP 136.A N CYS 133.A O no hydrogen 3.021 N/A GLY 139.A N LEU 112.A O no hydrogen 3.357 N/A TYR 140.A OH ASP 136.A OD2 no hydrogen 2.288 N/A PHE 141.A N LYS 148.A O no hydrogen 2.964 N/A ILE 143.A N SER 146.A O no hydrogen 3.292 N/A GLY 145.A N LEU 87.A O no hydrogen 2.766 N/A SER 146.A N ILE 143.A O no hydrogen 2.918 N/A SER 146.A OG ILE 143.A O no hydrogen 2.811 N/A LYS 148.A N PHE 141.A O no hydrogen 2.796 N/A LYS 148.A NZ SER 146.A OG no hydrogen 2.305 N/A VAL 149.A N GLN 403.A O no hydrogen 2.984 N/A ILE 151.A N VAL 401.A O no hydrogen 3.084 N/A ALA 152.A N ARG 419.A O no hydrogen 3.103 N/A GLN 153.A N ASP 336.A O no hydrogen 2.916 N/A GLU 154.A N ASN 421.A O no hydrogen 2.975 N/A ARG 155.A N ARG 334.A O no hydrogen 2.982 N/A ARG 155.A NH1 ASP 336.A OD2 no hydrogen 3.130 N/A ALA 157.A N LYS 332.A O no hydrogen 2.561 N/A ASN 159.A N ARG 179.A O no hydrogen 2.732 N/A ASN 159.A ND2 ALA 181.A O no hydrogen 2.623 N/A GLN 162.A N GLU 177.A O no hydrogen 2.894 N/A VAL 163.A N ASP 325.A OD2 no hydrogen 2.907 N/A PHE 164.A N VAL 175.A O no hydrogen 2.948 N/A LYS 165.A N GLN 324.A OE1 no hydrogen 2.491 N/A LYS 166.A N SER 173.A O no hydrogen 3.339 N/A SER 170.A N ALA 167.A O no hydrogen 3.021 N/A SER 170.A OG ILE 172.A O no hydrogen 3.235 N/A SER 173.A N LEU 196.A O no hydrogen 2.906 N/A SER 173.A OG HIS 174.A ND1 no hydrogen 3.065 N/A SER 173.A OG GLY 198.A O no hydrogen 3.274 N/A HIS 174.A ND1 SER 173.A OG no hydrogen 3.065 N/A VAL 175.A N PHE 164.A O no hydrogen 3.154 N/A ALA 176.A N VAL 194.A O no hydrogen 2.555 N/A GLU 177.A N GLN 162.A O no hydrogen 2.831 N/A ILE 178.A N LEU 192.A O no hydrogen 3.459 N/A ARG 179.A NH2 ALA 157.A O no hydrogen 2.766 N/A SER 180.A N SER 190.A O no hydrogen 2.441 N/A SER 180.A OG SER 190.A O no hydrogen 2.691 N/A ALA 181.A N ASN 159.A OD1 no hydrogen 2.859 N/A LYS 184.A NZ ASP 42.A OD2 no hydrogen 2.935 N/A ARG 187.A NE GLU 183.A O no hydrogen 3.099 N/A PHE 188.A N SER 186.A OG no hydrogen 3.387 N/A SER 190.A N SER 180.A O no hydrogen 2.644 N/A LEU 192.A N ILE 178.A O no hydrogen 3.039 N/A VAL 194.A N ALA 176.A O no hydrogen 3.069 N/A LYS 195.A N LYS 208.A O no hydrogen 3.167 N/A LYS 195.A NZ THR 210.A OG1 no hydrogen 2.489 N/A LYS 195.A NZ ASP 217.A OD2 no hydrogen 2.665 N/A LEU 196.A N HIS 174.A O no hydrogen 2.927 N/A TYR 197.A N THR 206.A O no hydrogen 2.809 N/A TYR 197.A OH ASP 217.A OD2 no hydrogen 3.385 N/A ARG 199.A NH2 ALA 167.A O no hydrogen 2.463 N/A ARG 199.A NH2 SER 170.A O no hydrogen 2.331 N/A SER 202.A N ARG 199.A O no hydrogen 2.868 N/A SER 202.A OG SER 203.A O no hydrogen 3.255 N/A ARG 205.A NH1 GLY 198.A O no hydrogen 2.285 N/A THR 206.A N ALA 204.A O no hydrogen 2.704 N/A THR 206.A OG1 ASP 258.A OD2 no hydrogen 3.225 N/A LYS 208.A N LYS 195.A O no hydrogen 3.228 N/A LYS 208.A NZ THR 206.A OG1 no hydrogen 2.974 N/A ALA 209.A N ILE 218.A O no hydrogen 2.883 N/A THR 210.A N GLN 193.A O no hydrogen 2.741 N/A THR 210.A OG1 GLN 193.A O no hydrogen 3.421 N/A THR 210.A OG1 ASP 217.A OD1 no hydrogen 3.053 N/A TYR 213.A OH GLU 288.A OE2 no hydrogen 3.413 N/A ILE 214.A N LEU 211.A O no hydrogen 3.098 N/A ILE 218.A N ALA 209.A O no hydrogen 3.113 N/A ILE 223.A N PRO 219.A O no hydrogen 3.271 N/A PHE 224.A N ILE 220.A O no hydrogen 2.964 N/A ARG 225.A N VAL 221.A O no hydrogen 3.173 N/A ARG 225.A NE ILE 230.A O no hydrogen 2.453 N/A ARG 225.A NH1 GLY 259.A O no hydrogen 2.484 N/A ARG 225.A NH2 ILE 230.A O no hydrogen 3.534 N/A ALA 226.A N ILE 222.A O no hydrogen 2.907 N/A LEU 227.A N ILE 223.A O no hydrogen 2.680 N/A GLY 228.A N PHE 224.A O no hydrogen 2.845 N/A ILE 229.A N PHE 224.A O no hydrogen 2.823 N/A ILE 235.A N PRO 231.A O no hydrogen 3.175 N/A LEU 236.A N ASP 232.A O no hydrogen 3.096 N/A GLU 237.A N GLY 233.A O no hydrogen 3.251 N/A HIS 238.A N GLU 234.A O no hydrogen 3.236 N/A ILE 239.A N ILE 235.A O no hydrogen 3.246 N/A CYS 240.A N LEU 236.A O no hydrogen 2.706 N/A CYS 240.A SG ASP 242.A O no hydrogen 3.096 N/A TYR 241.A OH HIS 238.A O no hydrogen 3.138 N/A ASN 244.A N ASP 242.A OD1 no hydrogen 2.914 N/A ASP 245.A N ASP 242.A O no hydrogen 3.186 N/A TRP 246.A N ASN 244.A O no hydrogen 2.869 N/A MET 248.A N ASP 245.A OD1 no hydrogen 2.966 N/A LEU 249.A N ASP 245.A O no hydrogen 3.308 N/A GLU 250.A N TRP 246.A O no hydrogen 2.731 N/A MET 251.A N GLN 247.A O no hydrogen 3.008 N/A LEU 252.A N MET 248.A O no hydrogen 3.095 N/A LEU 252.A N LEU 249.A O no hydrogen 2.965 N/A LYS 253.A N GLU 250.A O no hydrogen 3.224 N/A CYS 255.A N LEU 252.A O no hydrogen 2.975 N/A VAL 256.A N LEU 252.A O no hydrogen 3.342 N/A GLU 257.A N LYS 253.A O no hydrogen 3.153 N/A ASP 258.A N PRO 254.A O no hydrogen 2.938 N/A GLY 259.A N CYS 255.A O no hydrogen 3.009 N/A ILE 262.A N GLY 259.A O no hydrogen 3.346 N/A THR 267.A OG1 ASP 264.A O no hydrogen 3.345 N/A THR 267.A OG1 ASP 264.A OD1 no hydrogen 2.204 N/A ALA 268.A N ASP 264.A O no hydrogen 2.906 N/A LEU 269.A N ARG 265.A O no hydrogen 3.393 N/A PHE 271.A N THR 267.A O no hydrogen 3.213 N/A GLN 279.A NE2 ASP 283.A OD1 no hydrogen 3.361 N/A TYR 280.A N LYS 276.A O no hydrogen 3.004 N/A ALA 281.A N ARG 277.A O no hydrogen 2.830 N/A LYS 282.A N ILE 278.A O no hydrogen 2.635 N/A ASP 283.A N GLN 279.A O no hydrogen 3.156 N/A ILE 284.A N TYR 280.A O no hydrogen 3.006 N/A LEU 285.A N ALA 281.A O no hydrogen 3.049 N/A GLN 286.A N ASP 283.A O no hydrogen 2.839 N/A GLN 286.A NE2 GLN 295.A O no hydrogen 2.731 N/A LYS 287.A N ASP 283.A O no hydrogen 2.446 N/A GLU 288.A N ILE 284.A O no hydrogen 3.154 N/A ILE 293.A N LEU 290.A O no hydrogen 3.019 N/A GLN 295.A NE2 LYS 287.A O no hydrogen 2.973 N/A PHE 299.A N GLU 300.A OE2 no hydrogen 3.240 N/A LYS 303.A N PHE 299.A O no hydrogen 3.377 N/A LYS 303.A NZ LEU 285.A O no hydrogen 3.009 N/A LYS 303.A NZ GLN 286.A O no hydrogen 3.232 N/A LYS 303.A NZ PHE 289.A O no hydrogen 2.548 N/A LYS 303.A NZ THR 294.A O no hydrogen 3.137 N/A ALA 304.A N GLU 300.A O no hydrogen 3.198 N/A PHE 305.A N SER 301.A O no hydrogen 3.179 N/A PHE 306.A N ARG 302.A O no hydrogen 3.180 N/A LEU 307.A N LYS 303.A O no hydrogen 2.948 N/A GLY 308.A N ALA 304.A O no hydrogen 3.068 N/A TYR 309.A N PHE 305.A O no hydrogen 2.991 N/A TYR 309.A OH GLU 539.A OE2 no hydrogen 2.176 N/A MET 310.A N PHE 306.A O no hydrogen 2.880 N/A ILE 311.A N LEU 307.A O no hydrogen 3.151 N/A ASN 312.A N GLY 308.A O no hydrogen 2.855 N/A ASN 312.A ND2 ILE 239.A O no hydrogen 3.303 N/A ARG 313.A N TYR 309.A O no hydrogen 3.124 N/A ARG 313.A NH1 ASN 312.A OD1 no hydrogen 2.567 N/A LEU 314.A N MET 310.A O no hydrogen 2.969 N/A LEU 315.A N ILE 311.A O no hydrogen 2.879 N/A LEU 316.A N ASN 312.A O no hydrogen 2.952 N/A CYS 317.A N ARG 313.A O no hydrogen 3.203 N/A CYS 317.A SG LYS 322.A O no hydrogen 3.620 N/A ALA 318.A N LEU 314.A O no hydrogen 2.930 N/A LEU 319.A N LEU 315.A O no hydrogen 2.953 N/A ASP 320.A N CYS 317.A O no hydrogen 2.918 N/A ARG 321.A N LEU 316.A O no hydrogen 3.157 N/A ARG 321.A NH1 ASP 245.A OD2 no hydrogen 2.612 N/A ASP 325.A N VAL 163.A O no hydrogen 3.018 N/A HIS 329.A NE2 GLU 605.A OE1 no hydrogen 2.726 N/A PHE 330.A N THR 433.A OG1 no hydrogen 2.906 N/A GLY 331.A N HIS 329.A ND1 no hydrogen 3.019 N/A LYS 332.A N HIS 329.A O no hydrogen 2.926 N/A LYS 332.A NZ GLU 602.A OE1 no hydrogen 3.292 N/A LYS 332.A NZ GLU 602.A OE2 no hydrogen 2.444 N/A LYS 333.A N PHE 330.A O no hydrogen 3.298 N/A ARG 334.A N ARG 155.A O no hydrogen 2.830 N/A LEU 335.A N GLY 547.A O no hydrogen 2.906 N/A ASP 336.A N GLN 153.A O no hydrogen 2.588 N/A GLY 339.A N SER 31.A OG no hydrogen 2.342 N/A LEU 341.A N LEU 337.A O no hydrogen 3.077 N/A LEU 342.A N ALA 338.A O no hydrogen 2.912 N/A ALA 343.A N GLY 339.A O no hydrogen 2.852 N/A GLN 344.A N PRO 340.A O no hydrogen 2.883 N/A LEU 345.A N LEU 341.A O no hydrogen 3.274 N/A PHE 346.A N LEU 342.A O no hydrogen 2.543 N/A LYS 347.A N ALA 343.A O no hydrogen 3.193 N/A LYS 347.A NZ GLY 185.A O no hydrogen 2.387 N/A THR 348.A OG1 GLN 344.A O no hydrogen 2.959 N/A LEU 349.A N LEU 345.A O no hydrogen 2.898 N/A PHE 350.A N PHE 346.A O no hydrogen 2.623 N/A LYS 351.A N LYS 347.A O no hydrogen 3.238 N/A LYS 351.A NZ ASP 47.A O no hydrogen 2.955 N/A LYS 351.A NZ ASP 47.A OD1 no hydrogen 3.062 N/A LYS 351.A NZ ASP 47.A OD2 no hydrogen 3.091 N/A LYS 352.A N THR 348.A O no hydrogen 3.419 N/A LEU 353.A N LEU 349.A O no hydrogen 2.929 N/A THR 354.A N PHE 350.A O no hydrogen 2.664 N/A THR 354.A OG1 PHE 350.A O no hydrogen 2.755 N/A LYS 355.A N LYS 351.A O no hydrogen 2.815 N/A ASP 356.A N LYS 352.A O no hydrogen 2.978 N/A ILE 357.A N LEU 353.A O no hydrogen 2.815 N/A PHE 358.A N THR 354.A O no hydrogen 3.026 N/A ARG 359.A N LYS 355.A O no hydrogen 3.017 N/A TYR 360.A N ASP 356.A O no hydrogen 3.131 N/A MET 361.A N ILE 357.A O no hydrogen 3.042 N/A GLN 362.A N PHE 358.A O no hydrogen 3.132 N/A ARG 363.A N ARG 359.A O no hydrogen 3.157 N/A THR 364.A N TYR 360.A O no hydrogen 3.189 N/A THR 364.A N MET 361.A O no hydrogen 3.050 N/A THR 364.A OG1 TYR 360.A O no hydrogen 2.790 N/A GLU 367.A N GLU 366.A OE1 no hydrogen 3.117 N/A LYS 373.A N ASN 371.A OD1 no hydrogen 3.298 N/A THR 376.A N ALA 372.A O no hydrogen 3.431 N/A THR 376.A OG1 ALA 372.A O no hydrogen 2.734 N/A SER 377.A N LYS 373.A O no hydrogen 2.353 N/A GLY 378.A N THR 374.A O no hydrogen 2.899 N/A LEU 379.A N ILE 375.A O no hydrogen 3.066 N/A LYS 380.A NZ THR 88.A OG1 no hydrogen 2.308 N/A TYR 381.A N SER 377.A O no hydrogen 3.248 N/A ALA 382.A N GLY 378.A O no hydrogen 3.427 N/A LEU 383.A N LEU 379.A O no hydrogen 2.792 N/A ALA 384.A N LYS 380.A O no hydrogen 2.691 N/A THR 385.A N TYR 381.A O no hydrogen 3.112 N/A THR 385.A OG1 TYR 381.A O no hydrogen 2.343 N/A THR 385.A OG1 ASN 387.A OD1 no hydrogen 3.401 N/A GLY 386.A N ALA 382.A O no hydrogen 3.300 N/A ASN 387.A N THR 385.A OG1 no hydrogen 3.264 N/A TRP 388.A NE1 LEU 341.A O no hydrogen 2.631 N/A SER 396.A N LYS 392.A O no hydrogen 2.514 N/A SER 396.A OG TRP 388.A O no hydrogen 3.235 N/A SER 396.A OG LYS 393.A O no hydrogen 3.251 N/A SER 396.A OG ARG 398.A O no hydrogen 3.356 N/A VAL 401.A N GLY 386.A O no hydrogen 2.848 N/A SER 402.A OG VAL 149.A O no hydrogen 3.452 N/A SER 402.A OG LEU 383.A O no hydrogen 2.635 N/A GLN 403.A N VAL 149.A O no hydrogen 3.207 N/A GLN 403.A NE2 HIS 416.A NE2 no hydrogen 3.013 N/A LEU 405.A N GLU 147.A O no hydrogen 2.809 N/A ARG 407.A NE GLU 147.A OE1 no hydrogen 2.910 N/A ARG 407.A NE GLU 147.A OE2 no hydrogen 2.984 N/A ARG 407.A NH1 ASP 136.A OD1 no hydrogen 3.174 N/A ARG 407.A NH2 ASP 136.A OD1 no hydrogen 3.105 N/A ARG 407.A NH2 GLU 147.A OE1 no hydrogen 2.454 N/A THR 409.A OG1 ALA 675.A O no hydrogen 2.341 N/A TYR 410.A OH PHE 135.A O no hydrogen 2.533 N/A SER 412.A OG ASN 406.A OD1 no hydrogen 2.299 N/A THR 413.A N THR 409.A O no hydrogen 2.793 N/A THR 413.A OG1 ASN 406.A O no hydrogen 2.762 N/A THR 413.A OG1 THR 409.A O no hydrogen 3.206 N/A LEU 414.A N TYR 410.A O no hydrogen 2.831 N/A SER 415.A N SER 411.A O no hydrogen 3.035 N/A SER 415.A OG GLU 442.A OE2 no hydrogen 2.933 N/A SER 415.A OG ASN 454.A OD1 no hydrogen 2.983 N/A HIS 416.A N SER 412.A O no hydrogen 3.192 N/A HIS 416.A N THR 413.A O no hydrogen 3.283 N/A LEU 417.A N LEU 414.A O no hydrogen 3.203 N/A ARG 418.A N LEU 414.A O no hydrogen 3.383 N/A ARG 418.A NH1 LEU 457.A O no hydrogen 3.048 N/A ARG 418.A NH2 LEU 457.A O no hydrogen 3.461 N/A ARG 419.A NE SER 415.A O no hydrogen 3.248 N/A ARG 419.A NE ASN 454.A OD1 no hydrogen 3.566 N/A ARG 419.A NH2 SER 415.A OG no hydrogen 2.488 N/A THR 420.A N LYS 453.A O no hydrogen 2.711 N/A ASN 421.A N ALA 152.A O no hydrogen 2.881 N/A ASN 421.A ND2 GLN 153.A OE1 no hydrogen 3.489 N/A THR 422.A OG1 GLU 154.A OE1 no hydrogen 2.214 N/A THR 422.A OG1 LEU 451.A O no hydrogen 3.195 N/A LYS 426.A N ASP 328.A OD2 no hydrogen 3.282 N/A GLN 429.A N GLN 429.A OE1 no hydrogen 2.893 N/A HIS 431.A N HIS 434.A ND1 no hydrogen 3.483 N/A HIS 431.A NE2 ASP 326.A OD2 no hydrogen 3.301 N/A THR 433.A N HIS 431.A ND1 no hydrogen 2.931 N/A THR 433.A OG1 HIS 431.A ND1 no hydrogen 2.538 N/A HIS 434.A N HIS 431.A O no hydrogen 3.218 N/A TRP 435.A N ASN 432.A O no hydrogen 3.192 N/A TRP 435.A NE1 GLU 640.A OE1 no hydrogen 2.839 N/A LEU 437.A N HIS 434.A O no hydrogen 3.235 N/A VAL 438.A N HIS 434.A O no hydrogen 3.236 N/A CYS 439.A N ASN 454.A O no hydrogen 3.051 N/A THR 443.A OG1 VAL 452.A O no hydrogen 2.668 N/A GLY 450.A N THR 443.A OG1 no hydrogen 3.336 N/A LYS 453.A N THR 420.A O no hydrogen 3.142 N/A LYS 453.A NZ GLY 450.A O no hydrogen 2.429 N/A ASN 454.A ND2 GLU 442.A O no hydrogen 3.255 N/A LEU 455.A N ARG 418.A O no hydrogen 3.432 N/A SER 456.A N LEU 437.A O no hydrogen 3.106 N/A SER 456.A OG ILE 646.A O no hydrogen 2.514 N/A SER 459.A OG LEU 437.A O no hydrogen 3.280 N/A SER 459.A OG SER 456.A O no hydrogen 2.847 N/A CYS 460.A N TYR 550.A O no hydrogen 3.034 N/A CYS 460.A SG MET 458.A O no hydrogen 3.523 N/A SER 462.A N ARG 548.A O no hydrogen 2.854 N/A SER 462.A OG ASP 545.A O no hydrogen 2.608 N/A VAL 463.A N GLU 528.A OE1 no hydrogen 2.804 N/A THR 465.A OG1 GLY 464.A O no hydrogen 2.646 N/A ILE 470.A N PRO 467.A O no hydrogen 2.697 N/A ILE 471.A N PRO 467.A O no hydrogen 3.001 N/A THR 472.A N MET 468.A O no hydrogen 3.177 N/A THR 472.A OG1 MET 468.A O no hydrogen 3.093 N/A PHE 473.A N PRO 469.A O no hydrogen 3.267 N/A LEU 474.A N ILE 470.A O no hydrogen 3.003 N/A SER 475.A N ILE 471.A O no hydrogen 2.751 N/A SER 475.A OG ILE 471.A O no hydrogen 3.386 N/A GLU 476.A N THR 472.A O no hydrogen 3.060 N/A TRP 477.A N LEU 474.A O no hydrogen 2.768 N/A MET 479.A N LEU 474.A O no hydrogen 3.216 N/A GLU 480.A N VAL 505.A O no hydrogen 2.751 N/A GLU 483.A N GLU 483.A OE2 no hydrogen 2.524 N/A HIS 488.A ND1 GLU 237.A OE1 no hydrogen 2.918 N/A HIS 488.A ND1 GLU 237.A OE2 no hydrogen 2.814 N/A SER 490.A N VAL 486.A O no hydrogen 3.018 N/A SER 490.A OG VAL 486.A O no hydrogen 3.437 N/A ARG 495.A N LYS 538.A O no hydrogen 3.158 N/A VAL 496.A N GLY 504.A O no hydrogen 3.111 N/A PHE 497.A N LEU 540.A O no hydrogen 2.612 N/A VAL 498.A N VAL 501.A O no hydrogen 2.954 N/A ASN 499.A N ILE 542.A O no hydrogen 3.014 N/A ASN 499.A ND2 THR 544.A OG1 no hydrogen 3.371 N/A VAL 501.A N VAL 498.A O no hydrogen 2.866 N/A HIS 503.A N VAL 496.A O no hydrogen 3.288 N/A VAL 505.A N GLU 480.A O no hydrogen 2.907 N/A HIS 506.A N THR 494.A O no hydrogen 2.732 N/A HIS 506.A NE2 TRP 477.A O no hydrogen 3.125 N/A ARG 511.A NE ASN 508.A OD1 no hydrogen 2.701 N/A MET 513.A N PRO 509.A O no hydrogen 2.717 N/A GLU 514.A N ALA 510.A O no hydrogen 3.001 N/A THR 515.A N ARG 511.A O no hydrogen 3.051 N/A THR 515.A OG1 ARG 511.A O no hydrogen 2.710 N/A LEU 516.A N LEU 512.A O no hydrogen 2.503 N/A ARG 517.A N MET 513.A O no hydrogen 2.514 N/A ARG 517.A NH1 MET 531.A O no hydrogen 3.001 N/A THR 518.A N GLU 514.A O no hydrogen 3.201 N/A THR 518.A OG1 GLU 514.A O no hydrogen 2.574 N/A LEU 519.A N THR 515.A O no hydrogen 3.202 N/A ARG 520.A N ARG 517.A O no hydrogen 2.885 N/A ARG 520.A NH1 GLU 597.A OE2 no hydrogen 3.336 N/A ARG 520.A NH1 GLU 603.A OE2 no hydrogen 2.673 N/A ARG 520.A NH2 VAL 529.A O no hydrogen 2.279 N/A ARG 520.A NH2 GLU 603.A OE1 no hydrogen 3.048 N/A ARG 521.A N ARG 517.A O no hydrogen 3.057 N/A ARG 521.A NE GLU 597.A OE2 no hydrogen 2.880 N/A ARG 521.A NH1 GLU 557.A OE2 no hydrogen 3.514 N/A LYS 522.A N THR 518.A O no hydrogen 2.858 N/A ILE 525.A N LEU 519.A O no hydrogen 2.916 N/A GLU 528.A N ASN 526.A OD1 no hydrogen 2.621 N/A SER 530.A N PHE 543.A O no hydrogen 3.006 N/A MET 531.A N GLU 603.A OE1 no hydrogen 2.864 N/A ILE 532.A N LYS 541.A O no hydrogen 2.832 N/A ASP 534.A N GLU 539.A O no hydrogen 2.820 N/A GLU 537.A N ASP 534.A OD1 no hydrogen 3.243 N/A LYS 538.A N ILE 535.A O no hydrogen 2.749 N/A GLU 539.A N ASP 534.A O no hydrogen 2.935 N/A LEU 540.A N ARG 495.A O no hydrogen 2.850 N/A LYS 541.A N ILE 532.A O no hydrogen 2.826 N/A ILE 542.A N PHE 497.A O no hydrogen 2.942 N/A PHE 543.A N SER 530.A O no hydrogen 2.839 N/A THR 544.A N ASN 499.A OD1 no hydrogen 2.909 N/A THR 544.A OG1 THR 465.A O no hydrogen 3.155 N/A THR 544.A OG1 ASN 499.A OD1 no hydrogen 3.497 N/A GLY 547.A N SER 462.A O no hydrogen 2.609 N/A ARG 548.A N SER 462.A OG no hydrogen 2.462 N/A ARG 548.A NH1 ASP 545.A O no hydrogen 2.463 N/A TYR 550.A N CYS 460.A O no hydrogen 3.320 N/A ARG 551.A N ILE 599.A O no hydrogen 3.253 N/A ARG 551.A NE TRP 435.A O no hydrogen 3.279 N/A ARG 551.A NH2 GLU 604.A OE2 no hydrogen 3.000 N/A LEU 553.A N GLU 597.A O no hydrogen 3.079 N/A PHE 554.A N CYS 639.A O no hydrogen 2.970 N/A VAL 556.A N THR 637.A O no hydrogen 2.614 N/A GLU 557.A N GLU 563.A O no hydrogen 3.178 N/A ASP 559.A N HIS 561.A O no hydrogen 2.834 N/A LYS 562.A NZ ASP 558.A OD1 no hydrogen 2.923 N/A LYS 562.A NZ ASP 558.A OD2 no hydrogen 3.111 N/A GLU 563.A N GLU 557.A O no hydrogen 2.862 N/A LEU 564.A N GLU 563.A OE2 no hydrogen 3.209 N/A LYS 565.A N ILE 555.A O no hydrogen 2.876 N/A ARG 567.A NE LEU 564.A O no hydrogen 2.626 N/A ARG 567.A NH1 SER 3.A O no hydrogen 2.317 N/A ARG 567.A NH2 ASP 559.A OD2 no hydrogen 2.405 N/A LYS 568.A N ALA 4.A O no hydrogen 2.687 N/A LYS 568.A NZ ASP 10.A OD1 no hydrogen 3.096 N/A LYS 568.A NZ ASP 10.A OD2 no hydrogen 2.561 N/A GLY 569.A N GLU 2.A O no hydrogen 2.846 N/A ILE 571.A N ARG 567.A O no hydrogen 3.080 N/A ALA 572.A N LYS 568.A O no hydrogen 3.108 N/A LYS 573.A N GLY 569.A O no hydrogen 3.131 N/A MET 575.A N ILE 571.A O no hydrogen 2.784 N/A ALA 576.A N ALA 572.A O no hydrogen 2.506 N/A THR 577.A N LYS 573.A O no hydrogen 3.198 N/A THR 577.A OG1 LYS 573.A O no hydrogen 2.974 N/A GLU 578.A N LEU 574.A O no hydrogen 2.731 N/A TYR 579.A N MET 575.A O no hydrogen 3.084 N/A GLN 580.A N THR 577.A O no hydrogen 3.288 N/A TYR 585.A N THR 577.A OG1 no hydrogen 3.411 N/A TYR 585.A OH GLU 593.A OE1 no hydrogen 2.255 N/A THR 586.A OG1 GLU 21.A OE2 no hydrogen 3.534 N/A TRP 587.A N THR 586.A OG1 no hydrogen 2.555 N/A TRP 587.A NE1 TYR 598.A OH no hydrogen 3.123 N/A SER 588.A N GLU 21.A OE2 no hydrogen 2.605 N/A SER 588.A OG GLU 21.A OE2 no hydrogen 2.526 N/A SER 589.A OG THR 586.A O no hydrogen 2.219 N/A LEU 590.A N THR 586.A O no hydrogen 3.115 N/A LEU 591.A N TRP 587.A O no hydrogen 2.935 N/A ASN 592.A N SER 588.A O no hydrogen 2.662 N/A GLU 593.A N SER 589.A O no hydrogen 2.967 N/A GLY 594.A N LEU 591.A O no hydrogen 2.997 N/A LEU 595.A N LEU 590.A O no hydrogen 2.961 N/A GLU 597.A N LEU 553.A O no hydrogen 3.124 N/A ILE 599.A N ARG 551.A O no hydrogen 3.118 N/A ALA 601.A N ASP 600.A OD2 no hydrogen 2.415 N/A GLU 604.A N ASP 600.A O no hydrogen 2.954 N/A GLU 605.A N GLU 602.A O no hydrogen 3.134 N/A SER 606.A N GLU 603.A O no hydrogen 3.210 N/A SER 606.A OG GLU 603.A O no hydrogen 3.217 N/A ILE 607.A N GLU 604.A O no hydrogen 3.235 N/A LEU 608.A N THR 637.A OG1 no hydrogen 3.010 N/A ALA 610.A N HIS 638.A O no hydrogen 2.763 N/A ASP 615.A N GLN 612.A O no hydrogen 3.066 N/A LYS 625.A N ASP 622.A OD1 no hydrogen 2.789 N/A ARG 626.A NE THR 936.A O no hydrogen 3.405 N/A ARG 626.A NH2 ASP 658.A OD2 no hydrogen 2.926 N/A ARG 626.A NH2 THR 936.A O no hydrogen 3.253 N/A ARG 628.A NH1 ASP 937.A OD1 no hydrogen 2.591 N/A HIS 632.A ND1 HIS 631.A O no hydrogen 2.854 N/A THR 637.A N LEU 608.A O no hydrogen 2.883 N/A THR 637.A OG1 LEU 608.A O no hydrogen 2.842 N/A THR 637.A OG1 HIS 638.A ND1 no hydrogen 2.741 N/A HIS 638.A N LEU 608.A O no hydrogen 3.145 N/A HIS 638.A ND1 THR 637.A OG1 no hydrogen 2.741 N/A HIS 638.A NE2 GLU 597.A OE1 no hydrogen 2.778 N/A CYS 639.A SG ALA 610.A O no hydrogen 3.616 N/A CYS 639.A SG GLU 640.A O no hydrogen 3.313 N/A GLU 640.A N ALA 610.A O no hydrogen 2.585 N/A SER 644.A N HIS 642.A ND1 no hydrogen 3.342 N/A SER 644.A OG HIS 642.A ND1 no hydrogen 2.712 N/A MET 645.A N HIS 642.A O no hydrogen 3.114 N/A ILE 646.A N PRO 643.A O no hydrogen 3.206 N/A LEU 647.A N SER 644.A O no hydrogen 3.446 N/A ALA 650.A N GLU 442.A OE1 no hydrogen 3.032 N/A SER 652.A N GLY 648.A O no hydrogen 3.298 N/A SER 652.A N VAL 649.A O no hydrogen 3.260 N/A SER 652.A OG GLY 648.A O no hydrogen 2.223 N/A SER 652.A OG VAL 649.A O no hydrogen 3.449 N/A ILE 653.A N ALA 650.A O no hydrogen 3.180 N/A ILE 654.A N ALA 651.A O no hydrogen 3.258 N/A PHE 656.A N ALA 932.A O no hydrogen 3.081 N/A HIS 659.A N PHE 656.A O no hydrogen 3.019 N/A HIS 659.A ND1 ASP 658.A OD1 no hydrogen 2.908 N/A ASN 660.A N PRO 657.A O no hydrogen 3.298 N/A ASN 660.A ND2 ASN 665.A OD1 no hydrogen 3.487 N/A ASN 665.A ND2 PRO 657.A O no hydrogen 3.225 N/A THR 666.A OG1 ALA 441.A O no hydrogen 2.847 N/A TYR 667.A N PRO 663.A O no hydrogen 3.027 N/A GLN 668.A N ARG 664.A O no hydrogen 2.978 N/A GLN 668.A NE2 GLN 981.A OE1 no hydrogen 3.364 N/A SER 669.A N ASN 665.A O no hydrogen 3.179 N/A SER 669.A OG ASN 665.A O no hydrogen 2.756 N/A ALA 670.A N TYR 667.A O no hydrogen 3.111 N/A MET 671.A N TYR 667.A O no hydrogen 3.186 N/A GLY 672.A N GLN 668.A O no hydrogen 2.777 N/A GLN 674.A N MET 671.A O no hydrogen 2.747 N/A GLN 674.A NE2 ALA 670.A O no hydrogen 3.299 N/A MET 676.A N ARG 982.A O no hydrogen 2.898 N/A ASN 682.A ND2 LYS 131.A O no hydrogen 2.900 N/A ARG 686.A N ASN 682.A O no hydrogen 3.396 N/A ALA 691.A N PHE 754.A O no hydrogen 2.977 N/A ILE 693.A N LEU 752.A O no hydrogen 3.313 N/A TYR 695.A N ARG 750.A O no hydrogen 2.827 N/A GLN 698.A N GLY 718.A O no hydrogen 3.345 N/A LEU 701.A N ASN 720.A OD1 no hydrogen 3.117 N/A THR 703.A N GLY 930.A O no hydrogen 2.602 N/A THR 703.A OG1 GLU 929.A OE1 no hydrogen 2.258 N/A THR 703.A OG1 GLY 930.A O no hydrogen 3.315 N/A THR 704.A OG1 SER 652.A O no hydrogen 2.420 N/A ARG 705.A N SER 933.A OG no hydrogen 2.673 N/A ARG 705.A NH2 GLU 9.A OE2 no hydrogen 2.238 N/A MET 707.A N THR 704.A O no hydrogen 3.137 N/A TYR 709.A OH SER 16.A OG no hydrogen 2.472 N/A LEU 710.A N MET 707.A O no hydrogen 2.672 N/A LYS 711.A NZ GLU 708.A O no hydrogen 2.900 N/A PHE 712.A N MET 707.A O no hydrogen 3.513 N/A LEU 715.A N PHE 712.A O no hydrogen 3.071 N/A ALA 717.A N TYR 979.A OH no hydrogen 2.978 N/A GLN 719.A N TYR 980.A O no hydrogen 3.092 N/A GLN 719.A NE2 TYR 696.A O no hydrogen 2.826 N/A ALA 721.A N GLN 719.A O no hydrogen 2.770 N/A ILE 722.A N ASP 897.A OD2 no hydrogen 3.344 N/A VAL 723.A N GLY 976.A O no hydrogen 2.890 N/A ALA 724.A N LEU 898.A O no hydrogen 2.829 N/A ILE 725.A N PHE 974.A O no hydrogen 3.365 N/A ALA 726.A N ILE 900.A O no hydrogen 2.939 N/A TYR 728.A OH ASP 886.A O no hydrogen 3.063 N/A TYR 728.A OH ASN 962.A OD1 no hydrogen 2.279 N/A SER 729.A OG TYR 882.A OH no hydrogen 2.796 N/A ASN 732.A ND2 ALA 726.A O no hydrogen 2.330 N/A GLN 733.A N SER 736.A OG no hydrogen 2.611 N/A GLN 733.A NE2 GLY 730.A O no hydrogen 2.606 N/A SER 736.A N GLN 733.A O no hydrogen 3.071 N/A SER 736.A OG TYR 731.A O no hydrogen 2.533 N/A SER 736.A OG GLN 733.A O no hydrogen 2.469 N/A MET 737.A N THR 877.A O no hydrogen 2.813 N/A ILE 738.A N ILE 899.A O no hydrogen 3.074 N/A MET 739.A N ILE 880.A O no hydrogen 3.227 N/A ASN 740.A N ASP 897.A O no hydrogen 2.927 N/A ASN 740.A ND2 PRO 896.A O no hydrogen 3.566 N/A GLN 741.A N TYR 882.A O no hydrogen 2.524 N/A GLN 741.A NE2 GLN 741.A O no hydrogen 3.411 N/A GLN 741.A NE2 ASP 745.A OD1 no hydrogen 3.294 N/A SER 743.A N ASN 740.A OD1 no hydrogen 2.368 N/A SER 743.A OG ASN 740.A O no hydrogen 2.485 N/A SER 743.A OG ASN 740.A OD1 no hydrogen 2.863 N/A ILE 744.A N ASN 740.A O no hydrogen 3.322 N/A ASP 745.A N GLN 741.A O no hydrogen 3.147 N/A ARG 746.A N SER 742.A O no hydrogen 3.171 N/A GLY 747.A N ILE 744.A O no hydrogen 2.836 N/A LEU 748.A N SER 743.A O no hydrogen 2.964 N/A PHE 749.A N GLN 719.A OE1 no hydrogen 2.930 N/A ARG 750.A N GLY 747.A O no hydrogen 3.454 N/A SER 751.A N LYS 860.A O no hydrogen 3.123 N/A LEU 752.A N ILE 693.A O no hydrogen 2.946 N/A PHE 753.A N THR 858.A O no hydrogen 2.554 N/A PHE 754.A N ALA 691.A O no hydrogen 2.926 N/A ARG 755.A N VAL 856.A O no hydrogen 2.981 N/A ARG 755.A NH1 GLU 833.A OE1 no hydrogen 3.502 N/A SER 756.A N THR 689.A O no hydrogen 3.134 N/A SER 756.A OG ASP 688.A O no hydrogen 2.254 N/A TYR 757.A N VAL 854.A O no hydrogen 2.754 N/A ASP 759.A N VAL 852.A O no hydrogen 3.182 N/A GLU 761.A N LYS 850.A O no hydrogen 3.063 N/A LYS 762.A N GLU 770.A OE1 no hydrogen 2.915 N/A SER 767.A N GLY 765.A O no hydrogen 2.803 N/A THR 769.A OG1 GLU 770.A O no hydrogen 2.723 N/A GLU 770.A N LYS 762.A O no hydrogen 3.292 N/A THR 771.A N THR 813.A O no hydrogen 3.260 N/A PHE 772.A N GLU 761.A OE2 no hydrogen 2.432 N/A GLU 773.A N GLY 811.A O no hydrogen 3.115 N/A GLN 776.A N THR 780.A OG1 no hydrogen 3.197 N/A ASN 779.A ND2 GLN 776.A OE1 no hydrogen 2.738 N/A THR 780.A N GLN 776.A O no hydrogen 2.487 N/A THR 780.A OG1 GLN 776.A O no hydrogen 3.070 N/A LEU 781.A N LYS 822.A O no hydrogen 3.307 N/A LYS 784.A N TYR 788.A OH no hydrogen 2.907 N/A LYS 784.A N ASP 824.A OD2 no hydrogen 3.260 N/A LYS 784.A NZ SER 826.A O no hydrogen 3.382 N/A TYR 788.A OH ASP 824.A OD2 no hydrogen 2.295 N/A LYS 790.A NZ ARG 802.A O no hydrogen 2.419 N/A LYS 790.A NZ ASP 807.A OD1 no hydrogen 2.865 N/A LEU 791.A N TYR 788.A O no hydrogen 2.989 N/A ASP 792.A N LEU 796.A O no hydrogen 3.076 N/A GLY 795.A N ASP 792.A O no hydrogen 3.298 N/A LEU 796.A N ASP 794.A OD1 no hydrogen 2.924 N/A GLY 800.A N VAL 837.A O no hydrogen 2.922 N/A VAL 801.A N ALA 798.A O no hydrogen 3.475 N/A VAL 803.A N GLY 835.A O no hydrogen 2.721 N/A SER 804.A N ASP 807.A OD1 no hydrogen 2.775 N/A SER 804.A N ASP 807.A OD2 no hydrogen 3.410 N/A GLY 805.A N GLU 833.A O no hydrogen 3.139 N/A VAL 808.A N THR 787.A O no hydrogen 3.288 N/A ILE 809.A N THR 827.A O no hydrogen 3.111 N/A ILE 810.A N THR 827.A O no hydrogen 3.433 N/A GLY 811.A N GLY 795.A O no hydrogen 2.561 N/A LYS 812.A NZ ASP 759.A OD1 no hydrogen 2.359 N/A LYS 812.A NZ GLN 760.A O no hydrogen 2.386 N/A LYS 812.A NZ GLU 770.A OE1 no hydrogen 2.948 N/A THR 813.A N THR 771.A O no hydrogen 3.163 N/A THR 813.A OG1 GLU 773.A OE2 no hydrogen 2.687 N/A THR 814.A N ARG 823.A O no hydrogen 2.785 N/A LYS 822.A NZ GLU 773.A OE2 no hydrogen 2.365 N/A ARG 823.A N THR 814.A O no hydrogen 2.743 N/A ASP 824.A N LEU 781.A O no hydrogen 2.972 N/A ALA 825.A N LYS 812.A O no hydrogen 2.766 N/A SER 826.A N ASP 824.A OD1 no hydrogen 2.711 N/A SER 826.A OG ILE 810.A O no hydrogen 2.881 N/A SER 826.A OG ASP 824.A OD1 no hydrogen 3.203 N/A THR 827.A N ILE 810.A O no hydrogen 3.011 N/A LEU 829.A N ASP 807.A O no hydrogen 3.325 N/A GLU 833.A N ARG 830.A O no hydrogen 3.121 N/A GLY 835.A N VAL 803.A O no hydrogen 2.828 N/A ILE 836.A N ARG 857.A O no hydrogen 2.751 N/A VAL 837.A N VAL 801.A O no hydrogen 3.230 N/A ASP 838.A N ARG 855.A O no hydrogen 2.893 N/A GLN 839.A N ARG 855.A O no hydrogen 3.259 N/A LEU 841.A N LYS 853.A O no hydrogen 2.855 N/A THR 843.A N PHE 851.A O no hydrogen 3.201 N/A THR 843.A OG1 THR 844.A O no hydrogen 3.473 N/A THR 844.A N THR 843.A OG1 no hydrogen 2.590 N/A THR 844.A OG1 LEU 849.A O no hydrogen 2.614 N/A ASN 845.A N LEU 849.A O no hydrogen 3.105 N/A GLY 848.A N ASN 845.A O no hydrogen 3.359 N/A PHE 851.A N THR 843.A O no hydrogen 2.941 N/A VAL 852.A N ASP 759.A O no hydrogen 3.010 N/A LYS 853.A N LEU 841.A O no hydrogen 3.089 N/A LYS 853.A NZ ARG 83.A O no hydrogen 2.729 N/A LYS 853.A NZ LEU 84.A O no hydrogen 3.453 N/A LYS 853.A NZ ASN 86.A OD1 no hydrogen 3.101 N/A VAL 854.A N TYR 757.A O no hydrogen 2.927 N/A ARG 855.A N GLN 839.A O no hydrogen 2.840 N/A ARG 855.A NE ASP 838.A OD2 no hydrogen 2.967 N/A ARG 855.A NH1 ASN 684.A O no hydrogen 2.977 N/A ARG 855.A NH2 ASN 684.A O no hydrogen 2.480 N/A ARG 855.A NH2 ASP 838.A OD2 no hydrogen 2.978 N/A VAL 856.A N ARG 755.A O no hydrogen 2.813 N/A ARG 857.A N ILE 836.A O no hydrogen 2.538 N/A ARG 857.A NE ASP 838.A OD1 no hydrogen 3.475 N/A THR 858.A N PHE 753.A O no hydrogen 2.769 N/A THR 858.A OG1 ASN 834.A O no hydrogen 2.303 N/A THR 859.A OG1 SER 751.A O no hydrogen 3.456 N/A LYS 860.A N SER 751.A O no hydrogen 2.804 N/A LYS 860.A NZ ASP 989.A OD1 no hydrogen 2.848 N/A LYS 860.A NZ ASP 989.A OD2 no hydrogen 3.521 N/A GLN 863.A N ASP 866.A OD2 no hydrogen 3.104 N/A GLY 865.A N ILE 878.A O no hydrogen 2.882 N/A ASP 866.A N GLN 863.A O no hydrogen 3.238 N/A LYS 867.A N HIS 985.A O no hydrogen 2.936 N/A PHE 868.A N GLY 876.A O no hydrogen 3.089 N/A ALA 869.A N GLN 981.A O no hydrogen 3.108 N/A ARG 871.A NE GLU 916.A OE1 no hydrogen 3.330 N/A ARG 871.A NH1 GLY 702.A O no hydrogen 3.295 N/A ARG 871.A NH2 GLY 702.A O no hydrogen 3.003 N/A ARG 871.A NH2 GLU 916.A OE1 no hydrogen 2.510 N/A HIS 872.A NE2 PRO 655.A O no hydrogen 3.164 N/A GLN 874.A NE2 THR 910.A OG1 no hydrogen 2.621 N/A ILE 878.A N ASP 866.A O no hydrogen 3.333 N/A GLY 879.A N MET 737.A O no hydrogen 2.760 N/A THR 881.A OG1 GLN 741.A OE1 no hydrogen 2.665 N/A TYR 882.A N MET 739.A O no hydrogen 3.181 N/A TYR 882.A OH SER 729.A OG no hydrogen 2.796 N/A ARG 883.A NH1 GLU 885.A OE1 no hydrogen 2.196 N/A ARG 884.A N SER 742.A OG no hydrogen 2.795 N/A GLU 885.A N GLU 885.A OE2 no hydrogen 2.769 N/A MET 887.A N ARG 884.A O no hydrogen 3.201 N/A PHE 889.A N TYR 961.A O no hydrogen 3.037 N/A THR 890.A N ILE 894.A O no hydrogen 3.019 N/A THR 890.A OG1 GLU 958.A OE2 no hydrogen 2.750 N/A THR 890.A OG1 VAL 959.A O no hydrogen 3.241 N/A GLY 893.A N THR 890.A O no hydrogen 3.112 N/A ASP 897.A N ILE 722.A O no hydrogen 2.619 N/A LEU 898.A N ILE 722.A O no hydrogen 2.967 N/A ILE 899.A N ILE 738.A O no hydrogen 2.712 N/A ILE 900.A N ALA 724.A O no hydrogen 2.811 N/A ASN 901.A ND2 ASN 732.A O no hydrogen 2.554 N/A HIS 903.A N ASN 901.A OD1 no hydrogen 2.619 N/A ILE 905.A N PRO 902.A O no hydrogen 3.162 N/A ARG 908.A N ILE 905.A O no hydrogen 3.260 N/A ARG 908.A NE ALA 904.A O no hydrogen 2.692 N/A MET 909.A N ILE 905.A O no hydrogen 2.860 N/A ALA 912.A N ASN 660.A OD1 no hydrogen 2.831 N/A HIS 913.A NE2 TYR 980.A OH no hydrogen 3.332 N/A ILE 915.A N VAL 911.A O no hydrogen 2.849 N/A GLU 916.A N ALA 912.A O no hydrogen 2.807 N/A CYS 917.A N HIS 913.A O no hydrogen 3.430 N/A CYS 917.A SG GLY 976.A O no hydrogen 3.902 N/A CYS 917.A SG PRO 977.A O no hydrogen 4.025 N/A CYS 917.A SG THR 978.A OG1 no hydrogen 2.525 N/A LEU 919.A N ILE 915.A O no hydrogen 2.881 N/A SER 920.A N GLU 916.A O no hydrogen 2.816 N/A SER 920.A OG GLU 916.A O no hydrogen 2.551 N/A LYS 921.A N CYS 917.A O no hydrogen 3.043 N/A LYS 921.A NZ GLY 956.A O no hydrogen 3.151 N/A LYS 921.A NZ GLU 958.A OE1 no hydrogen 3.391 N/A LYS 921.A NZ PHE 975.A O no hydrogen 2.581 N/A VAL 922.A N LEU 918.A O no hydrogen 3.207 N/A ALA 923.A N LEU 919.A O no hydrogen 2.879 N/A ALA 924.A N SER 920.A O no hydrogen 3.177 N/A LEU 925.A N LYS 921.A O no hydrogen 3.446 N/A SER 926.A N VAL 922.A O no hydrogen 2.769 N/A SER 926.A OG VAL 922.A O no hydrogen 2.630 N/A SER 926.A OG ALA 923.A O no hydrogen 3.156 N/A SER 926.A OG ASN 928.A OD1 no hydrogen 3.362 N/A GLY 927.A N ALA 923.A O no hydrogen 2.788 N/A ASN 928.A N SER 926.A OG no hydrogen 3.328 N/A ALA 932.A N THR 703.A O no hydrogen 3.187 N/A SER 933.A N ASP 931.A OD1 no hydrogen 2.995 N/A SER 933.A OG ASP 931.A OD1 no hydrogen 2.481 N/A PHE 935.A N ASP 658.A OD2 no hydrogen 2.949 N/A THR 936.A OG1 SER 933.A O no hydrogen 2.876 N/A GLY 942.A N THR 939.A OG1 no hydrogen 2.845 N/A ILE 943.A N THR 939.A O no hydrogen 3.093 N/A SER 944.A N VAL 940.A O no hydrogen 2.805 N/A SER 944.A OG VAL 940.A O no hydrogen 3.191 N/A SER 944.A OG SER 954.A O no hydrogen 2.481 N/A LYS 945.A N GLU 941.A O no hydrogen 2.912 N/A LEU 946.A N GLY 942.A O no hydrogen 3.364 N/A LEU 947.A N ILE 943.A O no hydrogen 2.854 N/A ARG 948.A N SER 944.A O no hydrogen 3.024 N/A ARG 948.A NE ARG 948.A O no hydrogen 2.848 N/A GLU 949.A N LYS 945.A O no hydrogen 3.258 N/A HIS 950.A N LEU 946.A O no hydrogen 3.272 N/A HIS 950.A N LEU 947.A O no hydrogen 3.012 N/A GLY 951.A N ARG 948.A O no hydrogen 3.350 N/A ARG 955.A N GLN 953.A OE1 no hydrogen 2.731 N/A ARG 955.A NH2 SER 954.A OG no hydrogen 3.139 N/A GLY 956.A N GLN 953.A O no hydrogen 3.135 N/A PHE 957.A N GLN 953.A OE1 no hydrogen 2.937 N/A GLU 958.A N ILE 973.A O no hydrogen 2.868 N/A TYR 961.A N PHE 889.A O no hydrogen 2.753 N/A ASN 962.A N LYS 967.A O no hydrogen 3.076 N/A GLY 963.A N TYR 728.A OH no hydrogen 2.747 N/A HIS 964.A N ASN 962.A OD1 no hydrogen 3.210 N/A GLY 966.A N ASN 962.A O no hydrogen 2.860 N/A LEU 969.A N MET 960.A O no hydrogen 2.882 N/A ILE 973.A N GLU 958.A O no hydrogen 3.040 N/A PHE 975.A N GLY 956.A O no hydrogen 3.181 N/A GLY 976.A N VAL 723.A O no hydrogen 3.248 N/A THR 978.A N ALA 721.A O no hydrogen 2.818 N/A TYR 979.A N GLU 916.A OE1 no hydrogen 3.271 N/A TYR 979.A OH GLN 698.A O no hydrogen 3.288 N/A TYR 979.A OH GLY 718.A O no hydrogen 2.842 N/A TYR 980.A N GLN 719.A O no hydrogen 3.098 N/A TYR 980.A OH HIS 913.A NE2 no hydrogen 3.332 N/A GLN 981.A N ALA 869.A O no hydrogen 2.729 N/A ARG 982.A NH2 ILE 861.A O no hydrogen 3.560 N/A LEU 983.A N LYS 867.A O no hydrogen 2.951 N/A VAL 987.A N ASP 866.A OD1 no hydrogen 3.230 N/A LYS 990.A N VAL 987.A O no hydrogen 2.653 N/A LYS 990.A NZ HIS 985.A ND1 no hydrogen 2.997 N/A ILE 991.A N VAL 987.A O no hydrogen 2.887 N/A ARG 994.A NH1 PRO 998.A O no hydrogen 2.735 N/A ARG 994.A NH1 ASP 1013.A O no hydrogen 3.299 N/A ARG 994.A NH2 PRO 998.A O no hydrogen 2.590 N/A GLN 1000.A N GLN 1005.A O no hydrogen 2.675 N/A THR 1003.A OG1 GLN 1000.A OE1 no hydrogen 3.281 N/A GLN 1005.A N THR 1003.A OG1 no hydrogen 2.897 N/A ARG 1010.A NH2 THR 832.A OG1 no hydrogen 3.197 N/A ASP 1013.A N ARG 1010.A O no hydrogen 2.808 N/A GLY 1014.A N GLY 1009.A O no hydrogen 2.788 N/A GLY 1015.A N VAL 1007.A O no hydrogen 3.119 N/A ARG 1023.A N GLY 1019.A O no hydrogen 2.754 N/A ARG 1023.A NE ASP 1024.A OD1 no hydrogen 2.919 N/A ARG 1023.A NH2 ASP 1024.A OD1 no hydrogen 2.304 N/A ASP 1024.A N GLU 1020.A O no hydrogen 2.867 N/A CYS 1025.A SG MET 1021.A O no hydrogen 3.060 N/A MET 1026.A N GLU 1022.A O no hydrogen 3.123 N/A ILE 1027.A N ARG 1023.A O no hydrogen 3.131 N/A ALA 1028.A N ASP 1024.A O no hydrogen 2.908 N/A HIS 1029.A N CYS 1025.A O no hydrogen 3.118 N/A GLY 1030.A N MET 1026.A O no hydrogen 3.046 N/A GLY 1030.A N ILE 1027.A O no hydrogen 3.035 N/A ALA 1031.A N MET 1026.A O no hydrogen 3.282 N/A LEU 1035.A N ALA 1031.A O no hydrogen 3.071 N/A LYS 1036.A N ALA 1032.A O no hydrogen 3.041 N/A GLU 1037.A N SER 1033.A O no hydrogen 2.747 N/A ARG 1038.A N PHE 1034.A O no hydrogen 2.827 N/A LEU 1039.A N LEU 1035.A O no hydrogen 3.275 N/A LEU 1039.A N LYS 1036.A O no hydrogen 3.028 N/A MET 1040.A N LYS 1036.A O no hydrogen 2.578 N/A ALA 1042.A N GLU 1037.A O no hydrogen 2.932 N/A SER 1043.A OG ASP 1044.A OD2 no hydrogen 2.982 N/A VAL 1048.A N ILE 1082.A O no hydrogen 3.122 N/A ILE 1050.A N TYR 1080.A O no hydrogen 2.972 N/A CYS 1051.A N LEU 1056.A O no hydrogen 3.451 N/A GLY 1052.A N ASP 1078.A O no hydrogen 2.661 N/A LEU 1056.A N CYS 1054.A O no hydrogen 2.733 N/A ILE 1060.A N GLU 1069.A O no hydrogen 2.754 N/A ASN 1066.A ND2 ASN 1066.A O no hydrogen 2.444 N/A GLN 1067.A N LYS 1062.A O no hydrogen 3.291 N/A CYS 1070.A N ASN 1075.A O no hydrogen 2.994 N/A CYS 1070.A SG THR 1058.A O no hydrogen 4.008 N/A CYS 1070.A SG LYS 1071.A O no hydrogen 3.467 N/A CYS 1073.A N CYS 1070.A O no hydrogen 3.203 N/A ASN 1075.A N CYS 1070.A O no hydrogen 3.443 N/A ASN 1075.A ND2 ASP 1078.A O no hydrogen 2.751 N/A ILE 1077.A N ASN 1075.A OD1 no hydrogen 2.854 N/A ASP 1078.A N ASN 1075.A OD1 no hydrogen 2.605 N/A TYR 1080.A N ILE 1050.A O no hydrogen 3.160 N/A TYR 1080.A OH ASP 1078.A OD2 no hydrogen 3.126 N/A ILE 1082.A N VAL 1048.A O no hydrogen 2.963 N/A TYR 1086.A N ASP 1044.A O no hydrogen 2.629 N/A ALA 1087.A N ASP 1044.A OD1 no hydrogen 3.464 N/A ALA 1088.A N PRO 1085.A O no hydrogen 3.008 N/A LYS 1089.A N PRO 1085.A O no hydrogen 3.199 N/A LYS 1089.A NZ TYR 1086.A OH no hydrogen 2.660 N/A LYS 1089.A NZ GLN 1093.A OE1 no hydrogen 3.131 N/A LEU 1090.A N TYR 1086.A O no hydrogen 2.600 N/A LEU 1091.A N ALA 1087.A O no hydrogen 2.724 N/A PHE 1092.A N ALA 1088.A O no hydrogen 2.931 N/A GLN 1093.A N LYS 1089.A O no hydrogen 3.145 N/A GLU 1094.A N LEU 1090.A O no hydrogen 3.079 N/A LEU 1095.A N LEU 1091.A O no hydrogen 2.945 N/A MET 1096.A N PHE 1092.A O no hydrogen 2.905 N/A ALA 1097.A N GLN 1093.A O no hydrogen 2.917 N/A MET 1098.A N GLU 1094.A O no hydrogen 2.829 N/A ASN 1099.A N MET 1096.A O no hydrogen 3.419 N/A ASN 1099.A ND2 ASN 1099.A O no hydrogen 2.661 N/A ILE 1100.A N LEU 1095.A O no hydrogen 2.714 N/A THR 1101.A OG1 THR 1101.A O no hydrogen 2.615 N/A ARG 1103.A N THR 1101.A O no hydrogen 2.718 N/A LEU 1104.A N GLY 1055.A O no hydrogen 2.666 N/A TYR 1105.A OH ILE 1053.A O no hydrogen 2.378 N/A