Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 2mys_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ASP 1.A N ASP 1.A OD1 no hydrogen 2.690 N/A ALA 10.A N PHE 7.A O no hydrogen 3.220 N/A TYR 13.A N ALA 10.A O no hydrogen 2.568 N/A LEU 14.A N ALA 11.A O no hydrogen 2.869 N/A ARG 15.A N ALA 11.A O no hydrogen 2.664 N/A ARG 15.A NE GLU 77.A OE2 no hydrogen 2.896 N/A ARG 15.A NH2 GLU 77.A OE1 no hydrogen 3.512 N/A ARG 15.A NH2 GLU 77.A OE2 no hydrogen 3.485 N/A SER 16.A N GLU 19.A OE1 no hydrogen 2.804 N/A GLU 17.A N ASP 1.A OD1 no hydrogen 3.052 N/A LYS 18.A N SER 16.A OG no hydrogen 3.242 N/A LYS 18.A NZ GLU 22.A OE2 no hydrogen 2.985 N/A GLU 19.A N SER 16.A OG no hydrogen 3.319 N/A ARG 20.A N SER 16.A O no hydrogen 3.008 N/A GLU 22.A N LYS 18.A O no hydrogen 2.295 N/A ALA 23.A N ARG 20.A O no hydrogen 2.536 N/A GLN 24.A N ARG 20.A O no hydrogen 2.809 N/A ASN 25.A N ILE 21.A O no hydrogen 3.198 N/A ASN 25.A ND2 ILE 21.A O no hydrogen 3.007 N/A SER 30.A OG ASP 28.A O no hydrogen 3.414 N/A SER 31.A N ASP 28.A O no hydrogen 2.822 N/A SER 31.A OG ASP 28.A O no hydrogen 2.442 N/A VAL 32.A N GLY 43.A O no hydrogen 2.907 N/A PHE 33.A N PHE 68.A O no hydrogen 2.497 N/A VAL 34.A N VAL 42.A O no hydrogen 2.874 N/A VAL 35.A N GLN 66.A O no hydrogen 2.864 N/A LYS 38.A N HIS 36.A ND1 no hydrogen 2.854 N/A GLN 39.A N HIS 36.A ND1 no hydrogen 3.123 N/A VAL 42.A N VAL 34.A O no hydrogen 2.963 N/A ILE 45.A N SER 30.A O no hydrogen 2.769 N/A GLN 46.A N THR 52.A O no hydrogen 2.985 N/A SER 47.A OG THR 52.A OG1 no hydrogen 2.380 N/A THR 52.A OG1 SER 47.A OG no hydrogen 2.380 N/A VAL 53.A N LEU 60.A O no hydrogen 2.846 N/A THR 54.A OG1 GLU 58.A O no hydrogen 2.623 N/A LEU 60.A N VAL 53.A O no hydrogen 3.134 N/A VAL 62.A N VAL 51.A O no hydrogen 2.512 N/A PHE 68.A N PHE 33.A O no hydrogen 2.921 N/A ASN 71.A ND2 HIS 84.A O no hydrogen 3.607 N/A MET 79.A N TYR 105.A O no hydrogen 3.013 N/A ALA 80.A N ASP 78.A OD1 no hydrogen 2.814 N/A MET 81.A N ASP 78.A O no hydrogen 2.753 N/A MET 82.A N MET 79.A O no hydrogen 2.938 N/A THR 83.A OG1 THR 83.A O no hydrogen 2.625 N/A VAL 90.A N GLU 87.A O no hydrogen 3.176 N/A LEU 91.A N GLU 87.A O no hydrogen 3.299 N/A TYR 92.A N PRO 88.A O no hydrogen 2.764 N/A TYR 92.A OH PHE 41.A O no hydrogen 2.508 N/A ASN 93.A N ALA 89.A O no hydrogen 3.102 N/A ASN 93.A ND2 ILE 76.A O no hydrogen 3.102 N/A LEU 94.A N VAL 90.A O no hydrogen 3.334 N/A ARG 96.A N ASN 93.A O no hydrogen 3.294 N/A TYR 97.A OH ASN 114.A O no hydrogen 2.901 N/A TRP 100.A N TYR 97.A O no hydrogen 2.417 N/A MET 101.A N ARG 96.A O no hydrogen 2.368 N/A TYR 105.A N GLU 77.A O no hydrogen 2.581 N/A SER 106.A N PHE 109.A O no hydrogen 3.368 N/A GLY 107.A N ASP 78.A OD1 no hydrogen 3.289 N/A CYS 110.A SG VAL 111.A O no hydrogen 3.830 N/A THR 112.A N ARG 599.A O no hydrogen 2.995 N/A VAL 113.A N ILE 102.A O no hydrogen 3.148 N/A ASN 114.A N ILE 601.A O no hydrogen 3.055 N/A TYR 121.A OH TYR 103.A OH no hydrogen 2.693 N/A VAL 125.A N ASN 122.A O no hydrogen 3.265 N/A TYR 128.A N VAL 124.A O no hydrogen 2.859 N/A TYR 128.A OH PRO 137.A O no hydrogen 2.438 N/A ARG 129.A N LEU 126.A O no hydrogen 2.789 N/A ARG 129.A NH1 ASP 145.A OD2 no hydrogen 3.212 N/A GLY 130.A N ASP 145.A OD1 no hydrogen 3.295 N/A LYS 131.A NZ ALA 127.A O no hydrogen 3.472 N/A LYS 132.A N GLU 135.A OE1 no hydrogen 3.135 N/A ARG 133.A NH1 GLY 107.A O no hydrogen 3.215 N/A ARG 133.A NH2 GLY 107.A O no hydrogen 3.125 N/A GLU 135.A N LYS 132.A O no hydrogen 2.902 N/A SER 142.A N HIS 139.A O no hydrogen 2.588 N/A SER 142.A OG TYR 105.A OH no hydrogen 3.321 N/A SER 144.A N ILE 140.A O no hydrogen 2.948 N/A SER 144.A OG PHE 141.A O no hydrogen 3.492 N/A ASP 145.A N PHE 141.A O no hydrogen 2.727 N/A ASP 145.A N SER 142.A O no hydrogen 3.268 N/A ASN 146.A N SER 142.A O no hydrogen 3.007 N/A ASN 146.A ND2 LYS 131.A O no hydrogen 3.156 N/A ASN 146.A ND2 SER 142.A O no hydrogen 2.675 N/A ALA 147.A N ILE 143.A O no hydrogen 2.937 N/A TYR 148.A OH GLY 229.A O no hydrogen 2.388 N/A GLN 149.A N ASP 145.A O no hydrogen 2.794 N/A PHE 150.A N ASN 146.A O no hydrogen 2.758 N/A MET 151.A N ALA 147.A O no hydrogen 2.575 N/A LEU 152.A N TYR 148.A O no hydrogen 3.016 N/A THR 153.A N GLN 149.A O no hydrogen 2.788 N/A THR 153.A OG1 GLN 149.A O no hydrogen 3.422 N/A ASP 154.A N PHE 150.A O no hydrogen 2.941 N/A ARG 155.A N MET 151.A O no hydrogen 2.982 N/A ASN 157.A ND2 SER 592.A O no hydrogen 3.177 N/A GLN 158.A N PHE 418.A O no hydrogen 3.170 N/A SER 159.A N HIS 594.A O no hydrogen 3.196 N/A ILE 160.A N GLY 420.A O no hydrogen 2.711 N/A LEU 161.A N HIS 596.A O no hydrogen 2.709 N/A ILE 162.A N LEU 422.A O no hydrogen 2.889 N/A THR 163.A N VAL 598.A O no hydrogen 3.270 N/A THR 163.A OG1 ILE 162.A O no hydrogen 3.149 N/A THR 163.A OG1 ILE 424.A O no hydrogen 3.531 N/A SER 166.A OG SER 215.A OG no hydrogen 3.055 N/A ALA 168.A N GLU 165.A O no hydrogen 2.677 N/A THR 174.A N LYS 170.A O no hydrogen 2.657 N/A THR 174.A OG1 LYS 170.A O no hydrogen 2.484 N/A THR 174.A OG1 THR 171.A O no hydrogen 3.481 N/A THR 174.A OG1 ASP 423.A OD2 no hydrogen 3.101 N/A VAL 176.A N ASN 173.A O no hydrogen 2.600 N/A ILE 177.A N THR 174.A O no hydrogen 2.905 N/A TYR 179.A N ARG 175.A O no hydrogen 3.328 N/A TYR 179.A OH VAL 125.A O no hydrogen 3.353 N/A TYR 179.A OH ASP 145.A OD2 no hydrogen 2.358 N/A PHE 180.A N VAL 176.A O no hydrogen 3.070 N/A ALA 181.A N ILE 177.A O no hydrogen 2.988 N/A THR 182.A N GLN 178.A O no hydrogen 2.761 N/A THR 182.A OG1 GLN 178.A O no hydrogen 2.525 N/A THR 182.A OG1 TYR 179.A O no hydrogen 2.962 N/A ILE 183.A N TYR 179.A O no hydrogen 3.097 N/A ALA 184.A N ALA 181.A O no hydrogen 3.501 N/A SER 186.A OG GLU 188.A OE2 no hydrogen 3.497 N/A THR 190.A N ASP 193.A OD2 no hydrogen 3.272 N/A THR 190.A OG1 ASP 193.A OD2 no hydrogen 3.289 N/A ASP 193.A N THR 190.A O no hydrogen 2.884 N/A GLN 194.A N THR 190.A O no hydrogen 3.049 N/A ILE 195.A N LEU 191.A O no hydrogen 2.535 N/A SER 197.A N ASP 193.A O no hydrogen 2.298 N/A SER 197.A OG ASP 193.A O no hydrogen 3.289 N/A ALA 198.A N GLN 194.A O no hydrogen 2.774 N/A ASN 199.A N ILE 196.A O no hydrogen 2.932 N/A LEU 201.A N ALA 198.A O no hydrogen 3.040 N/A LEU 202.A N ALA 198.A O no hydrogen 3.383 N/A GLU 203.A N ASN 199.A O no hydrogen 2.812 N/A ALA 204.A N LEU 201.A O no hydrogen 2.809 N/A PHE 205.A N LEU 201.A O no hydrogen 3.254 N/A PHE 205.A N LEU 202.A O no hydrogen 3.080 N/A GLY 206.A N LEU 202.A O no hydrogen 2.390 N/A ASN 207.A ND2 ASN 214.A O no hydrogen 3.157 N/A ALA 208.A N SER 215.A O no hydrogen 3.207 N/A VAL 210.A N GLU 252.A OE2 no hydrogen 3.073 N/A ARG 211.A NH1 GLU 165.A OE1 no hydrogen 2.629 N/A ARG 211.A NH2 GLU 165.A OE1 no hydrogen 2.910 N/A ARG 211.A NH2 GLU 605.A OE2 no hydrogen 3.412 N/A ASP 213.A N ASN 212.A OD1 no hydrogen 2.518 N/A ASN 214.A N ASN 212.A OD1 no hydrogen 3.413 N/A ASN 214.A ND2 GLU 203.A OE1 no hydrogen 2.645 N/A SER 215.A N ALA 208.A O no hydrogen 2.922 N/A SER 215.A OG SER 166.A O no hydrogen 3.419 N/A SER 215.A OG SER 166.A OG no hydrogen 3.055 N/A ARG 217.A N GLY 206.A O no hydrogen 2.940 N/A ARG 217.A NH1 GLU 242.A OE1 no hydrogen 2.562 N/A ARG 217.A NH2 SER 166.A OG no hydrogen 3.108 N/A GLY 219.A N TYR 239.A O no hydrogen 2.985 N/A ILE 221.A N VAL 421.A O no hydrogen 3.158 N/A ARG 222.A N ASP 235.A O no hydrogen 3.009 N/A ARG 222.A NH1 ASP 235.A OD2 no hydrogen 3.245 N/A ILE 223.A N ILE 419.A O no hydrogen 3.089 N/A HIS 224.A N SER 233.A O no hydrogen 2.434 N/A PHE 225.A N TYR 417.A O no hydrogen 2.674 N/A GLY 226.A N LYS 230.A O no hydrogen 2.824 N/A LYS 230.A N THR 228.A OG1 no hydrogen 2.971 N/A LEU 231.A N ALA 184.A O no hydrogen 3.085 N/A ALA 232.A N HIS 224.A O no hydrogen 2.918 N/A SER 233.A N HIS 224.A O no hydrogen 2.946 N/A SER 233.A OG ALA 232.A O no hydrogen 2.555 N/A SER 233.A OG THR 411.A OG1 no hydrogen 3.254 N/A ALA 234.A N LEU 409.A O no hydrogen 3.530 N/A ILE 236.A N ASN 406.A OD1 no hydrogen 2.614 N/A TYR 239.A N GLY 219.A O no hydrogen 3.313 N/A TYR 239.A OH GLU 237.A OE2 no hydrogen 3.087 N/A GLU 242.A N ARG 217.A O no hydrogen 3.112 N/A ARG 244.A N GLU 242.A O no hydrogen 3.252 N/A ARG 244.A NE ARG 253.A O no hydrogen 3.020 N/A ARG 244.A NH1 GLU 242.A OE1 no hydrogen 2.528 N/A THR 246.A N SER 243.A O no hydrogen 2.942 N/A PHE 247.A N SER 243.A O no hydrogen 2.695 N/A PHE 247.A N ARG 244.A O no hydrogen 3.117 N/A GLN 248.A NE2 TYR 282.A O no hydrogen 3.141 N/A GLU 252.A N LEU 249.A O no hydrogen 3.052 N/A ARG 253.A NH2 HIS 256.A ND1 no hydrogen 3.506 N/A ARG 253.A NH2 ASP 295.A OD1 no hydrogen 3.216 N/A SER 254.A N TYR 259.A OH no hydrogen 3.349 N/A SER 254.A OG ARG 244.A O no hydrogen 3.183 N/A TYR 255.A N SER 254.A OG no hydrogen 2.617 N/A TYR 255.A OH GLU 242.A O no hydrogen 2.522 N/A HIS 256.A N ASN 207.A O no hydrogen 3.216 N/A HIS 256.A NE2 ASN 214.A OD1 no hydrogen 2.488 N/A ILE 257.A N ALA 204.A O no hydrogen 2.717 N/A TYR 259.A OH VAL 283.A O no hydrogen 2.270 N/A GLN 260.A N HIS 256.A O no hydrogen 2.746 N/A ILE 261.A N ILE 257.A O no hydrogen 2.793 N/A MET 262.A N PHE 258.A O no hydrogen 3.216 N/A SER 263.A N GLN 260.A O no hydrogen 2.798 N/A SER 263.A OG GLN 260.A O no hydrogen 2.623 N/A ASN 264.A ND2 ASN 264.A O no hydrogen 2.941 N/A ILE 268.A N PRO 265.A O no hydrogen 2.966 N/A MET 270.A N GLU 266.A O no hydrogen 2.566 N/A LEU 271.A N LEU 267.A O no hydrogen 2.777 N/A ILE 273.A N ILE 268.A O no hydrogen 2.832 N/A THR 274.A N TYR 280.A OH no hydrogen 2.675 N/A THR 274.A OG1 ASP 279.A OD2 no hydrogen 2.497 N/A THR 274.A OG1 TYR 280.A OH no hydrogen 3.080 N/A TYR 278.A N ASN 276.A OD1 no hydrogen 2.846 N/A ASP 279.A N ASN 276.A O no hydrogen 3.199 N/A TYR 280.A N PRO 277.A O no hydrogen 2.935 N/A TYR 280.A OH THR 274.A OG1 no hydrogen 3.080 N/A VAL 283.A N TYR 280.A O no hydrogen 2.845 N/A SER 284.A N HIS 281.A O no hydrogen 3.387 N/A SER 284.A OG PRO 277.A O no hydrogen 3.495 N/A GLU 285.A N GLN 248.A OE1 no hydrogen 2.476 N/A GLU 287.A N GLU 252.A O no hydrogen 2.636 N/A SER 292.A OG ASP 213.A OD2 no hydrogen 3.042 N/A ILE 293.A N VAL 290.A O no hydrogen 3.045 N/A GLU 297.A N ASP 294.A O no hydrogen 2.896 N/A GLU 298.A N ASP 294.A O no hydrogen 3.195 N/A LEU 299.A N ASP 295.A O no hydrogen 3.062 N/A ALA 301.A N GLU 297.A O no hydrogen 2.970 N/A THR 302.A N GLU 298.A O no hydrogen 2.601 N/A THR 302.A OG1 GLU 298.A O no hydrogen 2.818 N/A ASP 303.A N LEU 299.A O no hydrogen 2.763 N/A SER 304.A N MET 300.A O no hydrogen 2.655 N/A SER 304.A OG MET 300.A O no hydrogen 2.273 N/A ALA 305.A N ALA 301.A O no hydrogen 2.833 N/A ILE 306.A N THR 302.A O no hydrogen 3.036 N/A ASP 307.A N ASP 303.A O no hydrogen 3.390 N/A ILE 308.A N SER 304.A O no hydrogen 3.092 N/A LEU 309.A N ALA 305.A O no hydrogen 2.689 N/A GLY 310.A N ASP 307.A O no hydrogen 2.524 N/A PHE 311.A N ILE 306.A O no hydrogen 3.361 N/A SER 312.A N GLU 315.A OE1 no hydrogen 2.947 N/A THR 316.A OG1 ALA 313.A O no hydrogen 2.574 N/A ALA 317.A N ASP 314.A O no hydrogen 2.456 N/A ILE 318.A N GLU 315.A O no hydrogen 2.836 N/A TYR 319.A OH ASP 303.A OD2 no hydrogen 2.735 N/A THR 321.A N ILE 318.A O no hydrogen 3.007 N/A THR 321.A N TYR 319.A O no hydrogen 2.647 N/A THR 321.A OG1 ILE 318.A O no hydrogen 2.642 N/A GLY 322.A N TYR 319.A O no hydrogen 3.280 N/A HIS 326.A N GLY 322.A O no hydrogen 3.029 N/A HIS 326.A NE2 LEU 272.A O no hydrogen 3.114 N/A TYR 327.A N ALA 323.A O no hydrogen 2.771 N/A TYR 327.A OH TYR 560.A OH no hydrogen 2.955 N/A ASN 329.A N HIS 326.A O no hydrogen 2.705 N/A ASN 329.A ND2 ASP 279.A O no hydrogen 2.646 N/A LEU 330.A N TYR 327.A O no hydrogen 2.707 N/A GLN 333.A NE2 GLU 336.A O no hydrogen 2.617 N/A ALA 339.A N GLU 379.A O no hydrogen 3.120 N/A ASP 342.A N LYS 331.A O no hydrogen 3.156 N/A ALA 350.A N ALA 347.A O no hydrogen 2.573 N/A TYR 351.A N ASP 348.A O no hydrogen 2.989 N/A MET 353.A N ALA 349.A O no hydrogen 3.086 N/A GLY 354.A N TYR 351.A O no hydrogen 3.073 N/A LEU 355.A N ALA 350.A O no hydrogen 2.621 N/A SER 357.A OG ASP 348.A OD1 no hydrogen 2.285 N/A ALA 358.A N ASN 356.A OD1 no hydrogen 3.014 N/A LEU 360.A N ASN 356.A O no hydrogen 2.956 N/A LEU 361.A N SER 357.A O no hydrogen 2.992 N/A LYS 362.A N ALA 358.A O no hydrogen 2.895 N/A ALA 363.A N GLU 359.A O no hydrogen 3.150 N/A LEU 364.A N LEU 360.A O no hydrogen 3.057 N/A CYS 365.A N LEU 361.A O no hydrogen 3.108 N/A CYS 365.A SG ALA 339.A O no hydrogen 3.569 N/A TYR 366.A N LYS 362.A O no hydrogen 2.419 N/A ARG 368.A N THR 555.A OG1 no hydrogen 3.118 N/A VAL 369.A N VAL 376.A O no hydrogen 3.068 N/A GLU 379.A N CYS 365.A O no hydrogen 3.356 N/A THR 380.A N GLU 383.A OE1 no hydrogen 2.891 N/A THR 380.A OG1 GLU 383.A OE1 no hydrogen 3.152 N/A GLU 383.A N THR 380.A O no hydrogen 2.958 N/A VAL 384.A N THR 380.A O no hydrogen 3.003 N/A VAL 384.A N VAL 381.A O no hydrogen 2.921 N/A HIS 385.A N VAL 381.A O no hydrogen 3.163 N/A SER 387.A N GLU 383.A O no hydrogen 2.880 N/A SER 387.A OG GLU 383.A O no hydrogen 3.451 N/A SER 387.A OG VAL 384.A O no hydrogen 3.154 N/A VAL 388.A N VAL 384.A O no hydrogen 2.821 N/A GLY 389.A N HIS 385.A O no hydrogen 3.268 N/A ALA 390.A N ASN 386.A O no hydrogen 2.958 N/A LEU 391.A N SER 387.A O no hydrogen 2.899 N/A ALA 392.A N VAL 388.A O no hydrogen 2.892 N/A VAL 394.A N LEU 391.A O no hydrogen 2.560 N/A TYR 395.A N ALA 392.A O no hydrogen 3.081 N/A TYR 395.A OH PHE 205.A O no hydrogen 2.775 N/A PHE 398.A N TYR 395.A O no hydrogen 2.896 N/A LEU 399.A N GLU 396.A O no hydrogen 2.833 N/A MET 401.A N MET 397.A O no hydrogen 2.786 N/A VAL 402.A N PHE 398.A O no hydrogen 3.211 N/A ILE 403.A N LEU 399.A O no hydrogen 3.014 N/A ARG 404.A N TRP 400.A O no hydrogen 2.717 N/A ARG 404.A NE GLU 315.A OE1 no hydrogen 3.561 N/A ARG 404.A NE GLU 315.A OE2 no hydrogen 3.411 N/A ARG 404.A NH2 GLY 310.A O no hydrogen 3.316 N/A ARG 404.A NH2 GLU 315.A OE1 no hydrogen 3.488 N/A ILE 405.A N MET 401.A O no hydrogen 2.811 N/A ASN 406.A N VAL 402.A O no hydrogen 2.880 N/A ASN 406.A ND2 ILE 236.A O no hydrogen 3.017 N/A GLN 407.A N ILE 403.A O no hydrogen 2.831 N/A GLN 407.A NE2 ILE 403.A O no hydrogen 3.626 N/A GLN 408.A N ARG 404.A O no hydrogen 3.213 N/A GLN 408.A N ILE 405.A O no hydrogen 2.730 N/A GLN 408.A NE2 LEU 309.A O no hydrogen 2.608 N/A LEU 409.A N ILE 405.A O no hydrogen 2.967 N/A ASP 410.A N GLN 407.A O no hydrogen 3.375 N/A THR 411.A OG1 ALA 232.A O no hydrogen 2.398 N/A THR 411.A OG1 SER 233.A OG no hydrogen 3.254 N/A GLN 416.A N PHE 225.A O no hydrogen 3.351 N/A PHE 418.A N ASN 157.A OD1 no hydrogen 3.001 N/A ILE 419.A N ILE 223.A O no hydrogen 2.721 N/A GLY 420.A N GLN 158.A O no hydrogen 2.964 N/A VAL 421.A N ILE 221.A O no hydrogen 3.064 N/A LEU 422.A N ILE 160.A O no hydrogen 3.007 N/A PHE 430.A N ASN 433.A OD1 no hydrogen 2.955 N/A ASN 433.A ND2 PHE 430.A O no hydrogen 2.399 N/A ASN 433.A ND2 ASP 540.A O no hydrogen 2.883 N/A SER 434.A N GLN 437.A OE1 no hydrogen 2.563 N/A SER 434.A OG ASN 542.A O no hydrogen 3.216 N/A GLN 437.A N SER 434.A O no hydrogen 2.734 N/A LEU 438.A N SER 434.A O no hydrogen 3.274 N/A CYS 439.A N PHE 435.A O no hydrogen 3.165 N/A CYS 439.A SG PHE 435.A O no hydrogen 3.523 N/A ILE 440.A N GLU 436.A O no hydrogen 3.060 N/A ASN 441.A N GLN 437.A O no hydrogen 2.702 N/A PHE 442.A N LEU 438.A O no hydrogen 2.721 N/A THR 443.A N CYS 439.A O no hydrogen 3.071 N/A THR 443.A OG1 CYS 439.A O no hydrogen 2.529 N/A ASN 444.A N ILE 440.A O no hydrogen 2.902 N/A ASN 444.A ND2 ALA 425.A O no hydrogen 2.542 N/A ASN 444.A ND2 ILE 440.A O no hydrogen 3.687 N/A GLU 445.A N ASN 441.A O no hydrogen 2.700 N/A GLN 447.A N ASN 444.A O no hydrogen 2.891 N/A GLN 447.A NE2 ASN 451.A OD1 no hydrogen 2.719 N/A GLN 448.A N GLU 445.A O no hydrogen 3.491 N/A GLN 448.A NE2 GLY 473.A O no hydrogen 3.232 N/A PHE 450.A N LEU 446.A O no hydrogen 3.057 N/A PHE 450.A N GLN 447.A O no hydrogen 2.878 N/A ASN 451.A N GLN 447.A O no hydrogen 2.902 N/A ASN 451.A ND2 PHE 472.A O no hydrogen 3.388 N/A HIS 452.A N GLN 448.A O no hydrogen 3.134 N/A HIS 453.A N PHE 449.A O no hydrogen 3.415 N/A MET 454.A N PHE 450.A O no hydrogen 2.821 N/A PHE 455.A N ASN 451.A O no hydrogen 3.289 N/A VAL 456.A N HIS 452.A O no hydrogen 2.694 N/A LEU 457.A N HIS 453.A O no hydrogen 2.910 N/A GLU 458.A N MET 454.A O no hydrogen 2.703 N/A GLN 459.A N PHE 455.A O no hydrogen 3.342 N/A GLU 460.A N LEU 457.A O no hydrogen 3.002 N/A GLU 461.A N GLU 458.A O no hydrogen 2.770 N/A TYR 462.A N GLU 458.A O no hydrogen 3.380 N/A GLY 464.A N TYR 462.A O no hydrogen 3.133 N/A GLY 473.A N ASP 471.A OD1 no hydrogen 2.492 N/A LEU 476.A N GLY 473.A O no hydrogen 2.529 N/A ALA 477.A N MET 474.A O no hydrogen 3.233 N/A ILE 480.A N LEU 476.A O no hydrogen 3.227 N/A GLU 481.A N ALA 477.A O no hydrogen 2.936 N/A LEU 482.A N ALA 478.A O no hydrogen 3.393 N/A ILE 483.A N CYS 479.A O no hydrogen 3.381 N/A ILE 483.A N ILE 480.A O no hydrogen 2.894 N/A GLU 484.A N ILE 480.A O no hydrogen 3.001 N/A ILE 488.A N LEU 482.A O no hydrogen 3.118 N/A PHE 489.A N ILE 483.A O no hydrogen 3.396 N/A ILE 491.A N GLY 487.A O no hydrogen 3.189 N/A LEU 492.A N ILE 488.A O no hydrogen 2.738 N/A GLU 493.A N PHE 489.A O no hydrogen 2.492 N/A GLU 495.A N ILE 491.A O no hydrogen 3.363 N/A CYS 496.A SG LEU 492.A O no hydrogen 3.287 N/A CYS 496.A SG LEU 547.A O no hydrogen 3.755 N/A MET 497.A N GLU 494.A O no hydrogen 2.442 N/A PHE 498.A N GLU 495.A O no hydrogen 2.958 N/A ALA 501.A N PHE 498.A O no hydrogen 3.077 N/A SER 505.A OG GLU 495.A OE2 no hydrogen 2.790 N/A SER 505.A OG THR 502.A O no hydrogen 2.868 N/A PHE 506.A N THR 502.A O no hydrogen 2.773 N/A TYR 509.A OH HIS 529.A O no hydrogen 2.915 N/A ASP 510.A N ASN 507.A O no hydrogen 2.868 N/A HIS 512.A N LEU 508.A O no hydrogen 3.055 N/A HIS 512.A NE2 MET 486.A O no hydrogen 2.721 N/A LEU 513.A N TYR 509.A O no hydrogen 2.673 N/A LYS 515.A N HIS 512.A O no hydrogen 3.143 N/A SER 516.A N HIS 512.A O no hydrogen 2.778 N/A ASN 518.A ND2 VAL 533.A O no hydrogen 3.631 N/A GLN 520.A N SER 531.A O no hydrogen 3.246 N/A HIS 529.A N TYR 541.A O no hydrogen 2.703 N/A PHE 530.A N TYR 541.A O no hydrogen 3.019 N/A SER 531.A N GLN 520.A O no hydrogen 3.068 N/A SER 531.A OG GLN 520.A O no hydrogen 3.371 N/A LEU 532.A N VAL 539.A O no hydrogen 2.937 N/A VAL 533.A N ASN 518.A O no hydrogen 3.135 N/A HIS 534.A N GLY 537.A O no hydrogen 2.763 N/A HIS 534.A ND1 GLU 445.A OE1 no hydrogen 2.487 N/A TYR 535.A N GLU 445.A OE2 no hydrogen 2.497 N/A TYR 535.A OH CYS 622.A O no hydrogen 3.202 N/A GLY 537.A N HIS 534.A O no hydrogen 3.011 N/A VAL 539.A N LEU 532.A O no hydrogen 2.959 N/A TYR 541.A N PHE 530.A O no hydrogen 2.624 N/A TYR 541.A OH ASN 441.A OD1 no hydrogen 3.147 N/A TYR 541.A OH HIS 534.A NE2 no hydrogen 2.463 N/A ASN 542.A N ASN 433.A O no hydrogen 2.810 N/A SER 544.A OG ASN 542.A OD1 no hydrogen 3.407 N/A TRP 546.A NE1 SER 434.A OG no hydrogen 2.797 N/A ASN 549.A ND2 SER 577.A OG no hydrogen 2.702 N/A ASN 553.A ND2 ALA 363.A O no hydrogen 2.931 N/A VAL 556.A N ASN 553.A OD1 no hydrogen 2.785 N/A ILE 557.A N ASN 553.A O no hydrogen 3.287 N/A GLY 558.A N GLU 554.A O no hydrogen 3.076 N/A LEU 559.A N THR 555.A O no hydrogen 3.302 N/A TYR 560.A N VAL 556.A O no hydrogen 2.980 N/A TYR 560.A OH TYR 327.A OH no hydrogen 2.955 N/A GLN 561.A N ILE 557.A O no hydrogen 2.791 N/A GLN 561.A NE2 PHE 570.A O no hydrogen 2.838 N/A SER 562.A OG MET 353.A O no hydrogen 2.411 N/A SER 562.A OG GLY 354.A O no hydrogen 3.198 N/A SER 563.A N GLY 354.A O no hydrogen 3.162 N/A SER 563.A OG GLY 354.A O no hydrogen 2.692 N/A VAL 564.A N SER 562.A OG no hydrogen 2.981 N/A ALA 567.A N VAL 564.A O no hydrogen 2.960 N/A LEU 569.A N THR 565.A O no hydrogen 2.987 N/A PHE 570.A N ALA 567.A O no hydrogen 3.348 N/A THR 575.A OG1 ASN 549.A O no hydrogen 3.053 N/A VAL 576.A N ASN 549.A O no hydrogen 3.263 N/A SER 577.A N ASN 549.A OD1 no hydrogen 2.833 N/A SER 577.A OG GLU 493.A OE2 no hydrogen 2.560 N/A SER 577.A OG ASN 549.A OD1 no hydrogen 3.044 N/A LEU 579.A N VAL 576.A O no hydrogen 3.158 N/A PHE 580.A N VAL 576.A O no hydrogen 3.465 N/A ARG 581.A N SER 577.A O no hydrogen 3.294 N/A ASN 583.A N LEU 579.A O no hydrogen 2.618 N/A LEU 584.A N PHE 580.A O no hydrogen 2.713 N/A MET 587.A N LEU 584.A O no hydrogen 3.383 N/A ALA 588.A N ASN 585.A O no hydrogen 3.076 N/A LEU 590.A N LEU 586.A O no hydrogen 2.772 N/A SER 592.A OG ALA 588.A O no hydrogen 3.112 N/A THR 593.A OG1 ASN 589.A O no hydrogen 2.719 N/A HIS 594.A N ASN 157.A O no hydrogen 2.655 N/A HIS 596.A NE2 GLN 158.A OE1 no hydrogen 3.235 N/A VAL 598.A N LEU 161.A O no hydrogen 2.942 N/A ARG 599.A N CYS 110.A O no hydrogen 3.375 N/A ARG 599.A NE ASN 623.A O no hydrogen 3.178 N/A CYS 600.A N THR 163.A O no hydrogen 2.870 N/A ILE 601.A N THR 112.A O no hydrogen 2.492 N/A ASN 604.A ND2 THR 607.A O no hydrogen 3.083 N/A ASN 604.A ND2 ALA 610.A O no hydrogen 2.904 N/A THR 606.A OG1 ASN 604.A OD1 no hydrogen 3.297 N/A THR 606.A OG1 THR 607.A OG1 no hydrogen 2.933 N/A THR 607.A OG1 ASN 604.A OD1 no hydrogen 3.438 N/A THR 607.A OG1 THR 606.A O no hydrogen 3.413 N/A THR 607.A OG1 THR 606.A OG1 no hydrogen 2.933 N/A GLU 612.A N PRO 603.A O no hydrogen 2.769 N/A VAL 616.A N GLU 612.A O no hydrogen 3.344 N/A LEU 617.A N HIS 613.A O no hydrogen 2.792 N/A HIS 618.A N GLU 614.A O no hydrogen 3.059 N/A HIS 618.A ND1 GLU 614.A O no hydrogen 3.170 N/A GLN 619.A NE2 ILE 602.A O no hydrogen 2.721 N/A GLN 619.A NE2 LEU 615.A O no hydrogen 2.938 N/A LEU 620.A N VAL 616.A O no hydrogen 2.947 N/A ARG 621.A N LEU 617.A O no hydrogen 3.305 N/A ARG 621.A N HIS 618.A O no hydrogen 2.791 N/A ARG 621.A NH2 GLU 87.A OE2 no hydrogen 2.304 N/A CYS 622.A N HIS 618.A O no hydrogen 3.206 N/A CYS 622.A SG HIS 618.A O no hydrogen 3.711 N/A LEU 626.A N LEU 620.A O no hydrogen 2.981 N/A GLU 627.A N GLY 624.A O no hydrogen 2.890 N/A GLY 628.A N GLY 624.A O no hydrogen 2.775 N/A GLY 628.A N VAL 625.A O no hydrogen 3.222 N/A ILE 629.A N VAL 625.A O no hydrogen 3.187 N/A ARG 630.A N LEU 626.A O no hydrogen 3.359 N/A ILE 631.A N GLU 627.A O no hydrogen 3.206 N/A CYS 632.A N ILE 629.A O no hydrogen 3.002 N/A CYS 632.A SG GLY 628.A O no hydrogen 3.212 N/A ARG 633.A N ILE 629.A O no hydrogen 2.861 N/A ARG 633.A NH1 LEU 85.A O no hydrogen 2.837 N/A GLY 635.A N CYS 632.A O no hydrogen 3.117 N/A PHE 636.A N TYR 462.A OH no hydrogen 3.069 N/A ARG 639.A NE PHE 636.A O no hydrogen 2.752 N/A ARG 639.A NE PRO 637.A O no hydrogen 2.731 N/A ARG 639.A NH1 GLU 458.A OE1 no hydrogen 3.378 N/A ARG 639.A NH2 GLU 458.A OE2 no hydrogen 3.471 N/A ARG 639.A NH2 PHE 636.A O no hydrogen 2.538 N/A VAL 640.A N VAL 683.A O no hydrogen 3.109 N/A PHE 645.A N TYR 642.A O no hydrogen 2.931 N/A LYS 646.A N TYR 642.A O no hydrogen 2.808 N/A LYS 646.A NZ ASP 658.A O no hydrogen 3.365 N/A GLN 647.A N ALA 643.A O no hydrogen 3.030 N/A TYR 649.A N LYS 646.A O no hydrogen 2.862 N/A ARG 650.A N LYS 646.A O no hydrogen 2.695 N/A LEU 652.A N TYR 649.A O no hydrogen 2.831 N/A ASN 653.A N ARG 650.A O no hydrogen 3.257 N/A ASN 653.A ND2 LEU 652.A O no hydrogen 3.179 N/A ALA 656.A N ASN 653.A O no hydrogen 2.692 N/A LYS 661.A N ASP 658.A OD2 no hydrogen 2.706 N/A ALA 662.A N ASP 658.A O no hydrogen 3.291 N/A SER 663.A OG TYR 642.A O no hydrogen 3.366 N/A SER 663.A OG SER 659.A O no hydrogen 3.529 N/A GLU 664.A N LYS 660.A O no hydrogen 3.249 N/A LYS 665.A N LYS 661.A O no hydrogen 2.772 N/A LEU 666.A N ALA 662.A O no hydrogen 2.556 N/A LEU 667.A N SER 663.A O no hydrogen 3.129 N/A GLY 668.A N LYS 665.A O no hydrogen 2.859 N/A GLY 669.A N LEU 666.A O no hydrogen 3.021 N/A HIS 674.A ND1 VAL 672.A O no hydrogen 2.541 N/A THR 675.A OG1 ASP 673.A OD1 no hydrogen 3.020 N/A ALA 678.A N PHE 684.A O no hydrogen 2.599 N/A VAL 683.A N VAL 640.A O no hydrogen 2.961 N/A PHE 684.A N ALA 678.A O no hydrogen 2.321 N/A PHE 685.A N SER 638.A O no hydrogen 2.935 N/A GLY 687.A N THR 83.A O no hydrogen 2.571 N/A LEU 691.A N GLY 687.A O no hydrogen 3.240 N/A LEU 692.A N LEU 688.A O no hydrogen 2.661 N/A GLU 693.A N LEU 689.A O no hydrogen 3.091 N/A GLU 694.A N GLY 690.A O no hydrogen 3.350 N/A MET 695.A N LEU 691.A O no hydrogen 3.345 N/A ARG 696.A N LEU 692.A O no hydrogen 2.966 N/A ARG 696.A NE ARG 648.A O no hydrogen 2.851 N/A ARG 696.A NH2 ARG 648.A O no hydrogen 3.570 N/A ASP 697.A N GLU 693.A O no hydrogen 2.448 N/A ASP 698.A N GLU 694.A O no hydrogen 2.992 N/A ALA 700.A N ASP 697.A O no hydrogen 3.435 N/A GLU 701.A N ASP 698.A O no hydrogen 3.385 N/A ILE 703.A N LEU 699.A O no hydrogen 2.277 N/A THR 704.A N ALA 700.A O no hydrogen 2.667 N/A THR 704.A OG1 ALA 700.A O no hydrogen 3.163 N/A ALA 705.A N GLU 701.A O no hydrogen 3.162 N/A THR 706.A N ILE 702.A O no hydrogen 3.271 N/A THR 706.A OG1 ILE 702.A O no hydrogen 3.069 N/A GLN 707.A N ILE 703.A O no hydrogen 2.603 N/A GLN 707.A N THR 704.A O no hydrogen 3.241 N/A ALA 708.A N THR 704.A O no hydrogen 3.176 N/A CYS 710.A SG THR 706.A O no hydrogen 2.745 N/A ARG 711.A N GLN 707.A O no hydrogen 2.976 N/A GLY 712.A N ALA 708.A O no hydrogen 2.531 N/A PHE 713.A N ARG 709.A O no hydrogen 2.394 N/A LEU 714.A N CYS 710.A O no hydrogen 2.365 N/A MET 715.A N ARG 711.A O no hydrogen 3.106 N/A MET 715.A N GLY 712.A O no hydrogen 2.747 N/A ARG 716.A N GLY 712.A O no hydrogen 3.061 N/A VAL 717.A N LEU 714.A O no hydrogen 3.354 N/A GLU 718.A N MET 715.A O no hydrogen 2.771 N/A TYR 719.A N MET 715.A O no hydrogen 3.031 N/A ALA 721.A N GLU 718.A O no hydrogen 3.173 N/A MET 722.A N GLU 718.A O no hydrogen 2.821 N/A VAL 723.A N TYR 719.A O no hydrogen 2.927 N/A ARG 725.A N ALA 721.A O no hydrogen 2.987 N/A ARG 726.A N VAL 723.A O no hydrogen 2.951 N/A ILE 729.A N ARG 725.A O no hydrogen 3.103 N/A CYS 731.A N GLU 727.A O no hydrogen 2.891 N/A ILE 732.A N SER 728.A O no hydrogen 3.099 N/A GLN 733.A N ILE 729.A O no hydrogen 2.297 N/A TYR 734.A N PHE 730.A O no hydrogen 2.691 N/A ASN 735.A N CYS 731.A O no hydrogen 3.155 N/A ASN 735.A ND2 CYS 731.A O no hydrogen 3.305 N/A VAL 736.A N ILE 732.A O no hydrogen 3.313 N/A VAL 736.A N GLN 733.A O no hydrogen 3.314 N/A SER 738.A N TYR 734.A O no hydrogen 3.173 N/A MET 740.A N VAL 736.A O no hydrogen 3.096 N/A ASN 741.A N SER 738.A O no hydrogen 2.573 N/A VAL 742.A N SER 738.A O no hydrogen 2.925 N/A TRP 744.A N VAL 742.A O no hydrogen 2.521 N/A MET 747.A N TRP 744.A O no hydrogen 2.500 N/A PHE 749.A N TRP 746.A O no hydrogen 3.107 N/A PHE 750.A N MET 747.A O no hydrogen 2.995 N/A