Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 8fkx_NI.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): MET 20.A N GLY 16.A O no hydrogen 3.347 N/A GLY 21.A N GLN 18.A O no hydrogen 3.170 N/A SER 23.A N GLU 75.A OE1 no hydrogen 3.111 N/A SER 23.A N GLU 75.A OE2 no hydrogen 3.112 N/A SER 23.A OG GLU 75.A OE1 no hydrogen 3.288 N/A PHE 27.A N SER 23.A O no hydrogen 2.879 N/A LYS 28.A N TYR 24.A O no hydrogen 2.881 N/A ILE 30.A N VAL 26.A O no hydrogen 3.374 N/A MET 31.A N PHE 27.A O no hydrogen 3.163 N/A LYS 32.A N LYS 28.A O no hydrogen 2.944 N/A LYS 33.A N GLY 29.A O no hydrogen 2.783 N/A LYS 33.A NZ GLU 107.A OE1 no hydrogen 2.817 N/A GLY 34.A N ILE 30.A O no hydrogen 3.250 N/A GLY 34.A N MET 31.A O no hydrogen 3.138 N/A THR 39.A OG1 SER 63.A O no hydrogen 3.018 N/A GLN 42.A NE2 GLY 64.A O no hydrogen 3.398 N/A ARG 43.A N THR 39.A O no hydrogen 3.134 N/A ARG 43.A NE THR 39.A O no hydrogen 3.473 N/A LYS 44.A NZ ARG 219.A O no hydrogen 3.281 N/A THR 45.A N ILE 41.A O no hydrogen 2.986 N/A THR 45.A OG1 ILE 41.A O no hydrogen 2.922 N/A ILE 46.A N GLN 42.A O no hydrogen 2.917 N/A ILE 49.A N THR 45.A O no hydrogen 3.102 N/A LEU 50.A N ILE 46.A O no hydrogen 3.112 N/A ASP 51.A N PRO 47.A O no hydrogen 3.169 N/A GLY 52.A N VAL 48.A O no hydrogen 3.314 N/A GLY 52.A N ILE 49.A O no hydrogen 2.824 N/A VAL 56.A N VAL 216.A O no hydrogen 2.578 N/A ALA 57.A N LEU 195.A O no hydrogen 2.903 N/A MET 58.A N ILE 218.A O no hydrogen 2.923 N/A ARG 60.A NH2 ASP 322.A OD1 no hydrogen 2.639 N/A SER 63.A N ARG 60.A O no hydrogen 3.127 N/A SER 63.A OG ARG 60.A O no hydrogen 2.757 N/A LYS 65.A NZ ALA 59.A O no hydrogen 2.777 N/A CYS 68.A N LYS 65.A O no hydrogen 3.062 N/A CYS 68.A SG GLY 64.A O no hydrogen 3.590 N/A LEU 70.A N THR 66.A O no hydrogen 3.418 N/A LEU 71.A N ALA 67.A O no hydrogen 3.341 N/A MET 73.A N PHE 69.A O no hydrogen 3.285 N/A PHE 74.A N LEU 70.A O no hydrogen 2.862 N/A GLU 75.A N LEU 71.A O no hydrogen 3.094 N/A ARG 76.A N PRO 72.A O no hydrogen 3.019 N/A LEU 77.A N MET 73.A O no hydrogen 3.293 N/A LYS 78.A N PHE 74.A O no hydrogen 3.290 N/A THR 79.A OG1 HIS 80.A O no hydrogen 3.474 N/A HIS 80.A ND1 ASP 137.A OD2 no hydrogen 2.802 N/A SER 81.A N ASP 137.A OD1 no hydrogen 3.140 N/A GLN 83.A N SER 81.A OG no hydrogen 3.352 N/A ARG 87.A N ASP 137.A O no hydrogen 3.140 N/A ARG 87.A NH1 LEU 77.A O no hydrogen 3.362 N/A ARG 87.A NH2 THR 79.A O no hydrogen 2.561 N/A ALA 88.A N ASP 137.A O no hydrogen 3.331 N/A LEU 89.A N TYR 162.A O no hydrogen 2.745 N/A ILE 90.A N ILE 139.A O no hydrogen 2.803 N/A LEU 91.A N VAL 164.A O no hydrogen 3.021 N/A SER 92.A N ALA 141.A O no hydrogen 3.295 N/A THR 94.A OG1 GLU 96.A OE1 no hydrogen 3.456 N/A ARG 95.A NH1 ASP 123.A OD1 no hydrogen 3.247 N/A ARG 95.A NH1 ASP 123.A OD2 no hydrogen 3.263 N/A ARG 95.A NH2 ASP 123.A OD1 no hydrogen 3.073 N/A LEU 97.A N THR 94.A OG1 no hydrogen 3.171 N/A ALA 98.A N THR 94.A O no hydrogen 3.253 N/A LEU 99.A N ARG 95.A O no hydrogen 3.050 N/A GLN 100.A N GLU 96.A O no hydrogen 3.125 N/A THR 101.A N LEU 97.A O no hydrogen 2.909 N/A THR 101.A OG1 LEU 97.A O no hydrogen 2.913 N/A LEU 102.A N ALA 98.A O no hydrogen 2.875 N/A LYS 103.A N LEU 99.A O no hydrogen 3.076 N/A PHE 104.A N GLN 100.A O no hydrogen 3.266 N/A THR 105.A N THR 101.A O no hydrogen 2.990 N/A THR 105.A OG1 THR 101.A O no hydrogen 2.927 N/A LYS 106.A N LEU 102.A O no hydrogen 3.086 N/A GLU 107.A N LYS 103.A O no hydrogen 3.346 N/A LEU 108.A N PHE 104.A O no hydrogen 2.916 N/A GLY 109.A N THR 105.A O no hydrogen 2.926 N/A THR 112.A OG1 GLY 109.A O no hydrogen 2.662 N/A LEU 114.A N THR 112.A OG1 no hydrogen 3.353 N/A LYS 115.A N ASP 137.A OD2 no hydrogen 2.970 N/A ALA 117.A N ILE 138.A O no hydrogen 2.764 N/A ILE 119.A N ILE 140.A O no hydrogen 2.852 N/A GLN 128.A N ARG 124.A O no hydrogen 3.329 N/A GLN 128.A NE2 ARG 124.A O no hydrogen 3.182 N/A PHE 129.A N MET 125.A O no hydrogen 3.072 N/A ALA 130.A N GLU 126.A O no hydrogen 3.232 N/A ALA 131.A N ASP 127.A O no hydrogen 3.091 N/A LEU 132.A N GLN 128.A O no hydrogen 3.189 N/A HIS 133.A N PHE 129.A O no hydrogen 3.093 N/A HIS 133.A NE2 TYR 605.A OH no hydrogen 3.247 N/A GLU 134.A N ALA 131.A O no hydrogen 3.105 N/A ASN 135.A N LEU 132.A O no hydrogen 3.045 N/A ASN 135.A ND2 GLN 83.A O no hydrogen 2.657 N/A ILE 138.A N LYS 115.A O no hydrogen 2.821 N/A ILE 139.A N ALA 88.A O no hydrogen 3.064 N/A ILE 140.A N ALA 117.A O no hydrogen 2.781 N/A ALA 141.A N ILE 90.A O no hydrogen 2.948 N/A THR 142.A N ILE 119.A O no hydrogen 3.111 N/A ARG 145.A NE GLU 591.A OE2 no hydrogen 2.998 N/A ARG 145.A NH1 ASP 123.A O no hydrogen 2.831 N/A ARG 145.A NH2 ASP 123.A O no hydrogen 2.877 N/A ARG 145.A NH2 GLU 591.A OE1 no hydrogen 3.489 N/A ARG 145.A NH2 GLU 591.A OE2 no hydrogen 2.893 N/A LEU 146.A N THR 142.A O no hydrogen 3.253 N/A VAL 147.A N PRO 143.A O no hydrogen 3.261 N/A HIS 148.A N GLY 144.A O no hydrogen 3.507 N/A VAL 149.A N ARG 145.A O no hydrogen 2.859 N/A ALA 150.A N LEU 146.A O no hydrogen 2.842 N/A VAL 151.A N VAL 147.A O no hydrogen 2.925 N/A GLU 152.A N HIS 148.A O no hydrogen 2.894 N/A MET 153.A N VAL 149.A O no hydrogen 3.389 N/A SER 154.A N VAL 151.A O no hydrogen 3.391 N/A LEU 155.A N ALA 150.A O no hydrogen 3.154 N/A SER 159.A OG ALA 86.A O no hydrogen 2.970 N/A VAL 160.A N LEU 157.A O no hydrogen 3.122 N/A GLU 161.A N ARG 87.A O no hydrogen 2.707 N/A TYR 162.A N ARG 87.A O no hydrogen 2.973 N/A TYR 162.A OH PHE 69.A O no hydrogen 2.813 N/A VAL 163.A N GLN 192.A O no hydrogen 2.968 N/A VAL 164.A N LEU 89.A O no hydrogen 2.958 N/A PHE 165.A N VAL 194.A O no hydrogen 3.173 N/A ASP 166.A N LEU 91.A O no hydrogen 3.171 N/A ALA 168.A N PHE 196.A O no hydrogen 3.222 N/A ASP 169.A N SER 197.A OG no hydrogen 3.230 N/A ARG 170.A N ASP 169.A OD1 no hydrogen 2.566 N/A LEU 171.A N GLU 167.A O no hydrogen 3.298 N/A PHE 172.A N ALA 168.A O no hydrogen 3.446 N/A GLU 173.A N ASP 169.A O no hydrogen 3.308 N/A MET 174.A N ARG 170.A O no hydrogen 3.202 N/A GLY 175.A N PHE 172.A O no hydrogen 3.152 N/A PHE 176.A N LEU 171.A O no hydrogen 3.116 N/A GLN 179.A N GLN 179.A OE1 no hydrogen 2.743 N/A LEU 180.A N PHE 176.A O no hydrogen 3.027 N/A GLN 181.A N ALA 177.A O no hydrogen 3.203 N/A ILE 183.A N GLN 179.A O no hydrogen 3.011 N/A ILE 184.A N LEU 180.A O no hydrogen 2.951 N/A ALA 185.A N GLN 181.A O no hydrogen 3.184 N/A ARG 186.A N GLU 182.A O no hydrogen 3.429 N/A LEU 187.A N ILE 183.A O no hydrogen 3.194 N/A HIS 191.A N PRO 188.A O no hydrogen 3.356 N/A GLN 192.A N GLU 161.A O no hydrogen 2.827 N/A GLN 192.A NE2 ILE 49.A O no hydrogen 3.461 N/A GLN 192.A NE2 LYS 53.A O no hydrogen 2.976 N/A VAL 194.A N VAL 163.A O no hydrogen 3.080 N/A LEU 195.A N VAL 55.A O no hydrogen 2.930 N/A PHE 196.A N PHE 165.A O no hydrogen 3.211 N/A SER 197.A N ALA 57.A O no hydrogen 3.363 N/A SER 197.A OG THR 199.A O no hydrogen 2.485 N/A ALA 198.A N ASP 169.A OD2 no hydrogen 3.273 N/A THR 199.A N ASP 169.A OD2 no hydrogen 3.331 N/A LYS 202.A N ASP 560.A OD1 no hydrogen 3.197 N/A VAL 205.A N PRO 201.A O no hydrogen 3.307 N/A GLU 206.A N LYS 202.A O no hydrogen 3.228 N/A PHE 207.A N LEU 203.A O no hydrogen 2.857 N/A ALA 208.A N LEU 204.A O no hydrogen 2.715 N/A ARG 209.A N VAL 205.A O no hydrogen 3.172 N/A ALA 210.A N GLU 206.A O no hydrogen 3.461 N/A GLY 211.A N PHE 207.A O no hydrogen 2.895 N/A THR 213.A N ASP 54.A OD2 no hydrogen 3.255 N/A VAL 216.A N ASP 54.A O no hydrogen 3.034 N/A ILE 218.A N VAL 56.A O no hydrogen 2.869 N/A ASP 223.A N LEU 220.A O no hydrogen 3.208 N/A THR 224.A N ASP 221.A O no hydrogen 3.105 N/A THR 224.A OG1 ASP 221.A O no hydrogen 2.690 N/A LEU 230.A N ASN 227.A O no hydrogen 3.399 N/A LYS 231.A N GLY 355.A O no hydrogen 3.248 N/A THR 232.A N ASP 396.A OD1 no hydrogen 2.971 N/A THR 232.A OG1 ASP 396.A OD1 no hydrogen 3.502 N/A SER 233.A N ALA 357.A O no hydrogen 2.941 N/A PHE 234.A N MET 398.A O no hydrogen 3.242 N/A PHE 235.A N SER 359.A O no hydrogen 2.969 N/A LEU 236.A N GLY 400.A O no hydrogen 2.976 N/A VAL 237.A N VAL 361.A O no hydrogen 3.074 N/A ARG 238.A NH1 GLN 404.A OE1 no hydrogen 3.117 N/A ARG 238.A NH2 ASP 240.A OD2 no hydrogen 2.977 N/A THR 241.A N ARG 238.A O no hydrogen 3.025 N/A THR 241.A OG1 ARG 238.A O no hydrogen 2.773 N/A LYS 242.A N GLU 239.A O no hydrogen 3.377 N/A LYS 242.A NZ GLU 239.A OE1 no hydrogen 3.327 N/A LYS 242.A NZ TYR 332.A O no hydrogen 3.283 N/A LYS 242.A NZ LEU 360.A O no hydrogen 3.356 N/A LYS 242.A NZ GLU 365.A OE1 no hydrogen 3.229 N/A VAL 245.A N THR 241.A O no hydrogen 3.230 N/A LEU 246.A N LYS 242.A O no hydrogen 2.968 N/A LEU 247.A N ALA 243.A O no hydrogen 3.051 N/A HIS 248.A N ALA 244.A O no hydrogen 2.972 N/A LEU 249.A N VAL 245.A O no hydrogen 2.914 N/A LEU 250.A N LEU 246.A O no hydrogen 3.124 N/A HIS 251.A N LEU 247.A O no hydrogen 3.168 N/A ASN 252.A N HIS 248.A O no hydrogen 3.179 N/A VAL 254.A N LEU 249.A O no hydrogen 2.835 N/A ARG 255.A NE ASP 258.A OD2 no hydrogen 2.925 N/A ARG 255.A NH2 ASP 258.A OD2 no hydrogen 3.123 N/A GLN 257.A N GLN 257.A OE1 no hydrogen 2.878 N/A ASP 258.A N ARG 255.A O no hydrogen 3.148 N/A GLN 259.A N ASP 327.A OD2 no hydrogen 3.326 N/A THR 260.A N SER 309.A O no hydrogen 3.160 N/A VAL 261.A N ASN 328.A O no hydrogen 3.441 N/A VAL 262.A N LEU 311.A O no hydrogen 2.789 N/A PHE 263.A N ILE 330.A O no hydrogen 2.998 N/A VAL 264.A N VAL 313.A O no hydrogen 3.358 N/A THR 266.A OG1 HIS 269.A ND1 no hydrogen 3.285 N/A LYS 267.A N ASP 564.A O no hydrogen 2.869 N/A HIS 269.A N THR 266.A OG1 no hydrogen 3.430 N/A ALA 270.A N THR 266.A O no hydrogen 3.352 N/A GLU 271.A N LYS 267.A O no hydrogen 2.890 N/A TYR 272.A N HIS 268.A O no hydrogen 2.966 N/A LEU 273.A N HIS 269.A O no hydrogen 2.746 N/A THR 274.A N ALA 270.A O no hydrogen 2.937 N/A THR 274.A OG1 ALA 270.A O no hydrogen 2.501 N/A GLU 275.A N GLU 271.A O no hydrogen 3.291 N/A LEU 276.A N TYR 272.A O no hydrogen 2.953 N/A LEU 277.A N LEU 273.A O no hydrogen 2.624 N/A THR 278.A N THR 274.A O no hydrogen 2.894 N/A THR 278.A OG1 THR 274.A O no hydrogen 2.560 N/A THR 279.A N GLU 275.A O no hydrogen 3.318 N/A THR 279.A OG1 GLU 275.A O no hydrogen 3.147 N/A GLN 280.A N LEU 276.A O no hydrogen 3.370 N/A ARG 281.A N THR 278.A O no hydrogen 3.136 N/A VAL 282.A N LEU 277.A O no hydrogen 3.049 N/A SER 283.A OG SER 309.A OG no hydrogen 2.887 N/A CYS 284.A SG THR 274.A O no hydrogen 3.727 N/A CYS 284.A SG VAL 282.A O no hydrogen 3.507 N/A ALA 285.A N THR 310.A O no hydrogen 3.284 N/A ILE 287.A N ILE 312.A O no hydrogen 3.001 N/A SER 289.A N ASP 564.A OD2 no hydrogen 3.030 N/A LEU 291.A N TYR 288.A O no hydrogen 3.087 N/A THR 294.A N ASP 292.A OD2 no hydrogen 3.056 N/A ARG 296.A N ASP 292.A O no hydrogen 2.980 N/A LYS 297.A N PRO 293.A O no hydrogen 3.199 N/A ILE 298.A N THR 294.A O no hydrogen 3.175 N/A ASN 299.A N ALA 295.A O no hydrogen 2.911 N/A ASN 299.A ND2 HIS 286.A O no hydrogen 2.736 N/A LEU 300.A N ARG 296.A O no hydrogen 3.025 N/A ALA 301.A N LYS 297.A O no hydrogen 2.952 N/A LYS 302.A N ILE 298.A O no hydrogen 3.023 N/A PHE 303.A N ASN 299.A O no hydrogen 3.241 N/A THR 304.A N LEU 300.A O no hydrogen 2.945 N/A THR 304.A OG1 LEU 300.A O no hydrogen 2.839 N/A LEU 305.A N ALA 301.A O no hydrogen 2.977 N/A GLY 306.A N PHE 303.A O no hydrogen 3.297 N/A CYS 308.A N LYS 302.A O no hydrogen 3.287 N/A SER 309.A N SER 283.A OG no hydrogen 3.400 N/A SER 309.A OG SER 283.A O no hydrogen 2.941 N/A SER 309.A OG SER 283.A OG no hydrogen 2.887 N/A SER 309.A OG THR 310.A OG1 no hydrogen 3.350 N/A THR 310.A N SER 283.A O no hydrogen 3.351 N/A THR 310.A OG1 SER 309.A OG no hydrogen 3.350 N/A LEU 311.A N THR 260.A O no hydrogen 3.041 N/A ILE 312.A N ALA 285.A O no hydrogen 2.861 N/A VAL 313.A N VAL 262.A O no hydrogen 2.878 N/A ALA 317.A N THR 314.A OG1 no hydrogen 3.260 N/A ALA 318.A N THR 314.A O no hydrogen 2.916 N/A ARG 319.A N ASP 315.A O no hydrogen 3.275 N/A LEU 321.A N ALA 318.A O no hydrogen 3.086 N/A LEU 326.A N ARG 347.A O no hydrogen 2.911 N/A ASP 327.A N GLN 259.A O no hydrogen 3.109 N/A ASN 328.A N GLN 259.A O no hydrogen 3.506 N/A VAL 329.A N THR 356.A O no hydrogen 3.189 N/A ILE 330.A N VAL 261.A O no hydrogen 2.971 N/A ASN 331.A N TYR 358.A O no hydrogen 2.851 N/A ASN 331.A ND2 SER 359.A OG no hydrogen 3.248 N/A TYR 332.A N PHE 263.A O no hydrogen 2.980 N/A SER 333.A N PHE 263.A O no hydrogen 3.462 N/A LYS 339.A NZ ALA 555.A O no hydrogen 3.053 N/A LYS 339.A NZ GLY 556.A O no hydrogen 3.134 N/A LYS 339.A NZ VAL 558.A O no hydrogen 3.169 N/A PHE 341.A N LYS 337.A O no hydrogen 3.357 N/A LEU 342.A N GLY 338.A O no hydrogen 3.291 N/A HIS 343.A N LYS 339.A O no hydrogen 3.210 N/A ARG 344.A N LEU 340.A O no hydrogen 3.220 N/A ARG 344.A NH1 SER 333.A O no hydrogen 2.701 N/A ARG 344.A NH2 ASP 315.A OD2 no hydrogen 2.730 N/A ARG 344.A NH2 SER 333.A O no hydrogen 3.522 N/A VAL 345.A N PHE 341.A O no hydrogen 3.316 N/A VAL 348.A N VAL 345.A O no hydrogen 3.366 N/A ARG 353.A N ARG 350.A O no hydrogen 3.096 N/A THR 356.A N ASN 328.A OD1 no hydrogen 3.220 N/A ALA 357.A N LYS 231.A O no hydrogen 2.709 N/A TYR 358.A N VAL 329.A O no hydrogen 2.966 N/A SER 359.A N SER 233.A O no hydrogen 3.111 N/A LEU 360.A N ASN 331.A O no hydrogen 3.272 N/A VAL 361.A N PHE 235.A O no hydrogen 2.791 N/A ALA 362.A N GLU 365.A OE1 no hydrogen 2.918 N/A GLU 365.A N ALA 362.A O no hydrogen 2.839 N/A TYR 368.A OH PRO 443.A O no hydrogen 2.563 N/A LEU 369.A N GLU 365.A O no hydrogen 3.187 N/A LEU 370.A N ILE 366.A O no hydrogen 3.067 N/A ASP 371.A N PRO 367.A O no hydrogen 3.005 N/A LEU 372.A N TYR 368.A O no hydrogen 2.904 N/A HIS 373.A N LEU 369.A O no hydrogen 3.185 N/A HIS 373.A ND1 LEU 369.A O no hydrogen 3.066 N/A LEU 374.A N LEU 370.A O no hydrogen 3.051 N/A PHE 375.A N ASP 371.A O no hydrogen 2.970 N/A LEU 376.A N LEU 372.A O no hydrogen 2.750 N/A GLY 377.A N HIS 373.A O no hydrogen 2.661 N/A ARG 378.A N HIS 373.A O no hydrogen 3.084 N/A THR 381.A OG1 GLY 397.A O no hydrogen 2.368 N/A ALA 383.A N LEU 399.A O no hydrogen 3.185 N/A VAL 395.A N GLY 391.A O no hydrogen 3.223 N/A ASP 396.A N VAL 392.A O no hydrogen 2.944 N/A GLY 397.A N THR 232.A O no hydrogen 2.601 N/A LEU 399.A N THR 381.A O no hydrogen 3.026 N/A GLY 400.A N PHE 234.A O no hydrogen 3.216 N/A ARG 401.A N GLY 462.A O no hydrogen 2.992 N/A ARG 401.A NE LEU 461.A O no hydrogen 2.719 N/A ARG 401.A NH2 LEU 461.A O no hydrogen 3.412 N/A GLN 404.A NE2 GLN 404.A O no hydrogen 3.121 N/A GLN 404.A NE2 ASP 408.A OD1 no hydrogen 2.629 N/A VAL 407.A N PRO 403.A O no hydrogen 3.495 N/A ASP 408.A N GLN 404.A O no hydrogen 2.718 N/A GLU 409.A N SER 405.A O no hydrogen 3.036 N/A GLU 410.A N VAL 406.A O no hydrogen 3.475 N/A ASP 411.A N VAL 407.A O no hydrogen 2.911 N/A SER 412.A N ASP 408.A O no hydrogen 3.267 N/A LEU 414.A N GLU 410.A O no hydrogen 3.269 N/A GLN 415.A N ASP 411.A O no hydrogen 2.928 N/A SER 416.A N SER 412.A O no hydrogen 3.231 N/A THR 417.A N GLY 413.A O no hydrogen 3.058 N/A THR 417.A OG1 GLY 413.A O no hydrogen 3.086 N/A LEU 418.A N LEU 414.A O no hydrogen 2.754 N/A GLU 419.A N GLN 415.A O no hydrogen 3.106 N/A ALA 420.A N SER 416.A O no hydrogen 3.326 N/A ARG 425.A NE LEU 418.A O no hydrogen 3.159 N/A ARG 425.A NH2 GLU 419.A O no hydrogen 3.127 N/A GLY 426.A N LEU 422.A O no hydrogen 2.902 N/A LEU 427.A N GLU 423.A O no hydrogen 3.086 N/A ALA 428.A N LEU 424.A O no hydrogen 2.997 N/A ARG 429.A N ARG 425.A O no hydrogen 3.200 N/A VAL 430.A N GLY 426.A O no hydrogen 3.151 N/A ALA 431.A N LEU 427.A O no hydrogen 2.922 N/A ASP 432.A N ALA 428.A O no hydrogen 2.941 N/A ASN 433.A N ARG 429.A O no hydrogen 3.188 N/A ALA 434.A N VAL 430.A O no hydrogen 2.869 N/A GLN 435.A N ALA 431.A O no hydrogen 2.826 N/A GLN 436.A N ASP 432.A O no hydrogen 3.214 N/A GLN 437.A N ASN 433.A O no hydrogen 3.209 N/A TYR 438.A N ALA 434.A O no hydrogen 2.837 N/A VAL 439.A N GLN 435.A O no hydrogen 2.944 N/A ARG 440.A N GLN 436.A O no hydrogen 3.274 N/A SER 441.A N GLN 437.A O no hydrogen 3.181 N/A SER 441.A OG GLN 437.A O no hydrogen 3.242 N/A SER 441.A OG TYR 438.A O no hydrogen 3.075 N/A ARG 442.A N TYR 438.A O no hydrogen 2.988 N/A ARG 442.A NH2 ASP 364.A OD2 no hydrogen 3.504 N/A SER 446.A N ASP 371.A OD2 no hydrogen 3.300 N/A SER 446.A OG ASP 371.A OD1 no hydrogen 2.711 N/A SER 449.A N SER 446.A OG no hydrogen 3.416 N/A SER 449.A OG ASP 371.A OD1 no hydrogen 2.765 N/A SER 449.A OG SER 446.A OG no hydrogen 3.060 N/A ILE 450.A N SER 446.A O no hydrogen 3.407 N/A ARG 452.A N GLU 448.A O no hydrogen 3.157 N/A ALA 453.A N SER 449.A O no hydrogen 2.918 N/A LYS 454.A N ILE 450.A O no hydrogen 3.374 N/A GLU 455.A N LYS 451.A O no hydrogen 3.342 N/A MET 456.A N ARG 452.A O no hydrogen 3.208 N/A VAL 459.A N ASP 457.A OD1 no hydrogen 3.279 N/A LEU 461.A N LEU 458.A O no hydrogen 3.169 N/A GLY 462.A N ALA 383.A O no hydrogen 2.899 N/A HIS 464.A N ARG 401.A O no hydrogen 2.930 N/A LEU 466.A N HIS 464.A ND1 no hydrogen 3.410 N/A SER 468.A N HIS 464.A O no hydrogen 3.007 N/A SER 468.A OG HIS 464.A O no hydrogen 3.526 N/A SER 468.A OG PRO 465.A O no hydrogen 3.351 N/A SER 469.A N PRO 465.A O no hydrogen 3.024 N/A SER 469.A OG PRO 465.A O no hydrogen 3.110 N/A SER 469.A OG LEU 466.A O no hydrogen 3.085 N/A ARG 470.A N PHE 467.A O no hydrogen 3.290 N/A ARG 470.A NE LEU 466.A O no hydrogen 3.182 N/A ARG 470.A NH1 HIS 248.A NE2 no hydrogen 3.260 N/A ARG 470.A NH2 HIS 248.A NE2 no hydrogen 3.126 N/A PHE 471.A N SER 468.A O no hydrogen 3.150 N/A GLU 474.A N GLU 474.A OE1 no hydrogen 2.825 N/A LEU 476.A N GLU 472.A O no hydrogen 3.013 N/A GLN 477.A N GLU 473.A O no hydrogen 3.061 N/A ARG 478.A N GLU 474.A O no hydrogen 3.195 N/A LEU 479.A N GLU 475.A O no hydrogen 3.068 N/A ARG 480.A N LEU 476.A O no hydrogen 3.035 N/A LEU 481.A N GLN 477.A O no hydrogen 3.126 N/A VAL 482.A N ARG 478.A O no hydrogen 3.109 N/A ASP 483.A N LEU 479.A O no hydrogen 3.048 N/A SER 484.A N ARG 480.A O no hydrogen 3.263 N/A SER 484.A N LEU 481.A O no hydrogen 3.102 N/A SER 484.A OG ARG 480.A O no hydrogen 3.254 N/A ILE 485.A N VAL 482.A O no hydrogen 2.962 N/A LYS 486.A NZ ASP 483.A OD1 no hydrogen 2.646 N/A ASN 487.A N ASP 483.A O no hydrogen 3.390 N/A TYR 488.A N ILE 485.A O no hydrogen 3.126 N/A GLU 496.A N THR 493.A OG1 no hydrogen 3.365 N/A ILE 497.A N THR 493.A O no hydrogen 3.393 N/A ALA 499.A N ILE 497.A O no hydrogen 2.593 N/A ARG 502.A N SER 500.A OG no hydrogen 3.371 N/A GLN 507.A N ASP 503.A O no hydrogen 3.274 N/A VAL 508.A N LEU 504.A O no hydrogen 2.987 N/A MET 509.A N CYS 505.A O no hydrogen 2.916 N/A ARG 510.A N SER 506.A O no hydrogen 3.015 N/A ALA 511.A N GLN 507.A O no hydrogen 3.193 N/A LYS 512.A N VAL 508.A O no hydrogen 2.960 N/A LYS 512.A NZ ASP 516.A OD2 no hydrogen 2.244 N/A ARG 513.A N MET 509.A O no hydrogen 2.720 N/A ARG 513.A NE GLU 496.A OE2 no hydrogen 2.857 N/A ARG 513.A NH2 GLU 496.A OE2 no hydrogen 2.761 N/A GLN 514.A N ARG 510.A O no hydrogen 3.061 N/A LYS 515.A N ALA 511.A O no hydrogen 3.323 N/A ASP 516.A N LYS 512.A O no hydrogen 3.185 N/A LYS 518.A NZ GLN 514.A O no hydrogen 2.971 N/A ILE 520.A N ASP 516.A O no hydrogen 3.107 N/A ALA 521.A N ARG 517.A O no hydrogen 3.155 N/A ARG 522.A N LYS 518.A O no hydrogen 3.122 N/A PHE 523.A N ALA 519.A O no hydrogen 2.997 N/A GLN 524.A N ILE 520.A O no hydrogen 2.922 N/A GLN 525.A N ALA 521.A O no hydrogen 3.199 N/A GLY 526.A N ARG 522.A O no hydrogen 3.146 N/A GLN 527.A N PHE 523.A O no hydrogen 2.847 N/A GLN 528.A N GLN 524.A O no hydrogen 2.832 N/A GLY 529.A N GLN 525.A O no hydrogen 2.913 N/A ARG 530.A N GLY 526.A O no hydrogen 2.953 N/A ARG 530.A NE GLY 526.A O no hydrogen 3.427 N/A GLN 531.A N GLN 527.A O no hydrogen 3.096 N/A GLU 532.A N GLN 528.A O no hydrogen 2.894 N/A GLN 533.A N GLY 529.A O no hydrogen 2.975 N/A GLN 534.A N ARG 530.A O no hydrogen 3.053 N/A GLU 535.A N GLN 531.A O no hydrogen 2.898 N/A GLU 535.A N GLU 532.A O no hydrogen 3.055 N/A GLY 536.A N GLN 533.A O no hydrogen 3.317 N/A TYR 542.A N GLN 539.A O no hydrogen 3.379 N/A GLN 553.A N ALA 549.A O no hydrogen 3.106 N/A ALA 554.A N PHE 550.A O no hydrogen 2.708 N/A ALA 555.A N GLU 551.A O no hydrogen 3.096 N/A ALA 557.A N ALA 554.A O no hydrogen 3.051 N/A VAL 558.A N ALA 555.A O no hydrogen 3.221 N/A LEU 559.A N LEU 200.A O no hydrogen 3.160 N/A ASN 568.A ND2 ASP 564.A OD1 no hydrogen 3.462 N/A LEU 569.A N GLU 565.A O no hydrogen 3.044 N/A THR 570.A OG1 GLN 567.A O no hydrogen 3.177 N/A ARG 571.A N ASN 568.A O no hydrogen 3.120 N/A GLN 574.A N THR 570.A O no hydrogen 3.415 N/A GLN 575.A N ARG 571.A O no hydrogen 2.982 N/A GLN 575.A NE2 GLU 173.A O no hydrogen 3.215 N/A LYS 577.A N ARG 573.A O no hydrogen 3.332 N/A TRP 578.A N GLN 574.A O no hydrogen 3.042 N/A ASP 579.A N GLN 575.A O no hydrogen 3.428 N/A ARG 580.A N LEU 576.A O no hydrogen 3.094 N/A LYS 581.A N LYS 577.A O no hydrogen 2.657 N/A LYS 582.A N TRP 578.A O no hydrogen 2.877 N/A LYS 583.A N ASP 579.A O no hydrogen 3.049 N/A ARG 584.A N ARG 580.A O no hydrogen 3.038 N/A PHE 585.A N LYS 581.A O no hydrogen 2.971 N/A ILE 588.A N ILE 596.A O no hydrogen 2.857 N/A THR 590.A N ARG 594.A O no hydrogen 2.755 N/A THR 590.A OG1 SER 592.A OG no hydrogen 2.838 N/A THR 590.A OG1 ARG 594.A O no hydrogen 2.765 N/A SER 592.A OG THR 590.A OG1 no hydrogen 2.838 N/A GLY 593.A N THR 590.A O no hydrogen 2.733 N/A ILE 596.A N ILE 588.A O no hydrogen 3.097 N/A SER 598.A N LYS 586.A O no hydrogen 3.027 N/A SER 599.A OG SER 598.A O no hydrogen 2.615 N/A LYS 601.A NZ VAL 151.A O no hydrogen 2.814 N/A LYS 601.A NZ GLU 152.A O no hydrogen 2.575 N/A ARG 602.A NH1 TYR 600.A OH no hydrogen 3.356 N/A TYR 605.A N GLU 152.A OE1 no hydrogen 3.260 N/A TYR 605.A OH HIS 133.A NE2 no hydrogen 3.247 N/A LYS 607.A N ASP 603.A O no hydrogen 2.930 N/A TRP 608.A N LEU 604.A O no hydrogen 2.929 N/A LYS 609.A N TYR 605.A O no hydrogen 2.674 N/A GLN 610.A N GLN 606.A O no hydrogen 3.028 N/A LYS 611.A N LYS 607.A O no hydrogen 2.903 N/A LYS 611.A NZ GLU 126.A OE1 no hydrogen 3.083 N/A LYS 611.A NZ GLU 126.A OE2 no hydrogen 3.554 N/A GLN 612.A N TRP 608.A O no hydrogen 2.769 N/A