Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3zj4_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ARG 4.A NH1 GLU 323.A OE1 no hydrogen 3.122 N/A LEU 7.A N ARG 4.A O no hydrogen 3.194 N/A LYS 8.A N GLN 5.A O no hydrogen 3.335 N/A VAL 10.A N LEU 7.A O no hydrogen 3.402 N/A GLU 11.A N LYS 8.A O no hydrogen 3.206 N/A ASN 15.A N ASP 13.A OD1 no hydrogen 3.305 N/A THR 20.A OG1 THR 21.A O no hydrogen 3.142 N/A THR 21.A N GLY 25.A O no hydrogen 3.250 N/A THR 21.A OG1 GLY 24.A O no hydrogen 2.563 N/A ASP 22.A N GLN 50.A OE1 no hydrogen 3.241 N/A GLY 24.A N THR 21.A O no hydrogen 3.074 N/A ILE 27.A N MET 19.A O no hydrogen 3.021 N/A GLN 30.A NE2 GLU 29.A OE1 no hydrogen 2.473 N/A LEU 33.A N ASP 45.A OD2 no hydrogen 3.030 N/A LYS 34.A NZ SER 32.A O no hydrogen 3.286 N/A ALA 35.A N SER 40.A O no hydrogen 3.077 N/A LEU 42.A N LEU 33.A O no hydrogen 2.771 N/A ASP 45.A N LEU 42.A O no hydrogen 3.164 N/A ARG 49.A N ASP 45.A O no hydrogen 3.478 N/A ARG 49.A NE LEU 43.A O no hydrogen 3.150 N/A ARG 49.A NH2 LEU 43.A O no hydrogen 3.470 N/A GLN 50.A N PHE 46.A O no hydrogen 3.077 N/A GLN 50.A NE2 ILE 47.A O no hydrogen 3.521 N/A LYS 51.A N ILE 47.A O no hydrogen 3.384 N/A LYS 51.A NZ GLU 29.A O no hydrogen 3.517 N/A LYS 51.A NZ GLU 29.A OE2 no hydrogen 3.329 N/A LEU 52.A N PHE 48.A O no hydrogen 2.987 N/A GLN 53.A N ARG 49.A O no hydrogen 2.818 N/A PHE 55.A N LYS 51.A O no hydrogen 3.376 N/A ASP 56.A N LEU 52.A O no hydrogen 2.726 N/A HIS 57.A N GLN 53.A O no hydrogen 3.086 N/A GLU 58.A N PHE 55.A O no hydrogen 3.369 N/A ARG 59.A NH1 GLU 58.A OE1 no hydrogen 3.236 N/A ARG 63.A NH1 GLU 325.A O no hydrogen 3.177 N/A ARG 63.A NH2 THR 324.A O no hydrogen 3.247 N/A ARG 63.A NH2 GLU 325.A O no hydrogen 3.068 N/A HIS 66.A N VAL 107.A O no hydrogen 3.423 N/A HIS 66.A ND1 SER 105.A OG no hydrogen 3.102 N/A ARG 68.A NE ASP 115.A OD1 no hydrogen 2.934 N/A ARG 68.A NH1 ARG 111.A O no hydrogen 3.342 N/A ARG 68.A NH2 ASP 115.A OD1 no hydrogen 3.514 N/A ARG 68.A NH2 ASP 115.A OD2 no hydrogen 3.222 N/A ARG 68.A NH2 ALA 253.A O no hydrogen 2.930 N/A ARG 68.A NH2 ASP 254.A OD1 no hydrogen 2.843 N/A ALA 70.A N PHE 104.A O no hydrogen 2.994 N/A ALA 72.A N VAL 102.A O no hydrogen 3.141 N/A HIS 73.A N ARG 315.A O no hydrogen 2.855 N/A HIS 73.A NE2 GLU 323.A OE1 no hydrogen 2.749 N/A GLY 74.A N VAL 100.A O no hydrogen 2.979 N/A ILE 75.A N THR 312.A O no hydrogen 2.953 N/A PHE 76.A N THR 98.A O no hydrogen 2.576 N/A THR 77.A N GLU 310.A O no hydrogen 2.943 N/A SER 78.A N LYS 96.A O no hydrogen 2.856 N/A SER 78.A OG GLY 80.A O no hydrogen 2.934 N/A SER 78.A OG ALA 93.A O no hydrogen 3.412 N/A TYR 79.A N LEU 308.A O no hydrogen 2.903 N/A GLY 80.A N SER 78.A OG no hydrogen 3.420 N/A TRP 82.A N LEU 91.A O no hydrogen 3.028 N/A SER 83.A N ASP 81.A OD1 no hydrogen 3.318 N/A SER 83.A OG ASP 81.A OD1 no hydrogen 2.115 N/A ILE 85.A N TRP 82.A O no hydrogen 2.892 N/A THR 86.A N TRP 82.A O no hydrogen 2.793 N/A THR 86.A OG1 GLY 337.A O no hydrogen 2.747 N/A ALA 87.A N VAL 218.A O no hydrogen 2.647 N/A ALA 88.A N THR 86.A OG1 no hydrogen 3.167 N/A SER 89.A OG ASP 130.A OD1 no hydrogen 2.462 N/A SER 89.A OG ASP 130.A OD2 no hydrogen 3.351 N/A LEU 91.A N ALA 88.A O no hydrogen 3.291 N/A GLY 92.A N SER 89.A O no hydrogen 3.114 N/A LYS 94.A NZ ASP 95.A OD2 no hydrogen 3.331 N/A ASP 95.A N SER 78.A O no hydrogen 2.902 N/A LYS 96.A NZ SER 89.A O no hydrogen 2.587 N/A THR 98.A N PHE 76.A O no hydrogen 2.708 N/A VAL 100.A N GLY 74.A O no hydrogen 2.919 N/A PHE 101.A N ARG 126.A O no hydrogen 3.284 N/A VAL 102.A N ALA 72.A O no hydrogen 3.156 N/A ARG 103.A N ALA 124.A O no hydrogen 2.931 N/A ARG 103.A NH1 HIS 66.A O no hydrogen 2.676 N/A ARG 103.A NH2 ALA 67.A O no hydrogen 3.175 N/A PHE 104.A N ALA 70.A O no hydrogen 2.882 N/A SER 105.A N GLY 122.A O no hydrogen 3.309 N/A SER 105.A OG HIS 66.A ND1 no hydrogen 3.102 N/A THR 106.A N ARG 68.A O no hydrogen 3.085 N/A ALA 108.A N ASP 119.A OD2 no hydrogen 2.575 N/A SER 110.A N GLN 169.A OE1 no hydrogen 3.063 N/A SER 110.A OG GLU 62.A OE2 no hydrogen 3.126 N/A ARG 111.A N GLU 62.A OE1 no hydrogen 3.108 N/A SER 113.A N SER 110.A O no hydrogen 3.218 N/A SER 113.A OG SER 110.A O no hydrogen 2.288 N/A ASP 115.A N ALA 253.A O no hydrogen 3.004 N/A THR 116.A OG1 ALA 245.A O no hydrogen 3.513 N/A ARG 118.A NH1 ALA 194.A O no hydrogen 2.870 N/A ARG 118.A NH1 SER 196.A O no hydrogen 3.236 N/A ASP 119.A N GLY 199.A O no hydrogen 3.311 N/A VAL 120.A N ASP 119.A OD1 no hydrogen 2.713 N/A HIS 121.A N ASN 140.A OD1 no hydrogen 3.286 N/A GLY 122.A N SER 105.A O no hydrogen 2.840 N/A PHE 123.A N GLY 138.A O no hydrogen 2.418 N/A ALA 124.A N ARG 103.A O no hydrogen 3.182 N/A THR 125.A N ILE 136.A O no hydrogen 2.835 N/A ARG 126.A N PHE 101.A O no hydrogen 2.895 N/A ARG 126.A NE ASP 135.A OD1 no hydrogen 3.014 N/A ARG 126.A NH1 ASN 372.A OD1 no hydrogen 3.054 N/A ARG 126.A NH2 ASP 135.A OD2 no hydrogen 3.165 N/A ARG 126.A NH2 SER 328.A O no hydrogen 2.356 N/A PHE 127.A N PHE 134.A O no hydrogen 2.647 N/A TYR 128.A N PRO 99.A O no hydrogen 2.863 N/A TYR 128.A OH ILE 371.A O no hydrogen 2.628 N/A THR 129.A OG1 GLY 132.A O no hydrogen 2.459 N/A GLU 131.A N THR 129.A OG1 no hydrogen 2.989 N/A GLY 132.A N THR 129.A O no hydrogen 3.333 N/A PHE 134.A N PHE 127.A O no hydrogen 2.998 N/A ASP 135.A N HIS 333.A O no hydrogen 3.006 N/A ILE 136.A N THR 125.A O no hydrogen 2.830 N/A GLY 138.A N PHE 123.A O no hydrogen 3.300 N/A ASN 140.A N HIS 121.A O no hydrogen 2.982 N/A ASN 140.A ND2 ASN 198.A O no hydrogen 3.120 N/A PHE 144.A N PRO 294.A O no hydrogen 2.833 N/A GLN 147.A NE2 ASP 293.A OD1 no hydrogen 3.105 N/A GLN 147.A NE2 PHE 439.A O no hydrogen 2.971 N/A ILE 150.A N ASP 148.A OD1 no hydrogen 3.022 N/A ARG 151.A N ASP 148.A O no hydrogen 3.182 N/A PHE 152.A N ALA 149.A O no hydrogen 2.909 N/A LEU 155.A N ARG 151.A O no hydrogen 3.142 N/A ILE 156.A N PHE 152.A O no hydrogen 3.022 N/A HIS 157.A N PRO 153.A O no hydrogen 2.808 N/A SER 158.A N ASP 154.A O no hydrogen 3.342 N/A SER 158.A OG ASP 154.A O no hydrogen 3.527 N/A SER 158.A OG LEU 155.A O no hydrogen 2.509 N/A VAL 159.A N LEU 155.A O no hydrogen 3.151 N/A LYS 160.A N ILE 156.A O no hydrogen 2.999 N/A LYS 160.A NZ VAL 64.A O no hydrogen 3.149 N/A SER 162.A N VAL 167.A O no hydrogen 3.142 N/A SER 162.A OG ASP 164.A OD1 no hydrogen 2.939 N/A ASP 164.A N ASP 164.A OD1 no hydrogen 2.447 N/A GLU 166.A N SER 162.A O no hydrogen 2.694 N/A THR 172.A OG1 GLU 468.A OE1 no hydrogen 2.813 N/A THR 172.A OG1 GLU 468.A OE2 no hydrogen 3.166 N/A HIS 174.A N THR 172.A O no hydrogen 2.868 N/A HIS 174.A NE2 VAL 159.A O no hydrogen 2.853 N/A HIS 174.A NE2 ALA 171.A O no hydrogen 2.761 N/A SER 176.A OG SER 158.A O no hydrogen 2.406 N/A SER 176.A OG HIS 174.A ND1 no hydrogen 2.911 N/A TRP 178.A N HIS 174.A O no hydrogen 3.525 N/A TRP 178.A NE1 GLU 468.A OE1 no hydrogen 3.046 N/A ASP 179.A N ASP 175.A O no hydrogen 2.801 N/A PHE 180.A N SER 176.A O no hydrogen 3.145 N/A PHE 181.A N ALA 177.A O no hydrogen 3.038 N/A SER 182.A N TRP 178.A O no hydrogen 3.266 N/A SER 182.A OG TRP 178.A O no hydrogen 3.001 N/A SER 182.A OG ASP 179.A O no hydrogen 3.071 N/A SER 183.A N ASP 179.A O no hydrogen 2.981 N/A SER 183.A OG ASP 179.A O no hydrogen 2.201 N/A SER 183.A OG ASP 179.A OD1 no hydrogen 3.086 N/A GLN 184.A N PHE 180.A O no hydrogen 2.663 N/A SER 186.A OG PHE 145.A O no hydrogen 2.310 N/A ALA 187.A N GLN 184.A O no hydrogen 3.007 N/A LEU 188.A N PRO 185.A O no hydrogen 3.338 N/A HIS 189.A ND1 THR 295.A O no hydrogen 2.937 N/A LEU 191.A N ALA 187.A O no hydrogen 3.110 N/A PHE 192.A N LEU 188.A O no hydrogen 3.161 N/A TRP 193.A N HIS 189.A O no hydrogen 3.265 N/A TRP 193.A NE1 HIS 189.A NE2 no hydrogen 3.051 N/A ALA 194.A N THR 190.A O no hydrogen 2.802 N/A MET 195.A N LEU 191.A O no hydrogen 2.994 N/A SER 196.A OG TRP 193.A O no hydrogen 2.455 N/A ASN 198.A ND2 ASN 140.A O no hydrogen 3.271 N/A GLY 199.A N SER 196.A O no hydrogen 3.408 N/A ILE 200.A N GLY 197.A O no hydrogen 2.941 N/A ARG 202.A N ALA 238.A O no hydrogen 3.152 N/A ARG 202.A NE ASP 587.A OD1 no hydrogen 2.774 N/A ARG 202.A NH1 ARG 202.A O no hydrogen 3.038 N/A ARG 202.A NH1 ASP 259.A OD2 no hydrogen 3.028 N/A ARG 202.A NH2 ASP 587.A OD2 no hydrogen 3.311 N/A SER 203.A OG ASP 259.A OD1 no hydrogen 2.605 N/A SER 203.A OG ASP 259.A OD2 no hydrogen 3.223 N/A ARG 205.A N SER 203.A OG no hydrogen 2.925 N/A ARG 205.A NH2 ASP 259.A OD2 no hydrogen 3.210 N/A HIS 206.A N SER 203.A O no hydrogen 3.212 N/A GLY 209.A N TRP 231.A O no hydrogen 2.822 N/A PHE 210.A N ASN 139.A O no hydrogen 2.907 N/A GLY 211.A N TRP 229.A O no hydrogen 3.169 N/A HIS 213.A N GLY 211.A O no hydrogen 2.554 N/A HIS 213.A ND1 ASP 343.A OD2 no hydrogen 2.963 N/A THR 214.A OG1 LEU 291.A O no hydrogen 2.242 N/A PHE 215.A N VAL 227.A O no hydrogen 2.826 N/A ARG 216.A N ASP 339.A O no hydrogen 2.878 N/A ARG 216.A NE GLU 281.A OE1 no hydrogen 3.483 N/A ARG 216.A NE GLU 281.A OE2 no hydrogen 2.689 N/A ARG 216.A NH1 PHE 340.A O no hydrogen 2.909 N/A ARG 216.A NH1 GLU 342.A OE1 no hydrogen 3.216 N/A ARG 216.A NH2 GLU 281.A OE1 no hydrogen 3.291 N/A ARG 216.A NH2 GLU 342.A OE1 no hydrogen 3.453 N/A LEU 217.A N LYS 225.A O no hydrogen 2.924 N/A VAL 218.A N GLY 337.A O no hydrogen 3.028 N/A THR 219.A N LYS 223.A O no hydrogen 3.159 N/A THR 219.A OG1 ASP 221.A OD2 no hydrogen 2.592 N/A THR 219.A OG1 LYS 223.A O no hydrogen 3.538 N/A GLY 222.A N THR 219.A O no hydrogen 2.720 N/A LYS 223.A N THR 219.A OG1 no hydrogen 3.306 N/A SER 224.A OG GLU 281.A OE2 no hydrogen 3.022 N/A LYS 225.A N LEU 217.A O no hydrogen 3.141 N/A LEU 226.A N ILE 279.A O no hydrogen 2.906 N/A VAL 227.A N PHE 215.A O no hydrogen 3.021 N/A LYS 228.A N GLN 277.A O no hydrogen 3.254 N/A LYS 228.A NZ ILE 212.A O no hydrogen 3.485 N/A HIS 230.A N ALA 275.A O no hydrogen 2.783 N/A TRP 231.A N GLY 209.A O no hydrogen 2.790 N/A LYS 232.A N GLU 273.A O no hydrogen 2.933 N/A LYS 232.A NZ ASP 208.A OD2 no hydrogen 2.985 N/A THR 233.A N ASP 208.A OD1 no hydrogen 3.083 N/A THR 233.A OG1 ARG 205.A O no hydrogen 2.579 N/A LYS 234.A N SER 271.A O no hydrogen 3.134 N/A GLN 235.A N THR 233.A OG1 no hydrogen 3.201 N/A GLN 235.A NE2 ARG 205.A O no hydrogen 2.652 N/A LYS 237.A NZ SER 521.A O no hydrogen 3.297 N/A ALA 238.A N HIS 206.A O no hydrogen 3.321 N/A LEU 240.A N ILE 200.A O no hydrogen 2.910 N/A VAL 241.A N GLU 244.A OE1 no hydrogen 3.504 N/A GLU 243.A N GLU 243.A OE1 no hydrogen 2.686 N/A ALA 245.A N VAL 241.A O no hydrogen 3.001 N/A GLN 246.A N TRP 242.A O no hydrogen 3.083 N/A LEU 248.A N GLU 244.A O no hydrogen 2.938 N/A ALA 249.A N ALA 245.A O no hydrogen 2.826 N/A GLY 250.A N VAL 247.A O no hydrogen 3.216 N/A LYS 251.A N VAL 247.A O no hydrogen 3.116 N/A ASN 252.A N LEU 248.A O no hydrogen 2.789 N/A ASP 254.A N ASN 252.A OD1 no hydrogen 2.867 N/A HIS 256.A NE2 PRO 201.A O no hydrogen 2.882 N/A ARG 257.A N ASP 115.A OD2 no hydrogen 3.386 N/A GLN 258.A N ASP 254.A O no hydrogen 2.838 N/A ASP 259.A N PHE 255.A O no hydrogen 3.127 N/A LEU 260.A N HIS 256.A O no hydrogen 3.131 N/A TRP 261.A N ARG 257.A O no hydrogen 3.262 N/A ASP 262.A N GLN 258.A O no hydrogen 2.838 N/A ALA 263.A N ASP 259.A O no hydrogen 3.091 N/A ILE 264.A N LEU 260.A O no hydrogen 3.373 N/A GLU 265.A N TRP 261.A O no hydrogen 3.028 N/A SER 266.A N ALA 263.A O no hydrogen 3.261 N/A SER 266.A OG ASP 262.A O no hydrogen 3.387 N/A SER 266.A OG ALA 263.A O no hydrogen 3.121 N/A GLY 267.A N ILE 264.A O no hydrogen 3.238 N/A ASN 268.A ND2 SER 266.A OG no hydrogen 2.717 N/A SER 271.A N GLN 235.A OE1 no hydrogen 2.391 N/A TRP 272.A N MET 311.A O no hydrogen 2.832 N/A TRP 272.A NE1 MET 207.A O no hydrogen 3.044 N/A GLU 273.A N LYS 232.A O no hydrogen 2.951 N/A LEU 274.A N GLY 309.A O no hydrogen 2.717 N/A ALA 275.A N HIS 230.A O no hydrogen 2.915 N/A VAL 276.A N GLN 306.A O no hydrogen 2.915 N/A GLN 277.A N LYS 228.A O no hydrogen 3.249 N/A GLN 277.A NE2 LEU 298.A O no hydrogen 3.001 N/A ILE 279.A N LEU 226.A O no hydrogen 2.939 N/A ASP 282.A N ASP 282.A OD1 no hydrogen 2.204 N/A LYS 283.A N ASP 280.A O no hydrogen 2.793 N/A ALA 286.A N LYS 283.A O no hydrogen 3.347 N/A LEU 291.A N ALA 284.A O no hydrogen 3.195 N/A LEU 292.A N ASP 290.A OD1 no hydrogen 3.491 N/A ASP 293.A N ASP 290.A O no hydrogen 3.090 N/A THR 295.A N ASP 293.A OD1 no hydrogen 3.007 N/A THR 295.A OG1 ASP 293.A OD1 no hydrogen 2.689 N/A LYS 296.A NZ ASP 441.A O no hydrogen 2.221 N/A PHE 297.A N GLN 445.A OE1 no hydrogen 2.913 N/A GLU 301.A N GLU 301.A OE1 no hydrogen 2.878 N/A PHE 302.A N PRO 299.A O no hydrogen 3.195 N/A ALA 303.A N PRO 299.A O no hydrogen 3.219 N/A GLN 306.A N VAL 276.A O no hydrogen 2.915 N/A LEU 308.A N LEU 274.A O no hydrogen 2.736 N/A GLU 310.A N THR 77.A O no hydrogen 3.139 N/A MET 311.A N TRP 272.A O no hydrogen 2.815 N/A THR 312.A N ILE 75.A O no hydrogen 2.987 N/A THR 312.A OG1 GLU 310.A OE2 no hydrogen 2.223 N/A LEU 313.A N PRO 270.A O no hydrogen 2.940 N/A ARG 315.A N HIS 73.A O no hydrogen 3.061 N/A ARG 315.A NE ASP 2.A OD1 no hydrogen 3.019 N/A ASN 316.A ND2 TRP 261.A O no hydrogen 3.172 N/A ASN 316.A ND2 GLU 265.A OE1 no hydrogen 2.825 N/A MET 318.A N GLU 323.A OE2 no hydrogen 2.970 N/A ASN 319.A N GLU 323.A OE2 no hydrogen 3.433 N/A TYR 320.A OH GLY 69.A O no hydrogen 2.323 N/A ALA 322.A N ASN 319.A OD1 no hydrogen 3.014 N/A GLU 323.A N ASN 319.A O no hydrogen 3.271 N/A GLU 325.A N TYR 320.A O no hydrogen 2.884 N/A GLN 326.A N PHE 321.A O no hydrogen 2.995 N/A GLN 326.A NE2 ALA 322.A O no hydrogen 3.481 N/A SER 328.A N ASN 372.A OD1 no hydrogen 2.905 N/A SER 328.A OG GLN 326.A O no hydrogen 3.244 N/A SER 328.A OG GLN 357.A OE1 no hydrogen 2.862 N/A GLN 330.A N ASP 135.A OD2 no hydrogen 3.127 N/A HIS 333.A N GLN 330.A O no hydrogen 3.083 N/A HIS 333.A ND1 ASP 135.A OD2 no hydrogen 2.720 N/A HIS 333.A NE2 GLU 367.A OE2 no hydrogen 3.177 N/A ARG 336.A NE GLU 220.A OE1 no hydrogen 3.037 N/A ARG 336.A NH1 GLN 413.A O no hydrogen 2.856 N/A ARG 336.A NH1 GLY 418.A O no hydrogen 3.296 N/A ARG 336.A NH2 GLU 220.A OE1 no hydrogen 2.406 N/A ARG 336.A NH2 GLN 413.A O no hydrogen 3.390 N/A VAL 338.A N VAL 335.A O no hydrogen 3.239 N/A ASP 339.A N ARG 216.A O no hydrogen 2.940 N/A THR 341.A OG1 THR 214.A O no hydrogen 2.531 N/A LEU 345.A N ASP 343.A OD1 no hydrogen 3.001 N/A GLN 347.A N ASP 343.A O no hydrogen 2.945 N/A GLN 347.A NE2 THR 341.A O no hydrogen 2.979 N/A ARG 349.A N LEU 345.A O no hydrogen 3.381 N/A ARG 349.A NE TYR 353.A OH no hydrogen 3.189 N/A ARG 349.A NH2 VAL 137.A O no hydrogen 3.146 N/A ARG 349.A NH2 TYR 353.A OH no hydrogen 2.734 N/A LEU 350.A N LEU 346.A O no hydrogen 3.417 N/A TYR 351.A N GLY 348.A O no hydrogen 3.172 N/A SER 352.A N GLY 348.A O no hydrogen 3.169 N/A TYR 353.A N ARG 349.A O no hydrogen 3.050 N/A ASP 355.A N TYR 351.A O no hydrogen 3.088 N/A THR 356.A N SER 352.A O no hydrogen 2.867 N/A GLN 357.A NE2 TYR 353.A O no hydrogen 3.119 N/A LEU 358.A N ASP 355.A O no hydrogen 3.154 N/A ASN 359.A N THR 356.A O no hydrogen 3.173 N/A ARG 360.A N THR 356.A O no hydrogen 3.303 N/A ARG 360.A NH1 GLU 325.A O no hydrogen 2.711 N/A ARG 360.A NH2 ILE 327.A O no hydrogen 3.043 N/A ARG 360.A NH2 GLN 357.A OE1 no hydrogen 3.421 N/A HIS 361.A N GLN 357.A O no hydrogen 3.010 N/A HIS 361.A NE2 SER 328.A OG no hydrogen 3.036 N/A ASN 365.A ND2 ASP 384.A O no hydrogen 3.281 N/A ASN 365.A ND2 GLN 386.A O no hydrogen 3.595 N/A GLN 368.A N ASN 365.A O no hydrogen 3.304 N/A GLN 368.A NE2 GLN 388.A OE1 no hydrogen 2.312 N/A LEU 369.A N PHE 366.A O no hydrogen 3.328 N/A ASN 372.A N LEU 369.A O no hydrogen 2.865 N/A ASN 372.A ND2 GLN 326.A O no hydrogen 3.340 N/A ASN 372.A ND2 PHE 366.A O no hydrogen 3.008 N/A ARG 373.A N LEU 369.A O no hydrogen 2.874 N/A SER 376.A OG GLY 377.A O no hydrogen 3.413 N/A HIS 382.A N ASN 380.A OD1 no hydrogen 3.262 N/A ARG 383.A NH1 ASN 380.A O no hydrogen 3.187 N/A ARG 383.A NH1 HIS 382.A O no hydrogen 2.790 N/A ARG 383.A NH2 ASN 394.A O no hydrogen 3.433 N/A GLN 388.A NE2 ASP 384.A O no hydrogen 2.686 N/A ALA 389.A N GLN 368.A OE1 no hydrogen 2.801 N/A TRP 390.A N GLN 388.A OE1 no hydrogen 3.312 N/A ASN 394.A ND2 HIS 396.A O no hydrogen 2.862 N/A HIS 396.A N ASN 394.A OD1 no hydrogen 2.725 N/A ASN 404.A N SER 401.A OG no hydrogen 3.053 N/A ASN 404.A ND2 HIS 396.A O no hydrogen 3.111 N/A ASN 404.A ND2 TYR 398.A O no hydrogen 3.012 N/A LYS 405.A N TYR 402.A O no hydrogen 3.057 N/A GLY 406.A N ASN 404.A OD1 no hydrogen 3.151 N/A ASN 412.A N VAL 415.A O no hydrogen 2.605 N/A GLN 413.A NE2 GLU 220.A O no hydrogen 3.543 N/A THR 414.A OG1 ASN 412.A OD1 no hydrogen 2.875 N/A VAL 415.A N ASN 412.A OD1 no hydrogen 2.799 N/A ARG 417.A NH1 GLU 220.A OE2 no hydrogen 2.700 N/A ARG 417.A NH2 ALA 87.A O no hydrogen 3.055 N/A ARG 417.A NH2 GLU 131.A OE1 no hydrogen 3.064 N/A GLY 418.A N ASN 412.A O no hydrogen 2.812 N/A THR 422.A N ASP 339.A OD2 no hydrogen 3.011 N/A THR 422.A OG1 ASP 339.A OD2 no hydrogen 2.609 N/A ARG 425.A N THR 422.A O no hydrogen 3.253 N/A ARG 425.A NE ASP 339.A OD2 no hydrogen 3.077 N/A ARG 425.A NH1 GLU 342.A OE2 no hydrogen 2.625 N/A ARG 425.A NH2 ASP 339.A OD1 no hydrogen 3.172 N/A ARG 425.A NH2 ASP 339.A OD2 no hydrogen 2.879 N/A ASN 432.A ND2 VAL 430.A O no hydrogen 3.167 N/A GLU 434.A N ASN 432.A OD1 no hydrogen 3.432 N/A SER 436.A OG THR 438.A OG1 no hydrogen 2.736 N/A THR 438.A N SER 436.A OG no hydrogen 3.220 N/A THR 438.A OG1 ASP 290.A OD2 no hydrogen 2.379 N/A THR 438.A OG1 SER 436.A OG no hydrogen 2.736 N/A PHE 439.A N SER 436.A O no hydrogen 3.126 N/A ASP 440.A N ALA 437.A O no hydrogen 3.275 N/A TYR 443.A N ASP 441.A OD1 no hydrogen 3.452 N/A TYR 443.A OH GLN 484.A OE1 no hydrogen 2.630 N/A THR 444.A N ASP 441.A OD1 no hydrogen 3.289 N/A THR 444.A OG1 ASP 441.A OD1 no hydrogen 2.762 N/A THR 444.A OG1 ASP 441.A OD2 no hydrogen 2.477 N/A GLN 445.A NE2 PHE 297.A O no hydrogen 3.163 N/A ARG 447.A N TYR 443.A O no hydrogen 3.411 N/A ARG 447.A NE ASN 451.A OD1 no hydrogen 2.900 N/A ARG 447.A NH1 ILE 488.A O no hydrogen 3.203 N/A LEU 448.A N THR 444.A O no hydrogen 3.076 N/A PHE 449.A N GLN 445.A O no hydrogen 2.830 N/A PHE 450.A N PRO 446.A O no hydrogen 2.876 N/A ASN 451.A N ARG 447.A O no hydrogen 2.920 N/A ASN 451.A ND2 HIS 513.A O no hydrogen 2.977 N/A ASN 451.A ND2 ASN 515.A O no hydrogen 3.345 N/A SER 452.A N PHE 449.A O no hydrogen 3.209 N/A SER 452.A OG LEU 448.A O no hydrogen 2.565 N/A LEU 453.A N PHE 450.A O no hydrogen 3.353 N/A THR 454.A N GLU 457.A OE1 no hydrogen 3.403 N/A GLN 458.A N THR 454.A O no hydrogen 2.839 N/A GLN 458.A NE2 PHE 450.A O no hydrogen 2.511 N/A GLN 459.A N PRO 455.A O no hydrogen 3.125 N/A GLN 459.A NE2 ASN 463.A OD1 no hydrogen 3.690 N/A PHE 460.A N VAL 456.A O no hydrogen 2.875 N/A VAL 461.A N GLU 457.A O no hydrogen 3.163 N/A ILE 462.A N GLN 458.A O no hydrogen 3.195 N/A ASN 463.A N GLN 459.A O no hydrogen 2.618 N/A ALA 464.A N PHE 460.A O no hydrogen 2.771 N/A ILE 465.A N VAL 461.A O no hydrogen 3.053 N/A ARG 466.A N ILE 462.A O no hydrogen 2.867 N/A ARG 466.A NE ARG 495.A O no hydrogen 2.861 N/A ARG 466.A NH1 ASN 463.A OD1 no hydrogen 3.326 N/A ARG 466.A NH1 ASP 678.A OD1 no hydrogen 3.226 N/A ARG 466.A NH2 ARG 495.A O no hydrogen 2.622 N/A ARG 466.A NH2 ASP 678.A OD1 no hydrogen 3.033 N/A PHE 467.A N ASN 463.A O no hydrogen 3.158 N/A GLU 468.A N ALA 464.A O no hydrogen 2.817 N/A ALA 469.A N ILE 465.A O no hydrogen 2.835 N/A SER 470.A N PHE 467.A O no hydrogen 3.324 N/A HIS 471.A N GLU 468.A O no hydrogen 3.039 N/A HIS 471.A ND1 PHE 467.A O no hydrogen 2.708 N/A VAL 472.A N ALA 469.A O no hydrogen 3.435 N/A THR 473.A N ASP 175.A OD1 no hydrogen 3.365 N/A THR 473.A N ASP 175.A OD2 no hydrogen 2.718 N/A THR 473.A OG1 ASP 175.A OD2 no hydrogen 2.534 N/A VAL 477.A N ASN 474.A OD1 no hydrogen 2.976 N/A LYS 478.A N ASN 474.A O no hydrogen 3.454 N/A LYS 478.A NZ VAL 472.A O no hydrogen 3.183 N/A LYS 479.A N GLU 475.A O no hydrogen 3.015 N/A ASN 480.A N GLN 476.A O no hydrogen 2.839 N/A VAL 481.A N VAL 477.A O no hydrogen 2.841 N/A LEU 482.A N LYS 478.A O no hydrogen 3.080 N/A GLU 483.A N LYS 479.A O no hydrogen 3.145 N/A GLN 484.A N ASN 480.A O no hydrogen 3.231 N/A LEU 485.A N VAL 481.A O no hydrogen 2.830 N/A ASN 486.A N LEU 482.A O no hydrogen 2.834 N/A ASN 486.A ND2 GLN 506.A O no hydrogen 2.850 N/A LYS 487.A N GLU 483.A O no hydrogen 3.380 N/A ILE 488.A N LEU 485.A O no hydrogen 3.069 N/A SER 489.A N LEU 485.A O no hydrogen 2.945 N/A ASN 490.A ND2 ASN 486.A OD1 no hydrogen 2.480 N/A ASN 490.A ND2 PRO 505.A O no hydrogen 3.315 N/A VAL 492.A N SER 489.A OG no hydrogen 3.024 N/A ALA 493.A N SER 489.A O no hydrogen 3.160 N/A LYS 494.A N ASN 490.A O no hydrogen 2.764 N/A ARG 495.A N ASP 491.A O no hydrogen 2.809 N/A ARG 495.A NE ASP 678.A OD2 no hydrogen 3.277 N/A ARG 495.A NH1 ASP 491.A OD2 no hydrogen 2.796 N/A ARG 495.A NH2 GLN 459.A OE1 no hydrogen 2.489 N/A VAL 496.A N VAL 492.A O no hydrogen 2.950 N/A ALA 497.A N ALA 493.A O no hydrogen 3.086 N/A ALA 499.A N VAL 496.A O no hydrogen 3.044 N/A LEU 500.A N VAL 496.A O no hydrogen 3.478 N/A GLY 501.A N VAL 498.A O no hydrogen 3.042 N/A LEU 502.A N ALA 497.A O no hydrogen 2.941 N/A THR 510.A OG1 ASP 508.A OD1 no hydrogen 3.174 N/A THR 510.A OG1 ASP 508.A OD2 no hydrogen 3.414 N/A TYR 512.A N PRO 509.A O no hydrogen 3.374 N/A TYR 512.A OH ASN 486.A O no hydrogen 2.432 N/A HIS 513.A NE2 THR 444.A O no hydrogen 2.713 N/A ASN 515.A N HIS 513.A ND1 no hydrogen 3.038 N/A THR 517.A N SER 452.A OG no hydrogen 2.950 N/A THR 517.A OG1 GLU 301.A OE1 no hydrogen 3.319 N/A THR 517.A OG1 ARG 518.A O no hydrogen 3.558 N/A ARG 518.A N GLU 301.A OE2 no hydrogen 3.234 N/A SER 521.A OG GLU 457.A OE1 no hydrogen 2.402 N/A ILE 522.A N GLU 457.A OE2 no hydrogen 3.054 N/A PHE 523.A N GLU 457.A OE2 no hydrogen 3.084 N/A LEU 527.A N LYS 667.A O no hydrogen 2.884 N/A ALA 531.A N THR 529.A OG1 no hydrogen 2.846 N/A THR 532.A N GLY 560.A O no hydrogen 2.827 N/A THR 532.A OG1 ALA 531.A O no hydrogen 2.152 N/A LEU 533.A N ILE 530.A O no hydrogen 3.273 N/A ARG 534.A N ASP 587.A OD2 no hydrogen 2.665 N/A ARG 534.A NH2 ASP 262.A OD2 no hydrogen 3.147 N/A VAL 535.A N LYS 562.A O no hydrogen 3.038 N/A GLY 536.A N ALA 588.A O no hydrogen 3.014 N/A VAL 537.A N THR 564.A O no hydrogen 2.952 N/A LEU 538.A N VAL 590.A O no hydrogen 3.011 N/A SER 539.A N ILE 566.A O no hydrogen 2.944 N/A SER 539.A OG THR 540.A O no hydrogen 3.289 N/A SER 539.A OG SER 545.A OG no hydrogen 3.116 N/A THR 540.A N SER 539.A OG no hydrogen 2.412 N/A THR 540.A OG1 GLU 568.A OE1 no hydrogen 2.885 N/A THR 540.A OG1 GLU 568.A OE2 no hydrogen 2.452 N/A THR 541.A N GLU 568.A OE1 no hydrogen 2.827 N/A THR 541.A OG1 GLU 568.A OE1 no hydrogen 2.996 N/A LYS 542.A N THR 540.A OG1 no hydrogen 3.365 N/A SER 545.A OG SER 539.A OG no hydrogen 3.116 N/A SER 545.A OG GLU 593.A O no hydrogen 2.711 N/A LYS 548.A N GLY 544.A O no hydrogen 3.146 N/A LYS 548.A NZ GLU 593.A OE1 no hydrogen 3.484 N/A LYS 548.A NZ GLU 593.A OE2 no hydrogen 3.446 N/A ALA 549.A N SER 545.A O no hydrogen 2.559 N/A LYS 550.A N LEU 546.A O no hydrogen 2.658 N/A ALA 551.A N ASP 547.A O no hydrogen 3.046 N/A LEU 552.A N LYS 548.A O no hydrogen 3.407 N/A LYS 553.A N ALA 549.A O no hydrogen 3.231 N/A LYS 553.A NZ ASP 575.A OD1 no hydrogen 3.388 N/A LYS 553.A NZ ASP 575.A OD2 no hydrogen 3.083 N/A GLU 554.A N LYS 550.A O no hydrogen 3.260 N/A GLN 555.A N ALA 551.A O no hydrogen 3.446 N/A LEU 556.A N LEU 552.A O no hydrogen 3.188 N/A GLU 557.A N LYS 553.A O no hydrogen 3.124 N/A LYS 558.A NZ GLU 554.A O no hydrogen 3.102 N/A ASP 559.A N LEU 556.A O no hydrogen 3.244 N/A GLY 560.A N GLU 557.A O no hydrogen 3.115 N/A LYS 562.A N LEU 533.A O no hydrogen 2.827 N/A THR 564.A N VAL 535.A O no hydrogen 3.011 N/A VAL 565.A N ASP 575.A OD2 no hydrogen 3.055 N/A ILE 566.A N VAL 537.A O no hydrogen 3.051 N/A ALA 567.A N GLN 576.A O no hydrogen 3.263 N/A GLU 568.A N GLU 568.A OE1 no hydrogen 2.871 N/A ALA 571.A N TYR 569.A O no hydrogen 2.831 N/A VAL 574.A N ALA 571.A O no hydrogen 3.374 N/A ASP 575.A N VAL 565.A O no hydrogen 2.857 N/A GLN 576.A N VAL 565.A O no hydrogen 3.223 N/A TYR 578.A OH SER 539.A O no hydrogen 3.204 N/A ALA 580.A N THR 577.A OG1 no hydrogen 3.108 N/A ALA 581.A N TYR 578.A O no hydrogen 3.330 N/A THR 584.A N ASP 582.A OD2 no hydrogen 3.094 N/A THR 584.A OG1 ASP 582.A OD2 no hydrogen 2.719 N/A ALA 585.A N ASP 582.A O no hydrogen 3.361 N/A PHE 586.A N ALA 583.A O no hydrogen 3.198 N/A ASP 587.A N ARG 534.A O no hydrogen 2.551 N/A ALA 588.A N ARG 534.A O no hydrogen 3.297 N/A VAL 589.A N PRO 627.A O no hydrogen 3.179 N/A VAL 590.A N GLY 536.A O no hydrogen 3.132 N/A VAL 591.A N ALA 629.A O no hydrogen 2.639 N/A ALA 592.A N LEU 538.A O no hydrogen 2.857 N/A GLY 594.A N GLU 596.A OE2 no hydrogen 2.682 N/A ALA 595.A N ALA 592.A O no hydrogen 3.405 N/A VAL 598.A N ALA 595.A O no hydrogen 3.346 N/A PHE 599.A N GLU 596.A O no hydrogen 3.154 N/A ALA 604.A N GLY 601.A O no hydrogen 3.362 N/A MET 605.A N LYS 602.A O no hydrogen 2.927 N/A LEU 608.A N SER 606.A OG no hydrogen 3.203 N/A GLY 612.A N ALA 604.A O no hydrogen 3.409 N/A ARG 613.A N PRO 610.A O no hydrogen 3.167 N/A ARG 613.A NH1 TYR 578.A O no hydrogen 3.216 N/A ARG 613.A NH1 SER 579.A O no hydrogen 3.404 N/A ARG 613.A NH1 ALA 581.A O no hydrogen 3.165 N/A SER 615.A OG PHE 599.A O no hydrogen 3.476 N/A GLN 616.A N GLY 612.A O no hydrogen 2.900 N/A GLN 616.A NE2 ASP 620.A OD1 no hydrogen 3.010 N/A ILE 617.A N ARG 613.A O no hydrogen 3.209 N/A LEU 618.A N PRO 614.A O no hydrogen 3.359 N/A THR 619.A N SER 615.A O no hydrogen 2.967 N/A THR 619.A OG1 SER 615.A O no hydrogen 2.326 N/A ASP 620.A N GLN 616.A O no hydrogen 2.536 N/A GLY 621.A N ILE 617.A O no hydrogen 2.966 N/A TYR 622.A N LEU 618.A O no hydrogen 2.953 N/A TYR 622.A OH GLU 647.A OE1 no hydrogen 2.465 N/A ARG 623.A N THR 619.A O no hydrogen 2.998 N/A GLY 625.A N TYR 622.A O no hydrogen 3.074 N/A LYS 626.A N GLY 621.A O no hydrogen 3.221 N/A LYS 626.A NZ GLU 244.A OE2 no hydrogen 2.873 N/A LYS 626.A NZ ALA 583.A O no hydrogen 3.198 N/A LYS 626.A NZ PHE 586.A O no hydrogen 2.196 N/A VAL 628.A N GLY 649.A O no hydrogen 3.043 N/A ALA 629.A N VAL 589.A O no hydrogen 2.885 N/A ALA 630.A N TYR 651.A O no hydrogen 2.931 N/A VAL 631.A N VAL 591.A O no hydrogen 3.058 N/A GLY 632.A N GLY 653.A O no hydrogen 2.518 N/A SER 633.A OG GLU 596.A OE2 no hydrogen 3.287 N/A ALA 634.A N VAL 631.A O no hydrogen 3.158 N/A LYS 635.A N GLY 632.A O no hydrogen 3.453 N/A LYS 636.A N SER 633.A O no hydrogen 3.193 N/A ALA 637.A N ALA 634.A O no hydrogen 2.927 N/A GLN 639.A N LYS 635.A O no hydrogen 3.144 N/A SER 640.A N ALA 637.A O no hydrogen 3.277 N/A SER 640.A OG ALA 637.A O no hydrogen 2.191 N/A VAL 643.A N LEU 638.A O no hydrogen 2.915 N/A GLU 647.A N GLU 644.A O no hydrogen 3.019 N/A TYR 651.A N VAL 628.A O no hydrogen 3.021 N/A GLY 653.A N ALA 630.A O no hydrogen 3.350 N/A ALA 654.A N GLU 657.A OE1 no hydrogen 3.350 N/A VAL 658.A N ALA 654.A O no hydrogen 2.854 N/A ILE 659.A N GLN 655.A O no hydrogen 2.864 N/A LYS 660.A N ASP 656.A O no hydrogen 3.423 N/A LYS 660.A NZ LYS 660.A O no hydrogen 3.261 N/A GLY 661.A N GLU 657.A O no hydrogen 3.121 N/A VAL 662.A N VAL 658.A O no hydrogen 2.838 N/A GLU 663.A N ILE 659.A O no hydrogen 3.132 N/A GLU 664.A N LYS 660.A O no hydrogen 3.120 N/A GLY 665.A N GLY 661.A O no hydrogen 2.930 N/A LEU 666.A N VAL 662.A O no hydrogen 2.763 N/A PHE 669.A N GLY 665.A O no hydrogen 2.718 N/A LYS 670.A N VAL 668.A O no hydrogen 2.705 N/A LYS 670.A NZ GLU 244.A OE1 no hydrogen 2.829 N/A PHE 671.A N GLY 625.A O no hydrogen 2.696 N/A ARG 674.A N PHE 671.A O no hydrogen 3.410 N/A ARG 674.A NH1 TYR 622.A O no hydrogen 3.003 N/A ARG 674.A NH1 LYS 626.A O no hydrogen 2.586 N/A ARG 674.A NH2 LYS 626.A O no hydrogen 3.324 N/A ARG 674.A NH2 ALA 648.A O no hydrogen 3.116 N/A ASP 678.A N GLN 459.A OE1 no hydrogen 3.166 N/A