Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1aro_P.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LYS 1.A N ASP 3.A OD1 no hydrogen 2.848 N/A ILE 7.A N SER 5.A OG no hydrogen 3.364 N/A GLU 8.A N SER 5.A OG no hydrogen 3.343 N/A LEU 9.A N SER 5.A O no hydrogen 3.248 N/A ALA 11.A N GLU 8.A O no hydrogen 2.637 N/A ILE 12.A N GLU 8.A O no hydrogen 2.980 N/A ASN 15.A N ALA 11.A O no hydrogen 2.942 N/A THR 16.A N ILE 12.A O no hydrogen 2.768 N/A THR 16.A N PRO 13.A O no hydrogen 3.100 N/A THR 16.A OG1 ILE 12.A O no hydrogen 2.934 N/A LEU 17.A N PRO 13.A O no hydrogen 2.934 N/A ALA 18.A N PHE 14.A O no hydrogen 2.802 N/A HIS 20.A N THR 16.A O no hydrogen 2.842 N/A HIS 20.A ND1 THR 16.A O no hydrogen 3.163 N/A TYR 21.A N LEU 17.A O no hydrogen 3.086 N/A GLY 22.A N LEU 17.A O no hydrogen 3.389 N/A ALA 26.A N GLY 22.A O no hydrogen 3.136 N/A ARG 27.A NE LYS 143.A O no hydrogen 3.220 N/A ARG 27.A NH1 GLU 138.A O no hydrogen 3.503 N/A ARG 27.A NH1 ALA 139.A O no hydrogen 2.812 N/A ARG 27.A NH2 ALA 139.A O no hydrogen 2.716 N/A ARG 27.A NH2 LYS 143.A O no hydrogen 3.149 N/A GLU 28.A N LEU 25.A O no hydrogen 2.824 N/A GLN 29.A N LEU 25.A O no hydrogen 2.956 N/A GLN 29.A NE2 VAL 229.A O no hydrogen 3.269 N/A ALA 31.A N ARG 27.A O no hydrogen 3.279 N/A LEU 32.A N GLU 28.A O no hydrogen 3.329 N/A GLU 33.A N GLN 29.A O no hydrogen 2.863 N/A HIS 34.A N LEU 30.A O no hydrogen 2.770 N/A GLU 35.A N LEU 32.A O no hydrogen 3.008 N/A SER 36.A N GLU 33.A O no hydrogen 3.249 N/A SER 36.A OG GLU 33.A O no hydrogen 3.272 N/A SER 36.A OG MET 223.A O no hydrogen 2.753 N/A TYR 37.A N HIS 34.A O no hydrogen 3.133 N/A GLU 38.A N HIS 34.A O no hydrogen 3.324 N/A PHE 44.A N GLY 40.A O no hydrogen 3.229 N/A ARG 45.A N GLU 41.A O no hydrogen 2.941 N/A LYS 46.A N ALA 42.A O no hydrogen 3.056 N/A MET 47.A N PHE 44.A O no hydrogen 3.169 N/A PHE 48.A N PHE 44.A O no hydrogen 2.718 N/A GLU 49.A N ARG 45.A O no hydrogen 3.046 N/A GLN 51.A N PHE 48.A O no hydrogen 3.323 N/A LEU 52.A N GLU 49.A O no hydrogen 2.501 N/A LYS 60.A N THR 56.A O no hydrogen 3.338 N/A MET 61.A N LEU 57.A O no hydrogen 3.134 N/A ILE 62.A N LEU 58.A O no hydrogen 3.065 N/A ALA 63.A N PRO 59.A O no hydrogen 3.287 N/A ARG 64.A N LYS 60.A O no hydrogen 3.313 N/A ILE 65.A N MET 61.A O no hydrogen 3.026 N/A ASN 66.A N ALA 63.A O no hydrogen 2.302 N/A ASP 67.A N ALA 63.A O no hydrogen 2.913 N/A TRP 68.A N ARG 64.A O no hydrogen 2.869 N/A GLU 71.A N ASP 67.A O no hydrogen 2.897 N/A VAL 72.A N TRP 68.A O no hydrogen 3.146 N/A ALA 74.A N GLU 71.A O no hydrogen 3.204 N/A PHE 83.A N PRO 80.A O no hydrogen 3.488 N/A LEU 86.A N ALA 82.A O no hydrogen 2.891 N/A GLN 87.A N PHE 83.A O no hydrogen 2.914 N/A ILE 89.A N LEU 86.A O no hydrogen 2.961 N/A LYS 90.A NZ ASP 136.A OD2 no hydrogen 3.271 N/A ALA 93.A N LYS 90.A O no hydrogen 2.702 N/A VAL 94.A N LYS 90.A O no hydrogen 3.240 N/A ALA 95.A N PRO 91.A O no hydrogen 2.774 N/A TYR 96.A OH GLY 219.A O no hydrogen 2.644 N/A ILE 97.A N ALA 93.A O no hydrogen 2.645 N/A THR 98.A N VAL 94.A O no hydrogen 2.950 N/A THR 98.A OG1 VAL 94.A O no hydrogen 2.502 N/A ILE 99.A N ALA 95.A O no hydrogen 3.249 N/A LYS 100.A N TYR 96.A O no hydrogen 2.756 N/A LYS 100.A NZ SER 36.A O no hydrogen 3.285 N/A THR 101.A N ILE 97.A O no hydrogen 3.252 N/A THR 101.A OG1 ILE 97.A O no hydrogen 2.791 N/A THR 102.A N THR 98.A O no hydrogen 3.271 N/A THR 102.A OG1 THR 98.A O no hydrogen 2.382 N/A LEU 103.A N ILE 99.A O no hydrogen 3.402 N/A ALA 104.A N LYS 100.A O no hydrogen 3.417 N/A CYS 105.A N THR 101.A O no hydrogen 2.799 N/A LEU 106.A N THR 102.A O no hydrogen 3.272 N/A THR 107.A N ALA 104.A O no hydrogen 2.856 N/A THR 107.A OG1 ALA 104.A O no hydrogen 2.955 N/A SER 108.A N CYS 105.A O no hydrogen 3.321 N/A SER 108.A OG ASN 111.A O no hydrogen 3.518 N/A ASP 110.A N SER 108.A OG no hydrogen 3.291 N/A ASN 111.A N SER 108.A OG no hydrogen 3.120 N/A THR 112.A OG1 GLU 198.A OE1 no hydrogen 3.495 N/A THR 112.A OG1 GLU 198.A OE2 no hydrogen 3.564 N/A THR 113.A N ASN 111.A OD1 no hydrogen 3.203 N/A VAL 114.A N SER 197.A O no hydrogen 2.845 N/A GLN 115.A NE2 THR 655.A O no hydrogen 2.876 N/A VAL 117.A N THR 113.A O no hydrogen 2.872 N/A ALA 118.A N VAL 114.A O no hydrogen 2.671 N/A SER 119.A N GLN 115.A O no hydrogen 2.950 N/A ALA 120.A N ALA 116.A O no hydrogen 2.794 N/A ILE 121.A N VAL 117.A O no hydrogen 3.205 N/A GLY 122.A N ALA 118.A O no hydrogen 3.014 N/A ARG 123.A N SER 119.A O no hydrogen 3.133 N/A ILE 125.A N ILE 121.A O no hydrogen 3.281 N/A GLU 126.A N GLY 122.A O no hydrogen 3.479 N/A ASP 127.A N ARG 123.A O no hydrogen 3.204 N/A GLU 128.A N ALA 124.A O no hydrogen 2.983 N/A ALA 129.A N ILE 125.A O no hydrogen 2.695 N/A ARG 130.A N GLU 126.A O no hydrogen 2.603 N/A ARG 130.A NH2 SER 166.A OG no hydrogen 3.244 N/A PHE 131.A N ASP 127.A O no hydrogen 2.658 N/A PHE 131.A N GLU 128.A O no hydrogen 2.834 N/A ARG 133.A NH2 GLU 88.A OE1 no hydrogen 3.276 N/A ARG 133.A NH2 GLU 88.A OE2 no hydrogen 3.412 N/A ARG 135.A N PHE 131.A O no hydrogen 3.257 N/A ARG 135.A NH2 GLU 38.A OE1 no hydrogen 2.812 N/A ASP 136.A N GLY 132.A O no hydrogen 3.311 N/A LEU 137.A N ARG 133.A O no hydrogen 2.927 N/A GLU 138.A N ILE 134.A O no hydrogen 2.993 N/A ALA 139.A N ARG 135.A O no hydrogen 2.841 N/A LYS 140.A N ASP 136.A O no hydrogen 3.424 N/A HIS 141.A N LEU 137.A O no hydrogen 3.332 N/A HIS 141.A N GLU 138.A O no hydrogen 3.102 N/A HIS 141.A NE2 ASN 15.A OD1 no hydrogen 3.202 N/A PHE 142.A N ALA 139.A O no hydrogen 2.418 N/A LEU 158.A N SER 155.A O no hydrogen 3.040 N/A GLY 160.A N LEU 158.A O no hydrogen 3.170 N/A TRP 164.A N GLU 162.A OE2 no hydrogen 3.113 N/A SER 166.A N GLU 126.A OE2 no hydrogen 2.709 N/A TRP 167.A N GLU 126.A OE2 no hydrogen 3.427 N/A SER 172.A N HIS 168.A O no hydrogen 3.042 N/A ILE 173.A N LYS 169.A O no hydrogen 3.070 N/A ILE 173.A N GLU 170.A O no hydrogen 2.549 N/A HIS 174.A N GLU 170.A O no hydrogen 3.186 N/A HIS 174.A NE2 GLU 170.A OE2 no hydrogen 2.850 N/A VAL 175.A N ASP 171.A O no hydrogen 3.024 N/A GLY 176.A N SER 172.A O no hydrogen 3.165 N/A VAL 177.A N ILE 173.A O no hydrogen 2.841 N/A ARG 178.A N HIS 174.A O no hydrogen 2.937 N/A ARG 178.A NH1 GLU 181.A OE1 no hydrogen 2.625 N/A CYS 179.A N VAL 175.A O no hydrogen 3.169 N/A CYS 179.A SG THR 98.A OG1 no hydrogen 3.592 N/A CYS 179.A SG VAL 175.A O no hydrogen 3.561 N/A ILE 180.A N GLY 176.A O no hydrogen 2.730 N/A GLU 181.A N VAL 177.A O no hydrogen 2.872 N/A MET 182.A N ARG 178.A O no hydrogen 2.822 N/A LEU 183.A N CYS 179.A O no hydrogen 2.916 N/A ILE 184.A N ILE 180.A O no hydrogen 3.308 N/A GLU 185.A N GLU 181.A O no hydrogen 3.135 N/A SER 186.A N MET 182.A O no hydrogen 3.275 N/A SER 186.A OG MET 182.A O no hydrogen 3.091 N/A THR 187.A N LEU 183.A O no hydrogen 3.057 N/A THR 187.A OG1 LEU 183.A O no hydrogen 2.766 N/A THR 187.A OG1 THR 187.A O no hydrogen 2.493 N/A MET 189.A N THR 187.A O no hydrogen 2.499 N/A HIS 193.A N GLU 198.A O no hydrogen 3.049 N/A SER 197.A OG HIS 193.A O no hydrogen 2.725 N/A GLU 198.A N SER 197.A OG no hydrogen 2.521 N/A THR 199.A N THR 112.A O no hydrogen 2.779 N/A ALA 203.A N MET 189.A O no hydrogen 2.966 N/A ALA 207.A N ALA 203.A O no hydrogen 3.004 N/A ALA 209.A N GLU 205.A O no hydrogen 3.124 N/A ILE 210.A N TYR 206.A O no hydrogen 3.073 N/A ALA 211.A N ALA 207.A O no hydrogen 3.440 N/A THR 212.A N GLU 208.A O no hydrogen 2.874 N/A THR 212.A OG1 GLU 208.A O no hydrogen 2.511 N/A ARG 213.A N ALA 209.A O no hydrogen 3.302 N/A ILE 220.A N LEU 217.A O no hydrogen 2.951 N/A CYS 227.A N TRP 332.A O no hydrogen 2.876 N/A VAL 228.A N GLN 29.A OE1 no hydrogen 3.162 N/A LYS 232.A N GLY 241.A O no hydrogen 2.964 N/A LYS 232.A NZ LEU 158.A O no hydrogen 2.673 N/A THR 238.A OG1 GLY 160.A O no hydrogen 2.974 N/A THR 238.A OG1 GLY 161.A O no hydrogen 2.825 N/A GLY 239.A N LEU 250.A O no hydrogen 2.871 N/A GLY 241.A N LYS 232.A O no hydrogen 3.136 N/A TYR 242.A N GLY 240.A O no hydrogen 2.519 N/A TYR 242.A OH GLN 225.A O no hydrogen 2.961 N/A TRP 243.A N GLU 33.A OE2 no hydrogen 2.993 N/A TRP 243.A NE1 PRO 230.A O no hydrogen 3.100 N/A ALA 244.A N GLU 33.A OE1 no hydrogen 3.042 N/A ALA 244.A N GLU 33.A OE2 no hydrogen 3.448 N/A ASN 245.A N GLU 138.A OE2 no hydrogen 3.065 N/A GLY 246.A N GLU 138.A OE1 no hydrogen 3.334 N/A ARG 248.A N TYR 37.A OH no hydrogen 3.110 N/A ARG 248.A NE GLU 162.A O no hydrogen 3.320 N/A ARG 248.A NH1 ASP 127.A OD1 no hydrogen 3.137 N/A ARG 248.A NH2 GLU 162.A O no hydrogen 3.257 N/A LEU 252.A N ILE 237.A O no hydrogen 2.869 N/A ARG 254.A N MET 337.A O no hydrogen 2.680 N/A THR 255.A OG1 SER 257.A O no hydrogen 3.378 N/A LYS 258.A NZ GLU 162.A OE1 no hydrogen 2.511 N/A ALA 260.A N SER 257.A OG no hydrogen 3.288 N/A LEU 261.A N SER 257.A O no hydrogen 3.103 N/A MET 262.A N LYS 258.A O no hydrogen 2.819 N/A ARG 263.A N ALA 260.A O no hydrogen 3.257 N/A TYR 264.A N LEU 261.A O no hydrogen 3.447 N/A TYR 264.A OH PRO 629.A O no hydrogen 2.725 N/A VAL 267.A N TYR 264.A O no hydrogen 2.649 N/A VAL 272.A N MET 269.A O no hydrogen 3.401 N/A TYR 273.A OH GLY 236.A O no hydrogen 2.764 N/A LYS 274.A N PRO 270.A O no hydrogen 2.875 N/A LYS 274.A NZ GLU 271.A OE2 no hydrogen 3.325 N/A LYS 274.A NZ GLU 695.A OE1 no hydrogen 3.384 N/A LYS 274.A NZ GLU 695.A OE2 no hydrogen 2.829 N/A ALA 275.A N GLU 271.A O no hydrogen 2.926 N/A ILE 276.A N VAL 272.A O no hydrogen 2.961 N/A ASN 277.A N TYR 273.A O no hydrogen 2.892 N/A ILE 278.A N LYS 274.A O no hydrogen 2.751 N/A ALA 279.A N ALA 275.A O no hydrogen 2.867 N/A GLN 280.A N ASN 277.A O no hydrogen 2.954 N/A ASN 281.A N ASN 277.A O no hydrogen 3.223 N/A ASN 281.A N ILE 278.A O no hydrogen 3.174 N/A ASN 281.A ND2 ASN 277.A O no hydrogen 3.416 N/A THR 282.A OG1 ALA 279.A O no hydrogen 3.536 N/A THR 282.A OG1 PHE 702.A O no hydrogen 3.319 N/A TRP 284.A N ILE 331.A O no hydrogen 2.911 N/A LYS 285.A N THR 362.A O no hydrogen 2.971 N/A ASN 287.A N LEU 360.A O no hydrogen 2.875 N/A LYS 288.A N ILE 286.A O no hydrogen 3.020 N/A VAL 290.A N ASN 287.A OD1 no hydrogen 2.996 N/A LEU 291.A N ASN 287.A O no hydrogen 2.938 N/A ALA 292.A N LYS 288.A O no hydrogen 2.684 N/A VAL 293.A N VAL 290.A O no hydrogen 3.046 N/A ALA 294.A N VAL 290.A O no hydrogen 2.987 N/A ASN 295.A N LEU 291.A O no hydrogen 2.797 N/A ASN 295.A ND2 LEU 291.A O no hydrogen 2.665 N/A VAL 296.A N VAL 293.A O no hydrogen 2.798 N/A ILE 297.A N VAL 293.A O no hydrogen 3.091 N/A THR 298.A N ALA 294.A O no hydrogen 3.368 N/A THR 298.A OG1 ALA 294.A O no hydrogen 2.808 N/A LYS 299.A N VAL 296.A O no hydrogen 3.031 N/A LYS 299.A NZ THR 298.A OG1 no hydrogen 3.370 N/A LYS 304.A N VAL 301.A O no hydrogen 3.143 N/A LYS 306.A NZ ALA 109.A O no hydrogen 3.326 N/A LYS 309.A N ASP 305.A O no hydrogen 3.306 N/A SER 310.A N ALA 307.A O no hydrogen 3.243 N/A SER 310.A OG LYS 306.A O no hydrogen 3.337 N/A SER 310.A OG ALA 307.A O no hydrogen 3.210 N/A ARG 311.A N ALA 307.A O no hydrogen 2.564 N/A SER 314.A N SER 310.A O no hydrogen 3.304 N/A LEU 315.A N ARG 311.A O no hydrogen 2.957 N/A GLU 316.A N ARG 312.A O no hydrogen 2.972 N/A PHE 317.A N ILE 313.A O no hydrogen 2.850 N/A MET 318.A N SER 314.A O no hydrogen 3.074 N/A MET 318.A N LEU 315.A O no hydrogen 2.984 N/A LEU 319.A N GLU 316.A O no hydrogen 3.256 N/A GLU 320.A N GLU 316.A O no hydrogen 3.087 N/A GLN 321.A NE2 GLN 225.A OE1 no hydrogen 3.115 N/A LYS 324.A N GLU 320.A O no hydrogen 3.266 N/A LYS 324.A NZ GLU 35.A OE1 no hydrogen 3.090 N/A LYS 324.A NZ GLN 225.A OE1 no hydrogen 3.290 N/A PHE 325.A N GLN 321.A O no hydrogen 3.233 N/A ALA 326.A N ASN 323.A O no hydrogen 3.116 N/A HIS 328.A N PHE 325.A O no hydrogen 3.073 N/A ILE 331.A N TRP 284.A O no hydrogen 2.642 N/A TRP 332.A N CYS 227.A O no hydrogen 3.074 N/A ASN 336.A N TYR 344.A O no hydrogen 2.632 N/A ASN 336.A ND2 ALA 251.A O no hydrogen 2.447 N/A ASN 336.A ND2 TYR 335.A O no hydrogen 3.678 N/A MET 337.A N LEU 252.A O no hydrogen 2.912 N/A ASP 338.A N ARG 342.A O no hydrogen 2.980 N/A ARG 340.A NH2 ASP 338.A OD2 no hydrogen 2.923 N/A GLY 341.A N ASP 338.A O no hydrogen 3.473 N/A TYR 344.A N ASN 336.A O no hydrogen 2.795 N/A TYR 344.A OH ASP 338.A OD2 no hydrogen 3.002 N/A ALA 345.A N GLN 352.A OE1 no hydrogen 3.207 N/A VAL 346.A N PRO 334.A O no hydrogen 3.102 N/A SER 347.A OG PHE 349.A O no hydrogen 2.850 N/A MET 348.A N PHE 224.A O no hydrogen 3.434 N/A GLN 352.A NE2 VAL 343.A O no hydrogen 3.562 N/A GLN 352.A NE2 LEU 704.A O no hydrogen 3.112 N/A THR 357.A N ASN 354.A O no hydrogen 3.190 N/A THR 357.A N ASN 354.A OD1 no hydrogen 2.831 N/A THR 357.A OG1 ASN 354.A OD1 no hydrogen 2.650 N/A LYS 358.A N ASN 354.A O no hydrogen 3.003 N/A LYS 358.A NZ GLY 353.A O no hydrogen 3.031 N/A GLY 359.A N ASP 355.A O no hydrogen 2.689 N/A LEU 360.A N MET 356.A O no hydrogen 2.991 N/A THR 362.A N LYS 285.A O no hydrogen 2.916 N/A THR 362.A OG1 LEU 363.A O no hydrogen 3.497 N/A ALA 364.A N ALA 283.A O no hydrogen 3.192 N/A LYS 365.A NZ GLU 700.A OE1 no hydrogen 2.362 N/A LYS 367.A NZ ASP 715.A OD1 no hydrogen 3.237 N/A LYS 367.A NZ ASP 715.A OD2 no hydrogen 3.308 N/A ILE 369.A N TYR 445.A O no hydrogen 3.345 N/A TYR 374.A N GLY 370.A O no hydrogen 3.324 N/A TYR 375.A N LYS 371.A O no hydrogen 3.253 N/A TYR 375.A N GLU 372.A O no hydrogen 2.612 N/A TRP 376.A N GLU 372.A O no hydrogen 3.033 N/A LEU 377.A N GLY 373.A O no hydrogen 2.833 N/A LYS 378.A N TYR 374.A O no hydrogen 3.387 N/A ILE 379.A N TYR 375.A O no hydrogen 2.900 N/A HIS 380.A N TRP 376.A O no hydrogen 2.747 N/A GLY 381.A N LEU 377.A O no hydrogen 2.915 N/A ALA 382.A N LYS 378.A O no hydrogen 2.976 N/A ALA 382.A N ILE 379.A O no hydrogen 3.233 N/A ASN 383.A N ILE 379.A O no hydrogen 3.268 N/A CYS 384.A N HIS 380.A O no hydrogen 2.982 N/A CYS 384.A SG HIS 380.A O no hydrogen 3.026 N/A CYS 384.A SG CYS 427.A O no hydrogen 3.765 N/A ALA 385.A N ALA 382.A O no hydrogen 2.504 N/A GLY 386.A N ALA 382.A O no hydrogen 3.041 N/A ASP 388.A N GLY 386.A O no hydrogen 2.611 N/A ARG 395.A N PHE 392.A O no hydrogen 2.921 N/A ARG 395.A NH2 ASP 388.A O no hydrogen 3.459 N/A ILE 396.A N PHE 392.A O no hydrogen 2.797 N/A LYS 397.A N PRO 393.A O no hydrogen 3.495 N/A ILE 399.A N ILE 396.A O no hydrogen 2.742 N/A GLU 400.A N GLU 400.A OE1 no hydrogen 2.800 N/A GLU 401.A N LYS 397.A O no hydrogen 2.827 N/A ASN 402.A N ILE 399.A O no hydrogen 2.661 N/A ASN 402.A ND2 PHE 398.A O no hydrogen 2.681 N/A HIS 403.A N GLU 400.A O no hydrogen 2.954 N/A ASN 405.A N ASN 402.A O no hydrogen 2.861 N/A ASN 405.A ND2 ASN 402.A OD1 no hydrogen 3.106 N/A ILE 406.A N ASN 402.A O no hydrogen 3.227 N/A MET 407.A N HIS 403.A O no hydrogen 3.242 N/A ALA 408.A N GLU 404.A O no hydrogen 3.292 N/A CYS 409.A N ILE 406.A O no hydrogen 2.903 N/A CYS 409.A SG ASN 405.A O no hydrogen 2.882 N/A ASN 416.A N LEU 414.A O no hydrogen 2.328 N/A ASN 416.A ND2 LYS 411.A O no hydrogen 3.094 N/A GLU 421.A N TRP 418.A O no hydrogen 2.900 N/A GLN 422.A N TRP 419.A O no hydrogen 2.777 N/A GLN 422.A NE2 TRP 418.A O no hydrogen 3.055 N/A ASP 423.A N ALA 385.A O no hydrogen 3.382 N/A SER 424.A OG CYS 384.A O no hydrogen 3.053 N/A PHE 426.A N ASP 355.A OD2 no hydrogen 3.083 N/A CYS 427.A N ASP 355.A OD2 no hydrogen 3.464 N/A PHE 428.A N PRO 425.A O no hydrogen 3.309 N/A LEU 429.A N PRO 425.A O no hydrogen 2.749 N/A ALA 430.A N PHE 426.A O no hydrogen 3.193 N/A CYS 432.A N PHE 428.A O no hydrogen 3.103 N/A CYS 432.A SG ILE 406.A O no hydrogen 4.001 N/A PHE 433.A N LEU 429.A O no hydrogen 3.175 N/A GLU 434.A N ALA 430.A O no hydrogen 3.013 N/A TYR 435.A N PHE 431.A O no hydrogen 2.685 N/A ALA 436.A N CYS 432.A O no hydrogen 2.637 N/A GLY 437.A N PHE 433.A O no hydrogen 2.920 N/A VAL 438.A N GLU 434.A O no hydrogen 3.081 N/A VAL 438.A N TYR 435.A O no hydrogen 3.099 N/A GLN 439.A N TYR 435.A O no hydrogen 3.172 N/A HIS 440.A N GLY 437.A O no hydrogen 3.318 N/A HIS 441.A N GLY 437.A O no hydrogen 3.150 N/A GLY 442.A N VAL 438.A O no hydrogen 2.782 N/A SER 444.A OG HIS 441.A O no hydrogen 2.890 N/A TYR 445.A N GLY 442.A O no hydrogen 3.193 N/A CYS 447.A N TYR 445.A O no hydrogen 2.824 N/A SER 448.A OG LEU 363.A O no hydrogen 2.763 N/A LEU 449.A N GLU 434.A OE2 no hydrogen 3.265 N/A LEU 451.A N THR 711.A O no hydrogen 3.055 N/A SER 456.A OG VAL 476.A O no hydrogen 2.973 N/A CYS 457.A SG SER 456.A O no hydrogen 2.304 N/A CYS 457.A SG TYR 488.A OH no hydrogen 2.968 N/A SER 458.A OG ASP 682.A OD2 no hydrogen 3.065 N/A PHE 463.A N GLY 459.A O no hydrogen 2.981 N/A SER 464.A OG ILE 460.A O no hydrogen 2.462 N/A ALA 465.A N GLN 461.A O no hydrogen 2.991 N/A MET 466.A N HIS 462.A O no hydrogen 2.633 N/A LEU 467.A N PHE 463.A O no hydrogen 2.636 N/A ARG 468.A N SER 464.A O no hydrogen 2.575 N/A ARG 468.A NH2 TYR 731.A O no hydrogen 2.126 N/A ASP 469.A N SER 464.A O no hydrogen 3.292 N/A ARG 474.A N GLU 470.A O no hydrogen 2.727 N/A ARG 474.A NH1 GLU 470.A OE1 no hydrogen 2.677 N/A ARG 474.A NH2 SER 481.A O no hydrogen 3.445 N/A ALA 475.A N GLY 472.A O no hydrogen 2.750 N/A VAL 476.A N GLY 472.A O no hydrogen 3.121 N/A LEU 479.A N GLY 473.A O no hydrogen 3.085 N/A ILE 490.A N ASP 486.A O no hydrogen 3.184 N/A VAL 491.A N ILE 487.A O no hydrogen 2.786 N/A ALA 492.A N GLY 489.A O no hydrogen 2.825 N/A LYS 493.A N GLY 489.A O no hydrogen 3.258 N/A LYS 493.A NZ ILE 490.A O no hydrogen 3.262 N/A LYS 494.A N ILE 490.A O no hydrogen 3.528 N/A VAL 495.A N VAL 491.A O no hydrogen 3.339 N/A VAL 495.A N ALA 492.A O no hydrogen 2.688 N/A ASN 496.A N ALA 492.A O no hydrogen 3.109 N/A ASN 496.A ND2 VAL 520.A O no hydrogen 2.889 N/A GLU 497.A N LYS 493.A O no hydrogen 2.692 N/A ILE 498.A N LYS 494.A O no hydrogen 3.301 N/A LEU 499.A N VAL 495.A O no hydrogen 2.953 N/A GLN 500.A N ASN 496.A O no hydrogen 3.144 N/A ALA 501.A N GLU 497.A O no hydrogen 3.151 N/A ASP 502.A N ILE 498.A O no hydrogen 3.101 N/A ALA 503.A N LEU 499.A O no hydrogen 2.765 N/A ILE 504.A N LEU 499.A O no hydrogen 3.467 N/A GLY 506.A N ALA 503.A O no hydrogen 3.246 N/A TRP 515.A N LEU 511.A O no hydrogen 3.156 N/A ALA 517.A N GLY 513.A O no hydrogen 2.776 N/A TYR 518.A N TRP 515.A O no hydrogen 2.893 N/A GLY 519.A N TRP 515.A O no hydrogen 2.581 N/A SER 523.A N THR 521.A OG1 no hydrogen 2.787 N/A VAL 524.A N THR 521.A O no hydrogen 3.300 N/A THR 531.A N SER 528.A O no hydrogen 2.611 N/A THR 531.A OG1 ARG 527.A O no hydrogen 2.673 N/A SER 536.A OG ALA 533.A O no hydrogen 2.823 N/A SER 536.A OG TYR 534.A O no hydrogen 3.246 N/A GLY 540.A N LYS 537.A O no hydrogen 2.487 N/A PHE 541.A N GLU 538.A O no hydrogen 2.519 N/A ARG 542.A N GLU 538.A O no hydrogen 3.008 N/A GLN 544.A NE2 THR 531.A OG1 no hydrogen 3.229 N/A VAL 545.A N PHE 541.A O no hydrogen 2.669 N/A LEU 546.A N ARG 542.A O no hydrogen 2.682 N/A ASP 548.A N GLN 544.A O no hydrogen 2.605 N/A ASP 548.A N VAL 545.A O no hydrogen 3.018 N/A THR 549.A N VAL 545.A O no hydrogen 2.983 N/A THR 549.A OG1 VAL 545.A O no hydrogen 3.452 N/A ALA 553.A N ILE 550.A O no hydrogen 2.721 N/A ILE 554.A N ILE 550.A O no hydrogen 3.221 N/A ILE 554.A N GLN 551.A O no hydrogen 3.170 N/A ASP 555.A N GLN 551.A O no hydrogen 3.220 N/A SER 556.A OG ALA 553.A O no hydrogen 3.375 N/A SER 556.A OG ASP 555.A OD1 no hydrogen 3.163 N/A GLY 557.A N ILE 554.A O no hydrogen 3.143 N/A LYS 558.A N ALA 553.A O no hydrogen 2.587 N/A PHE 562.A N GLY 559.A O no hydrogen 2.493 N/A THR 563.A N MET 561.A O no hydrogen 2.944 N/A ALA 568.A N PRO 565.A O no hydrogen 2.553 N/A ALA 569.A N PRO 565.A O no hydrogen 3.298 N/A GLY 570.A N ASN 566.A O no hydrogen 2.866 N/A TYR 571.A N GLN 567.A O no hydrogen 3.202 N/A TYR 571.A N ALA 568.A O no hydrogen 2.999 N/A MET 572.A N ALA 568.A O no hydrogen 3.204 N/A ALA 573.A N ALA 569.A O no hydrogen 2.986 N/A LYS 574.A N GLY 570.A O no hydrogen 3.353 N/A LEU 575.A N TYR 571.A O no hydrogen 3.342 N/A ILE 576.A N MET 572.A O no hydrogen 2.642 N/A TRP 577.A N ALA 573.A O no hydrogen 2.795 N/A GLU 578.A N LYS 574.A O no hydrogen 3.096 N/A SER 579.A N LEU 575.A O no hydrogen 3.049 N/A SER 579.A OG LEU 575.A O no hydrogen 2.860 N/A VAL 580.A N ILE 576.A O no hydrogen 2.819 N/A SER 581.A N TRP 577.A O no hydrogen 2.806 N/A SER 581.A OG TRP 577.A O no hydrogen 2.667 N/A THR 583.A N SER 579.A O no hydrogen 3.109 N/A THR 583.A OG1 SER 579.A O no hydrogen 2.563 N/A VAL 584.A N VAL 580.A O no hydrogen 3.067 N/A GLU 589.A N VAL 585.A O no hydrogen 2.972 N/A ALA 590.A N ALA 586.A O no hydrogen 2.599 N/A MET 591.A N ALA 587.A O no hydrogen 3.061 N/A ASN 592.A N VAL 588.A O no hydrogen 3.113 N/A ASN 592.A N GLU 589.A O no hydrogen 3.187 N/A TRP 593.A N GLU 589.A O no hydrogen 3.088 N/A TRP 593.A NE1 PRO 757.A O no hydrogen 3.210 N/A LEU 594.A N ALA 590.A O no hydrogen 3.254 N/A LYS 595.A N MET 591.A O no hydrogen 2.905 N/A SER 596.A N ASN 592.A O no hydrogen 2.692 N/A SER 596.A OG ASN 592.A O no hydrogen 2.703 N/A ALA 597.A N TRP 593.A O no hydrogen 3.080 N/A ALA 598.A N LEU 594.A O no hydrogen 2.795 N/A LYS 599.A N SER 596.A O no hydrogen 3.292 N/A LYS 599.A NZ GLU 670.A OE1 no hydrogen 3.411 N/A LEU 601.A N ALA 597.A O no hydrogen 2.869 N/A ALA 602.A N ALA 598.A O no hydrogen 3.408 N/A ALA 603.A N LEU 600.A O no hydrogen 2.781 N/A VAL 605.A N ARG 615.A O no hydrogen 3.481 N/A THR 610.A OG1 LYS 608.A O no hydrogen 2.751 N/A ARG 615.A NH1 LEU 601.A O no hydrogen 3.336 N/A ARG 615.A NH2 LEU 601.A O no hydrogen 2.656 N/A ALA 619.A N SER 618.A OG no hydrogen 2.508 N/A VAL 620.A N GLN 632.A O no hydrogen 3.171 N/A HIS 621.A N GLN 747.A OE1 no hydrogen 3.421 N/A TRP 622.A N VAL 630.A O no hydrogen 2.961 N/A TRP 622.A NE1 SER 680.A OG no hydrogen 3.292 N/A THR 624.A N PHE 628.A O no hydrogen 3.077 N/A THR 624.A OG1 ASP 626.A OD1 no hydrogen 2.785 N/A THR 624.A OG1 PHE 628.A O no hydrogen 3.271 N/A GLY 627.A N THR 624.A O no hydrogen 2.842 N/A VAL 630.A N TRP 622.A O no hydrogen 2.784 N/A GLN 632.A N VAL 620.A O no hydrogen 2.995 N/A GLN 632.A NE2 GLY 672.A O no hydrogen 3.117 N/A TYR 634.A N GLN 669.A OE1 no hydrogen 3.381 N/A TYR 634.A OH ASN 676.A OD1 no hydrogen 3.128 N/A LYS 636.A N GLU 663.A O no hydrogen 2.944 N/A GLN 639.A NE2 ILE 656.A O no hydrogen 3.113 N/A LEU 642.A N PRO 654.A O no hydrogen 2.992 N/A LEU 644.A N LEU 652.A O no hydrogen 2.788 N/A GLN 649.A N LEU 647.A O no hydrogen 2.679 N/A LEU 652.A N LEU 644.A O no hydrogen 2.622 N/A THR 658.A OG1 ASN 657.A O no hydrogen 2.401 N/A ASN 659.A N ILE 638.A O no hydrogen 2.808 N/A ASP 665.A N TYR 634.A O no hydrogen 2.928 N/A HIS 667.A N ASP 665.A OD1 no hydrogen 3.022 N/A LYS 668.A N ASP 665.A OD1 no hydrogen 3.346 N/A GLN 669.A N ASP 665.A O no hydrogen 3.242 N/A GLN 669.A NE2 SER 618.A O no hydrogen 3.310 N/A GLN 669.A NE2 GLN 632.A O no hydrogen 2.990 N/A GLU 670.A N ALA 666.A O no hydrogen 3.360 N/A SER 671.A N HIS 667.A O no hydrogen 2.977 N/A SER 671.A OG HIS 667.A O no hydrogen 2.906 N/A SER 671.A OG LYS 668.A O no hydrogen 3.511 N/A ASN 676.A N GLY 672.A O no hydrogen 3.325 N/A PHE 677.A N ILE 673.A O no hydrogen 3.069 N/A PHE 677.A N ALA 674.A O no hydrogen 3.157 N/A VAL 678.A N ALA 674.A O no hydrogen 3.056 N/A HIS 679.A N PRO 675.A O no hydrogen 2.955 N/A SER 680.A N ASN 676.A O no hydrogen 3.024 N/A SER 680.A OG ARG 340.A O no hydrogen 3.534 N/A GLN 681.A N PHE 677.A O no hydrogen 2.953 N/A ASP 682.A N VAL 678.A O no hydrogen 3.135 N/A GLY 683.A N HIS 679.A O no hydrogen 3.177 N/A SER 684.A N SER 680.A O no hydrogen 3.266 N/A SER 684.A OG ASP 626.A OD1 no hydrogen 2.409 N/A HIS 685.A N GLN 681.A O no hydrogen 2.901 N/A HIS 685.A N ASP 682.A O no hydrogen 3.183 N/A LEU 686.A N ASP 682.A O no hydrogen 3.112 N/A ARG 687.A N GLY 683.A O no hydrogen 3.109 N/A ARG 687.A NE ASP 626.A OD2 no hydrogen 2.653 N/A ARG 687.A NH2 ASP 626.A OD1 no hydrogen 2.583 N/A ARG 687.A NH2 ASP 626.A OD2 no hydrogen 2.783 N/A THR 689.A N HIS 685.A O no hydrogen 2.837 N/A THR 689.A OG1 HIS 685.A O no hydrogen 3.061 N/A VAL 690.A N LEU 686.A O no hydrogen 2.919 N/A VAL 691.A N ARG 687.A O no hydrogen 3.062 N/A TRP 692.A N LYS 688.A O no hydrogen 2.993 N/A ALA 693.A N THR 689.A O no hydrogen 2.786 N/A HIS 694.A N VAL 691.A O no hydrogen 3.093 N/A HIS 694.A ND1 ILE 699.A O no hydrogen 3.000 N/A TYR 697.A OH GLU 725.A OE1 no hydrogen 2.597 N/A GLY 698.A N GLU 695.A O no hydrogen 3.062 N/A ILE 699.A N ALA 693.A O no hydrogen 2.809 N/A PHE 702.A N THR 282.A OG1 no hydrogen 2.913 N/A ALA 703.A N GLY 710.A O no hydrogen 2.981 N/A ILE 705.A N SER 708.A O no hydrogen 2.686 N/A SER 708.A OG ILE 705.A O no hydrogen 2.196 N/A GLY 710.A N ALA 703.A O no hydrogen 3.025 N/A ALA 716.A N ILE 712.A O no hydrogen 2.925 N/A ALA 716.A N PRO 713.A O no hydrogen 2.941 N/A ASN 718.A N ASP 715.A O no hydrogen 2.746 N/A LEU 719.A N ASP 715.A O no hydrogen 3.403 N/A LEU 719.A N ALA 716.A O no hydrogen 3.189 N/A ALA 722.A N ASN 718.A O no hydrogen 2.728 N/A VAL 723.A N LEU 719.A O no hydrogen 2.652 N/A ARG 724.A N PHE 720.A O no hydrogen 2.838 N/A GLU 725.A N LYS 721.A O no hydrogen 2.937 N/A THR 726.A N ALA 722.A O no hydrogen 3.075 N/A THR 726.A N VAL 723.A O no hydrogen 2.872 N/A THR 726.A OG1 ALA 722.A O no hydrogen 2.722 N/A MET 727.A N VAL 723.A O no hydrogen 3.150 N/A VAL 728.A N ARG 724.A O no hydrogen 3.337 N/A ASP 729.A N GLU 725.A O no hydrogen 2.918 N/A THR 730.A N THR 726.A O no hydrogen 2.897 N/A THR 730.A N MET 727.A O no hydrogen 2.836 N/A THR 730.A OG1 THR 726.A O no hydrogen 2.790 N/A TYR 731.A N MET 727.A O no hydrogen 3.252 N/A TYR 731.A OH HIS 462.A ND1 no hydrogen 3.001 N/A GLU 732.A N VAL 728.A O no hydrogen 3.138 N/A SER 733.A N ASP 729.A O no hydrogen 3.309 N/A SER 733.A OG ASP 729.A O no hydrogen 2.568 N/A ALA 738.A N ASP 735.A OD1 no hydrogen 3.108 N/A ASP 739.A N ASP 735.A O no hydrogen 2.979 N/A PHE 740.A N VAL 736.A O no hydrogen 2.790 N/A TYR 741.A N LEU 737.A O no hydrogen 2.900 N/A ASP 742.A N ALA 738.A O no hydrogen 3.140 N/A GLN 743.A N ASP 739.A O no hydrogen 2.798 N/A PHE 744.A N PHE 740.A O no hydrogen 2.912 N/A PHE 744.A N TYR 741.A O no hydrogen 2.861 N/A ALA 745.A N TYR 741.A O no hydrogen 2.868 N/A ASP 746.A N ASP 742.A O no hydrogen 2.882 N/A GLN 747.A N PHE 744.A O no hydrogen 2.668 N/A GLN 747.A NE2 HIS 621.A O no hydrogen 2.835 N/A GLN 747.A NE2 GLN 743.A O no hydrogen 3.245 N/A LEU 748.A N ALA 745.A O no hydrogen 3.310 N/A LEU 753.A N HIS 749.A O no hydrogen 3.297 N/A ASP 754.A N SER 751.A O no hydrogen 2.372 N/A LYS 755.A N LEU 753.A O no hydrogen 2.534 N/A GLY 763.A N LEU 467.A O no hydrogen 3.202 N/A ARG 768.A NH2 SER 464.A O no hydrogen 3.188 N/A ILE 770.A N LEU 767.A O no hydrogen 2.162 N/A LEU 771.A N ARG 768.A O no hydrogen 2.586 N/A