Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 8h6k_5C.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ASP 6.A N VAL 2.A O no hydrogen 3.153 N/A PHE 7.A N TYR 3.A O no hydrogen 2.978 N/A LEU 8.A N GLU 4.A O no hydrogen 2.852 N/A ALA 9.A N MET 5.A O no hydrogen 2.859 N/A ASP 10.A N ASP 6.A O no hydrogen 2.975 N/A LEU 11.A N PHE 7.A O no hydrogen 2.974 N/A MET 12.A N LEU 8.A O no hydrogen 2.826 N/A ASP 13.A N ALA 9.A O no hydrogen 2.925 N/A ASN 14.A N ASP 10.A O no hydrogen 2.895 N/A ASN 14.A N LEU 11.A O no hydrogen 3.232 N/A GLU 16.A N ASN 14.A OD1 no hydrogen 2.457 N/A LEU 17.A N ASN 14.A OD1 no hydrogen 2.381 N/A ARG 19.A NE ILE 313.A O no hydrogen 2.806 N/A VAL 21.A N ASN 76.A O no hydrogen 3.184 N/A THR 22.A N GLY 99.A O no hydrogen 2.915 N/A THR 22.A OG1 MET 78.A O no hydrogen 2.856 N/A LEU 23.A N MET 78.A O no hydrogen 3.275 N/A CYS 24.A N VAL 101.A O no hydrogen 2.894 N/A HIS 29.A NE2 GLU 108.A OE1 no hydrogen 3.337 N/A LYS 31.A NZ GLY 25.A O no hydrogen 3.238 N/A LYS 31.A NZ HIS 26.A O no hydrogen 2.822 N/A THR 32.A OG1 ASP 79.A OD2 no hydrogen 3.384 N/A CYS 33.A SG SER 187.A O no hydrogen 3.476 N/A VAL 35.A N LYS 31.A O no hydrogen 3.213 N/A ASP 36.A N THR 32.A O no hydrogen 2.915 N/A CYS 37.A N CYS 33.A O no hydrogen 2.881 N/A CYS 37.A SG CYS 33.A O no hydrogen 3.121 N/A CYS 37.A SG SER 187.A O no hydrogen 3.155 N/A LEU 38.A N PHE 34.A O no hydrogen 2.949 N/A ILE 39.A N VAL 35.A O no hydrogen 2.911 N/A GLU 40.A N ASP 36.A O no hydrogen 2.894 N/A GLN 41.A N CYS 37.A O no hydrogen 2.908 N/A THR 42.A N LEU 38.A O no hydrogen 2.936 N/A THR 42.A N ILE 39.A O no hydrogen 3.132 N/A THR 42.A OG1 LEU 38.A O no hydrogen 3.098 N/A THR 42.A OG1 ILE 39.A O no hydrogen 2.894 N/A THR 42.A OG1 HIS 43.A ND1 no hydrogen 3.152 N/A HIS 43.A N ILE 39.A O no hydrogen 2.662 N/A GLU 45.A N GLU 45.A OE1 no hydrogen 2.471 N/A GLU 51.A N GLU 51.A OE1 no hydrogen 2.601 N/A ARG 52.A N THR 48.A O no hydrogen 2.532 N/A ARG 52.A NH1 ASP 513.A OD2 no hydrogen 2.706 N/A GLY 53.A N GLU 49.A O no hydrogen 2.475 N/A VAL 54.A N GLU 49.A O no hydrogen 3.334 N/A ILE 56.A N GLU 49.A OE2 no hydrogen 3.166 N/A LYS 57.A NZ GLU 89.A OE2 no hydrogen 3.549 N/A LYS 57.A NZ SER 488.A O no hydrogen 3.157 N/A SER 58.A OG GLU 89.A OE1 no hydrogen 3.157 N/A THR 59.A N ASP 79.A O no hydrogen 2.907 N/A VAL 61.A N ILE 77.A O no hydrogen 2.881 N/A THR 62.A N SER 408.A O no hydrogen 3.047 N/A THR 62.A OG1 ASN 76.A OD1 no hydrogen 3.025 N/A THR 62.A OG1 SER 408.A O no hydrogen 3.545 N/A VAL 63.A N PHE 75.A O no hydrogen 2.943 N/A LEU 65.A N TYR 73.A O no hydrogen 2.950 N/A ASP 67.A N ASP 67.A OD1 no hydrogen 2.587 N/A ASP 67.A N LYS 71.A O no hydrogen 3.433 N/A THR 68.A N ASP 307.A OD2 no hydrogen 3.131 N/A THR 68.A OG1 ASP 307.A OD1 no hydrogen 3.131 N/A THR 68.A OG1 ASP 307.A OD2 no hydrogen 2.752 N/A GLY 70.A N ASP 67.A O no hydrogen 3.034 N/A PHE 75.A N VAL 63.A O no hydrogen 2.886 N/A ASN 76.A N ARG 19.A O no hydrogen 3.428 N/A ILE 77.A N VAL 61.A O no hydrogen 2.898 N/A MET 78.A N VAL 21.A O no hydrogen 3.254 N/A ASP 79.A N THR 59.A O no hydrogen 2.909 N/A THR 80.A OG1 PRO 81.A O no hydrogen 3.540 N/A PHE 86.A N HIS 83.A O no hydrogen 3.174 N/A SER 87.A N VAL 84.A O no hydrogen 2.918 N/A SER 87.A OG VAL 84.A O no hydrogen 2.250 N/A GLU 89.A N PHE 86.A O no hydrogen 2.924 N/A THR 91.A N SER 87.A O no hydrogen 3.144 N/A THR 91.A OG1 SER 87.A O no hydrogen 3.380 N/A ALA 92.A N ASP 88.A O no hydrogen 3.165 N/A GLY 93.A N GLU 89.A O no hydrogen 3.355 N/A LEU 94.A N VAL 90.A O no hydrogen 2.915 N/A ARG 95.A N THR 91.A O no hydrogen 3.193 N/A ARG 95.A N ALA 92.A O no hydrogen 2.937 N/A ARG 95.A NH1 HIS 352.A NE2 no hydrogen 3.204 N/A ARG 95.A NH1 ARG 453.A O no hydrogen 2.602 N/A ARG 95.A NH2 ARG 453.A O no hydrogen 3.543 N/A ARG 95.A NH2 PRO 454.A O no hydrogen 3.392 N/A ILE 96.A N GLY 93.A O no hydrogen 2.935 N/A SER 97.A OG GLY 99.A O no hydrogen 3.044 N/A ASP 98.A N ASN 20.A O no hydrogen 2.551 N/A GLY 99.A N ASN 20.A O no hydrogen 2.930 N/A VAL 100.A N ALA 127.A O no hydrogen 2.896 N/A VAL 101.A N THR 22.A O no hydrogen 2.889 N/A LEU 102.A N THR 129.A O no hydrogen 2.857 N/A PHE 103.A N CYS 24.A O no hydrogen 2.905 N/A ILE 104.A N CYS 131.A O no hydrogen 2.949 N/A ALA 106.A N ASN 133.A O no hydrogen 3.171 N/A GLU 108.A N ASP 105.A O no hydrogen 3.152 N/A GLU 108.A N ASP 105.A OD1 no hydrogen 2.319 N/A GLY 109.A N ASP 105.A O no hydrogen 2.736 N/A ASN 113.A N HIS 26.A ND1 no hydrogen 3.297 N/A ASN 113.A ND2 GLY 25.A O no hydrogen 3.275 N/A GLU 115.A N MET 111.A O no hydrogen 3.459 N/A ARG 116.A N LEU 112.A O no hydrogen 2.996 N/A LEU 117.A N ASN 113.A O no hydrogen 2.837 N/A ILE 118.A N THR 114.A O no hydrogen 2.928 N/A LYS 119.A N GLU 115.A O no hydrogen 2.965 N/A HIS 120.A N ARG 116.A O no hydrogen 2.924 N/A ALA 121.A N LEU 117.A O no hydrogen 2.857 N/A VAL 122.A N ILE 118.A O no hydrogen 2.948 N/A GLN 123.A N LYS 119.A O no hydrogen 3.320 N/A GLU 124.A N ALA 121.A O no hydrogen 3.185 N/A ARG 125.A N VAL 122.A O no hydrogen 2.821 N/A LEU 126.A N ALA 121.A O no hydrogen 3.301 N/A THR 129.A N VAL 100.A O no hydrogen 2.947 N/A THR 129.A OG1 VAL 100.A O no hydrogen 3.493 N/A VAL 130.A N ASN 181.A O no hydrogen 3.219 N/A CYS 131.A N LEU 102.A O no hydrogen 2.886 N/A ASN 133.A N ILE 104.A O no hydrogen 2.878 N/A ASN 133.A ND2 SER 187.A OG no hydrogen 3.038 N/A LYS 134.A N ASN 133.A OD1 no hydrogen 2.498 N/A LYS 134.A NZ HIS 28.A O no hydrogen 3.469 N/A LYS 134.A NZ ASP 105.A OD2 no hydrogen 2.985 N/A ASP 136.A N SER 186.A OG no hydrogen 3.211 N/A ARG 137.A N LYS 134.A O no hydrogen 3.231 N/A ARG 137.A NE GLU 141.A OE1 no hydrogen 3.308 N/A ARG 137.A NH2 GLU 141.A OE2 no hydrogen 3.275 N/A LEU 138.A N ILE 135.A O no hydrogen 2.922 N/A ILE 139.A N ASP 136.A O no hydrogen 2.894 N/A LEU 140.A N ASP 136.A O no hydrogen 2.834 N/A LEU 142.A N ARG 137.A O no hydrogen 2.703 N/A LEU 144.A N LEU 138.A O no hydrogen 3.275 N/A ALA 149.A N PRO 145.A O no hydrogen 3.029 N/A TYR 150.A N PRO 146.A O no hydrogen 2.927 N/A TYR 151.A N THR 147.A O no hydrogen 2.909 N/A LYS 152.A N ASP 148.A O no hydrogen 2.878 N/A LYS 152.A NZ ALA 107.A O no hydrogen 3.341 N/A LYS 152.A NZ PRO 739.A O no hydrogen 2.794 N/A LEU 153.A N ALA 149.A O no hydrogen 2.957 N/A ARG 154.A N TYR 150.A O no hydrogen 2.900 N/A HIS 155.A N TYR 151.A O no hydrogen 2.868 N/A ILE 156.A N LYS 152.A O no hydrogen 2.949 N/A VAL 157.A N LEU 153.A O no hydrogen 2.957 N/A ASP 158.A N ARG 154.A O no hydrogen 2.882 N/A GLU 159.A N HIS 155.A O no hydrogen 2.932 N/A VAL 160.A N ILE 156.A O no hydrogen 2.961 N/A ASN 161.A N VAL 157.A O no hydrogen 2.911 N/A ASN 161.A ND2 LEU 175.A O no hydrogen 2.573 N/A GLY 162.A N ASP 158.A O no hydrogen 2.882 N/A LEU 163.A N GLU 159.A O no hydrogen 2.947 N/A ILE 164.A N VAL 160.A O no hydrogen 2.906 N/A SER 165.A N ASN 161.A O no hydrogen 2.911 N/A SER 165.A OG GLY 162.A O no hydrogen 2.850 N/A MET 166.A N GLY 162.A O no hydrogen 2.932 N/A TYR 167.A N LEU 163.A O no hydrogen 3.289 N/A SER 168.A N SER 165.A O no hydrogen 3.193 N/A LEU 175.A N ASN 161.A OD1 no hydrogen 2.720 N/A LEU 178.A N SER 176.A OG no hydrogen 3.031 N/A LEU 179.A N SER 176.A O no hydrogen 3.184 N/A GLY 180.A N PRO 177.A O no hydrogen 3.059 N/A ASN 181.A N SER 176.A O no hydrogen 3.133 N/A ASN 181.A ND2 ILE 174.A O no hydrogen 2.917 N/A CYS 183.A N VAL 130.A O no hydrogen 3.033 N/A PHE 184.A N PHE 193.A O no hydrogen 2.943 N/A SER 185.A N ILE 132.A O no hydrogen 3.049 N/A SER 185.A OG ILE 191.A O no hydrogen 2.174 N/A SER 186.A N ILE 191.A O no hydrogen 2.868 N/A SER 186.A OG SER 185.A O no hydrogen 3.401 N/A ILE 191.A N SER 186.A O no hydrogen 2.926 N/A PHE 193.A N PHE 184.A O no hydrogen 2.892 N/A GLY 196.A N THR 194.A OG1 no hydrogen 3.066 N/A PHE 198.A N THR 194.A O no hydrogen 3.090 N/A ALA 199.A N LEU 195.A O no hydrogen 2.920 N/A LYS 200.A N GLY 196.A O no hydrogen 2.860 N/A ILE 201.A N SER 197.A O no hydrogen 2.960 N/A TYR 202.A N PHE 198.A O no hydrogen 2.884 N/A ALA 203.A N ALA 199.A O no hydrogen 2.890 N/A ASP 204.A N LYS 200.A O no hydrogen 2.869 N/A THR 205.A N ILE 201.A O no hydrogen 2.917 N/A THR 205.A OG1 ILE 201.A O no hydrogen 3.161 N/A THR 205.A OG1 TYR 202.A O no hydrogen 3.095 N/A PHE 206.A N TYR 202.A O no hydrogen 3.032 N/A GLU 213.A N ASN 210.A OD1 no hydrogen 3.174 N/A PHE 214.A N ASN 210.A O no hydrogen 3.488 N/A ALA 215.A N TYR 211.A O no hydrogen 2.866 N/A LYS 216.A N GLN 212.A O no hydrogen 2.925 N/A ARG 217.A N PHE 214.A O no hydrogen 3.006 N/A LEU 218.A N ALA 215.A O no hydrogen 3.159 N/A TYR 223.A N THR 232.A O no hydrogen 2.904 N/A ASN 225.A ND2 ALA 235.A O no hydrogen 3.561 N/A THR 228.A OG1 ASN 225.A O no hydrogen 2.890 N/A THR 228.A OG1 LYS 230.A O no hydrogen 2.964 N/A ARG 229.A N ASN 225.A O no hydrogen 2.827 N/A ARG 229.A NH2 PRO 226.A O no hydrogen 3.251 N/A LYS 230.A N THR 228.A OG1 no hydrogen 3.369 N/A THR 232.A N TYR 223.A O no hydrogen 2.908 N/A THR 232.A OG1 LYS 233.A O no hydrogen 3.301 N/A SER 239.A OG SER 238.A O no hydrogen 2.268 N/A SER 240.A OG GLN 241.A O no hydrogen 2.965 N/A SER 240.A OG GLU 246.A OE2 no hydrogen 2.977 N/A GLN 241.A N GLU 246.A OE2 no hydrogen 3.070 N/A ARG 242.A NH2 TYR 151.A OH no hydrogen 3.357 N/A SER 243.A N ILE 222.A O no hydrogen 2.819 N/A SER 243.A OG ARG 217.A O no hydrogen 3.485 N/A SER 243.A OG LEU 218.A O no hydrogen 3.018 N/A GLU 246.A N ARG 242.A O no hydrogen 3.003 N/A PHE 247.A N SER 243.A O no hydrogen 2.907 N/A ILE 248.A N PHE 244.A O no hydrogen 3.092 N/A LEU 249.A N PHE 244.A O no hydrogen 3.148 N/A GLU 250.A N VAL 245.A O no hydrogen 2.959 N/A TYR 253.A N LEU 249.A O no hydrogen 2.887 N/A TYR 253.A OH LEU 144.A O no hydrogen 2.076 N/A LYS 254.A N GLU 250.A O no hydrogen 2.914 N/A ILE 255.A N PRO 251.A O no hydrogen 2.882 N/A LEU 256.A N LEU 252.A O no hydrogen 2.945 N/A ALA 257.A N TYR 253.A O no hydrogen 2.902 N/A GLN 258.A N LYS 254.A O no hydrogen 2.868 N/A VAL 259.A N ILE 255.A O no hydrogen 2.934 N/A VAL 260.A N LEU 256.A O no hydrogen 2.907 N/A GLY 261.A N ALA 257.A O no hydrogen 2.890 N/A ASP 262.A N GLN 258.A O no hydrogen 3.156 N/A THR 265.A OG1 ASP 264.A OD1 no hydrogen 3.350 N/A SER 266.A N ASP 262.A O no hydrogen 3.307 N/A SER 266.A OG SER 266.A O no hydrogen 2.565 N/A ARG 269.A NH1 ARG 269.A O no hydrogen 2.833 N/A THR 270.A OG1 LEU 267.A O no hydrogen 2.987 N/A LEU 271.A N LEU 267.A O no hydrogen 2.882 N/A ASP 272.A N PRO 268.A O no hydrogen 2.917 N/A GLU 273.A N ARG 269.A O no hydrogen 2.892 N/A LEU 274.A N THR 270.A O no hydrogen 2.931 N/A ILE 276.A N LEU 271.A O no hydrogen 3.287 N/A LEU 283.A N THR 279.A O no hydrogen 3.321 N/A LEU 283.A N LYS 280.A O no hydrogen 3.015 N/A LYS 284.A N GLU 281.A O no hydrogen 2.979 N/A LEU 290.A N ASN 286.A O no hydrogen 3.088 N/A LEU 291.A N ILE 287.A O no hydrogen 2.880 N/A ARG 292.A N ARG 288.A O no hydrogen 2.951 N/A LEU 293.A N PRO 289.A O no hydrogen 2.889 N/A VAL 294.A N LEU 290.A O no hydrogen 2.921 N/A CYS 295.A N LEU 291.A O no hydrogen 2.945 N/A CYS 295.A SG LEU 291.A O no hydrogen 3.071 N/A LYS 296.A N ARG 292.A O no hydrogen 2.887 N/A LYS 297.A N LEU 293.A O no hydrogen 2.909 N/A PHE 298.A N VAL 294.A O no hydrogen 2.933 N/A PHE 299.A N CYS 295.A O no hydrogen 2.892 N/A THR 303.A OG1 PRO 66.A O no hydrogen 2.778 N/A ASP 307.A N THR 303.A O no hydrogen 3.234 N/A MET 308.A N GLY 304.A O no hydrogen 2.920 N/A CYS 309.A N PHE 305.A O no hydrogen 2.932 N/A CYS 309.A SG PHE 305.A O no hydrogen 3.208 N/A VAL 310.A N VAL 306.A O no hydrogen 2.910 N/A GLN 311.A N ASP 307.A O no hydrogen 2.899 N/A GLN 311.A N MET 308.A O no hydrogen 3.245 N/A GLN 311.A NE2 LEU 179.A O no hydrogen 3.301 N/A ILE 313.A N CYS 309.A O no hydrogen 2.747 N/A SER 315.A OG GLU 16.A O no hydrogen 3.488 N/A LYS 317.A N SER 315.A OG no hydrogen 3.151 N/A LYS 317.A NZ ASP 342.A O no hydrogen 3.225 N/A GLY 319.A N SER 315.A O no hydrogen 3.076 N/A ALA 320.A N LYS 317.A O no hydrogen 3.058 N/A LYS 323.A N GLY 319.A O no hydrogen 3.359 N/A LYS 323.A NZ SER 97.A O no hydrogen 3.522 N/A LYS 323.A NZ GLU 124.A OE1 no hydrogen 2.511 N/A ILE 324.A N ALA 320.A O no hydrogen 3.293 N/A GLU 325.A N LYS 321.A O no hydrogen 2.911 N/A HIS 326.A N PRO 322.A O no hydrogen 2.913 N/A HIS 326.A N LYS 323.A O no hydrogen 3.295 N/A THR 327.A N LYS 323.A O no hydrogen 2.884 N/A THR 327.A OG1 LYS 323.A O no hydrogen 2.895 N/A TYR 328.A N ILE 324.A O no hydrogen 2.966 N/A SER 334.A N ASP 333.A OD1 no hydrogen 2.770 N/A SER 334.A OG ASP 333.A OD1 no hydrogen 2.763 N/A ALA 339.A N ASP 335.A O no hydrogen 3.283 N/A MET 340.A N LEU 336.A O no hydrogen 2.876 N/A MET 340.A N GLY 337.A O no hydrogen 3.289 N/A SER 341.A N GLY 337.A O no hydrogen 2.897 N/A ASP 342.A N GLU 338.A O no hydrogen 2.915 N/A CYS 343.A SG PRO 316.A O no hydrogen 3.902 N/A CYS 343.A SG LEU 372.A O no hydrogen 3.858 N/A MET 350.A N SER 373.A O no hydrogen 3.294 N/A CYS 351.A N ILE 440.A O no hydrogen 3.193 N/A CYS 351.A SG ARG 370.A O no hydrogen 3.584 N/A HIS 352.A N ARG 370.A O no hydrogen 3.045 N/A THR 353.A N ALA 438.A O no hydrogen 3.161 N/A THR 353.A OG1 PHE 368.A O no hydrogen 3.187 N/A THR 354.A N PHE 368.A O no hydrogen 2.958 N/A LYS 355.A N PHE 368.A O no hydrogen 2.993 N/A LYS 355.A NZ GLU 89.A OE1 no hydrogen 2.653 N/A LYS 355.A NZ GLU 89.A OE2 no hydrogen 2.993 N/A TYR 357.A N HIS 366.A O no hydrogen 2.911 N/A TYR 357.A OH SER 58.A O no hydrogen 2.508 N/A SER 358.A OG THR 359.A O no hydrogen 2.823 N/A VAL 363.A N ASP 361.A O no hydrogen 3.312 N/A GLN 364.A N GLN 364.A OE1 no hydrogen 2.699 N/A PHE 365.A N ASP 431.A OD2 no hydrogen 2.851 N/A HIS 366.A N TYR 357.A O no hydrogen 2.892 N/A ALA 367.A N ILE 427.A O no hydrogen 2.929 N/A PHE 368.A N LYS 355.A O no hydrogen 2.859 N/A GLY 369.A N VAL 425.A O no hydrogen 2.990 N/A ARG 370.A N HIS 352.A O no hydrogen 3.151 N/A ARG 370.A NH1 ASP 98.A OD1 no hydrogen 3.322 N/A ARG 370.A NH2 ASP 98.A OD1 no hydrogen 3.490 N/A VAL 371.A N ASN 423.A O no hydrogen 3.340 N/A LEU 372.A N MET 350.A O no hydrogen 2.647 N/A SER 373.A N MET 350.A O no hydrogen 3.363 N/A SER 373.A OG ALA 339.A O no hydrogen 3.328 N/A THR 375.A OG1 VAL 419.A O no hydrogen 2.656 N/A ILE 376.A N VAL 419.A O no hydrogen 2.906 N/A ALA 378.A N ASN 417.A O no hydrogen 2.879 N/A GLN 380.A N HIS 377.A O no hydrogen 3.443 N/A VAL 382.A N CYS 400.A O no hydrogen 2.886 N/A LYS 383.A N THR 441.A O no hydrogen 2.930 N/A LYS 383.A NZ GLU 394.A OE1 no hydrogen 2.731 N/A VAL 384.A N GLN 398.A O no hydrogen 2.915 N/A LEU 385.A N THR 439.A O no hydrogen 2.850 N/A GLU 395.A N GLU 395.A OE1 no hydrogen 2.384 N/A GLN 398.A N VAL 384.A O no hydrogen 2.939 N/A CYS 400.A N VAL 382.A O no hydrogen 2.951 N/A CYS 400.A SG VAL 382.A O no hydrogen 4.010 N/A CYS 400.A SG GLN 398.A O no hydrogen 3.865 N/A VAL 402.A N GLN 380.A O no hydrogen 3.175 N/A GLY 403.A N GLU 428.A O no hydrogen 3.110 N/A TRP 406.A N LEU 426.A O no hydrogen 3.330 N/A ILE 407.A N ILE 414.A O no hydrogen 2.898 N/A SER 408.A OG VAL 409.A O no hydrogen 3.498 N/A VAL 409.A N TYR 412.A O no hydrogen 2.855 N/A TYR 412.A N VAL 409.A O no hydrogen 2.925 N/A ILE 414.A N ILE 407.A O no hydrogen 2.920 N/A VAL 416.A N LEU 405.A O no hydrogen 3.499 N/A ARG 418.A NH1 ASP 13.A OD2 no hydrogen 3.109 N/A VAL 419.A N ILE 376.A O no hydrogen 2.910 N/A GLY 422.A N VAL 371.A O no hydrogen 2.854 N/A ASN 423.A ND2 MET 12.A O no hydrogen 3.546 N/A VAL 425.A N GLY 369.A O no hydrogen 2.866 N/A ILE 427.A N ALA 367.A O no hydrogen 2.847 N/A ILE 434.A N ASP 431.A O no hydrogen 3.052 N/A LYS 436.A NZ ASN 486.A O no hydrogen 2.205 N/A LYS 436.A NZ ASN 486.A OD1 no hydrogen 2.254 N/A LYS 436.A NZ TYR 489.A O no hydrogen 2.744 N/A LYS 436.A NZ LEU 492.A O no hydrogen 3.165 N/A THR 437.A OG1 THR 353.A O no hydrogen 2.879 N/A THR 439.A N LEU 385.A O no hydrogen 2.947 N/A ILE 440.A N CYS 351.A O no hydrogen 3.315 N/A THR 441.A N LYS 383.A O no hydrogen 2.911 N/A THR 441.A OG1 GLU 447.A OE2 no hydrogen 3.568 N/A GLU 448.A N ASN 446.A OD1 no hydrogen 3.455 N/A GLN 450.A N TYR 328.A OH no hydrogen 3.009 N/A GLN 450.A NE2 THR 329.A OG1 no hydrogen 3.416 N/A ARG 453.A N THR 327.A O no hydrogen 2.662 N/A ARG 453.A NH1 TYR 328.A O no hydrogen 2.919 N/A LYS 456.A NZ PHE 457.A O no hydrogen 3.370 N/A SER 461.A OG SER 491.A O no hydrogen 3.033 N/A ILE 463.A N GLY 506.A O no hydrogen 2.920 N/A LYS 464.A N VAL 534.A O no hydrogen 2.569 N/A ILE 465.A N ILE 504.A O no hydrogen 2.911 N/A VAL 467.A N HIS 502.A O no hydrogen 2.937 N/A GLU 468.A N LYS 529.A O no hydrogen 2.969 N/A VAL 470.A N ASP 527.A O no hydrogen 3.045 N/A GLU 474.A N ASN 471.A O no hydrogen 2.906 N/A LEU 475.A N PRO 472.A O no hydrogen 2.911 N/A MET 478.A N GLU 474.A O no hydrogen 3.477 N/A LEU 479.A N LEU 475.A O no hydrogen 3.270 N/A ASP 480.A N PRO 476.A O no hydrogen 3.228 N/A GLY 481.A N LYS 477.A O no hydrogen 3.085 N/A LEU 482.A N MET 478.A O no hydrogen 2.747 N/A ARG 483.A N LEU 479.A O no hydrogen 2.946 N/A ARG 483.A NH1 ASP 480.A OD1 no hydrogen 3.463 N/A ARG 483.A NH2 ASP 480.A OD1 no hydrogen 3.040 N/A LYS 484.A N ASP 480.A O no hydrogen 2.998 N/A VAL 485.A N GLY 481.A O no hydrogen 2.991 N/A ASN 486.A N LEU 482.A O no hydrogen 2.952 N/A LYS 487.A N ARG 483.A O no hydrogen 3.231 N/A LYS 487.A N LYS 484.A O no hydrogen 2.938 N/A SER 488.A N LYS 484.A O no hydrogen 3.324 N/A SER 488.A N VAL 485.A O no hydrogen 2.940 N/A SER 488.A OG LYS 484.A O no hydrogen 3.211 N/A SER 488.A OG TYR 523.A OH no hydrogen 3.057 N/A TYR 489.A N VAL 485.A O no hydrogen 3.179 N/A TYR 489.A OH ASP 518.A OD2 no hydrogen 2.536 N/A SER 491.A OG TYR 511.A OH no hydrogen 3.183 N/A LEU 492.A N TYR 489.A O no hydrogen 3.267 N/A THR 493.A N LEU 505.A O no hydrogen 3.023 N/A LYS 495.A N VAL 503.A O no hydrogen 2.921 N/A GLU 497.A N GLU 501.A O no hydrogen 2.800 N/A SER 499.A OG GLU 498.A OE1 no hydrogen 1.998 N/A SER 499.A OG ARG 815.A O no hydrogen 3.557 N/A GLY 500.A N GLU 497.A O no hydrogen 2.986 N/A VAL 503.A N LYS 495.A O no hydrogen 2.893 N/A ILE 504.A N ILE 465.A O no hydrogen 2.862 N/A LEU 505.A N THR 493.A O no hydrogen 2.845 N/A GLY 506.A N ILE 463.A O no hydrogen 2.911 N/A THR 507.A OG1 ASN 85.A O no hydrogen 3.063 N/A LEU 512.A N GLY 508.A O no hydrogen 2.988 N/A ASP 513.A N GLU 509.A O no hydrogen 2.865 N/A CYS 514.A N LEU 510.A O no hydrogen 2.944 N/A CYS 514.A SG LEU 510.A O no hydrogen 3.029 N/A VAL 515.A N TYR 511.A O no hydrogen 2.952 N/A MET 516.A N LEU 512.A O no hydrogen 2.876 N/A HIS 517.A N ASP 513.A O no hydrogen 2.933 N/A ASP 518.A N CYS 514.A O no hydrogen 2.943 N/A LEU 519.A N VAL 515.A O no hydrogen 2.890 N/A ARG 520.A N MET 516.A O no hydrogen 2.889 N/A ARG 520.A NH2 ILE 528.A O no hydrogen 3.017 N/A LYS 521.A N HIS 517.A O no hydrogen 2.958 N/A MET 522.A N ASP 518.A O no hydrogen 3.044 N/A TYR 523.A N ASP 518.A O no hydrogen 3.353 N/A SER 524.A OG LEU 519.A O no hydrogen 3.084 N/A LYS 529.A N GLU 468.A O no hydrogen 2.847 N/A LYS 529.A NZ GLU 468.A OE2 no hydrogen 3.564 N/A ALA 531.A N ALA 466.A O no hydrogen 3.045 N/A VAL 534.A N LYS 464.A O no hydrogen 3.058 N/A THR 536.A N VAL 462.A O no hydrogen 3.331 N/A PHE 537.A N GLU 657.A OE2 no hydrogen 3.422 N/A CYS 538.A N MET 703.A O no hydrogen 2.926 N/A GLU 539.A N LEU 658.A O no hydrogen 2.981 N/A THR 540.A N ARG 701.A O no hydrogen 2.932 N/A THR 540.A OG1 ARG 660.A O no hydrogen 2.899 N/A THR 540.A OG1 ASN 661.A O no hydrogen 3.536 N/A SER 545.A OG ALA 564.A O no hydrogen 3.555 N/A CYS 549.A SG PHE 550.A O no hydrogen 3.463 N/A ALA 551.A N ILE 560.A O no hydrogen 2.903 N/A THR 553.A OG1 ASN 555.A O no hydrogen 2.624 N/A THR 553.A OG1 GLN 682.A OE1 no hydrogen 2.979 N/A LYS 556.A NZ PRO 554.A O no hydrogen 3.391 N/A LYS 557.A N ASN 555.A O no hydrogen 2.941 N/A LYS 557.A NZ THR 553.A OG1 no hydrogen 3.286 N/A LYS 557.A NZ ASN 558.A OD1 no hydrogen 3.140 N/A LYS 559.A N VAL 670.A O no hydrogen 2.936 N/A ILE 560.A N ALA 551.A O no hydrogen 2.912 N/A THR 561.A N ASP 668.A O no hydrogen 2.872 N/A THR 561.A OG1 CYS 549.A O no hydrogen 3.395 N/A ILE 563.A N LYS 665.A O no hydrogen 2.991 N/A GLU 565.A N LYS 663.A O no hydrogen 3.316 N/A LEU 567.A N ASN 661.A O no hydrogen 3.187 N/A ASP 574.A N GLY 570.A O no hydrogen 3.246 N/A ILE 575.A N LEU 571.A O no hydrogen 2.918 N/A GLU 576.A N ALA 572.A O no hydrogen 2.902 N/A ASN 577.A N GLU 573.A O no hydrogen 3.055 N/A GLU 578.A N ILE 575.A O no hydrogen 3.201 N/A VAL 579.A N ASP 574.A O no hydrogen 3.272 N/A TRP 584.A N GLN 581.A O no hydrogen 3.405 N/A LYS 588.A N ASN 585.A O no hydrogen 2.810 N/A LYS 588.A N ASN 585.A OD1 no hydrogen 3.302 N/A LEU 589.A N ASN 585.A O no hydrogen 3.222 N/A GLY 590.A N ARG 586.A O no hydrogen 2.950 N/A GLU 591.A N LYS 587.A O no hydrogen 2.907 N/A PHE 592.A N LYS 588.A O no hydrogen 2.815 N/A PHE 593.A N LEU 589.A O no hydrogen 2.949 N/A GLN 594.A N GLY 590.A O no hydrogen 2.902 N/A THR 595.A N GLU 591.A O no hydrogen 2.962 N/A THR 595.A OG1 PHE 592.A O no hydrogen 3.300 N/A LYS 596.A N PHE 593.A O no hydrogen 3.189 N/A TYR 597.A OH ASP 574.A OD1 no hydrogen 3.321 N/A LEU 602.A N ASP 600.A OD1 no hydrogen 3.399 N/A ALA 604.A N ASP 600.A O no hydrogen 2.824 N/A ARG 605.A N LEU 601.A O no hydrogen 2.928 N/A SER 606.A N ALA 603.A O no hydrogen 3.091 N/A SER 606.A OG LEU 602.A O no hydrogen 3.305 N/A SER 606.A OG ASP 622.A O no hydrogen 2.993 N/A THR 615.A N ASP 613.A OD1 no hydrogen 2.707 N/A THR 615.A OG1 ILE 575.A O no hydrogen 2.833 N/A ASN 618.A ND2 VAL 662.A O no hydrogen 3.507 N/A LEU 620.A N ALA 609.A O no hydrogen 3.107 N/A VAL 621.A N PHE 664.A O no hydrogen 2.893 N/A THR 624.A OG1 ASP 622.A OD1 no hydrogen 2.781 N/A THR 624.A OG1 ASP 622.A OD2 no hydrogen 2.944 N/A LEU 625.A N ASP 623.A O no hydrogen 3.124 N/A SER 627.A OG SER 627.A O no hydrogen 2.443 N/A ASP 630.A N GLU 628.A O no hydrogen 2.930 N/A LEU 634.A N ASP 630.A O no hydrogen 2.654 N/A GLY 635.A N LYS 631.A O no hydrogen 2.946 N/A SER 636.A OG LEU 633.A O no hydrogen 3.088 N/A VAL 637.A N LEU 633.A O no hydrogen 3.024 N/A LYS 638.A N LEU 634.A O no hydrogen 2.777 N/A ASP 639.A N GLY 635.A O no hydrogen 2.991 N/A SER 640.A N SER 636.A O no hydrogen 3.010 N/A SER 640.A OG SER 636.A O no hydrogen 3.478 N/A ILE 641.A N VAL 637.A O no hydrogen 2.838 N/A VAL 642.A N LYS 638.A O no hydrogen 2.825 N/A GLN 643.A N ASP 639.A O no hydrogen 3.062 N/A GLY 644.A N SER 640.A O no hydrogen 2.936 N/A PHE 645.A N ILE 641.A O no hydrogen 2.808 N/A GLN 646.A N VAL 642.A O no hydrogen 2.914 N/A TRP 647.A N GLN 643.A O no hydrogen 3.039 N/A GLY 648.A N GLY 644.A O no hydrogen 2.886 N/A THR 649.A N PHE 645.A O no hydrogen 2.885 N/A THR 649.A OG1 ASN 618.A OD1 no hydrogen 3.236 N/A ARG 650.A N GLN 646.A O no hydrogen 2.939 N/A GLU 651.A N TRP 647.A O no hydrogen 3.009 N/A GLY 652.A N GLY 648.A O no hydrogen 2.974 N/A CYS 655.A SG GLU 539.A OE2 no hydrogen 3.179 N/A CYS 655.A SG LEU 654.A O no hydrogen 2.871 N/A GLU 657.A N GLU 539.A OE2 no hydrogen 2.628 N/A ILE 659.A N THR 649.A O no hydrogen 3.298 N/A ARG 660.A N GLU 539.A O no hydrogen 3.130 N/A ARG 660.A NH1 GLU 576.A OE1 no hydrogen 3.102 N/A ARG 660.A NH1 GLU 576.A OE2 no hydrogen 3.189 N/A ASN 661.A N PRO 617.A O no hydrogen 3.338 N/A LYS 663.A N GLU 565.A O no hydrogen 3.262 N/A LYS 663.A NZ GLU 565.A OE2 no hydrogen 2.621 N/A PHE 664.A N ILE 619.A O no hydrogen 2.781 N/A LYS 665.A N ILE 563.A O no hydrogen 2.728 N/A ILE 666.A N VAL 621.A O no hydrogen 2.955 N/A LEU 667.A N THR 561.A O no hydrogen 2.748 N/A ASP 668.A N THR 561.A O no hydrogen 2.948 N/A VAL 670.A N LYS 559.A O no hydrogen 2.921 N/A HIS 677.A ND1 GLU 674.A OE2 no hydrogen 2.845 N/A ARG 678.A N PRO 675.A O no hydrogen 3.034 N/A GLY 679.A N PRO 675.A O no hydrogen 2.892 N/A GLN 682.A N GLY 679.A O no hydrogen 3.076 N/A ILE 683.A N GLY 679.A O no hydrogen 2.920 N/A ALA 687.A N ILE 683.A O no hydrogen 2.937 N/A ARG 688.A N ILE 684.A O no hydrogen 2.923 N/A ARG 688.A NH2 TYR 692.A OH no hydrogen 2.783 N/A ARG 689.A N PRO 685.A O no hydrogen 2.911 N/A VAL 690.A N THR 686.A O no hydrogen 2.872 N/A VAL 691.A N ALA 687.A O no hydrogen 2.935 N/A TYR 692.A N ARG 688.A O no hydrogen 2.930 N/A SER 693.A N ARG 689.A O no hydrogen 2.890 N/A SER 693.A OG ARG 689.A O no hydrogen 2.477 N/A ALA 694.A N VAL 690.A O no hydrogen 2.866 N/A PHE 695.A N VAL 691.A O no hydrogen 2.929 N/A LEU 696.A N TYR 692.A O no hydrogen 2.908 N/A MET 697.A N SER 693.A O no hydrogen 2.888 N/A ARG 701.A N THR 540.A O no hydrogen 2.907 N/A ARG 701.A NE PRO 700.A O no hydrogen 3.391 N/A MET 703.A N CYS 538.A O no hydrogen 2.848 N/A GLU 704.A N GLN 780.A O no hydrogen 2.852 N/A TYR 706.A N HIS 778.A O no hydrogen 2.853 N/A TYR 707.A N ILE 750.A O no hydrogen 2.862 N/A PHE 708.A N VAL 775.A O no hydrogen 2.559 N/A VAL 709.A N ALA 748.A O no hydrogen 2.874 N/A GLU 710.A N LEU 773.A O no hydrogen 2.974 N/A VAL 711.A N ILE 746.A O no hydrogen 2.867 N/A GLN 712.A N PHE 771.A O no hydrogen 2.784 N/A GLN 712.A NE2 GLU 108.A OE2 no hydrogen 2.985 N/A ALA 713.A N TYR 744.A O no hydrogen 2.923 N/A CYS 717.A N PRO 714.A O no hydrogen 3.321 N/A CYS 717.A SG THR 766.A O no hydrogen 4.000 N/A VAL 718.A N ALA 715.A O no hydrogen 2.917 N/A TYR 722.A N VAL 718.A O no hydrogen 3.441 N/A THR 723.A N SER 719.A O no hydrogen 3.250 N/A VAL 724.A N ALA 720.A O no hydrogen 3.159 N/A LEU 725.A N VAL 721.A O no hydrogen 2.934 N/A ALA 726.A N TYR 722.A O no hydrogen 2.706 N/A ARG 727.A N THR 723.A O no hydrogen 3.215 N/A ARG 727.A N VAL 724.A O no hydrogen 2.933 N/A ARG 728.A N LEU 725.A O no hydrogen 3.477 N/A ARG 728.A NH1 ASP 754.A O no hydrogen 2.707 N/A ARG 728.A NH1 PHE 756.A O no hydrogen 2.782 N/A ARG 728.A NH2 PHE 756.A O no hydrogen 3.520 N/A ARG 728.A NH2 ASP 761.A OD2 no hydrogen 2.944 N/A THR 733.A N LYS 747.A O no hydrogen 2.813 N/A GLN 734.A N LYS 747.A O no hydrogen 2.925 N/A ALA 736.A N THR 745.A O no hydrogen 2.901 N/A ILE 738.A N LEU 743.A O no hydrogen 2.977 N/A TYR 744.A N ALA 713.A O no hydrogen 2.891 N/A THR 745.A N ALA 736.A O no hydrogen 2.890 N/A ILE 746.A N VAL 711.A O no hydrogen 2.883 N/A LYS 747.A N GLN 734.A O no hydrogen 2.873 N/A ALA 748.A N VAL 709.A O no hydrogen 2.935 N/A ILE 750.A N TYR 707.A O no hydrogen 2.948 N/A ALA 752.A N PRO 705.A O no hydrogen 3.257 N/A ASP 754.A N PRO 751.A O no hydrogen 2.845 N/A SER 755.A N ALA 752.A O no hydrogen 3.283 N/A SER 755.A OG ALA 752.A O no hydrogen 3.524 N/A GLY 757.A N GLU 509.A OE2 no hydrogen 2.958 N/A ASP 761.A N GLY 757.A O no hydrogen 3.075 N/A LEU 762.A N PHE 758.A O no hydrogen 2.910 N/A ARG 763.A N GLU 759.A O no hydrogen 2.913 N/A ARG 763.A NH1 GLU 759.A OE2 no hydrogen 3.493 N/A THR 764.A N THR 760.A O no hydrogen 2.894 N/A THR 764.A OG1 THR 760.A O no hydrogen 2.909 N/A THR 764.A OG1 ASP 761.A O no hydrogen 3.506 N/A HIS 765.A N ASP 761.A O no hydrogen 2.925 N/A THR 766.A OG1 LEU 762.A O no hydrogen 3.036 N/A GLY 768.A N ARG 763.A O no hydrogen 2.696 N/A GLN 769.A N THR 766.A O no hydrogen 3.163 N/A ALA 770.A N THR 766.A OG1 no hydrogen 3.140 N/A PHE 771.A N GLN 712.A O no hydrogen 3.290 N/A LEU 773.A N GLU 710.A O no hydrogen 3.132 N/A VAL 775.A N PHE 708.A O no hydrogen 2.908 N/A HIS 777.A N TYR 706.A O no hydrogen 2.912 N/A HIS 778.A N TYR 706.A O no hydrogen 3.037 N/A HIS 778.A ND1 TRP 779.A O no hydrogen 2.996 N/A GLN 780.A N GLU 704.A O no hydrogen 2.906 N/A VAL 782.A N LEU 702.A O no hydrogen 3.035 N/A LEU 787.A N ASP 785.A OD1 no hydrogen 2.885 N/A SER 790.A OG ASP 788.A OD2 no hydrogen 2.840 N/A ILE 791.A N ASP 788.A O no hydrogen 3.383 N/A LEU 796.A N GLU 797.A OE1 no hydrogen 2.467 N/A HIS 803.A N PRO 800.A O no hydrogen 2.938 N/A LEU 804.A N ALA 801.A O no hydrogen 2.919 N/A ARG 806.A NH1 PRO 786.A O no hydrogen 2.983 N/A GLU 807.A N HIS 803.A O no hydrogen 3.062 N/A PHE 808.A N LEU 804.A O no hydrogen 3.138 N/A MET 809.A N ALA 805.A O no hydrogen 3.417 N/A ILE 810.A N ARG 806.A O no hydrogen 3.142 N/A LYS 811.A N GLU 807.A O no hydrogen 3.074 N/A LYS 811.A NZ GLU 807.A OE2 no hydrogen 2.368 N/A THR 812.A N PHE 808.A O no hydrogen 3.205 N/A THR 812.A OG1 PHE 808.A O no hydrogen 2.077 N/A ARG 813.A N MET 809.A O no hydrogen 2.940 N/A ARG 814.A N ILE 810.A O no hydrogen 2.676 N/A ARG 815.A N LYS 811.A O no hydrogen 2.697 N/A LYS 816.A N THR 812.A O no hydrogen 2.821 N/A LYS 816.A NZ ASP 656.A O no hydrogen 2.986 N/A LYS 816.A NZ GLU 657.A OE1 no hydrogen 3.176 N/A LEU 818.A N ARG 813.A O no hydrogen 2.735 N/A