Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 2ajq_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): MET 1.A N GLU 49.A OE2 no hydrogen 3.029 N/A ILE 2.A N LEU 55.A O no hydrogen 3.029 N/A VAL 3.A N TYR 24.A O no hydrogen 2.734 N/A SER 4.A N VAL 57.A O no hydrogen 2.819 N/A SER 4.A OG VAL 22.A O no hydrogen 2.893 N/A SER 4.A OG TYR 42.A OH no hydrogen 2.662 N/A ALA 7.A N CYS 20.A O no hydrogen 3.004 N/A ASN 9.A N LYS 17.A O no hydrogen 3.145 N/A ASN 9.A ND2 THR 16.A OG1 no hydrogen 3.006 N/A SER 14.A N LEU 11.A O no hydrogen 3.133 N/A VAL 15.A N LEU 12.A O no hydrogen 3.469 N/A THR 16.A N ASN 9.A OD1 no hydrogen 2.839 N/A LYS 17.A N ASN 9.A OD1 no hydrogen 2.754 N/A PHE 18.A N GLN 76.A OE1 no hydrogen 2.820 N/A HIS 19.A N ALA 7.A O no hydrogen 2.895 N/A HIS 19.A NE2 TRP 160.A O no hydrogen 2.681 N/A GLY 21.A N TYR 34.A O no hydrogen 3.008 N/A VAL 22.A N ALA 5.A O no hydrogen 3.210 N/A ILE 23.A N VAL 32.A O no hydrogen 3.142 N/A TYR 24.A N VAL 3.A O no hydrogen 2.832 N/A TYR 26.A N MET 1.A O no hydrogen 3.241 N/A TYR 26.A OH GLU 183.A OE2 no hydrogen 2.968 N/A SER 27.A N ASP 25.A OD1 no hydrogen 2.886 N/A SER 27.A OG ASP 25.A OD1 no hydrogen 2.880 N/A ALA 29.A N ASP 25.A O no hydrogen 2.941 N/A GLU 30.A N THR 28.A OG1 no hydrogen 3.280 N/A TYR 34.A N GLY 21.A O no hydrogen 2.856 N/A ARG 35.A N ASP 38.A OD2 no hydrogen 2.719 N/A ARG 35.A NE GLU 165.A OE2 no hydrogen 2.752 N/A ARG 35.A NH2 GLU 165.A OE1 no hydrogen 3.459 N/A ASP 38.A N ARG 35.A O no hydrogen 2.462 N/A PHE 39.A N PRO 36.A O no hydrogen 3.445 N/A TYR 42.A N ASP 38.A O no hydrogen 2.831 N/A TYR 42.A OH SER 4.A OG no hydrogen 2.662 N/A LEU 43.A N PHE 39.A O no hydrogen 3.117 N/A ASP 44.A N GLY 40.A O no hydrogen 3.314 N/A ALA 45.A N ALA 41.A O no hydrogen 2.878 N/A LEU 46.A N TYR 42.A O no hydrogen 3.195 N/A GLU 47.A N LEU 43.A O no hydrogen 3.110 N/A ALA 48.A N ASP 44.A O no hydrogen 3.023 N/A VAL 50.A N LEU 46.A O no hydrogen 3.372 N/A ALA 51.A N GLU 47.A O no hydrogen 2.908 N/A ARG 52.A N ALA 48.A O no hydrogen 2.931 N/A ARG 52.A NE GLU 49.A OE1 no hydrogen 3.367 N/A ARG 52.A NH2 GLU 49.A OE1 no hydrogen 2.849 N/A GLY 53.A N VAL 50.A O no hydrogen 3.187 N/A GLY 54.A N GLU 49.A O no hydrogen 2.705 N/A LEU 55.A N GLU 49.A OE2 no hydrogen 3.102 N/A ILE 56.A N ASN 87.A O no hydrogen 2.827 N/A VAL 57.A N ILE 2.A O no hydrogen 2.909 N/A PHE 58.A N ILE 89.A O no hydrogen 3.043 N/A HIS 59.A ND1 THR 91.A OG1 no hydrogen 2.579 N/A ASN 60.A N ASP 90.A OD1 no hydrogen 2.712 N/A HIS 62.A N ASP 90.A OD2 no hydrogen 2.905 N/A TYR 64.A N ASN 60.A O no hydrogen 3.123 N/A TYR 64.A OH ALA 10.A O no hydrogen 2.830 N/A VAL 66.A N GLY 61.A O no hydrogen 2.983 N/A ALA 68.A N TYR 64.A O no hydrogen 2.816 N/A LEU 69.A N ASP 65.A O no hydrogen 2.900 N/A LEU 69.A N VAL 66.A O no hydrogen 3.150 N/A THR 70.A N VAL 66.A O no hydrogen 3.078 N/A THR 70.A OG1 VAL 66.A O no hydrogen 3.189 N/A THR 70.A OG1 PHE 81.A O no hydrogen 2.884 N/A LYS 71.A N PRO 67.A O no hydrogen 3.034 N/A LYS 71.A NZ LEU 12.A O no hydrogen 2.807 N/A LYS 71.A NZ GLU 13.A O no hydrogen 3.011 N/A LYS 71.A NZ VAL 15.A O no hydrogen 3.273 N/A LEU 72.A N ALA 68.A O no hydrogen 2.960 N/A ALA 73.A N LEU 69.A O no hydrogen 3.149 N/A LYS 74.A N LYS 71.A O no hydrogen 3.387 N/A LEU 75.A N LYS 71.A O no hydrogen 3.354 N/A GLN 76.A N LEU 72.A O no hydrogen 3.028 N/A LEU 77.A N ALA 73.A O no hydrogen 3.315 N/A ARG 79.A N ALA 73.A O no hydrogen 2.752 N/A ARG 79.A NH1 ASP 44.A OD1 no hydrogen 3.387 N/A ARG 79.A NH2 ASP 44.A OD1 no hydrogen 3.543 N/A ASN 87.A N PRO 84.A O no hydrogen 2.714 N/A ASN 87.A ND2 GLY 54.A O no hydrogen 3.010 N/A CYS 88.A N ARG 85.A O no hydrogen 3.036 N/A CYS 88.A SG PRO 84.A O no hydrogen 3.889 N/A ILE 89.A N ILE 56.A O no hydrogen 2.898 N/A ASP 90.A N HIS 218.A NE2 no hydrogen 2.876 N/A THR 91.A N PHE 58.A O no hydrogen 3.257 N/A THR 91.A OG1 HIS 59.A ND1 no hydrogen 2.579 N/A LEU 92.A N ASP 90.A OD1 no hydrogen 2.957 N/A VAL 93.A N ASP 90.A O no hydrogen 2.849 N/A LEU 94.A N ASP 90.A O no hydrogen 2.977 N/A SER 95.A N THR 91.A O no hydrogen 2.643 N/A ARG 96.A N LEU 92.A O no hydrogen 3.063 N/A LEU 97.A N VAL 93.A O no hydrogen 3.039 N/A LEU 97.A N LEU 94.A O no hydrogen 2.919 N/A ILE 98.A N LEU 94.A O no hydrogen 2.738 N/A HIS 99.A N SER 95.A O no hydrogen 2.871 N/A ASN 101.A ND2 ASP 104.A OD2 no hydrogen 3.109 N/A ASP 104.A N ASN 101.A O no hydrogen 3.087 N/A THR 105.A N ASN 101.A O no hydrogen 3.424 N/A THR 105.A OG1 ASN 101.A O no hydrogen 3.441 N/A ASP 106.A N LEU 102.A O no hydrogen 2.976 N/A MET 107.A N ASP 104.A O no hydrogen 2.940 N/A LEU 110.A N ASP 106.A O no hydrogen 2.740 N/A LEU 110.A N MET 107.A O no hydrogen 3.233 N/A ARG 111.A N MET 107.A O no hydrogen 3.071 N/A SER 112.A N GLY 108.A O no hydrogen 3.144 N/A SER 112.A OG GLY 108.A O no hydrogen 2.946 N/A GLY 113.A N LEU 109.A O no hydrogen 3.221 N/A ARG 119.A N PRO 116.A O no hydrogen 3.234 N/A PHE 120.A N GLY 117.A O no hydrogen 3.028 N/A GLY 121.A N ASP 106.A OD2 no hydrogen 2.995 N/A SER 122.A N ARG 119.A O no hydrogen 3.243 N/A HIS 123.A NE2 HIS 99.A O no hydrogen 3.200 N/A ALA 124.A N SER 122.A OG no hydrogen 2.944 N/A TRP 128.A N ALA 124.A O no hydrogen 3.210 N/A TRP 128.A NE1 SER 95.A OG no hydrogen 2.976 N/A GLY 129.A N LEU 125.A O no hydrogen 3.042 N/A GLY 129.A N GLU 126.A O no hydrogen 2.590 N/A TYR 130.A N GLU 126.A O no hydrogen 3.264 N/A ARG 131.A N ALA 127.A O no hydrogen 3.295 N/A ARG 131.A NH1 ASP 106.A OD2 no hydrogen 3.033 N/A ARG 131.A NH1 SER 122.A O no hydrogen 2.688 N/A ARG 131.A NH2 ASP 106.A OD2 no hydrogen 2.482 N/A LEU 132.A N TRP 128.A O no hydrogen 2.910 N/A GLU 134.A N GLY 129.A O no hydrogen 2.898 N/A TYR 139.A OH GLU 159.A O no hydrogen 2.829 N/A ASP 141.A N GLU 138.A O no hydrogen 2.820 N/A ASP 142.A N GLU 138.A O no hydrogen 3.188 N/A LYS 144.A N LYS 140.A O no hydrogen 3.202 N/A ARG 145.A N ASP 141.A O no hydrogen 3.229 N/A LEU 147.A N LYS 144.A O no hydrogen 3.080 N/A GLU 148.A N ARG 145.A O no hydrogen 3.000 N/A GLN 150.A NE2 MET 146.A O no hydrogen 2.529 N/A GLY 151.A N GLU 148.A O no hydrogen 3.179 N/A TYR 154.A OH GLU 159.A OE1 no hydrogen 2.828 N/A GLY 157.A N TYR 154.A OH no hydrogen 3.228 N/A MET 158.A N GLU 159.A OE1 no hydrogen 2.902 N/A GLU 159.A N GLU 159.A OE1 no hydrogen 2.597 N/A TRP 161.A N MET 158.A O no hydrogen 3.460 N/A ASN 164.A ND2 TYR 139.A OH no hydrogen 2.879 N/A ASN 164.A ND2 ASN 162.A O no hydrogen 3.632 N/A MET 167.A N ASN 164.A O no hydrogen 2.628 N/A MET 167.A N ASN 164.A OD1 no hydrogen 2.821 N/A MET 168.A N ASN 164.A O no hydrogen 3.225 N/A ASP 169.A N GLU 165.A O no hydrogen 3.266 N/A TYR 170.A N GLU 166.A O no hydrogen 3.370 N/A ASN 171.A N MET 167.A O no hydrogen 2.911 N/A ASN 171.A ND2 CYS 20.A O no hydrogen 3.601 N/A GLN 173.A N ASP 169.A O no hydrogen 3.051 N/A GLN 173.A NE2 GLY 137.A O no hydrogen 3.627 N/A ASP 174.A N TYR 170.A O no hydrogen 3.115 N/A VAL 175.A N VAL 172.A O no hydrogen 2.836 N/A VAL 176.A N VAL 172.A O no hydrogen 3.104 N/A VAL 177.A N GLN 173.A O no hydrogen 3.268 N/A THR 178.A N ASP 174.A O no hydrogen 3.290 N/A THR 178.A OG1 ASP 174.A O no hydrogen 2.643 N/A LYS 179.A N VAL 175.A O no hydrogen 2.863 N/A LYS 179.A NZ GLU 183.A OE1 no hydrogen 3.245 N/A LYS 179.A NZ GLU 183.A OE2 no hydrogen 2.743 N/A ALA 180.A N VAL 176.A O no hydrogen 2.812 N/A LEU 181.A N VAL 177.A O no hydrogen 2.770 N/A LEU 182.A N THR 178.A O no hydrogen 2.769 N/A GLU 183.A N LYS 179.A O no hydrogen 3.037 N/A LYS 184.A N ALA 180.A O no hydrogen 3.103 N/A LEU 185.A N LEU 181.A O no hydrogen 3.023 N/A LEU 185.A N LEU 182.A O no hydrogen 3.068 N/A LEU 186.A N LEU 182.A O no hydrogen 2.692 N/A SER 187.A N GLU 183.A O no hydrogen 3.041 N/A SER 187.A OG GLU 183.A O no hydrogen 3.514 N/A SER 187.A OG LYS 184.A O no hydrogen 2.929 N/A ASP 188.A N LEU 185.A O no hydrogen 3.151 N/A LYS 189.A NZ LEU 186.A O no hydrogen 3.156 N/A LYS 189.A NZ PHE 192.A O no hydrogen 2.763 N/A HIS 190.A N ASP 188.A OD1 no hydrogen 3.445 N/A HIS 190.A NE2 GLY 598.A O no hydrogen 2.960 N/A TYR 191.A N ASP 188.A O no hydrogen 3.031 N/A PHE 192.A N ASP 188.A O no hydrogen 2.965 N/A THR 199.A OG1 ASP 197.A OD1 no hydrogen 2.944 N/A THR 199.A OG1 ASP 197.A OD2 no hydrogen 3.283 N/A ASP 200.A N ASP 197.A O no hydrogen 3.058 N/A TYR 203.A N GLY 53.A O no hydrogen 3.145 N/A THR 205.A N GLY 202.A O no hydrogen 2.906 N/A PHE 206.A N GLY 202.A O no hydrogen 2.894 N/A TRP 207.A N TYR 203.A O no hydrogen 3.183 N/A TRP 207.A NE1 GLU 86.A O no hydrogen 2.859 N/A SER 208.A N THR 204.A O no hydrogen 3.315 N/A SER 208.A OG THR 204.A O no hydrogen 3.103 N/A SER 208.A OG GLU 209.A OE2 no hydrogen 3.252 N/A GLU 209.A N THR 205.A O no hydrogen 2.953 N/A SER 210.A OG PHE 206.A O no hydrogen 2.552 N/A SER 210.A OG TRP 207.A O no hydrogen 3.405 N/A LEU 211.A N TYR 191.A O no hydrogen 2.941 N/A VAL 214.A N LEU 211.A O no hydrogen 3.039 N/A ASP 215.A N GLU 212.A O no hydrogen 3.111 N/A ILE 216.A N GLU 212.A O no hydrogen 3.088 N/A GLU 217.A N ALA 213.A O no hydrogen 2.957 N/A HIS 218.A N ASP 215.A O no hydrogen 3.201 N/A HIS 218.A ND1 VAL 214.A O no hydrogen 2.818 N/A ARG 219.A N ASP 215.A O no hydrogen 3.025 N/A ARG 219.A NE ASP 215.A OD1 no hydrogen 2.930 N/A ARG 219.A NH1 GLU 631.A OE2 no hydrogen 2.832 N/A ALA 220.A N ILE 216.A O no hydrogen 2.842 N/A ALA 221.A N GLU 217.A O no hydrogen 3.122 N/A TRP 222.A N HIS 218.A O no hydrogen 3.230 N/A LEU 223.A N ARG 219.A O no hydrogen 3.022 N/A LEU 224.A N ALA 220.A O no hydrogen 2.902 N/A ALA 225.A N ALA 221.A O no hydrogen 2.949 N/A LYS 226.A N TRP 222.A O no hydrogen 3.208 N/A GLN 227.A N LEU 223.A O no hydrogen 2.962 N/A GLU 228.A N LEU 224.A O no hydrogen 3.006 N/A ARG 229.A N ALA 225.A O no hydrogen 3.224 N/A ASN 230.A N LYS 226.A O no hydrogen 3.013 N/A ASN 230.A ND2 HIS 640.A NE2 no hydrogen 3.269 N/A ASN 230.A ND2 TYR 648.A O no hydrogen 2.896 N/A GLY 231.A N GLN 227.A O no hydrogen 3.137 N/A PHE 232.A N ILE 416.A O no hydrogen 2.916 N/A PHE 234.A N GLY 414.A O no hydrogen 3.065 N/A ASP 235.A N ALA 454.A O no hydrogen 2.730 N/A LYS 237.A NZ GLU 240.A OE1 no hydrogen 2.707 N/A ALA 238.A N ASP 235.A OD1 no hydrogen 3.398 N/A ILE 239.A N ASP 235.A O no hydrogen 3.309 N/A GLU 240.A N THR 236.A O no hydrogen 2.850 N/A GLU 241.A N LYS 237.A O no hydrogen 2.895 N/A LEU 242.A N ALA 238.A O no hydrogen 2.846 N/A TYR 243.A N ILE 239.A O no hydrogen 2.908 N/A TYR 243.A OH GLU 401.A OE2 no hydrogen 2.787 N/A VAL 244.A N GLU 240.A O no hydrogen 3.222 N/A GLU 245.A N GLU 241.A O no hydrogen 3.279 N/A LEU 246.A N LEU 242.A O no hydrogen 2.887 N/A ALA 247.A N TYR 243.A O no hydrogen 2.854 N/A ALA 248.A N VAL 244.A O no hydrogen 3.035 N/A ARG 249.A N GLU 245.A O no hydrogen 3.111 N/A ARG 249.A NE GLU 388.A OE2 no hydrogen 2.708 N/A ARG 249.A NH2 GLU 388.A OE1 no hydrogen 2.956 N/A ARG 249.A NH2 GLU 388.A OE2 no hydrogen 3.088 N/A ARG 250.A N LEU 246.A O no hydrogen 2.709 N/A ARG 250.A NH1 GLN 393.A OE1 no hydrogen 2.995 N/A ARG 250.A NH1 GLU 401.A OE1 no hydrogen 3.038 N/A ARG 250.A NH1 GLU 401.A OE2 no hydrogen 3.143 N/A ARG 250.A NH2 GLU 401.A OE2 no hydrogen 2.656 N/A SER 251.A N ALA 247.A O no hydrogen 2.891 N/A SER 251.A OG ALA 247.A O no hydrogen 3.363 N/A GLU 252.A N ALA 248.A O no hydrogen 3.048 N/A LEU 253.A N ARG 249.A O no hydrogen 3.020 N/A LEU 254.A N ARG 250.A O no hydrogen 2.798 N/A ARG 255.A N SER 251.A O no hydrogen 2.914 N/A ARG 255.A NE GLU 252.A OE1 no hydrogen 2.927 N/A ARG 255.A NH2 GLU 252.A OE1 no hydrogen 2.941 N/A LYS 256.A N GLU 252.A O no hydrogen 3.146 N/A LEU 257.A N LEU 253.A O no hydrogen 2.983 N/A THR 258.A N LEU 254.A O no hydrogen 2.960 N/A THR 258.A N ARG 255.A O no hydrogen 3.255 N/A THR 258.A OG1 LEU 254.A O no hydrogen 3.374 N/A THR 258.A OG1 ARG 255.A O no hydrogen 2.981 N/A GLU 259.A N LYS 256.A O no hydrogen 3.247 N/A THR 260.A N LYS 256.A O no hydrogen 3.242 N/A THR 260.A OG1 LYS 256.A O no hydrogen 3.488 N/A THR 260.A OG1 GLU 378.A OE2 no hydrogen 3.391 N/A PHE 261.A N LEU 257.A O no hydrogen 3.109 N/A TRP 264.A N VAL 332.A O no hydrogen 3.238 N/A TRP 264.A NE1 GLN 266.A OE1 no hydrogen 2.992 N/A GLN 266.A N GLU 330.A O no hydrogen 3.065 N/A GLN 266.A NE2 GLU 330.A OE2 no hydrogen 3.359 N/A LYS 268.A N PRO 328.A O no hydrogen 3.112 N/A THR 271.A N ILE 289.A O no hydrogen 3.136 N/A GLU 272.A N ILE 289.A O no hydrogen 3.252 N/A CYS 275.A SG MET 273.A O no hydrogen 3.500 N/A HIS 276.A N LYS 281.A O no hydrogen 2.801 N/A GLY 280.A N HIS 276.A O no hydrogen 2.834 N/A LEU 283.A N PHE 274.A O no hydrogen 2.898 N/A TYR 286.A N LEU 283.A O no hydrogen 3.392 N/A ILE 289.A N GLU 272.A O no hydrogen 2.847 N/A LYS 290.A N TYR 326.A O no hydrogen 3.020 N/A THR 291.A OG1 GLU 272.A OE2 no hydrogen 2.830 N/A GLY 296.A N ASP 316.A OD1 no hydrogen 3.309 N/A LYS 299.A N GLU 314.A O no hydrogen 2.840 N/A GLN 306.A N ASN 303.A O no hydrogen 2.740 N/A ASP 316.A N ILE 297.A O no hydrogen 2.812 N/A ARG 318.A N ASP 316.A OD2 no hydrogen 2.800 N/A ALA 322.A N GLY 295.A O no hydrogen 3.027 N/A GLY 323.A N PRO 292.A O no hydrogen 3.251 N/A ALA 324.A N VAL 321.A O no hydrogen 2.977 N/A TYR 326.A N LYS 290.A O no hydrogen 3.211 N/A GLU 330.A N GLN 266.A O no hydrogen 3.144 N/A VAL 332.A N TRP 264.A O no hydrogen 2.869 N/A PHE 334.A N GLY 262.A O no hydrogen 3.370 N/A ASN 335.A N HIS 341.A ND1 no hydrogen 3.228 N/A SER 337.A N ASN 335.A OD1 no hydrogen 2.761 N/A SER 338.A N ASN 335.A O no hydrogen 2.966 N/A HIS 341.A N SER 338.A OG no hydrogen 2.841 N/A ILE 342.A N SER 338.A O no hydrogen 2.889 N/A GLN 343.A N ARG 339.A O no hydrogen 2.984 N/A GLN 343.A NE2 ARG 339.A O no hydrogen 3.668 N/A LYS 344.A N ASP 340.A O no hydrogen 3.040 N/A LYS 345.A N HIS 341.A O no hydrogen 3.020 N/A LYS 345.A NZ GLU 348.A OE1 no hydrogen 3.152 N/A LYS 345.A NZ GLU 348.A OE2 no hydrogen 3.211 N/A LEU 346.A N ILE 342.A O no hydrogen 3.061 N/A GLN 347.A N GLN 343.A O no hydrogen 3.122 N/A GLN 347.A NE2 GLN 343.A O no hydrogen 3.361 N/A GLU 348.A N LYS 344.A O no hydrogen 3.191 N/A ALA 349.A N LEU 346.A O no hydrogen 2.865 N/A GLY 350.A N GLN 347.A O no hydrogen 2.944 N/A TRP 351.A N LEU 346.A O no hydrogen 3.139 N/A THR 357.A N ALA 361.A O no hydrogen 2.866 N/A THR 357.A OG1 ALA 361.A O no hydrogen 2.871 N/A GLY 360.A N THR 357.A O no hydrogen 2.651 N/A VAL 363.A N LYS 355.A O no hydrogen 3.001 N/A VAL 368.A N ASP 365.A OD1 no hydrogen 3.011 N/A LEU 369.A N ASP 365.A O no hydrogen 3.038 N/A GLU 370.A N ASP 366.A O no hydrogen 2.998 N/A GLY 371.A N VAL 368.A O no hydrogen 2.855 N/A VAL 372.A N LEU 369.A O no hydrogen 3.106 N/A ARG 373.A NH1 GLU 370.A O no hydrogen 3.096 N/A ARG 373.A NH1 VAL 372.A O no hydrogen 2.947 N/A VAL 374.A N GLN 380.A OE1 no hydrogen 3.016 N/A GLU 378.A N ASP 376.A OD1 no hydrogen 3.264 N/A LYS 379.A NZ ASP 376.A OD2 no hydrogen 2.965 N/A GLN 380.A N ASP 376.A O no hydrogen 2.835 N/A GLN 380.A NE2 VAL 372.A O no hydrogen 3.224 N/A ALA 381.A N PRO 377.A O no hydrogen 3.069 N/A ALA 382.A N GLU 378.A O no hydrogen 3.074 N/A ALA 382.A N LYS 379.A O no hydrogen 3.188 N/A ILE 383.A N GLN 380.A O no hydrogen 2.879 N/A LEU 385.A N ALA 382.A O no hydrogen 2.806 N/A ILE 386.A N ALA 382.A O no hydrogen 2.949 N/A ILE 386.A N ILE 383.A O no hydrogen 3.060 N/A LYS 387.A N ILE 383.A O no hydrogen 2.969 N/A LYS 387.A NZ GLU 370.A OE1 no hydrogen 3.524 N/A GLU 388.A N ASP 384.A O no hydrogen 3.073 N/A TYR 389.A N LEU 385.A O no hydrogen 2.956 N/A LEU 390.A N ILE 386.A O no hydrogen 2.923 N/A MET 391.A N LYS 387.A O no hydrogen 3.161 N/A ILE 392.A N GLU 388.A O no hydrogen 2.788 N/A GLN 393.A N TYR 389.A O no hydrogen 2.861 N/A LYS 394.A N LEU 390.A O no hydrogen 2.952 N/A ARG 395.A N MET 391.A O no hydrogen 3.117 N/A ARG 395.A NE PRO 446.A O no hydrogen 2.825 N/A ARG 395.A NH2 PRO 446.A O no hydrogen 3.143 N/A ILE 396.A N ILE 392.A O no hydrogen 2.917 N/A GLY 397.A N GLN 393.A O no hydrogen 2.779 N/A GLN 398.A N LYS 394.A O no hydrogen 3.025 N/A GLN 398.A NE2 GLN 439.A O no hydrogen 2.886 N/A SER 399.A N ARG 395.A O no hydrogen 2.873 N/A SER 399.A OG ARG 395.A O no hydrogen 2.840 N/A ALA 400.A N ILE 396.A O no hydrogen 2.803 N/A GLU 401.A N ILE 396.A O no hydrogen 2.957 N/A GLY 402.A N GLY 397.A O no hydrogen 2.928 N/A ALA 405.A N GLY 402.A O no hydrogen 3.187 N/A TRP 406.A N GLN 398.A O no hydrogen 3.218 N/A LEU 407.A N SER 399.A O no hydrogen 3.154 N/A ARG 408.A N ALA 405.A O no hydrogen 3.026 N/A ARG 408.A NE GLY 402.A O no hydrogen 2.667 N/A ARG 408.A NH2 GLU 401.A O no hydrogen 2.898 N/A TYR 409.A N TRP 406.A O no hydrogen 2.801 N/A VAL 410.A N TRP 406.A O no hydrogen 3.133 N/A ALA 411.A N LYS 415.A O no hydrogen 3.005 N/A GLY 414.A N ALA 411.A O no hydrogen 3.074 N/A LYS 415.A N ASP 413.A OD1 no hydrogen 3.232 N/A LYS 415.A NZ ASP 413.A O no hydrogen 3.398 N/A LYS 415.A NZ HIS 460.A ND1 no hydrogen 3.202 N/A ILE 416.A N PHE 232.A O no hydrogen 2.930 N/A HIS 417.A ND1 GLU 228.A O no hydrogen 2.905 N/A HIS 417.A NE2 ASP 413.A OD1 no hydrogen 3.289 N/A HIS 417.A NE2 ASP 413.A OD2 no hydrogen 3.171 N/A SER 419.A N ALA 433.A O no hydrogen 3.149 N/A SER 419.A OG ALA 433.A O no hydrogen 2.773 N/A VAL 420.A N GLU 228.A OE2 no hydrogen 2.603 N/A ASN 421.A N THR 431.A O no hydrogen 2.986 N/A ASN 423.A N ASN 421.A OD1 no hydrogen 3.196 N/A ASN 423.A ND2 GLY 428.A O no hydrogen 3.490 N/A GLY 424.A N ASN 421.A O no hydrogen 3.288 N/A ALA 425.A N ARG 429.A O no hydrogen 3.117 N/A THR 427.A OG1 GLN 615.A OE1 no hydrogen 2.518 N/A GLY 428.A N ALA 425.A O no hydrogen 2.755 N/A THR 431.A N ASN 421.A O no hydrogen 2.954 N/A HIS 432.A NE2 TRP 651.A O no hydrogen 2.902 N/A ALA 433.A N SER 419.A O no hydrogen 3.334 N/A ALA 438.A N ASN 436.A OD1 no hydrogen 2.934 N/A GLN 439.A N ASN 436.A O no hydrogen 3.131 N/A SER 445.A N GLY 442.A O no hydrogen 3.026 N/A SER 445.A OG GLY 442.A O no hydrogen 2.909 N/A GLY 448.A N SER 445.A O no hydrogen 2.825 N/A CYS 451.A N TYR 447.A O no hydrogen 3.135 N/A CYS 451.A SG TYR 447.A O no hydrogen 3.097 N/A ARG 452.A N GLY 448.A O no hydrogen 2.894 N/A ARG 452.A NE ILE 440.A O no hydrogen 3.190 N/A ARG 452.A NE PRO 441.A O no hydrogen 2.715 N/A ARG 452.A NH2 ILE 440.A O no hydrogen 2.577 N/A ALA 453.A N GLU 449.A O no hydrogen 2.963 N/A ALA 454.A N CYS 451.A O no hydrogen 3.139 N/A PHE 455.A N ARG 452.A O no hydrogen 2.933 N/A GLY 456.A N PRO 233.A O no hydrogen 3.163 N/A ALA 457.A N GLN 471.A OE1 no hydrogen 2.906 N/A GLU 458.A N PRO 698.A O no hydrogen 3.003 N/A HIS 459.A N GLY 456.A O no hydrogen 2.869 N/A HIS 459.A NE2 ALA 453.A O no hydrogen 2.759 N/A HIS 460.A N ALA 457.A O no hydrogen 2.735 N/A ASP 462.A N LYS 467.A O no hydrogen 2.725 N/A ILE 464.A N ASP 462.A OD2 no hydrogen 3.190 N/A THR 465.A N ASP 462.A OD2 no hydrogen 3.017 N/A THR 465.A OG1 ASP 462.A OD2 no hydrogen 3.056 N/A GLY 466.A N ASP 462.A O no hydrogen 2.863 N/A LYS 467.A N THR 465.A OG1 no hydrogen 3.293 N/A TRP 469.A N HIS 460.A O no hydrogen 3.003 N/A TRP 469.A NE1 ASP 462.A OD1 no hydrogen 3.369 N/A VAL 470.A N CYS 660.A O no hydrogen 2.677 N/A GLN 471.A N GLY 697.A O no hydrogen 2.668 N/A GLN 471.A NE2 GLN 657.A OE1 no hydrogen 2.650 N/A ALA 472.A N VAL 658.A O no hydrogen 2.887 N/A GLY 473.A N LYS 695.A O no hydrogen 2.801 N/A ILE 474.A N ILE 656.A O no hydrogen 2.941 N/A ASP 475.A N GLU 693.A O no hydrogen 3.036 N/A ALA 476.A N ASP 654.A O no hydrogen 2.916 N/A SER 477.A N ASP 691.A O no hydrogen 3.125 N/A SER 477.A OG GLU 693.A OE2 no hydrogen 3.476 N/A ARG 482.A N GLY 478.A O no hydrogen 3.244 N/A ARG 482.A NH1 LEU 689.A O no hydrogen 2.517 N/A ARG 482.A NH1 ASP 691.A OD2 no hydrogen 3.015 N/A CYS 483.A N LEU 479.A O no hydrogen 3.115 N/A CYS 483.A SG LEU 479.A O no hydrogen 3.166 N/A LEU 484.A N GLU 480.A O no hydrogen 3.106 N/A ALA 485.A N LEU 481.A O no hydrogen 3.013 N/A HIS 486.A N ARG 482.A O no hydrogen 3.002 N/A HIS 486.A N CYS 483.A O no hydrogen 3.158 N/A PHE 487.A N CYS 483.A O no hydrogen 3.199 N/A MET 488.A N LEU 484.A O no hydrogen 3.144 N/A PHE 491.A N MET 488.A O no hydrogen 2.801 N/A ASP 492.A N MET 488.A O no hydrogen 2.780 N/A GLU 495.A N ASP 492.A O no hydrogen 3.020 N/A TYR 496.A N ASP 492.A OD2 no hydrogen 2.679 N/A TYR 496.A OH ASN 509.A OD1 no hydrogen 2.593 N/A HIS 498.A N GLY 494.A O no hydrogen 3.022 N/A GLU 499.A N GLU 495.A O no hydrogen 3.172 N/A ILE 500.A N TYR 496.A O no hydrogen 3.104 N/A LEU 501.A N ALA 497.A O no hydrogen 3.208 N/A ASN 502.A N HIS 498.A O no hydrogen 3.007 N/A GLY 503.A N GLU 499.A O no hydrogen 3.258 N/A GLY 503.A N ILE 500.A O no hydrogen 2.707 N/A THR 507.A N ASP 504.A O no hydrogen 3.126 N/A LYS 508.A N ASP 504.A O no hydrogen 3.259 N/A LYS 508.A NZ GLU 499.A OE2 no hydrogen 2.622 N/A ASN 509.A N ILE 505.A O no hydrogen 2.943 N/A GLN 510.A N HIS 506.A O no hydrogen 2.947 N/A GLN 510.A NE2 LEU 515.A O no hydrogen 3.219 N/A ILE 511.A N THR 507.A O no hydrogen 2.958 N/A ALA 512.A N LYS 508.A O no hydrogen 3.074 N/A ALA 513.A N ASN 509.A O no hydrogen 2.824 N/A LEU 515.A N GLN 510.A O no hydrogen 3.055 N/A ASN 520.A N THR 517.A OG1 no hydrogen 3.021 N/A ALA 521.A N THR 517.A O no hydrogen 3.291 N/A LYS 522.A N ARG 518.A O no hydrogen 3.217 N/A THR 523.A N ASP 519.A O no hydrogen 3.126 N/A PHE 524.A N ALA 521.A O no hydrogen 3.133 N/A ILE 525.A N ALA 521.A O no hydrogen 3.023 N/A PHE 528.A N PHE 524.A O no hydrogen 2.672 N/A LEU 529.A N ILE 525.A O no hydrogen 2.814 N/A TYR 530.A N TYR 526.A O no hydrogen 3.281 N/A GLY 531.A N PHE 528.A O no hydrogen 3.426 N/A ALA 532.A N GLY 527.A O no hydrogen 2.976 N/A ILE 537.A N GLY 533.A O no hydrogen 3.284 N/A GLY 538.A N ASP 534.A O no hydrogen 3.006 N/A GLN 539.A N GLU 535.A O no hydrogen 2.876 N/A ILE 540.A N ILE 537.A O no hydrogen 3.057 N/A VAL 541.A N GLY 538.A O no hydrogen 3.125 N/A GLY 542.A N GLN 539.A O no hydrogen 3.340 N/A ALA 543.A N GLY 538.A O no hydrogen 3.095 N/A GLY 548.A N GLY 544.A O no hydrogen 3.066 N/A LYS 549.A N LYS 545.A O no hydrogen 2.905 N/A LEU 551.A N ARG 547.A O no hydrogen 3.012 N/A LEU 551.A N GLY 548.A O no hydrogen 2.915 N/A LYS 552.A N GLY 548.A O no hydrogen 3.057 N/A LYS 552.A NZ ALA 532.A O no hydrogen 3.108 N/A LYS 552.A NZ ASP 534.A OD1 no hydrogen 2.973 N/A LYS 553.A N LYS 549.A O no hydrogen 3.118 N/A LYS 553.A NZ GLU 557.A OE2 no hydrogen 3.140 N/A LYS 554.A N GLU 550.A O no hydrogen 3.140 N/A PHE 555.A N LEU 551.A O no hydrogen 3.296 N/A LEU 556.A N LYS 552.A O no hydrogen 2.883 N/A GLU 557.A N LYS 553.A O no hydrogen 3.083 N/A ASN 558.A N LYS 554.A O no hydrogen 3.034 N/A THR 559.A OG1 PHE 555.A O no hydrogen 2.877 N/A ILE 562.A N THR 559.A O no hydrogen 2.940 N/A ALA 564.A N PRO 560.A O no hydrogen 2.865 N/A LEU 565.A N ALA 561.A O no hydrogen 2.888 N/A ARG 566.A N ILE 562.A O no hydrogen 2.941 N/A GLU 567.A N ALA 563.A O no hydrogen 3.037 N/A SER 568.A N ALA 564.A O no hydrogen 2.960 N/A ILE 569.A N LEU 565.A O no hydrogen 3.050 N/A GLN 570.A N ARG 566.A O no hydrogen 2.730 N/A GLN 571.A N GLU 567.A O no hydrogen 2.906 N/A THR 572.A N SER 568.A O no hydrogen 3.249 N/A THR 572.A N ILE 569.A O no hydrogen 3.274 N/A THR 572.A OG1 SER 568.A O no hydrogen 2.849 N/A LEU 573.A N ILE 569.A O no hydrogen 3.306 N/A VAL 574.A N GLN 570.A O no hydrogen 3.049 N/A GLU 575.A N LYS 587.A O no hydrogen 2.919 N/A SER 576.A N LYS 587.A O no hydrogen 3.376 N/A GLN 578.A N GLN 585.A O no hydrogen 2.965 N/A VAL 580.A N GLU 583.A O no hydrogen 2.855 N/A GLU 583.A N VAL 580.A O no hydrogen 2.925 N/A GLN 585.A N GLN 578.A O no hydrogen 2.656 N/A LYS 587.A N SER 576.A O no hydrogen 2.835 N/A LYS 589.A N LEU 573.A O no hydrogen 2.611 N/A LYS 589.A NZ GLN 571.A O no hydrogen 2.711 N/A ARG 590.A N LEU 573.A O no hydrogen 3.418 N/A ARG 591.A NH2 VAL 603.A O no hydrogen 3.569 N/A ARG 591.A NH2 ARG 604.A O no hydrogen 3.481 N/A ILE 593.A N VAL 601.A O no hydrogen 3.167 N/A GLY 595.A N ARG 599.A O no hydrogen 2.936 N/A GLY 598.A N GLY 595.A O no hydrogen 2.840 N/A ARG 599.A N ASP 597.A OD1 no hydrogen 3.442 N/A ARG 599.A NH1 GLU 217.A OE2 no hydrogen 3.325 N/A ARG 599.A NH1 ASP 597.A OD1 no hydrogen 3.386 N/A ARG 599.A NH2 GLU 217.A OE2 no hydrogen 2.642 N/A ARG 599.A NH2 ASN 423.A OD1 no hydrogen 3.386 N/A LYS 600.A N TYR 191.A OH no hydrogen 3.027 N/A VAL 601.A N ILE 593.A O no hydrogen 2.810 N/A VAL 603.A N ARG 591.A O no hydrogen 2.997 N/A SER 605.A OG HIS 607.A ND1 no hydrogen 2.768 N/A HIS 607.A ND1 SER 605.A OG no hydrogen 2.768 N/A ALA 608.A N SER 605.A O no hydrogen 3.158 N/A ALA 609.A N PRO 606.A O no hydrogen 3.120 N/A THR 612.A N ALA 608.A O no hydrogen 2.913 N/A THR 612.A OG1 ALA 608.A O no hydrogen 2.981 N/A LEU 613.A N ALA 609.A O no hydrogen 2.890 N/A LEU 614.A N LEU 610.A O no hydrogen 2.983 N/A GLN 615.A N ASN 611.A O no hydrogen 2.872 N/A SER 616.A N THR 612.A O no hydrogen 3.126 N/A SER 616.A OG THR 427.A O no hydrogen 3.083 N/A ALA 617.A N LEU 613.A O no hydrogen 3.109 N/A GLY 618.A N LEU 614.A O no hydrogen 2.948 N/A ALA 619.A N GLN 615.A O no hydrogen 2.870 N/A LEU 620.A N SER 616.A O no hydrogen 2.963 N/A ILE 621.A N ALA 617.A O no hydrogen 2.736 N/A CYS 622.A N GLY 618.A O no hydrogen 3.000 N/A CYS 622.A SG GLY 618.A O no hydrogen 3.054 N/A CYS 622.A SG HIS 653.A O no hydrogen 3.398 N/A LYS 623.A N ALA 619.A O no hydrogen 2.883 N/A LYS 623.A NZ GLU 217.A OE1 no hydrogen 2.886 N/A LYS 623.A NZ GLU 217.A OE2 no hydrogen 2.539 N/A LYS 623.A NZ PRO 422.A O no hydrogen 3.000 N/A LYS 623.A NZ GLY 428.A O no hydrogen 2.948 N/A LEU 624.A N LEU 620.A O no hydrogen 3.025 N/A TRP 625.A N ILE 621.A O no hydrogen 2.882 N/A TRP 625.A NE1 ALA 673.A O no hydrogen 2.805 N/A ILE 626.A N CYS 622.A O no hydrogen 3.058 N/A ILE 627.A N LYS 623.A O no hydrogen 3.304 N/A ILE 627.A N LEU 624.A O no hydrogen 3.185 N/A LYS 628.A N LEU 624.A O no hydrogen 2.847 N/A THR 629.A N TRP 625.A O no hydrogen 2.795 N/A THR 629.A OG1 TRP 625.A O no hydrogen 3.124 N/A GLU 630.A N ILE 626.A O no hydrogen 3.382 N/A GLU 631.A N ILE 627.A O no hydrogen 2.972 N/A MET 632.A N LYS 628.A O no hydrogen 2.815 N/A LEU 633.A N THR 629.A O no hydrogen 2.900 N/A VAL 634.A N GLU 630.A O no hydrogen 2.974 N/A GLU 635.A N GLU 631.A O no hydrogen 3.031 N/A LYS 636.A N MET 632.A O no hydrogen 2.910 N/A LYS 636.A N LEU 633.A O no hydrogen 3.206 N/A LYS 636.A NZ THR 672.A OG1 no hydrogen 3.038 N/A LYS 636.A NZ GLU 675.A OE2 no hydrogen 2.982 N/A GLY 637.A N VAL 634.A O no hydrogen 3.141 N/A LEU 638.A N LEU 633.A O no hydrogen 3.138 N/A LYS 639.A N ASP 645.A OD2 no hydrogen 2.670 N/A LYS 639.A NZ ASP 643.A OD1 no hydrogen 2.668 N/A LYS 639.A NZ ASP 643.A OD2 no hydrogen 2.672 N/A HIS 640.A ND1 GLU 630.A OE2 no hydrogen 2.790 N/A GLY 641.A N PHE 646.A O no hydrogen 2.846 N/A TRP 642.A NE1 ASN 230.A O no hydrogen 2.749 N/A GLY 644.A N GLY 641.A O no hydrogen 2.894 N/A ASP 645.A N LYS 639.A O no hydrogen 2.927 N/A PHE 646.A N LYS 639.A O no hydrogen 3.370 N/A ALA 647.A N GLY 659.A O no hydrogen 2.748 N/A TYR 648.A N HIS 640.A NE2 no hydrogen 3.207 N/A TYR 648.A OH ILE 626.A O no hydrogen 3.042 N/A MET 649.A N GLN 657.A O no hydrogen 3.035 N/A ALA 650.A N GLN 657.A O no hydrogen 3.343 N/A TRP 651.A NE1 HIS 653.A O no hydrogen 2.594 N/A VAL 652.A N GLU 655.A O no hydrogen 2.761 N/A GLU 655.A N VAL 652.A O no hydrogen 3.273 N/A ILE 656.A N ILE 474.A O no hydrogen 2.947 N/A GLN 657.A N ALA 650.A O no hydrogen 2.863 N/A GLN 657.A NE2 GLU 655.A OE1 no hydrogen 2.638 N/A GLN 657.A NE2 CYS 703.A O no hydrogen 3.470 N/A VAL 658.A N ALA 472.A O no hydrogen 2.818 N/A GLY 659.A N ALA 647.A O no hydrogen 2.792 N/A CYS 660.A N VAL 470.A O no hydrogen 2.639 N/A CYS 660.A SG VAL 658.A O no hydrogen 3.740 N/A ARG 661.A N ASP 645.A O no hydrogen 2.919 N/A ARG 661.A NE GLY 644.A O no hydrogen 3.002 N/A ARG 661.A NH2 ASP 645.A OD1 no hydrogen 2.722 N/A ILE 665.A N THR 662.A OG1 no hydrogen 3.338 N/A ALA 666.A N THR 662.A O no hydrogen 3.053 N/A GLN 667.A N GLU 663.A O no hydrogen 2.887 N/A GLN 667.A NE2 GLU 671.A OE1 no hydrogen 2.740 N/A VAL 668.A N GLU 664.A O no hydrogen 3.279 N/A VAL 669.A N ILE 665.A O no hydrogen 2.801 N/A ILE 670.A N ALA 666.A O no hydrogen 2.981 N/A GLU 671.A N GLN 667.A O no hydrogen 3.099 N/A THR 672.A N VAL 668.A O no hydrogen 2.834 N/A THR 672.A OG1 VAL 668.A O no hydrogen 2.847 N/A ALA 673.A N VAL 669.A O no hydrogen 2.872 N/A GLN 674.A N ILE 670.A O no hydrogen 3.367 N/A GLN 674.A NE2 ASP 691.A OD1 no hydrogen 3.003 N/A GLU 675.A N GLU 671.A O no hydrogen 3.052 N/A ALA 676.A N THR 672.A O no hydrogen 2.819 N/A MET 677.A N ALA 673.A O no hydrogen 3.056 N/A ARG 678.A N GLN 674.A O no hydrogen 3.224 N/A TRP 679.A N GLU 675.A O no hydrogen 3.032 N/A VAL 680.A N ALA 676.A O no hydrogen 2.954 N/A GLY 681.A N MET 677.A O no hydrogen 3.082 N/A ASP 682.A N ARG 678.A O no hydrogen 3.057 N/A HIS 683.A N TRP 679.A O no hydrogen 2.759 N/A HIS 683.A NE2 GLU 212.A OE2 no hydrogen 2.925 N/A TRP 684.A N VAL 680.A O no hydrogen 3.268 N/A TRP 684.A NE1 GLU 212.A OE1 no hydrogen 2.899 N/A ASN 685.A N ASP 682.A O no hydrogen 2.970 N/A PHE 686.A N GLY 681.A O no hydrogen 2.813 N/A ARG 687.A N HIS 486.A ND1 no hydrogen 2.926 N/A CYS 688.A SG LEU 689.A O no hydrogen 3.725 N/A THR 692.A N GLN 674.A OE1 no hydrogen 2.741 N/A THR 692.A OG1 GLN 674.A OE1 no hydrogen 2.679 N/A GLU 693.A N ASP 475.A O no hydrogen 3.008 N/A LYS 695.A N GLY 473.A O no hydrogen 3.019 N/A GLY 697.A N GLN 471.A O no hydrogen 2.830 N/A ASN 699.A ND2 GLU 458.A OE2 no hydrogen 2.874 N/A TRP 700.A N PHE 455.A O no hydrogen 2.849 N/A ALA 701.A N ASN 699.A OD1 no hydrogen 2.712 N/A ILE 702.A N ASN 699.A O no hydrogen 3.277 N/A ILE 702.A N ASN 699.A OD1 no hydrogen 3.202 N/A CYS 703.A N ASN 699.A O no hydrogen 3.191 N/A CYS 703.A SG GLN 471.A O no hydrogen 3.664 N/A CYS 703.A SG LYS 695.A O no hydrogen 3.563 N/A CYS 703.A SG ASN 699.A O no hydrogen 3.450 N/A