Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 8wa0_c.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LYS 7.A NZ ASN 6.A O no hydrogen 3.239 N/A GLY 11.A N SER 129.A O no hydrogen 2.977 N/A MET 14.A N ASN 10.A O no hydrogen 3.253 N/A LYS 15.A N GLY 11.A O no hydrogen 3.293 N/A ARG 16.A N THR 12.A O no hydrogen 3.207 N/A LEU 17.A N ALA 13.A O no hydrogen 3.108 N/A ILE 18.A N MET 14.A O no hydrogen 2.985 N/A SER 19.A N LYS 15.A O no hydrogen 3.024 N/A ARG 20.A N ARG 16.A O no hydrogen 2.992 N/A LEU 21.A N LEU 17.A O no hydrogen 2.837 N/A ILE 22.A N ILE 18.A O no hydrogen 3.072 N/A ASP 23.A N SER 19.A O no hydrogen 3.352 N/A HIS 24.A N ARG 20.A O no hydrogen 3.265 N/A PHE 25.A N LEU 21.A O no hydrogen 3.083 N/A GLY 26.A N ILE 22.A O no hydrogen 2.997 N/A THR 30.A N GLY 26.A O no hydrogen 3.283 N/A THR 30.A OG1 LEU 21.A O no hydrogen 3.356 N/A THR 30.A OG1 GLY 26.A O no hydrogen 2.807 N/A SER 31.A N MET 27.A O no hydrogen 3.159 N/A SER 31.A OG MET 27.A O no hydrogen 2.802 N/A ILE 33.A N TYR 29.A O no hydrogen 3.122 N/A LEU 34.A N THR 30.A O no hydrogen 2.927 N/A ASP 35.A N SER 31.A O no hydrogen 3.223 N/A GLN 36.A N HIS 32.A O no hydrogen 3.219 N/A VAL 37.A N ILE 33.A O no hydrogen 3.066 N/A LYS 38.A N LEU 34.A O no hydrogen 3.165 N/A THR 39.A N ASP 35.A O no hydrogen 3.346 N/A THR 39.A OG1 ASP 35.A O no hydrogen 3.162 N/A LEU 40.A N GLN 36.A O no hydrogen 3.262 N/A GLY 41.A N VAL 37.A O no hydrogen 2.954 N/A PHE 42.A N LYS 38.A O no hydrogen 3.055 N/A GLN 43.A N THR 39.A O no hydrogen 3.086 N/A GLN 44.A N LEU 40.A O no hydrogen 3.127 N/A ALA 45.A N GLY 41.A O no hydrogen 3.159 N/A THR 46.A N PHE 42.A O no hydrogen 3.294 N/A THR 46.A OG1 PHE 42.A O no hydrogen 2.830 N/A ALA 47.A N GLN 43.A O no hydrogen 3.183 N/A THR 48.A N GLN 44.A O no hydrogen 2.945 N/A THR 48.A OG1 GLN 44.A O no hydrogen 2.996 N/A SER 49.A N ALA 45.A O no hydrogen 3.057 N/A SER 49.A OG THR 48.A O no hydrogen 2.657 N/A ASP 56.A N GLY 53.A O no hydrogen 3.196 N/A THR 59.A OG1 VAL 142.A O no hydrogen 3.405 N/A LYS 63.A N ILE 60.A O no hydrogen 3.393 N/A LYS 63.A NZ GLN 161.A O no hydrogen 3.320 N/A LEU 66.A N SER 62.A O no hydrogen 3.350 N/A VAL 67.A N LYS 63.A O no hydrogen 3.025 N/A GLN 68.A N GLY 64.A O no hydrogen 2.977 N/A ASP 69.A N TRP 65.A O no hydrogen 3.122 N/A ALA 70.A N LEU 66.A O no hydrogen 3.249 N/A GLU 71.A N VAL 67.A O no hydrogen 3.112 N/A GLN 72.A N GLN 68.A O no hydrogen 3.259 N/A GLN 73.A N ASP 69.A O no hydrogen 3.223 N/A SER 74.A N ALA 70.A O no hydrogen 3.160 N/A SER 74.A OG ALA 70.A O no hydrogen 3.207 N/A LEU 75.A N GLU 71.A O no hydrogen 3.202 N/A ILE 76.A N GLN 72.A O no hydrogen 3.253 N/A LEU 77.A N GLN 73.A O no hydrogen 3.203 N/A GLU 78.A N SER 74.A O no hydrogen 3.283 N/A GLU 78.A N LEU 75.A O no hydrogen 3.106 N/A LYS 79.A N LEU 75.A O no hydrogen 3.274 N/A HIS 80.A N ILE 76.A O no hydrogen 3.277 N/A HIS 80.A ND1 ASN 85.A OD1 no hydrogen 3.132 N/A HIS 81.A N LEU 77.A O no hydrogen 3.184 N/A HIS 81.A ND1 VAL 86.A O no hydrogen 3.028 N/A HIS 82.A N GLU 78.A O no hydrogen 3.469 N/A TYR 83.A N LYS 79.A O no hydrogen 3.193 N/A GLY 84.A N HIS 81.A O no hydrogen 3.231 N/A ASN 85.A N HIS 80.A O no hydrogen 3.087 N/A LYS 91.A N HIS 87.A O no hydrogen 3.241 N/A LEU 92.A N ALA 88.A O no hydrogen 3.183 N/A ARG 93.A N VAL 89.A O no hydrogen 3.161 N/A GLN 94.A N GLU 90.A O no hydrogen 3.280 N/A SER 95.A N LYS 91.A O no hydrogen 3.310 N/A ILE 96.A N LEU 92.A O no hydrogen 3.295 N/A GLU 97.A N ARG 93.A O no hydrogen 3.004 N/A ILE 98.A N GLN 94.A O no hydrogen 2.834 N/A TRP 99.A N SER 95.A O no hydrogen 3.508 N/A TYR 100.A N ILE 96.A O no hydrogen 3.193 N/A ALA 101.A N GLU 97.A O no hydrogen 3.236 N/A THR 102.A N ILE 98.A O no hydrogen 3.178 N/A THR 102.A OG1 ILE 98.A O no hydrogen 3.046 N/A SER 103.A N TRP 99.A O no hydrogen 3.138 N/A SER 103.A OG HIS 139.A NE2 no hydrogen 3.191 N/A GLU 104.A N TYR 100.A O no hydrogen 3.061 N/A TYR 105.A N ALA 101.A O no hydrogen 3.033 N/A TYR 105.A OH GLU 396.A OE1 no hydrogen 3.241 N/A LEU 106.A N THR 102.A O no hydrogen 3.241 N/A ARG 107.A N SER 103.A O no hydrogen 3.143 N/A GLN 108.A N GLU 104.A O no hydrogen 3.162 N/A GLU 109.A N TYR 105.A O no hydrogen 3.049 N/A MET 110.A N ARG 107.A O no hydrogen 3.287 N/A ASN 113.A N GLU 109.A O no hydrogen 3.371 N/A PHE 114.A N MET 110.A O no hydrogen 3.177 N/A ARG 115.A N ASN 111.A O no hydrogen 2.986 N/A MET 116.A N PRO 112.A O no hydrogen 2.996 N/A THR 117.A N ASN 113.A O no hydrogen 2.955 N/A THR 117.A OG1 ASN 113.A O no hydrogen 2.757 N/A THR 117.A OG1 ASN 113.A OD1 no hydrogen 3.037 N/A ASP 118.A N PHE 114.A O no hydrogen 3.272 N/A ASN 121.A ND2 ASP 56.A O no hydrogen 2.893 N/A ILE 125.A N ASN 121.A O no hydrogen 3.132 N/A MET 126.A N PRO 122.A O no hydrogen 3.113 N/A SER 127.A N VAL 123.A O no hydrogen 3.315 N/A SER 127.A OG VAL 123.A O no hydrogen 3.055 N/A SER 127.A OG HIS 124.A O no hydrogen 3.206 N/A PHE 128.A N HIS 124.A O no hydrogen 2.934 N/A SER 129.A N ILE 125.A O no hydrogen 3.209 N/A SER 129.A OG ILE 125.A O no hydrogen 2.658 N/A GLY 130.A N SER 127.A O no hydrogen 3.264 N/A ARG 132.A N MET 126.A O no hydrogen 3.389 N/A ALA 135.A N ASN 134.A OD1 no hydrogen 2.865 N/A VAL 138.A N ASN 134.A O no hydrogen 3.052 N/A HIS 139.A N ALA 135.A O no hydrogen 2.901 N/A HIS 139.A NE2 SER 103.A OG no hydrogen 3.191 N/A GLN 140.A N SER 136.A O no hydrogen 3.341 N/A LEU 141.A N GLN 137.A O no hydrogen 3.498 N/A VAL 142.A N VAL 138.A O no hydrogen 2.918 N/A GLY 143.A N HIS 139.A O no hydrogen 2.712 N/A ARG 145.A N SER 162.A O no hydrogen 3.273 N/A GLY 146.A N ILE 160.A O no hydrogen 3.373 N/A ASP 150.A N GLN 154.A O no hydrogen 2.793 N/A ILE 156.A N MET 148.A O no hydrogen 3.212 N/A ASN 163.A ND2 GLY 143.A O no hydrogen 2.906 N/A LEU 164.A N GLN 140.A O no hydrogen 3.432 N/A ARG 165.A NH1 THR 59.A OG1 no hydrogen 2.913 N/A GLU 166.A N ASN 163.A OD1 no hydrogen 2.945 N/A GLY 167.A N ASN 163.A O no hydrogen 2.924 N/A SER 169.A N GLU 172.A OE1 no hydrogen 3.242 N/A SER 169.A OG GLU 172.A OE1 no hydrogen 3.237 N/A TYR 173.A N SER 169.A O no hydrogen 2.855 N/A ILE 174.A N LEU 170.A O no hydrogen 3.149 N/A ILE 175.A N THR 171.A O no hydrogen 3.229 N/A SER 176.A N GLU 172.A O no hydrogen 2.978 N/A SER 176.A OG TYR 173.A O no hydrogen 2.719 N/A CYS 177.A N TYR 173.A O no hydrogen 3.140 N/A CYS 177.A N ILE 174.A O no hydrogen 3.082 N/A CYS 177.A SG TYR 173.A O no hydrogen 3.429 N/A TYR 178.A N ILE 175.A O no hydrogen 3.217 N/A ARG 181.A N CYS 177.A O no hydrogen 3.320 N/A LYS 182.A N TYR 178.A O no hydrogen 3.451 N/A GLY 183.A N GLY 179.A O no hydrogen 3.157 N/A VAL 184.A N ALA 180.A O no hydrogen 3.168 N/A VAL 185.A N ARG 181.A O no hydrogen 3.044 N/A ASP 186.A N LYS 182.A O no hydrogen 3.014 N/A THR 187.A N GLY 183.A O no hydrogen 3.062 N/A THR 187.A OG1 GLY 183.A O no hydrogen 2.983 N/A THR 187.A OG1 ASP 186.A OD1 no hydrogen 3.367 N/A ALA 188.A N VAL 184.A O no hydrogen 3.399 N/A VAL 189.A N VAL 185.A O no hydrogen 3.153 N/A ARG 190.A N ASP 186.A O no hydrogen 2.805 N/A THR 191.A N THR 187.A O no hydrogen 3.093 N/A THR 191.A OG1 THR 187.A O no hydrogen 3.363 N/A THR 191.A OG1 ALA 188.A O no hydrogen 2.671 N/A SER 192.A OG ALA 188.A O no hydrogen 3.437 N/A ASP 193.A N VAL 189.A O no hydrogen 3.082 N/A ALA 194.A N ARG 190.A O no hydrogen 3.223 N/A TYR 196.A N SER 192.A O no hydrogen 3.470 N/A LEU 197.A N ASP 193.A O no hydrogen 3.148 N/A THR 198.A N ALA 194.A O no hydrogen 2.959 N/A THR 198.A OG1 ALA 194.A O no hydrogen 2.851 N/A ARG 199.A N GLY 195.A O no hydrogen 2.973 N/A ARG 200.A N TYR 196.A O no hydrogen 3.274 N/A ARG 200.A NH2 GLU 996.A OE2 no hydrogen 3.093 N/A LEU 201.A N LEU 197.A O no hydrogen 3.057 N/A VAL 202.A N THR 198.A O no hydrogen 3.126 N/A GLU 203.A N ARG 199.A O no hydrogen 3.287 N/A VAL 204.A N ARG 200.A O no hydrogen 3.478 N/A VAL 210.A N GLU 311.A O no hydrogen 3.282 N/A ARG 211.A N ILE 292.A O no hydrogen 3.242 N/A GLY 216.A N ASP 214.A OD1 no hydrogen 3.199 N/A THR 217.A OG1 THR 285.A O no hydrogen 3.354 N/A ARG 219.A N THR 217.A OG1 no hydrogen 3.336 N/A ILE 221.A N ILE 280.A O no hydrogen 3.138 N/A VAL 223.A N ILE 278.A O no hydrogen 2.934 N/A PHE 235.A N PRO 231.A O no hydrogen 3.323 N/A ILE 236.A N GLU 232.A O no hydrogen 2.904 N/A GLN 237.A N ARG 233.A O no hydrogen 3.004 N/A THR 238.A N ILE 234.A O no hydrogen 3.162 N/A THR 238.A OG1 ILE 234.A O no hydrogen 2.964 N/A LEU 239.A N PHE 235.A O no hydrogen 3.438 N/A ILE 240.A N ILE 236.A O no hydrogen 3.172 N/A GLY 241.A N ILE 262.A O no hydrogen 3.170 N/A LEU 244.A N GLN 260.A O no hydrogen 3.199 N/A ALA 245.A N SER 279.A O no hydrogen 2.814 N/A ILE 248.A N ALA 256.A O no hydrogen 3.116 N/A MET 250.A N ARG 253.A O no hydrogen 2.914 N/A ARG 253.A N MET 250.A O no hydrogen 3.214 N/A CYS 254.A SG ILE 248.A O no hydrogen 3.446 N/A CYS 254.A SG ALA 256.A O no hydrogen 3.088 N/A ILE 255.A N ILE 248.A O no hydrogen 2.999 N/A ALA 256.A N ILE 248.A O no hydrogen 3.517 N/A THR 257.A N GLN 260.A OE1 no hydrogen 3.195 N/A ARG 258.A N ASP 247.A OD1 no hydrogen 2.847 N/A ASN 259.A N LEU 244.A O no hydrogen 3.158 N/A ILE 262.A N ARG 242.A O no hydrogen 3.139 N/A ILE 262.A N ASP 261.A OD1 no hydrogen 3.229 N/A VAL 267.A N GLY 263.A O no hydrogen 3.074 N/A ASN 268.A N ILE 264.A O no hydrogen 3.081 N/A ARG 269.A N GLY 265.A O no hydrogen 3.245 N/A PHE 270.A N LEU 266.A O no hydrogen 3.085 N/A ILE 271.A N VAL 267.A O no hydrogen 3.060 N/A THR 272.A N ASN 268.A O no hydrogen 3.050 N/A THR 272.A OG1 ASN 268.A O no hydrogen 2.981 N/A PHE 273.A N ARG 269.A O no hydrogen 2.989 N/A ALA 275.A N PHE 270.A O no hydrogen 3.193 N/A ILE 278.A N VAL 223.A O no hydrogen 3.373 N/A ILE 280.A N ILE 221.A O no hydrogen 2.790 N/A ARG 281.A N VAL 243.A O no hydrogen 2.988 N/A ARG 281.A NH1 ASP 214.A OD1 no hydrogen 2.761 N/A ARG 281.A NH2 ASP 214.A OD1 no hydrogen 2.972 N/A ARG 281.A NH2 ASP 214.A OD2 no hydrogen 3.258 N/A THR 282.A OG1 GLU 1068.A OE1 no hydrogen 2.849 N/A THR 285.A N THR 282.A O no hydrogen 2.819 N/A THR 285.A OG1 ARG 219.A O no hydrogen 2.694 N/A ARG 287.A NH1 CYS 215.A O no hydrogen 3.067 N/A SER 288.A OG TRP 291.A O no hydrogen 3.025 N/A TRP 291.A N SER 288.A OG no hydrogen 3.219 N/A ILE 292.A N VAL 209.A O no hydrogen 3.380 N/A ARG 294.A N ARG 212.A O no hydrogen 3.098 N/A ARG 294.A NE VAL 307.A O no hydrogen 2.742 N/A ARG 294.A NH2 VAL 307.A O no hydrogen 3.174 N/A TYR 297.A N CYS 293.A O no hydrogen 3.366 N/A GLY 298.A N ARG 294.A O no hydrogen 2.997 N/A ARG 299.A N GLY 241.A O no hydrogen 3.099 N/A ARG 299.A NE ASP 261.A OD2 no hydrogen 3.222 N/A ARG 299.A NH2 ASP 261.A OD2 no hydrogen 3.181 N/A SER 300.A N ASP 305.A O no hydrogen 2.874 N/A GLY 304.A N SER 300.A O no hydrogen 3.356 N/A VAL 307.A N GLY 298.A O no hydrogen 3.448 N/A GLU 308.A N GLU 311.A OE1 no hydrogen 3.352 N/A GLY 310.A N VAL 210.A O no hydrogen 3.000 N/A VAL 313.A N GLU 311.A O no hydrogen 3.140 N/A ALA 317.A N VAL 313.A O no hydrogen 3.062 N/A GLY 318.A N GLY 314.A O no hydrogen 3.198 N/A GLN 319.A N ILE 315.A O no hydrogen 3.180 N/A SER 320.A N ILE 316.A O no hydrogen 2.918 N/A SER 320.A OG ILE 316.A O no hydrogen 2.807 N/A ILE 321.A N ALA 317.A O no hydrogen 3.141 N/A GLY 322.A N GLY 318.A O no hydrogen 3.148 N/A GLU 323.A N GLN 319.A O no hydrogen 3.021 N/A GLY 325.A N GLY 322.A O no hydrogen 2.933 N/A VAL 331.A N ALA 400.A O no hydrogen 3.095 N/A ARG 332.A NH1 GLU 396.A O no hydrogen 3.244 N/A GLY 337.A N VAL 393.A O no hydrogen 3.036 N/A ILE 339.A N GLN 391.A O no hydrogen 3.216 N/A LYS 340.A N THR 367.A O no hydrogen 2.881 N/A HIS 347.A N LEU 359.A O no hydrogen 3.171 N/A THR 349.A N ALA 357.A O no hydrogen 2.991 N/A ARG 350.A NH1 GLU 90.A OE1 no hydrogen 3.395 N/A ARG 350.A NH2 ASN 85.A O no hydrogen 3.239 N/A THR 351.A N HIS 355.A O no hydrogen 2.996 N/A THR 351.A OG1 HIS 355.A O no hydrogen 3.061 N/A GLY 354.A N THR 351.A O no hydrogen 3.017 N/A ALA 357.A N THR 349.A O no hydrogen 3.202 N/A PHE 358.A N LEU 385.A O no hydrogen 2.991 N/A LEU 359.A N HIS 347.A O no hydrogen 2.776 N/A CYS 360.A N SER 383.A O no hydrogen 2.890 N/A CYS 360.A SG SER 383.A O no hydrogen 3.928 N/A VAL 366.A N VAL 377.A O no hydrogen 2.983 N/A THR 367.A N LYS 340.A O no hydrogen 3.318 N/A THR 367.A OG1 LYS 340.A O no hydrogen 3.245 N/A ILE 368.A N HIS 375.A O no hydrogen 3.063 N/A GLU 369.A N LYS 338.A O no hydrogen 2.992 N/A SER 370.A OG ILE 373.A O no hydrogen 2.727 N/A ILE 373.A N SER 370.A OG no hydrogen 2.958 N/A HIS 375.A N ILE 368.A O no hydrogen 3.063 N/A ASN 376.A ND2 VAL 366.A O no hydrogen 3.182 N/A VAL 377.A N VAL 366.A O no hydrogen 3.026 N/A SER 383.A N CYS 360.A O no hydrogen 3.392 N/A SER 383.A OG GLU 401.A O no hydrogen 2.820 N/A LEU 384.A N GLU 401.A O no hydrogen 3.087 N/A LEU 385.A N PHE 358.A O no hydrogen 2.754 N/A LEU 386.A N ILE 399.A O no hydrogen 3.080 N/A GLN 388.A N GLN 391.A OE1 no hydrogen 3.389 N/A ASN 389.A N GLU 343.A OE2 no hydrogen 3.364 N/A ASP 390.A N ILE 339.A O no hydrogen 3.135 N/A GLN 391.A N GLN 388.A O no hydrogen 3.314 N/A VAL 393.A N GLY 337.A O no hydrogen 2.946 N/A SER 395.A N ASN 336.A OD1 no hydrogen 2.746 N/A GLU 396.A N ALA 333.A O no hydrogen 3.252 N/A ILE 399.A N VAL 331.A O no hydrogen 3.189 N/A GLU 401.A N LEU 384.A O no hydrogen 2.956 N/A ILE 402.A N GLU 329.A O no hydrogen 3.143 N/A ARG 403.A N GLU 401.A OE1 no hydrogen 3.144 N/A VAL 415.A N TYR 988.A O no hydrogen 2.770 N/A LYS 417.A N PHE 986.A O no hydrogen 3.046 N/A LYS 417.A NZ ALA 88.A O no hydrogen 2.843 N/A ILE 419.A N VAL 984.A O no hydrogen 3.018 N/A SER 421.A N ASP 981.A O no hydrogen 3.332 N/A SER 421.A OG SER 423.A O no hydrogen 2.799 N/A SER 423.A N SER 421.A OG no hydrogen 3.367 N/A SER 423.A OG ASP 422.A O no hydrogen 2.786 N/A SER 423.A OG ASP 422.A OD2 no hydrogen 3.536 N/A GLY 425.A N LEU 977.A O no hydrogen 2.865 N/A GLU 426.A N LEU 456.A O no hydrogen 3.053 N/A HIS 428.A N TRP 454.A O no hydrogen 2.858 N/A TYR 434.A N LEU 446.A O no hydrogen 3.106 N/A GLU 438.A N VAL 444.A O no hydrogen 2.979 N/A ASN 443.A ND2 HIS 972.A NE2 no hydrogen 3.145 N/A HIS 445.A N VAL 969.A O no hydrogen 3.153 N/A HIS 445.A ND1 TYR 434.A O no hydrogen 3.270 N/A HIS 445.A NE2 HIS 972.A ND1 no hydrogen 3.194 N/A SER 451.A N ALA 963.A O no hydrogen 3.235 N/A HIS 452.A NE2 GLY 84.A O no hydrogen 3.187 N/A LEU 453.A N TYR 961.A O no hydrogen 2.766 N/A TRP 454.A N HIS 428.A O no hydrogen 3.033 N/A ILE 455.A N LYS 959.A O no hydrogen 3.457 N/A LEU 457.A N SER 957.A O no hydrogen 2.988 N/A GLY 458.A N ASP 424.A O no hydrogen 3.480 N/A ARG 459.A N ILE 818.A O no hydrogen 3.435 N/A CYS 461.A N LEU 816.A O no hydrogen 2.938 N/A LEU 468.A N SER 464.A O no hydrogen 3.014 N/A HIS 471.A N TYR 467.A O no hydrogen 2.873 N/A LYS 472.A N ASP 475.A OD2 no hydrogen 2.942 N/A LYS 472.A NZ SER 469.A O no hydrogen 2.866 N/A GLN 474.A N ILE 803.A O no hydrogen 2.835 N/A GLN 474.A NE2 ASP 473.A OD1 no hydrogen 3.066 N/A MET 477.A N GLY 801.A O no hydrogen 3.361 N/A LEU 488.A N ASN 485.A O no hydrogen 3.242 N/A LEU 489.A N SER 486.A O no hydrogen 3.113 N/A SER 490.A N ASP 487.A O no hydrogen 3.344 N/A ARG 493.A N LYS 496.A O no hydrogen 2.892 N/A LYS 496.A N ARG 493.A O no hydrogen 3.158 N/A PHE 497.A N ILE 746.A O no hydrogen 2.915 N/A LEU 501.A N HIS 742.A O no hydrogen 2.688 N/A SER 504.A N TYR 521.A O no hydrogen 3.447 N/A GLU 506.A N LEU 519.A O no hydrogen 3.068 N/A SER 517.A N LEU 713.A O no hydrogen 3.413 N/A LEU 519.A N LEU 711.A O no hydrogen 3.026 N/A ALA 520.A N LEU 711.A O no hydrogen 3.168 N/A TYR 521.A N SER 504.A O no hydrogen 2.891 N/A PHE 522.A N THR 709.A O no hydrogen 2.569 N/A ARG 528.A N PRO 525.A O no hydrogen 3.007 N/A ARG 529.A N ILE 704.A O no hydrogen 3.095 N/A LYS 530.A NZ SER 700.A O no hydrogen 2.451 N/A LYS 536.A N PHE 540.A O no hydrogen 3.112 N/A PHE 539.A N TYR 657.A O no hydrogen 2.556 N/A PHE 541.A N VAL 655.A O no hydrogen 3.186 N/A GLU 545.A N ILE 594.A O no hydrogen 3.114 N/A HIS 547.A N LEU 592.A O no hydrogen 2.601 N/A LEU 549.A N ILE 590.A O no hydrogen 2.803 N/A SER 553.A N PRO 550.A O no hydrogen 3.255 N/A MET 556.A N ILE 569.A O no hydrogen 2.684 N/A ASN 560.A N VAL 581.A O no hydrogen 2.907 N/A VAL 563.A N GLY 579.A O no hydrogen 3.090 N/A ASP 566.A N SER 575.A O no hydrogen 3.090 N/A ILE 569.A N LEU 573.A O no hydrogen 3.037 N/A THR 570.A N LEU 573.A O no hydrogen 3.011 N/A SER 575.A N THR 567.A O no hydrogen 2.572 N/A GLY 579.A N VAL 563.A O no hydrogen 2.977 N/A LEU 580.A N PHE 595.A O no hydrogen 3.016 N/A VAL 581.A N SER 561.A O no hydrogen 2.921 N/A ARG 582.A N LYS 593.A O no hydrogen 2.528 N/A GLU 584.A N GLU 591.A O no hydrogen 2.482 N/A LYS 586.A N ARG 589.A O no hydrogen 2.856 N/A ILE 590.A N LEU 549.A O no hydrogen 2.668 N/A GLU 591.A N GLU 584.A O no hydrogen 2.688 N/A LEU 592.A N HIS 547.A O no hydrogen 2.865 N/A LYS 593.A N ARG 582.A O no hydrogen 2.570 N/A ILE 594.A N GLU 545.A O no hydrogen 2.538 N/A PHE 595.A N LEU 580.A O no hydrogen 2.802 N/A HIS 600.A N VAL 649.A O no hydrogen 2.834 N/A LYS 607.A N THR 605.A O no hydrogen 2.855 N/A VAL 614.A N VAL 637.A O no hydrogen 3.358 N/A ILE 616.A N ILE 635.A O no hydrogen 2.952 N/A ILE 635.A N ILE 616.A O no hydrogen 3.232 N/A TYR 636.A N ARG 652.A O no hydrogen 2.868 N/A VAL 637.A N VAL 614.A O no hydrogen 3.189 N/A GLN 638.A N LEU 650.A O no hydrogen 2.687 N/A ILE 640.A N PHE 648.A O no hydrogen 2.640 N/A PHE 648.A N ILE 640.A O no hydrogen 2.784 N/A VAL 649.A N HIS 600.A O no hydrogen 3.015 N/A LEU 650.A N GLN 638.A O no hydrogen 2.682 N/A VAL 651.A N ASP 598.A O no hydrogen 3.160 N/A ARG 652.A N TYR 636.A O no hydrogen 2.571 N/A TYR 657.A N PHE 539.A O no hydrogen 3.045 N/A ILE 659.A N ASP 537.A O no hydrogen 3.193 N/A PRO 670.A N SER 490.A O no hydrogen 3.245 N/A ARG 683.A N VAL 712.A O no hydrogen 3.102 N/A VAL 685.A N CYS 710.A O no hydrogen 2.660 N/A CYS 710.A N VAL 685.A O no hydrogen 3.056 N/A LEU 711.A N ALA 520.A O no hydrogen 2.721 N/A VAL 712.A N ARG 683.A O no hydrogen 2.783 N/A LEU 713.A N SER 517.A O no hydrogen 2.929 N/A ALA 727.A N PHE 513.A O no hydrogen 3.176 N/A ARG 728.A N ASN 747.A O no hydrogen 3.341 N/A SER 730.A N ARG 745.A O no hydrogen 3.203 N/A LEU 739.A N THR 736.A O no hydrogen 3.069 N/A ILE 746.A N PHE 497.A O no hydrogen 2.651 N/A ASN 747.A N ARG 728.A O no hydrogen 3.044 N/A LEU 748.A N ASN 495.A O no hydrogen 3.431 N/A VAL 749.A N GLU 726.A O no hydrogen 3.171 N/A ASN 760.A N GLY 757.A O no hydrogen 2.989 N/A ASP 761.A N LYS 758.A O no hydrogen 3.002 N/A ILE 778.A N ASP 774.A O no hydrogen 3.091 N/A TYR 787.A N SER 783.A O no hydrogen 2.951 N/A SER 788.A N ILE 784.A O no hydrogen 3.082 N/A LYS 789.A N TYR 785.A O no hydrogen 3.075 N/A ALA 790.A N SER 786.A O no hydrogen 2.977 N/A LYS 791.A N TYR 787.A O no hydrogen 3.001 N/A ILE 803.A N ASP 475.A O no hydrogen 2.978 N/A HIS 804.A N ILE 817.A O no hydrogen 2.829 N/A THR 805.A N ASP 473.A OD1 no hydrogen 3.076 N/A ASN 810.A N LEU 807.A O no hydrogen 3.078 N/A LEU 816.A N CYS 461.A O no hydrogen 3.381 N/A ILE 817.A N HIS 804.A O no hydrogen 3.019 N/A ILE 818.A N ARG 459.A O no hydrogen 3.066 N/A LEU 819.A N THR 802.A O no hydrogen 3.018 N/A SER 820.A OG ASN 823.A OD1 no hydrogen 3.465 N/A ASN 823.A N SER 820.A O no hydrogen 3.171 N/A CYS 824.A N SER 820.A O no hydrogen 3.120 N/A CYS 824.A SG SER 820.A O no hydrogen 3.651 N/A SER 825.A N ILE 955.A O no hydrogen 3.255 N/A ARG 826.A NE SER 952.A OG no hydrogen 3.381 N/A ARG 826.A NH2 SER 952.A OG no hydrogen 3.334 N/A MET 827.A N ILE 953.A O no hydrogen 3.008 N/A SER 847.A N ASN 844.A O no hydrogen 3.124 N/A SER 847.A OG ASN 844.A O no hydrogen 2.812 N/A HIS 850.A ND1 SER 847.A O no hydrogen 3.084 N/A THR 853.A OG1 HIS 854.A O no hydrogen 3.207 N/A ASN 855.A N TYR 862.A OH no hydrogen 2.865 N/A LEU 863.A N VAL 859.A O no hydrogen 2.949 N/A ASP 866.A N GLN 864.A O no hydrogen 3.012 N/A TYR 880.A OH PRO 893.A O no hydrogen 2.810 N/A ASP 883.A N LYS 887.A O no hydrogen 3.401 N/A GLY 886.A N ASP 883.A OD1 no hydrogen 2.787 N/A LYS 887.A N ASP 883.A OD1 no hydrogen 2.587 N/A PHE 889.A N LEU 881.A O no hydrogen 2.984 N/A ILE 898.A N TYR 907.A O no hydrogen 2.970 N/A LEU 904.A N ASN 900.A O no hydrogen 2.965 N/A TYR 907.A N ILE 898.A O no hydrogen 2.893 N/A TYR 907.A OH ASN 905.A OD1 no hydrogen 3.251 N/A SER 922.A N GLN 925.A OE1 no hydrogen 3.302 N/A GLY 924.A N VAL 945.A O no hydrogen 3.141 N/A ILE 927.A N GLY 943.A O no hydrogen 2.985 N/A ASN 936.A N ALA 934.A O no hydrogen 2.721 N/A LEU 940.A N PRO 938.A O no hydrogen 2.692 N/A LYS 941.A N PRO 939.A O no hydrogen 2.800 N/A GLY 943.A N ILE 927.A O no hydrogen 3.275 N/A GLN 944.A N ARG 956.A O no hydrogen 3.233 N/A GLN 944.A NE2 GLY 924.A O no hydrogen 3.208 N/A VAL 945.A N GLN 925.A O no hydrogen 3.222 N/A ILE 946.A N VAL 954.A O no hydrogen 2.898 N/A GLN 949.A N SER 952.A O no hydrogen 3.022 N/A VAL 954.A N LEU 947.A O no hydrogen 2.872 N/A ILE 955.A N SER 825.A O no hydrogen 3.148 N/A ARG 956.A N GLN 944.A O no hydrogen 3.133 N/A ARG 956.A NE LEU 457.A O no hydrogen 3.017 N/A ARG 956.A NH1 GLU 426.A OE1 no hydrogen 3.459 N/A ARG 956.A NH2 GLU 426.A OE1 no hydrogen 3.473 N/A ARG 956.A NH2 LEU 457.A O no hydrogen 3.282 N/A SER 957.A N ASN 823.A O no hydrogen 3.312 N/A SER 957.A OG ASN 823.A O no hydrogen 2.949 N/A ALA 958.A N SER 942.A O no hydrogen 2.903 N/A LYS 959.A N ILE 455.A O no hydrogen 3.312 N/A TYR 961.A N LEU 453.A O no hydrogen 3.020 N/A ALA 963.A N SER 451.A O no hydrogen 2.904 N/A THR 968.A N THR 985.A O no hydrogen 3.410 N/A THR 968.A OG1 THR 985.A OG1 no hydrogen 2.558 N/A VAL 969.A N HIS 445.A O no hydrogen 3.010 N/A HIS 970.A N LEU 983.A O no hydrogen 3.089 N/A GLY 971.A N ASN 443.A O no hydrogen 2.967 N/A GLY 971.A N VAL 969.A O no hydrogen 3.203 N/A GLU 975.A N HIS 972.A O no hydrogen 3.463 N/A LEU 977.A N GLY 425.A O no hydrogen 2.717 N/A TYR 978.A N ASP 981.A OD2 no hydrogen 3.321 N/A GLU 979.A N ASP 424.A OD1 no hydrogen 2.785 N/A GLY 980.A N SER 421.A O no hydrogen 3.085 N/A ASP 981.A N TYR 978.A O no hydrogen 3.295 N/A THR 982.A OG1 HIS 970.A ND1 no hydrogen 3.315 N/A LEU 983.A N ILE 419.A O no hydrogen 3.122 N/A THR 985.A N THR 968.A O no hydrogen 3.312 N/A THR 985.A OG1 THR 968.A OG1 no hydrogen 2.558 N/A PHE 986.A N LYS 417.A O no hydrogen 3.082 N/A TYR 988.A N VAL 415.A O no hydrogen 2.738 N/A LYS 990.A N GLU 413.A O no hydrogen 2.939 N/A GLU 996.A N LEU 992.A O no hydrogen 3.106 N/A GLN 997.A N PRO 993.A O no hydrogen 2.999 N/A VAL 998.A N LYS 994.A O no hydrogen 2.864 N/A LEU 999.A N VAL 995.A O no hydrogen 3.028 N/A GLU 1000.A N GLU 996.A O no hydrogen 2.901 N/A ARG 1002.A N GLU 1000.A O no hydrogen 2.852 N/A SER 1006.A N SER 1003.A O no hydrogen 3.020 N/A SER 1006.A OG SER 1003.A O no hydrogen 2.678 N/A GLU 1012.A N SER 1008.A O no hydrogen 3.402 N/A LYS 1013.A N MET 1009.A O no hydrogen 3.281 N/A ARG 1014.A N ASN 1010.A O no hydrogen 3.296 N/A ARG 1014.A NH1 ASN 1010.A O no hydrogen 2.966 N/A ILE 1015.A N LEU 1011.A O no hydrogen 3.040 N/A GLU 1016.A N GLU 1012.A O no hydrogen 3.052 N/A GLY 1017.A N LYS 1013.A O no hydrogen 3.023 N/A TRP 1018.A N ARG 1014.A O no hydrogen 2.756 N/A ASN 1019.A N ILE 1015.A O no hydrogen 3.183 N/A LYS 1020.A N GLU 1016.A O no hydrogen 3.370 N/A CYS 1021.A N GLY 1017.A O no hydrogen 3.141 N/A CYS 1021.A SG GLY 1017.A O no hydrogen 3.534 N/A ILE 1022.A N TRP 1018.A O no hydrogen 2.837 N/A THR 1023.A OG1 LYS 1020.A O no hydrogen 3.032 N/A LEU 1026.A N ILE 1022.A O no hydrogen 3.044 N/A GLY 1031.A N GLY 1027.A O no hydrogen 2.716 N/A ILE 1034.A N TRP 1030.A O no hydrogen 3.117 N/A GLY 1035.A N GLY 1031.A O no hydrogen 2.973 N/A ALA 1036.A N PHE 1032.A O no hydrogen 2.893 N/A GLU 1037.A N LEU 1033.A O no hydrogen 3.065 N/A LEU 1038.A N ILE 1034.A O no hydrogen 3.034 N/A THR 1039.A N GLY 1035.A O no hydrogen 2.957 N/A THR 1039.A OG1 GLY 1035.A O no hydrogen 3.152 N/A THR 1039.A OG1 ALA 1036.A O no hydrogen 2.893 N/A ILE 1040.A N ALA 1036.A O no hydrogen 2.884 N/A ALA 1041.A N GLU 1037.A O no hydrogen 2.988 N/A GLN 1042.A N LEU 1038.A O no hydrogen 3.253 N/A SER 1043.A N THR 1039.A O no hydrogen 3.088 N/A SER 1043.A OG THR 1039.A O no hydrogen 2.812 N/A ARG 1044.A N ILE 1040.A O no hydrogen 3.105 N/A ILE 1045.A N ALA 1041.A O no hydrogen 3.310 N/A SER 1046.A N GLN 1042.A O no hydrogen 3.060 N/A SER 1046.A OG GLN 1042.A O no hydrogen 3.146 N/A SER 1046.A OG SER 1043.A O no hydrogen 2.860 N/A LEU 1047.A N SER 1043.A O no hydrogen 3.080 N/A VAL 1048.A N ARG 1044.A O no hydrogen 3.357 N/A ASN 1049.A N ILE 1045.A O no hydrogen 3.060 N/A LYS 1050.A N SER 1046.A O no hydrogen 2.843 N/A LYS 1050.A NZ ILE 1007.A O no hydrogen 3.379 N/A ILE 1051.A N LEU 1047.A O no hydrogen 3.229 N/A GLN 1052.A N VAL 1048.A O no hydrogen 3.039 N/A GLN 1052.A NE2 GLN 1052.A O no hydrogen 3.527 N/A GLN 1053.A N ASN 1049.A O no hydrogen 3.065 N/A TYR 1055.A N ILE 1051.A O no hydrogen 3.322 N/A TYR 1055.A OH ILE 321.A O no hydrogen 3.179 N/A ARG 1056.A N GLN 1052.A O no hydrogen 2.949 N/A SER 1057.A N GLN 1053.A O no hydrogen 3.170 N/A SER 1057.A OG VAL 1054.A O no hydrogen 2.601 N/A GLN 1058.A N TYR 1055.A O no hydrogen 3.307 N/A GLY 1059.A N ARG 1056.A O no hydrogen 3.447 N/A VAL 1060.A N TYR 1055.A O no hydrogen 3.246 N/A ARG 1065.A N HIS 1063.A ND1 no hydrogen 3.432 N/A ARG 1065.A NH1 ARG 299.A O no hydrogen 2.923 N/A GLU 1068.A N ASN 1064.A O no hydrogen 3.047 N/A ILE 1069.A N ARG 1065.A O no hydrogen 3.276 N/A VAL 1071.A N LEU 1067.A O no hydrogen 2.889 N/A ARG 1072.A N GLU 1068.A O no hydrogen 3.131 N/A ARG 1072.A NH1 PRO 283.A O no hydrogen 3.161 N/A ARG 1072.A NH1 CYS 286.A O no hydrogen 3.096 N/A ARG 1072.A NH2 CYS 286.A O no hydrogen 3.191 N/A GLN 1073.A N ILE 1070.A O no hydrogen 3.288 N/A GLN 1073.A NE2 THR 289.A O no hydrogen 3.551 N/A THR 1075.A N VAL 1071.A O no hydrogen 3.048 N/A THR 1075.A OG1 THR 1075.A O no hydrogen 2.659 N/A SER 1076.A OG GLN 1073.A O no hydrogen 3.281 N/A LYS 1077.A NZ ASN 1126.A O no hydrogen 3.490 N/A VAL 1078.A N ILE 1095.A O no hydrogen 2.763 N/A LEU 1079.A N ARG 1114.A O no hydrogen 2.918 N/A VAL 1080.A N GLU 1093.A O no hydrogen 3.358 N/A SER 1081.A N CYS 1112.A O no hydrogen 2.969 N/A SER 1081.A OG GLU 1082.A OE1 no hydrogen 3.193 N/A GLU 1082.A N SER 1081.A OG no hydrogen 2.733 N/A GLY 1084.A N SER 1081.A O no hydrogen 3.065 N/A SER 1086.A N PHE 1089.A O no hydrogen 3.204 N/A VAL 1088.A N SER 1086.A OG no hydrogen 3.354 N/A SER 1090.A N GLU 1093.A OE1 no hydrogen 3.294 N/A ILE 1095.A N VAL 1078.A O no hydrogen 3.123 N/A LEU 1097.A N SER 1076.A O no hydrogen 3.103 N/A ALA 1100.A N GLY 1096.A O no hydrogen 3.034 N/A GLU 1101.A N LEU 1097.A O no hydrogen 3.045 N/A ARG 1102.A N LEU 1098.A O no hydrogen 3.171 N/A MET 1103.A N ARG 1099.A O no hydrogen 3.113 N/A GLY 1104.A N ALA 1100.A O no hydrogen 3.046 N/A ARG 1105.A N GLU 1101.A O no hydrogen 3.450 N/A ALA 1106.A N ARG 1102.A O no hydrogen 3.342 N/A LEU 1107.A N MET 1103.A O no hydrogen 2.710 N/A ARG 1114.A N LEU 1079.A O no hydrogen 3.243 N/A VAL 1116.A N LYS 1077.A O no hydrogen 3.488 N/A LEU 1118.A N ILE 1074.A O no hydrogen 3.296 N/A THR 1121.A N GLU 1000.A OE1 no hydrogen 3.239 N/A THR 1121.A OG1 GLU 1000.A OE1 no hydrogen 2.817 N/A ALA 1123.A N GLY 1119.A O no hydrogen 2.985 N/A LEU 1125.A N ARG 1122.A O no hydrogen 3.013 N/A ASN 1126.A N ARG 1122.A O no hydrogen 3.359 N/A ASN 1126.A N ALA 1123.A O no hydrogen 3.138 N/A THR 1127.A OG1 SER 1124.A O no hydrogen 3.024 N/A SER 1129.A OG ASP 1153.A OD2 no hydrogen 3.047 N/A SER 1132.A N SER 1129.A OG no hydrogen 3.405 N/A ALA 1134.A N SER 1129.A O no hydrogen 3.019 N/A SER 1135.A N PHE 1130.A O no hydrogen 3.249 N/A THR 1139.A N GLN 1137.A O no hydrogen 3.172 N/A VAL 1142.A N GLU 1138.A O no hydrogen 3.240 N/A LEU 1143.A N THR 1139.A O no hydrogen 3.281 N/A ALA 1144.A N ALA 1140.A O no hydrogen 3.176 N/A LYS 1145.A N ARG 1141.A O no hydrogen 3.339 N/A ALA 1146.A N VAL 1142.A O no hydrogen 3.175 N/A ALA 1147.A N LEU 1143.A O no hydrogen 3.072 N/A LEU 1148.A N ALA 1144.A O no hydrogen 3.314 N/A ARG 1149.A N LYS 1145.A O no hydrogen 3.226 N/A ARG 1151.A N ALA 1146.A O no hydrogen 3.353 N/A VAL 1162.A N LEU 1158.A O no hydrogen 3.318 N/A VAL 1162.A N LYS 1159.A O no hydrogen 3.206 N/A VAL 1163.A N LYS 1159.A O no hydrogen 3.394 N/A GLY 1165.A N VAL 1162.A O no hydrogen 2.987 N/A GLY 1166.A N ASN 1161.A O no hydrogen 3.163 N/A VAL 1170.A N ILE 1168.A O no hydrogen 2.845 N/A GLY 1171.A N GLY 310.A O no hydrogen 2.892 N/A