Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 7qo5_Z.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): MET 1.A N GLU 14.A OE1 no hydrogen 3.012 N/A LYS 7.A NZ SER 5.A OG no hydrogen 3.032 N/A GLN 9.A NE2 GLN 9.A O no hydrogen 2.892 N/A GLN 9.A NE2 ASP 13.A OD1 no hydrogen 2.672 N/A THR 11.A OG1 SER 5.A O no hydrogen 3.076 N/A THR 11.A OG1 LYS 8.A O no hydrogen 3.433 N/A ASP 13.A N GLN 9.A O no hydrogen 3.208 N/A GLU 14.A N GLN 10.A O no hydrogen 3.382 N/A GLN 15.A N THR 11.A O no hydrogen 2.994 N/A GLN 15.A NE2 SER 19.A O no hydrogen 2.696 N/A SER 16.A N ILE 12.A O no hydrogen 2.943 N/A SER 16.A OG ILE 12.A O no hydrogen 3.512 N/A SER 16.A OG ASP 13.A O no hydrogen 3.478 N/A GLN 17.A NE2 ASP 13.A O no hydrogen 3.397 N/A ILE 18.A N GLN 15.A O no hydrogen 3.320 N/A SER 19.A N GLN 15.A O no hydrogen 3.081 N/A SER 19.A OG ILE 18.A O no hydrogen 3.067 N/A THR 24.A OG1 SER 67.A O no hydrogen 3.369 N/A LYS 27.A N GLN 23.A O no hydrogen 3.268 N/A LYS 28.A N THR 24.A O no hydrogen 3.497 N/A ASP 29.A N PRO 25.A O no hydrogen 2.931 N/A LYS 30.A N ASN 26.A O no hydrogen 2.868 N/A LYS 31.A N LYS 27.A O no hydrogen 2.885 N/A LYS 32.A N LYS 28.A O no hydrogen 3.074 N/A GLU 33.A N LYS 30.A O no hydrogen 3.180 N/A GLU 40.A N GLN 37.A O no hydrogen 3.075 N/A GLU 41.A N GLN 37.A O no hydrogen 2.928 N/A ASP 42.A N LEU 38.A O no hydrogen 3.267 N/A LYS 44.A N GLU 40.A O no hydrogen 3.225 N/A LEU 45.A N ASP 42.A O no hydrogen 3.274 N/A LYS 46.A NZ ASP 42.A O no hydrogen 3.310 N/A ASP 48.A N LYS 44.A O no hydrogen 2.922 N/A LEU 49.A N LEU 45.A O no hydrogen 3.067 N/A GLU 50.A N LYS 46.A O no hydrogen 3.291 N/A GLU 50.A N THR 47.A O no hydrogen 3.210 N/A LEU 52.A N ASP 48.A O no hydrogen 3.499 N/A VAL 53.A N LEU 49.A O no hydrogen 3.108 N/A GLU 54.A N GLU 50.A O no hydrogen 2.871 N/A ARG 55.A N LEU 51.A O no hydrogen 3.106 N/A ARG 55.A N LEU 52.A O no hydrogen 3.036 N/A ARG 55.A NE LEU 51.A O no hydrogen 3.179 N/A TYR 64.A N SER 61.A O no hydrogen 3.316 N/A TYR 64.A OH LEU 52.A O no hydrogen 3.409 N/A GLU 65.A N SER 61.A O no hydrogen 2.940 N/A ALA 66.A N SER 62.A O no hydrogen 3.261 N/A SER 67.A OG SER 16.A O no hydrogen 3.391 N/A SER 67.A OG ILE 18.A O no hydrogen 3.262 N/A SER 67.A OG LEU 63.A O no hydrogen 3.137 N/A ASN 69.A N ALA 66.A O no hydrogen 3.454 N/A LYS 72.A N LEU 68.A O no hydrogen 3.138 N/A SER 74.A OG ALA 70.A O no hydrogen 2.951 N/A LYS 76.A N GLU 73.A O no hydrogen 3.170 N/A ASN 77.A N GLU 73.A O no hydrogen 3.120 N/A SER 78.A N SER 74.A O no hydrogen 3.255 N/A SER 78.A OG SER 74.A O no hydrogen 2.999 N/A THR 79.A N SER 74.A O no hydrogen 2.958 N/A THR 79.A OG1 SER 74.A O no hydrogen 3.227 N/A SER 80.A OG LYS 76.A O no hydrogen 3.249 N/A SER 81.A OG ILE 75.A O no hydrogen 3.223 N/A THR 83.A OG1 THR 79.A O no hydrogen 3.064 N/A LYS 87.A NZ LEU 38.A O no hydrogen 3.440 N/A LEU 89.A N VAL 85.A O no hydrogen 3.470 N/A LYS 90.A N PRO 86.A O no hydrogen 3.101 N/A PHE 91.A N PRO 88.A O no hydrogen 3.082 N/A THR 95.A OG1 LEU 92.A O no hydrogen 2.871 N/A LEU 99.A N THR 95.A O no hydrogen 3.401 N/A CYS 100.A N TYR 96.A O no hydrogen 3.421 N/A CYS 100.A SG TYR 96.A O no hydrogen 3.777 N/A SER 101.A N PRO 97.A O no hydrogen 2.839 N/A SER 101.A OG PRO 97.A O no hydrogen 3.022 N/A ILE 102.A N LEU 99.A O no hydrogen 3.184 N/A TYR 103.A N LEU 99.A O no hydrogen 3.137 N/A ASP 104.A N CYS 100.A O no hydrogen 3.026 N/A LYS 105.A NZ SER 101.A OG no hydrogen 3.189 N/A ASN 110.A N ASP 108.A OD1 no hydrogen 3.387 N/A LEU 111.A N ASP 108.A O no hydrogen 3.259 N/A LYS 112.A N ASP 108.A O no hydrogen 2.988 N/A SER 113.A N PRO 109.A O no hydrogen 3.294 N/A SER 113.A OG PRO 109.A O no hydrogen 2.821 N/A SER 114.A OG ASN 110.A O no hydrogen 3.442 N/A SER 114.A OG LEU 111.A O no hydrogen 3.381 N/A LEU 115.A N LEU 111.A O no hydrogen 3.159 N/A LEU 119.A N LEU 115.A O no hydrogen 3.107 N/A SER 120.A N ALA 116.A O no hydrogen 3.207 N/A SER 120.A OG ASP 180.A OD2 no hydrogen 3.026 N/A LEU 122.A N VAL 118.A O no hydrogen 3.437 N/A ALA 123.A N LEU 119.A O no hydrogen 3.167 N/A MET 124.A N SER 120.A O no hydrogen 3.276 N/A THR 125.A N ILE 121.A O no hydrogen 3.008 N/A THR 125.A OG1 ILE 121.A O no hydrogen 3.188 N/A TYR 126.A N LEU 122.A O no hydrogen 3.258 N/A TYR 126.A OH LYS 90.A O no hydrogen 3.057 N/A SER 127.A N ALA 123.A O no hydrogen 2.973 N/A SER 127.A N MET 124.A O no hydrogen 3.328 N/A SER 127.A OG ALA 123.A O no hydrogen 3.159 N/A SER 127.A OG MET 124.A O no hydrogen 2.896 N/A GLY 130.A N TYR 126.A O no hydrogen 3.328 N/A LYS 131.A NZ LYS 90.A O no hydrogen 3.524 N/A HIS 132.A N TYR 126.A O no hydrogen 3.317 N/A SER 134.A OG GLY 130.A O no hydrogen 3.564 N/A LEU 135.A N LYS 131.A O no hydrogen 3.235 N/A ARG 136.A N HIS 132.A O no hydrogen 3.208 N/A ARG 136.A NH2 HIS 156.A O no hydrogen 3.147 N/A TYR 137.A N ASP 133.A O no hydrogen 2.999 N/A ARG 138.A N SER 134.A O no hydrogen 3.198 N/A LEU 139.A N ARG 136.A O no hydrogen 3.183 N/A LEU 140.A N ARG 136.A O no hydrogen 3.107 N/A SER 141.A N TYR 137.A O no hydrogen 3.199 N/A SER 141.A OG TYR 137.A O no hydrogen 2.808 N/A PHE 146.A N ASP 145.A OD2 no hydrogen 2.667 N/A GLU 147.A N ASP 59.A OD1 no hydrogen 3.018 N/A GLY 150.A N GLU 147.A O no hydrogen 2.844 N/A HIS 151.A N GLY 148.A O no hydrogen 3.393 N/A HIS 151.A ND1 GLU 147.A O no hydrogen 3.263 N/A GLU 152.A N GLY 148.A O no hydrogen 2.996 N/A TYR 153.A N TRP 149.A O no hydrogen 3.121 N/A ARG 155.A N HIS 151.A O no hydrogen 3.416 N/A HIS 156.A N GLU 152.A O no hydrogen 3.279 N/A LEU 157.A N TYR 153.A O no hydrogen 3.192 N/A ALA 158.A N ILE 154.A O no hydrogen 3.046 N/A LEU 159.A N ARG 155.A O no hydrogen 3.282 N/A ILE 161.A N LEU 157.A O no hydrogen 3.116 N/A GLY 162.A N ALA 158.A O no hydrogen 2.779 N/A GLU 163.A N LEU 159.A O no hydrogen 3.389 N/A VAL 164.A N GLU 160.A O no hydrogen 3.517 N/A TYR 165.A N ILE 161.A O no hydrogen 3.159 N/A ASN 166.A N GLY 162.A O no hydrogen 3.048 N/A ASP 167.A N VAL 164.A O no hydrogen 3.329 N/A GLN 168.A N TYR 165.A O no hydrogen 3.196 N/A VAL 169.A N TYR 165.A O no hydrogen 3.476 N/A GLU 170.A N ASN 166.A O no hydrogen 2.836 N/A GLU 176.A N ALA 173.A O no hydrogen 3.428 N/A THR 177.A OG1 GLU 163.A OE1 no hydrogen 3.078 N/A THR 177.A OG1 GLU 174.A O no hydrogen 3.139 N/A SER 184.A OG ASP 167.A OD2 no hydrogen 3.567 N/A SER 187.A OG GLY 186.A O no hydrogen 3.083 N/A THR 190.A OG1 SER 184.A O no hydrogen 3.146 N/A THR 190.A OG1 GLY 186.A O no hydrogen 2.917 N/A GLY 192.A N ALA 189.A O no hydrogen 3.088 N/A PHE 193.A N ALA 189.A O no hydrogen 3.133 N/A PHE 193.A N THR 190.A O no hydrogen 3.176 N/A GLU 194.A N THR 190.A O no hydrogen 3.229 N/A PHE 195.A N SER 191.A O no hydrogen 3.412 N/A SER 196.A N GLY 192.A O no hydrogen 3.076 N/A LYS 197.A N PHE 193.A O no hydrogen 2.982 N/A GLU 198.A N GLU 194.A O no hydrogen 3.285 N/A ASP 199.A N PHE 195.A O no hydrogen 3.393 N/A THR 200.A N SER 196.A O no hydrogen 2.983 N/A THR 200.A OG1 SER 196.A O no hydrogen 2.733 N/A THR 200.A OG1 LYS 197.A O no hydrogen 3.139 N/A LEU 201.A N LYS 197.A O no hydrogen 3.061 N/A CYS 204.A N THR 200.A O no hydrogen 3.310 N/A PHE 211.A N ILE 207.A O no hydrogen 3.092 N/A LYS 213.A N PRO 209.A O no hydrogen 3.356 N/A HIS 214.A N TYR 210.A O no hydrogen 3.006 N/A ASN 215.A N PHE 211.A O no hydrogen 3.217 N/A ASN 215.A ND2 PHE 211.A O no hydrogen 2.706 N/A GLY 216.A N LEU 212.A O no hydrogen 2.982 N/A ASP 222.A N GLU 218.A O no hydrogen 3.128 N/A LEU 223.A N ASP 219.A O no hydrogen 3.111 N/A LEU 224.A N ALA 220.A O no hydrogen 3.341 N/A LEU 225.A N VAL 221.A O no hydrogen 2.958 N/A GLU 228.A N LEU 224.A O no hydrogen 3.112 N/A SER 229.A N LEU 225.A O no hydrogen 3.013 N/A SER 229.A OG LEU 225.A O no hydrogen 2.848 N/A SER 229.A OG GLU 226.A O no hydrogen 3.397 N/A ASP 231.A N ILE 227.A O no hydrogen 3.158 N/A PHE 236.A N ASP 231.A O no hydrogen 3.343 N/A ASN 240.A ND2 GLN 243.A OE1 no hydrogen 3.650 N/A THR 241.A N VAL 237.A O no hydrogen 3.342 N/A THR 241.A OG1 VAL 237.A O no hydrogen 2.864 N/A PHE 242.A N ASP 238.A O no hydrogen 3.063 N/A GLN 243.A N GLU 239.A O no hydrogen 3.292 N/A ARG 244.A N ASN 240.A O no hydrogen 3.136 N/A VAL 245.A N THR 241.A O no hydrogen 3.325 N/A CYS 246.A N PHE 242.A O no hydrogen 3.000 N/A CYS 246.A SG PHE 242.A O no hydrogen 3.390 N/A CYS 246.A SG GLN 243.A O no hydrogen 3.826 N/A GLN 247.A N GLN 243.A O no hydrogen 3.347 N/A TYR 248.A N ARG 244.A O no hydrogen 3.192 N/A VAL 250.A N CYS 246.A O no hydrogen 3.241 N/A ALA 251.A N GLN 247.A O no hydrogen 3.158 N/A CYS 252.A N TYR 248.A O no hydrogen 3.318 N/A CYS 252.A SG TYR 248.A O no hydrogen 3.026 N/A LEU 255.A N CYS 252.A O no hydrogen 2.985 N/A ASP 261.A N PRO 257.A O no hydrogen 3.021 N/A VAL 262.A N PRO 258.A O no hydrogen 3.189 N/A ALA 263.A N PRO 259.A O no hydrogen 3.277 N/A PHE 264.A N GLU 260.A O no hydrogen 3.241 N/A PHE 264.A N ASP 261.A O no hydrogen 3.292 N/A LEU 265.A N ASP 261.A O no hydrogen 3.282 N/A LYS 266.A N VAL 262.A O no hydrogen 3.017 N/A THR 267.A N PHE 264.A O no hydrogen 3.057 N/A THR 267.A OG1 ASP 222.A OD1 no hydrogen 3.304 N/A ALA 268.A N PHE 264.A O no hydrogen 3.361 N/A TYR 269.A N LEU 265.A O no hydrogen 3.171 N/A TYR 269.A OH MET 293.A O no hydrogen 3.199 N/A SER 270.A N LYS 266.A O no hydrogen 3.074 N/A SER 270.A OG LYS 266.A O no hydrogen 3.010 N/A ILE 271.A N THR 267.A O no hydrogen 2.890 N/A TYR 272.A N ALA 268.A O no hydrogen 3.149 N/A TYR 272.A OH PHE 242.A O no hydrogen 3.314 N/A LEU 273.A N TYR 269.A O no hydrogen 2.927 N/A SER 274.A N SER 270.A O no hydrogen 3.019 N/A SER 274.A OG SER 270.A O no hydrogen 3.386 N/A GLN 275.A N ILE 271.A O no hydrogen 2.853 N/A ASN 276.A ND2 ASP 238.A OD1 no hydrogen 3.161 N/A THR 279.A OG1 VAL 891.A O no hydrogen 3.141 N/A ILE 282.A N LEU 278.A O no hydrogen 3.263 N/A ALA 285.A N ALA 281.A O no hydrogen 3.158 N/A VAL 286.A N ILE 282.A O no hydrogen 3.160 N/A ARG 287.A N ALA 283.A O no hydrogen 3.252 N/A LEU 288.A N LEU 284.A O no hydrogen 3.171 N/A ARG 295.A N GLU 291.A O no hydrogen 3.348 N/A PHE 298.A N ILE 294.A O no hydrogen 3.134 N/A ASP 299.A N ARG 295.A O no hydrogen 2.804 N/A ALA 300.A N SER 296.A O no hydrogen 2.845 N/A THR 301.A N VAL 297.A O no hydrogen 3.221 N/A SER 302.A N PHE 298.A O no hydrogen 3.298 N/A SER 302.A OG PHE 298.A O no hydrogen 2.911 N/A ASP 303.A N ASP 299.A O no hydrogen 2.984 N/A TYR 312.A N LYS 308.A O no hydrogen 3.257 N/A TYR 312.A N GLN 309.A O no hydrogen 3.222 N/A TYR 312.A OH SER 302.A O no hydrogen 3.083 N/A TYR 312.A OH HIS 338.A ND1 no hydrogen 3.214 N/A LEU 314.A N LEU 310.A O no hydrogen 2.837 N/A ALA 315.A N ALA 311.A O no hydrogen 3.026 N/A ALA 316.A N TYR 312.A O no hydrogen 3.118 N/A GLN 317.A N ILE 313.A O no hydrogen 3.183 N/A GLN 317.A NE2 GLU 900.A OE2 no hydrogen 3.123 N/A LYS 318.A N LEU 314.A O no hydrogen 3.003 N/A THR 319.A N ALA 315.A O no hydrogen 3.364 N/A THR 319.A OG1 ALA 316.A O no hydrogen 2.737 N/A THR 319.A OG1 THR 349.A OG1 no hydrogen 3.185 N/A SER 320.A N ALA 316.A O no hydrogen 3.016 N/A SER 320.A OG LEU 348.A O no hydrogen 3.166 N/A SER 320.A OG THR 349.A O no hydrogen 3.140 N/A SER 320.A OG GLY 350.A O no hydrogen 3.472 N/A TYR 323.A OH LEU 786.A O no hydrogen 2.986 N/A GLY 325.A N GLU 322.A O no hydrogen 3.254 N/A GLN 327.A NE2 LYS 318.A O no hydrogen 3.271 N/A ILE 329.A N GLY 325.A O no hydrogen 3.433 N/A GLY 331.A N GLN 327.A O no hydrogen 3.091 N/A GLU 337.A N GLY 333.A O no hydrogen 3.434 N/A HIS 338.A N LYS 334.A O no hydrogen 3.324 N/A PHE 339.A N LEU 335.A O no hydrogen 3.124 N/A LYS 344.A NZ HIS 833.A O no hydrogen 2.894 N/A LYS 344.A NZ GLN 835.A OE1 no hydrogen 3.487 N/A LEU 346.A N LEU 342.A O no hydrogen 3.084 N/A LEU 348.A N LYS 344.A O no hydrogen 3.137 N/A LEU 348.A N GLU 345.A O no hydrogen 3.202 N/A THR 349.A N GLU 345.A O no hydrogen 3.189 N/A THR 349.A OG1 ALA 316.A O no hydrogen 3.474 N/A THR 349.A OG1 THR 319.A OG1 no hydrogen 3.185 N/A GLY 350.A N LEU 346.A O no hydrogen 3.133 N/A LYS 352.A NZ LEU 346.A O no hydrogen 3.472 N/A LYS 352.A NZ ASP 464.A O no hydrogen 2.802 N/A VAL 353.A N ASN 347.A O no hydrogen 3.304 N/A GLU 355.A N LYS 352.A O no hydrogen 2.828 N/A ASP 356.A N LYS 352.A O no hydrogen 3.382 N/A ILE 357.A N VAL 353.A O no hydrogen 3.297 N/A SER 360.A N ILE 357.A O no hydrogen 3.271 N/A LEU 362.A N TYR 358.A O no hydrogen 2.806 N/A ASP 363.A N LYS 359.A O no hydrogen 3.114 N/A SER 365.A N HIS 361.A O no hydrogen 3.190 N/A SER 365.A OG HIS 361.A O no hydrogen 3.265 N/A LYS 366.A N LEU 362.A O no hydrogen 2.971 N/A LYS 366.A NZ ASN 364.A O no hydrogen 3.225 N/A SER 371.A OG ASN 387.A OD1 no hydrogen 3.439 N/A ASN 380.A N ALA 377.A O no hydrogen 3.138 N/A ALA 382.A N GLN 378.A O no hydrogen 3.268 N/A SER 383.A OG GLN 379.A O no hydrogen 3.119 N/A SER 384.A N ASN 380.A O no hydrogen 3.195 N/A SER 384.A OG ASN 380.A O no hydrogen 3.340 N/A SER 384.A OG LEU 381.A O no hydrogen 3.175 N/A ASN 387.A N SER 383.A O no hydrogen 3.214 N/A GLY 388.A N PHE 385.A O no hydrogen 3.060 N/A PHE 389.A N PHE 385.A O no hydrogen 3.174 N/A LEU 390.A N VAL 386.A O no hydrogen 3.113 N/A LEU 390.A N ASN 387.A O no hydrogen 3.399 N/A ASN 391.A N GLY 388.A O no hydrogen 3.261 N/A ASN 391.A ND2 VAL 368.A O no hydrogen 3.505 N/A CYS 395.A N ILE 425.A O no hydrogen 3.081 N/A CYS 395.A SG ASN 391.A O no hydrogen 3.795 N/A CYS 395.A SG TYR 394.A O no hydrogen 3.460 N/A LYS 398.A NZ GLN 434.A OE1 no hydrogen 3.394 N/A ILE 400.A N ASP 397.A O no hydrogen 3.047 N/A VAL 401.A N ASP 397.A O no hydrogen 3.359 N/A ASP 402.A N LYS 398.A O no hydrogen 3.009 N/A ASN 403.A N LEU 399.A O no hydrogen 3.162 N/A ASN 403.A N ILE 400.A O no hydrogen 3.064 N/A TYR 408.A N ASP 404.A O no hydrogen 3.092 N/A LYS 409.A N ASN 405.A O no hydrogen 3.220 N/A THR 410.A N VAL 407.A O no hydrogen 3.408 N/A THR 410.A OG1 VAL 407.A O no hydrogen 2.742 N/A MET 415.A N GLY 412.A O no hydrogen 3.160 N/A THR 416.A OG1 GLU 446.A O no hydrogen 3.336 N/A SER 417.A N ASP 413.A O no hydrogen 3.126 N/A SER 417.A OG ASP 413.A O no hydrogen 3.341 N/A SER 417.A OG GLY 414.A O no hydrogen 3.204 N/A ALA 418.A N GLY 414.A O no hydrogen 2.831 N/A VAL 419.A N MET 415.A O no hydrogen 3.307 N/A ALA 420.A N THR 416.A O no hydrogen 3.278 N/A SER 421.A N SER 417.A O no hydrogen 3.064 N/A SER 421.A OG SER 384.A O no hydrogen 2.808 N/A SER 421.A OG SER 417.A O no hydrogen 3.484 N/A SER 421.A OG ALA 418.A O no hydrogen 2.830 N/A GLY 423.A N VAL 419.A O no hydrogen 3.340 N/A SER 424.A N ALA 420.A O no hydrogen 3.338 N/A SER 424.A OG ALA 420.A O no hydrogen 3.321 N/A ILE 425.A N ILE 422.A O no hydrogen 3.228 N/A TYR 426.A N GLY 423.A O no hydrogen 3.106 N/A GLN 427.A NE2 ALA 821.A O no hydrogen 3.449 N/A ASN 429.A ND2 ASP 431.A O no hydrogen 3.128 N/A GLN 435.A NE2 GLY 432.A O no hydrogen 3.181 N/A LEU 436.A N GLY 432.A O no hydrogen 3.317 N/A ASP 437.A N LEU 433.A O no hydrogen 3.053 N/A LYS 438.A N GLN 434.A O no hydrogen 3.438 N/A LYS 438.A NZ ASP 404.A OD1 no hydrogen 3.269 N/A LYS 438.A NZ ASP 404.A OD2 no hydrogen 3.506 N/A TYR 439.A OH ASP 404.A OD1 no hydrogen 3.089 N/A LEU 440.A N LEU 436.A O no hydrogen 3.171 N/A TYR 441.A N ASP 437.A O no hydrogen 3.244 N/A TYR 441.A N LYS 438.A O no hydrogen 3.277 N/A VAL 442.A N TYR 439.A O no hydrogen 3.437 N/A ALA 449.A N PRO 445.A O no hydrogen 3.130 N/A GLY 450.A N GLU 446.A O no hydrogen 3.315 N/A ALA 451.A N VAL 447.A O no hydrogen 3.088 N/A LEU 452.A N ALA 449.A O no hydrogen 3.240 N/A LEU 453.A N ALA 449.A O no hydrogen 3.410 N/A GLY 454.A N GLY 450.A O no hydrogen 3.303 N/A ILE 455.A N ALA 451.A O no hydrogen 3.088 N/A GLY 456.A N LEU 452.A O no hydrogen 3.224 N/A ILE 457.A N LEU 453.A O no hydrogen 3.299 N/A SER 458.A N GLY 454.A O no hydrogen 3.059 N/A SER 458.A OG TYR 426.A O no hydrogen 3.182 N/A SER 458.A OG GLY 454.A O no hydrogen 3.369 N/A ALA 459.A N ILE 455.A O no hydrogen 3.076 N/A SER 460.A OG ILE 457.A O no hydrogen 3.163 N/A VAL 462.A N ALA 459.A O no hydrogen 3.422 N/A GLU 466.A N HIS 463.A O no hydrogen 3.252 N/A VAL 467.A N HIS 463.A O no hydrogen 3.381 N/A LEU 474.A N ALA 470.A O no hydrogen 3.242 N/A GLN 475.A N LEU 471.A O no hydrogen 3.041 N/A VAL 478.A N LEU 474.A O no hydrogen 3.073 N/A THR 479.A N GLN 475.A O no hydrogen 3.196 N/A THR 479.A OG1 GLN 475.A O no hydrogen 2.805 N/A ASN 480.A N ASP 476.A O no hydrogen 3.390 N/A ASP 482.A N ASN 480.A OD1 no hydrogen 3.340 N/A SER 486.A N ASP 482.A O no hydrogen 3.076 N/A SER 486.A OG VAL 478.A O no hydrogen 2.990 N/A SER 486.A OG ASP 482.A O no hydrogen 3.070 N/A SER 487.A N THR 483.A O no hydrogen 2.997 N/A SER 487.A OG THR 483.A O no hydrogen 3.063 N/A SER 487.A OG LYS 484.A O no hydrogen 3.061 N/A ALA 488.A N LYS 484.A O no hydrogen 3.474 N/A ALA 489.A N ILE 485.A O no hydrogen 3.123 N/A ILE 490.A N SER 486.A O no hydrogen 3.228 N/A LEU 491.A N SER 487.A O no hydrogen 3.260 N/A GLY 492.A N ALA 488.A O no hydrogen 3.218 N/A GLY 492.A N ALA 489.A O no hydrogen 3.215 N/A LEU 493.A N ALA 489.A O no hydrogen 3.129 N/A GLY 494.A N ILE 490.A O no hydrogen 3.115 N/A ILE 495.A N LEU 491.A O no hydrogen 3.403 N/A ALA 496.A N GLY 492.A O no hydrogen 3.180 N/A PHE 497.A N LEU 493.A O no hydrogen 3.423 N/A ALA 498.A N ILE 495.A O no hydrogen 3.332 N/A GLY 499.A N GLU 324.A O no hydrogen 2.965 N/A SER 500.A N PHE 497.A O no hydrogen 2.824 N/A SER 500.A OG GLU 324.A O no hydrogen 3.451 N/A SER 500.A OG GLY 325.A O no hydrogen 2.927 N/A SER 500.A OG ASP 464.A OD1 no hydrogen 3.211 N/A SER 500.A OG PHE 497.A O no hydrogen 2.737 N/A LEU 506.A N ASN 502.A O no hydrogen 3.013 N/A GLY 507.A N ASP 503.A O no hydrogen 3.092 N/A LEU 508.A N GLU 504.A O no hydrogen 3.243 N/A LEU 509.A N LEU 506.A O no hydrogen 3.245 N/A THR 516.A OG1 ASP 548.A O no hydrogen 2.754 N/A LEU 518.A N SER 515.A O no hydrogen 3.065 N/A THR 522.A OG1 THR 483.A OG1 no hydrogen 3.099 N/A ALA 526.A N ALA 523.A O no hydrogen 3.140 N/A LEU 528.A N ALA 524.A O no hydrogen 2.879 N/A ALA 529.A N MET 525.A O no hydrogen 3.411 N/A ALA 531.A N SER 527.A O no hydrogen 2.904 N/A HIS 532.A N LEU 528.A O no hydrogen 3.298 N/A VAL 533.A N ALA 529.A O no hydrogen 3.276 N/A THR 537.A OG1 GLY 289.A O no hydrogen 3.263 N/A CYS 538.A N GLY 289.A O no hydrogen 3.307 N/A CYS 538.A SG GLY 289.A O no hydrogen 3.213 N/A CYS 538.A SG GLU 290.A OE2 no hydrogen 3.883 N/A CYS 538.A SG THR 537.A OG1 no hydrogen 3.741 N/A ASN 539.A ND2 MET 575.A O no hydrogen 3.184 N/A MET 547.A N THR 543.A O no hydrogen 3.008 N/A ASP 548.A N THR 544.A O no hydrogen 3.220 N/A ASN 549.A N SER 545.A O no hydrogen 3.255 N/A PHE 550.A N ILE 546.A O no hydrogen 3.427 N/A LEU 551.A N MET 547.A O no hydrogen 3.262 N/A GLU 552.A N ASP 548.A O no hydrogen 3.172 N/A ARG 553.A N ASN 549.A O no hydrogen 3.152 N/A THR 554.A N PHE 550.A O no hydrogen 3.213 N/A THR 554.A OG1 PHE 550.A O no hydrogen 2.926 N/A ALA 555.A N LEU 551.A O no hydrogen 2.999 N/A ILE 556.A N GLU 552.A O no hydrogen 2.899 N/A THR 560.A OG1 SER 639.A O no hydrogen 3.530 N/A VAL 563.A N LYS 559.A O no hydrogen 3.303 N/A ARG 564.A N THR 560.A O no hydrogen 2.955 N/A ARG 564.A NE HIS 807.A NE2 no hydrogen 3.447 N/A PHE 565.A N ASP 561.A O no hydrogen 3.062 N/A LEU 566.A N TRP 562.A O no hydrogen 3.208 N/A ALA 567.A N VAL 563.A O no hydrogen 2.908 N/A LEU 568.A N ARG 564.A O no hydrogen 3.311 N/A ALA 569.A N PHE 565.A O no hydrogen 2.884 N/A LEU 570.A N LEU 566.A O no hydrogen 3.390 N/A ILE 572.A N LEU 568.A O no hydrogen 2.922 N/A LEU 573.A N ALA 569.A O no hydrogen 2.910 N/A TYR 574.A N LEU 570.A O no hydrogen 3.397 N/A ASP 582.A N GLU 579.A O no hydrogen 3.416 N/A LEU 585.A N VAL 581.A O no hydrogen 3.298 N/A THR 587.A N ASP 583.A O no hydrogen 3.289 N/A THR 587.A OG1 ASP 583.A O no hydrogen 3.214 N/A ILE 588.A N VAL 584.A O no hydrogen 2.958 N/A SER 589.A N LEU 585.A O no hydrogen 3.024 N/A SER 589.A OG GLU 600.A OE1 no hydrogen 2.906 N/A ALA 590.A N GLU 586.A O no hydrogen 2.759 N/A HIS 593.A ND1 THR 596.A OG1 no hydrogen 2.893 N/A THR 596.A OG1 HIS 593.A ND1 no hydrogen 2.893 N/A SER 597.A N HIS 593.A O no hydrogen 3.039 N/A SER 597.A OG HIS 593.A O no hydrogen 2.930 N/A GLU 600.A N THR 596.A O no hydrogen 3.263 N/A GLY 604.A N GLU 600.A O no hydrogen 3.076 N/A SER 605.A N LEU 602.A O no hydrogen 3.305 N/A SER 605.A OG VAL 601.A O no hydrogen 3.383 N/A SER 605.A OG LEU 602.A O no hydrogen 3.440 N/A SER 605.A OG ALA 651.A O no hydrogen 3.319 N/A CYS 606.A SG GLY 571.A O no hydrogen 3.354 N/A ALA 607.A N VAL 603.A O no hydrogen 3.114 N/A TYR 608.A N GLY 604.A O no hydrogen 3.355 N/A THR 609.A OG1 ASP 659.A OD1 no hydrogen 3.123 N/A THR 609.A OG1 GLU 662.A OE1 no hydrogen 3.029 N/A THR 609.A OG1 GLU 662.A OE2 no hydrogen 3.396 N/A GLY 610.A N ASP 659.A OD1 no hydrogen 3.341 N/A GLN 618.A N VAL 614.A O no hydrogen 3.014 N/A ASP 619.A N LEU 615.A O no hydrogen 3.224 N/A LEU 621.A N ILE 617.A O no hydrogen 3.153 N/A HIS 622.A N GLN 618.A O no hydrogen 3.188 N/A LEU 624.A N LEU 620.A O no hydrogen 3.303 N/A THR 625.A N LEU 621.A O no hydrogen 3.274 N/A THR 625.A OG1 LEU 621.A O no hydrogen 3.132 N/A ASN 628.A N LEU 624.A O no hydrogen 3.046 N/A VAL 629.A N THR 625.A O no hydrogen 3.110 N/A LYS 630.A N PRO 626.A O no hydrogen 3.234 N/A GLY 631.A N LYS 627.A O no hydrogen 2.930 N/A ASP 634.A N LYS 630.A O no hydrogen 2.903 N/A ALA 635.A N GLY 631.A O no hydrogen 3.058 N/A SER 639.A OG GLU 557.A O no hydrogen 3.189 N/A GLU 641.A N ILE 637.A O no hydrogen 2.933 N/A LYS 642.A N LYS 638.A O no hydrogen 3.335 N/A LYS 643.A N SER 639.A O no hydrogen 3.080 N/A GLY 644.A N GLU 640.A O no hydrogen 3.129 N/A LYS 645.A N GLU 641.A O no hydrogen 3.030 N/A SER 646.A N LYS 642.A O no hydrogen 3.303 N/A SER 646.A OG LYS 642.A O no hydrogen 3.208 N/A SER 646.A OG LYS 643.A O no hydrogen 3.268 N/A SER 647.A N LYS 643.A O no hydrogen 3.143 N/A SER 647.A OG ALA 598.A O no hydrogen 3.527 N/A SER 647.A OG LYS 643.A O no hydrogen 2.985 N/A SER 647.A OG GLY 644.A O no hydrogen 3.160 N/A ASP 650.A N SER 646.A O no hydrogen 3.157 N/A ALA 651.A N SER 647.A O no hydrogen 2.797 N/A THR 652.A N ASP 648.A O no hydrogen 3.121 N/A THR 652.A OG1 ASP 619.A O no hydrogen 3.435 N/A THR 652.A OG1 ASP 648.A O no hydrogen 3.075 N/A THR 653.A OG1 LYS 649.A O no hydrogen 3.377 N/A THR 653.A OG1 ASP 650.A O no hydrogen 2.876 N/A ASP 654.A N ASP 650.A O no hydrogen 2.982 N/A GLY 655.A N ALA 651.A O no hydrogen 2.887 N/A LYS 656.A N THR 652.A O no hydrogen 3.463 N/A ASN 657.A N THR 653.A O no hydrogen 2.911 N/A ASN 657.A ND2 THR 653.A O no hydrogen 2.750 N/A ASP 658.A N ASP 654.A O no hydrogen 3.155 N/A ASP 659.A N GLY 655.A O no hydrogen 3.327 N/A GLU 660.A N LYS 656.A O no hydrogen 2.996 N/A GLU 662.A N ASP 658.A O no hydrogen 3.469 N/A GLU 663.A N ASP 659.A O no hydrogen 3.012 N/A LYS 664.A NZ ALA 251.A O no hydrogen 2.746 N/A GLU 665.A N ASP 854.A O no hydrogen 3.230 N/A ASP 670.A N GLY 667.A O no hydrogen 3.148 N/A GLU 671.A N GLY 667.A O no hydrogen 3.174 N/A LEU 672.A N ILE 668.A O no hydrogen 3.431 N/A TYR 674.A N ASP 670.A O no hydrogen 3.249 N/A ALA 675.A N GLU 671.A O no hydrogen 3.396 N/A LEU 677.A N ALA 673.A O no hydrogen 3.354 N/A GLY 678.A N TYR 674.A O no hydrogen 2.997 N/A ILE 679.A N ALA 675.A O no hydrogen 3.010 N/A ALA 680.A N VAL 676.A O no hydrogen 3.289 N/A LEU 681.A N LEU 677.A O no hydrogen 2.837 N/A ILE 682.A N GLY 678.A O no hydrogen 3.323 N/A ALA 683.A N ILE 679.A O no hydrogen 2.889 N/A GLY 685.A N ILE 682.A O no hydrogen 3.143 N/A LYS 690.A N ASP 687.A O no hydrogen 3.299 N/A LYS 690.A NZ ASP 723.A OD2 no hydrogen 3.020 N/A SER 693.A N GLY 689.A O no hydrogen 3.330 N/A LEU 694.A N LYS 690.A O no hydrogen 3.197 N/A ARG 695.A NE ALA 806.A O no hydrogen 3.124 N/A ARG 695.A NH2 HIS 807.A O no hydrogen 2.876 N/A HIS 696.A N MET 692.A O no hydrogen 3.444 N/A LEU 700.A N HIS 696.A O no hydrogen 2.953 N/A MET 701.A N PHE 697.A O no hydrogen 3.288 N/A HIS 702.A N GLY 698.A O no hydrogen 3.239 N/A TYR 703.A N HIS 699.A O no hydrogen 2.798 N/A GLY 704.A N LEU 700.A O no hydrogen 3.232 N/A ASN 705.A N MET 701.A O no hydrogen 3.169 N/A ARG 709.A NH1 ASP 738.A OD1 no hydrogen 3.124 N/A ARG 709.A NH1 THR 784.A O no hydrogen 3.550 N/A ALA 715.A N MET 711.A O no hydrogen 3.148 N/A MET 716.A N VAL 712.A O no hydrogen 3.092 N/A GLY 717.A N PRO 713.A O no hydrogen 2.923 N/A SER 720.A N MET 716.A O no hydrogen 3.171 N/A SER 720.A OG MET 716.A O no hydrogen 3.110 N/A VAL 721.A N ILE 718.A O no hydrogen 3.355 N/A PHE 729.A N MET 726.A O no hydrogen 3.134 N/A THR 731.A OG1 ARG 695.A O no hydrogen 3.042 N/A THR 731.A OG1 VAL 728.A O no hydrogen 2.801 N/A LEU 732.A N VAL 728.A O no hydrogen 2.955 N/A THR 733.A N PHE 729.A O no hydrogen 3.236 N/A THR 733.A OG1 PHE 729.A O no hydrogen 3.018 N/A THR 733.A OG1 ASP 730.A O no hydrogen 2.987 N/A THR 733.A OG1 ALA 771.A O no hydrogen 3.383 N/A ARG 734.A NE ASP 730.A O no hydrogen 2.970 N/A PHE 735.A N LEU 732.A O no hydrogen 3.191 N/A SER 736.A N LEU 732.A O no hydrogen 3.085 N/A SER 736.A OG LEU 732.A O no hydrogen 3.077 N/A HIS 737.A N THR 733.A O no hydrogen 3.061 N/A LEU 741.A N SER 744.A OG no hydrogen 3.284 N/A ASN 746.A N VAL 743.A O no hydrogen 2.983 N/A ILE 748.A N SER 744.A O no hydrogen 3.400 N/A PHE 749.A N MET 745.A O no hydrogen 3.314 N/A ALA 750.A N ASN 746.A O no hydrogen 2.786 N/A MET 751.A N SER 747.A O no hydrogen 3.001 N/A GLY 752.A N ILE 748.A O no hydrogen 2.932 N/A LEU 753.A N ALA 750.A O no hydrogen 3.077 N/A CYS 754.A N ALA 750.A O no hydrogen 3.368 N/A CYS 754.A SG MET 751.A O no hydrogen 2.977 N/A GLY 755.A N MET 751.A O no hydrogen 3.268 N/A ALA 756.A N GLY 752.A O no hydrogen 2.818 N/A GLY 757.A N LEU 753.A O no hydrogen 2.943 N/A THR 758.A OG1 CYS 754.A O no hydrogen 3.202 N/A GLN 765.A N ALA 761.A O no hydrogen 3.417 N/A GLN 765.A NE2 GLY 755.A O no hydrogen 2.962 N/A LEU 766.A N ARG 762.A O no hydrogen 3.114 N/A LEU 767.A N LEU 763.A O no hydrogen 3.385 N/A ARG 768.A N ALA 764.A O no hydrogen 3.264 N/A ARG 768.A NE ALA 764.A O no hydrogen 3.263 N/A GLN 769.A N GLN 765.A O no hydrogen 3.007 N/A LEU 770.A N LEU 766.A O no hydrogen 3.346 N/A ALA 771.A N LEU 767.A O no hydrogen 3.399 N/A SER 772.A N GLN 769.A O no hydrogen 3.275 N/A SER 772.A OG ARG 768.A O no hydrogen 2.762 N/A SER 772.A OG GLN 769.A O no hydrogen 3.480 N/A TYR 774.A N LEU 770.A O no hydrogen 3.252 N/A GLN 778.A N GLN 778.A OE1 no hydrogen 2.713 N/A GLN 778.A NE2 LYS 366.A O no hydrogen 2.192 N/A GLN 788.A NE2 LYS 795.A O no hydrogen 3.423 N/A GLY 789.A N LEU 791.A O no hydrogen 3.106 N/A LEU 790.A N LEU 791.A O no hydrogen 3.415 N/A THR 797.A OG1 GLU 324.A OE1 no hydrogen 2.859 N/A MET 800.A N THR 797.A O no hydrogen 3.164 N/A VAL 802.A N THR 799.A O no hydrogen 3.161 N/A PHE 803.A N THR 799.A O no hydrogen 3.171 N/A ASN 804.A N MET 800.A O no hydrogen 3.069 N/A ASP 805.A N VAL 802.A O no hydrogen 3.169 N/A HIS 807.A N ASN 804.A O no hydrogen 3.249 N/A LYS 811.A NZ ASP 561.A OD2 no hydrogen 3.567 N/A THR 813.A OG1 ASP 413.A OD1 no hydrogen 2.918 N/A ALA 815.A N LYS 811.A O no hydrogen 3.352 N/A SER 816.A N THR 813.A O no hydrogen 3.066 N/A SER 816.A OG THR 813.A O no hydrogen 3.380 N/A ILE 817.A N LEU 814.A O no hydrogen 3.127 N/A LEU 818.A N LEU 814.A O no hydrogen 3.302 N/A THR 820.A OG1 ILE 817.A O no hydrogen 3.206 N/A ALA 821.A N GLN 427.A OE1 no hydrogen 3.379 N/A SER 826.A OG ARG 898.A O no hydrogen 3.374 N/A SER 828.A OG THR 871.A OG1 no hydrogen 3.267 N/A LEU 831.A N LEU 901.A O no hydrogen 3.172 N/A LYS 832.A NZ THR 903.A O no hydrogen 3.153 N/A LYS 832.A NZ GLU 905.A OE2 no hydrogen 2.738 N/A ASN 841.A ND2 VAL 865.A O no hydrogen 3.592 N/A ALA 842.A N VAL 865.A O no hydrogen 3.174 N/A GLY 843.A N LYS 880.A O no hydrogen 3.044 N/A ILE 844.A N VAL 863.A O no hydrogen 3.086 N/A ARG 845.A N PRO 878.A O no hydrogen 3.439 N/A ARG 845.A NE ILE 844.A O no hydrogen 3.443 N/A ASN 862.A ND2 ILE 859.A O no hydrogen 3.626 N/A VAL 863.A N ILE 844.A O no hydrogen 3.281 N/A VAL 865.A N ALA 842.A O no hydrogen 3.195 N/A THR 871.A N GLU 870.A OE2 no hydrogen 3.048 N/A THR 871.A OG1 SER 828.A OG no hydrogen 3.267 N/A LYS 880.A N GLY 843.A O no hydrogen 3.148 N/A TRP 884.A NE1 ILE 881.A O no hydrogen 2.824 N/A THR 886.A N GLY 883.A O no hydrogen 3.304 N/A THR 886.A OG1 GLY 883.A O no hydrogen 2.877 N/A GLN 887.A N TRP 884.A O no hydrogen 3.309 N/A SER 888.A N GLY 883.A O no hydrogen 2.945 N/A THR 889.A N ASP 904.A O no hydrogen 3.436 N/A VAL 891.A N GLU 902.A O no hydrogen 3.102 N/A ASN 894.A ND2 ALA 899.A O no hydrogen 3.654 N/A GLY 896.A N ASN 894.A OD1 no hydrogen 2.856 N/A ARG 898.A N GLY 789.A O no hydrogen 2.983 N/A ARG 898.A NH1 PHE 321.A O no hydrogen 3.464 N/A ASP 904.A N THR 889.A O no hydrogen 3.160 N/A GLU 905.A N GLU 905.A OE2 no hydrogen 2.671 N/A TYR 906.A OH ASP 904.A OD2 no hydrogen 3.390 N/A