Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 8w9r_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ILE 3.A N PRO 60.A O no hydrogen 3.277 N/A VAL 5.A N VAL 62.A O no hydrogen 3.186 N/A LEU 12.A N HIS 10.A ND1 no hydrogen 3.316 N/A VAL 13.A N LYS 26.A O no hydrogen 2.949 N/A ILE 15.A N LEU 24.A O no hydrogen 3.072 N/A GLN 16.A NE2 GLY 20.A O no hydrogen 3.183 N/A GLN 16.A NE2 ALA 94.A O no hydrogen 2.831 N/A SER 17.A N HIS 22.A O no hydrogen 2.919 N/A SER 17.A OG ASN 19.A OD1 no hydrogen 3.162 N/A SER 17.A OG HIS 22.A O no hydrogen 3.027 N/A GLY 20.A N SER 17.A O no hydrogen 3.128 N/A LYS 21.A N ASN 19.A OD1 no hydrogen 2.773 N/A LYS 21.A NZ TYR 101.A OH no hydrogen 3.428 N/A HIS 22.A N SER 17.A OG no hydrogen 3.114 N/A LEU 24.A N ILE 15.A O no hydrogen 2.899 N/A ILE 25.A N LEU 721.A O no hydrogen 2.611 N/A LYS 26.A N VAL 13.A O no hydrogen 3.078 N/A LYS 26.A NZ TYR 658.A OH no hydrogen 2.877 N/A GLU 27.A N CYS 719.A O no hydrogen 3.418 N/A ASP 28.A N ASN 11.A O no hydrogen 3.394 N/A GLY 30.A N ASP 28.A OD1 no hydrogen 3.159 N/A GLN 31.A NE2 GLY 585.A O no hydrogen 3.545 N/A GLN 31.A NE2 PHE 656.A O no hydrogen 2.257 N/A TRP 32.A N PHE 584.A O no hydrogen 3.374 N/A GLU 35.A N GLN 43.A OE1 no hydrogen 2.919 N/A SER 39.A OG ASN 42.A OD1 no hydrogen 2.696 N/A GLN 43.A NE2 GLU 35.A O no hydrogen 2.970 N/A GLN 43.A NE2 SER 39.A O no hydrogen 3.170 N/A ALA 44.A N LEU 40.A O no hydrogen 2.914 N/A GLY 45.A N VAL 41.A O no hydrogen 3.079 N/A PHE 47.A N GLN 43.A O no hydrogen 3.146 N/A ALA 48.A N ALA 44.A O no hydrogen 2.755 N/A GLN 50.A NE2 VAL 46.A O no hydrogen 3.476 N/A LEU 51.A N PHE 47.A O no hydrogen 2.831 N/A ALA 52.A N ALA 48.A O no hydrogen 2.914 N/A ASN 53.A N VAL 49.A O no hydrogen 2.956 N/A ASN 53.A ND2 VAL 49.A O no hydrogen 3.244 N/A LYS 54.A N GLN 50.A O no hydrogen 3.046 N/A LEU 55.A N LEU 51.A O no hydrogen 3.079 N/A GLY 56.A N ASN 53.A O no hydrogen 3.259 N/A ILE 57.A N ALA 52.A O no hydrogen 3.047 N/A VAL 62.A N ILE 3.A O no hydrogen 3.026 N/A ASP 64.A N VAL 5.A O no hydrogen 3.074 N/A ASN 68.A N ALA 65.A O no hydrogen 3.273 N/A ASN 68.A ND2 PRO 6.A O no hydrogen 2.928 N/A ASN 68.A ND2 ASP 84.A OD2 no hydrogen 2.798 N/A PHE 70.A N TYR 81.A O no hydrogen 3.080 N/A ILE 76.A N SER 74.A OG no hydrogen 3.408 N/A TYR 81.A N PHE 70.A O no hydrogen 2.901 N/A TYR 81.A OH ASP 77.A OD1 no hydrogen 2.439 N/A CYS 82.A N SER 119.A O no hydrogen 3.243 N/A CYS 82.A SG ASN 68.A O no hydrogen 3.736 N/A THR 83.A N ASN 68.A O no hydrogen 3.170 N/A LEU 86.A N PHE 134.A O no hydrogen 3.282 N/A GLU 90.A N SER 87.A O no hydrogen 3.217 N/A GLN 92.A N PRO 88.A O no hydrogen 2.871 N/A LYS 93.A N ARG 89.A O no hydrogen 2.920 N/A ALA 94.A N GLU 90.A O no hydrogen 2.961 N/A LEU 95.A N ILE 91.A O no hydrogen 2.854 N/A ASN 96.A N GLN 92.A O no hydrogen 2.852 N/A ARG 97.A N LYS 93.A O no hydrogen 2.955 N/A ARG 97.A NH2 ASP 18.A O no hydrogen 3.155 N/A GLN 98.A N ALA 94.A O no hydrogen 3.087 N/A ARG 99.A N LEU 95.A O no hydrogen 3.049 N/A ARG 99.A NH1 PRO 105.A O no hydrogen 3.105 N/A ALA 100.A N ASN 96.A O no hydrogen 3.012 N/A TYR 101.A N ARG 97.A O no hydrogen 3.285 N/A TYR 102.A N GLN 98.A O no hydrogen 3.431 N/A ASP 103.A N ALA 100.A O no hydrogen 3.315 N/A ARG 104.A N ARG 99.A O no hydrogen 2.921 N/A LEU 107.A N ASN 96.A OD1 no hydrogen 3.162 N/A THR 108.A OG1 GLU 111.A OE2 no hydrogen 3.280 N/A ASN 112.A N THR 108.A O no hydrogen 2.918 N/A LYS 113.A N ILE 109.A O no hydrogen 3.039 N/A THR 114.A N SER 110.A O no hydrogen 3.175 N/A THR 114.A OG1 SER 110.A O no hydrogen 2.856 N/A LEU 115.A N GLU 111.A O no hydrogen 2.947 N/A LEU 116.A N ASN 112.A O no hydrogen 2.953 N/A SER 117.A OG LYS 113.A O no hydrogen 2.511 N/A SER 117.A OG THR 114.A O no hydrogen 3.114 N/A GLN 118.A N LEU 115.A O no hydrogen 3.373 N/A GLN 118.A NE2 THR 114.A O no hydrogen 3.035 N/A ILE 120.A N ILE 132.A O no hydrogen 3.317 N/A ILE 121.A N LYS 80.A O no hydrogen 2.996 N/A TYR 122.A N VAL 130.A O no hydrogen 3.014 N/A ASP 124.A N ASN 128.A O no hydrogen 2.824 N/A GLY 127.A N ASP 124.A O no hydrogen 3.288 N/A ASP 129.A N SER 735.A O no hydrogen 3.126 N/A VAL 130.A N TYR 122.A O no hydrogen 2.733 N/A SER 131.A N TYR 733.A O no hydrogen 2.653 N/A ILE 132.A N ILE 120.A O no hydrogen 2.991 N/A ILE 133.A N HIS 731.A O no hydrogen 3.003 N/A SER 135.A N ALA 729.A O no hydrogen 2.974 N/A SER 135.A OG TYR 733.A OH no hydrogen 3.223 N/A GLY 136.A N HIS 10.A O no hydrogen 3.243 N/A SER 139.A N GLU 27.A OE2 no hydrogen 3.111 N/A SER 139.A OG GLU 27.A OE2 no hydrogen 2.474 N/A HIS 140.A N GLY 136.A O no hydrogen 2.923 N/A HIS 140.A NE2 ASP 732.A O no hydrogen 3.013 N/A ALA 141.A N ALA 137.A O no hydrogen 2.909 N/A ILE 142.A N MET 138.A O no hydrogen 2.945 N/A PHE 143.A N SER 139.A O no hydrogen 3.118 N/A THR 144.A N HIS 140.A O no hydrogen 2.983 N/A THR 144.A OG1 HIS 140.A O no hydrogen 2.605 N/A THR 144.A OG1 ALA 141.A O no hydrogen 3.148 N/A TYR 145.A N ALA 141.A O no hydrogen 3.101 N/A ALA 146.A N ILE 142.A O no hydrogen 3.103 N/A GLN 147.A N PHE 143.A O no hydrogen 3.099 N/A GLN 147.A NE2 VAL 734.A O no hydrogen 2.752 N/A SER 148.A N THR 144.A O no hydrogen 3.150 N/A SER 148.A OG THR 144.A O no hydrogen 2.880 N/A GLN 149.A N TYR 145.A O no hydrogen 3.107 N/A TRP 150.A N ALA 146.A O no hydrogen 3.138 N/A ASN 151.A N GLN 147.A O no hydrogen 3.126 N/A LYS 152.A N GLN 149.A O no hydrogen 3.450 N/A LYS 152.A NZ GLN 149.A O no hydrogen 2.767 N/A ASN 153.A N TRP 150.A O no hydrogen 3.182 N/A ASN 153.A ND2 GLU 190.A OE1 no hydrogen 3.492 N/A ILE 154.A N ASN 151.A O no hydrogen 3.315 N/A ILE 155.A N VAL 187.A O no hydrogen 3.097 N/A LEU 157.A N GLY 185.A O no hydrogen 2.970 N/A TYR 160.A N LYS 156.A O no hydrogen 3.088 N/A ILE 161.A N LEU 157.A O no hydrogen 2.992 N/A ARG 162.A N ASP 158.A O no hydrogen 3.131 N/A GLU 163.A N TYR 160.A O no hydrogen 3.121 N/A ILE 164.A N ILE 161.A O no hydrogen 2.977 N/A THR 165.A OG1 ARG 162.A O no hydrogen 3.043 N/A THR 167.A OG1 ILE 164.A O no hydrogen 3.148 N/A VAL 168.A N THR 165.A O no hydrogen 3.306 N/A GLN 171.A N GLN 171.A OE1 no hydrogen 2.918 N/A TYR 172.A OH ASP 469.A OD1 no hydrogen 2.708 N/A ARG 173.A N TYR 750.A O no hydrogen 3.264 N/A ARG 173.A NE THR 751.A O no hydrogen 3.400 N/A ARG 175.A N VAL 748.A O no hydrogen 2.935 N/A ARG 175.A NH1 ASP 745.A O no hydrogen 2.718 N/A ARG 175.A NH1 ASP 745.A OD1 no hydrogen 3.545 N/A ARG 175.A NH1 ALA 747.A O no hydrogen 3.066 N/A ARG 175.A NH2 ASP 745.A O no hydrogen 3.397 N/A LYS 178.A N GLU 181.A OE1 no hydrogen 3.392 N/A ILE 180.A N GLU 179.A OE1 no hydrogen 3.262 N/A HIS 182.A N LYS 178.A O no hydrogen 3.237 N/A HIS 182.A ND1 ASP 158.A OD1 no hydrogen 3.288 N/A THR 183.A N ILE 180.A O no hydrogen 3.180 N/A THR 183.A OG1 GLU 179.A O no hydrogen 2.907 N/A HIS 184.A N ILE 180.A O no hydrogen 2.753 N/A TYR 186.A N VAL 741.A O no hydrogen 2.910 N/A VAL 187.A N ILE 155.A O no hydrogen 2.976 N/A ARG 189.A N ASN 153.A O no hydrogen 3.378 N/A SER 195.A OG GLU 429.A OE1 no hydrogen 3.322 N/A VAL 200.A N LEU 196.A O no hydrogen 3.278 N/A ASP 201.A N LEU 197.A O no hydrogen 2.621 N/A ALA 202.A N PRO 198.A O no hydrogen 3.437 N/A ASN 203.A N LEU 199.A O no hydrogen 3.107 N/A ASN 203.A ND2 GLU 206.A OE2 no hydrogen 2.727 N/A LYS 205.A NZ SER 438.A OG no hydrogen 2.826 N/A GLU 206.A N GLU 206.A OE1 no hydrogen 2.928 N/A SER 207.A N ASN 203.A O no hydrogen 3.330 N/A SER 207.A OG ASN 203.A O no hydrogen 2.725 N/A SER 208.A N LEU 204.A O no hydrogen 3.068 N/A SER 208.A OG LEU 204.A O no hydrogen 2.711 N/A SER 208.A OG ARG 435.A O no hydrogen 3.257 N/A SER 209.A N LYS 205.A O no hydrogen 3.075 N/A TYR 210.A N GLU 206.A O no hydrogen 3.086 N/A TYR 210.A OH GLU 478.A OE1 no hydrogen 2.940 N/A TYR 211.A N SER 207.A O no hydrogen 3.152 N/A PHE 212.A N SER 208.A O no hydrogen 2.949 N/A LYS 213.A N SER 209.A O no hydrogen 3.137 N/A LYS 214.A N TYR 210.A O no hydrogen 3.136 N/A LYS 214.A NZ GLU 478.A OE1 no hydrogen 3.312 N/A LYS 214.A NZ GLU 478.A OE2 no hydrogen 2.757 N/A LEU 215.A N TYR 211.A O no hydrogen 2.993 N/A MET 216.A N PHE 212.A O no hydrogen 2.986 N/A SER 217.A N LYS 213.A O no hydrogen 2.930 N/A SER 218.A N LEU 215.A O no hydrogen 3.092 N/A SER 218.A OG LEU 215.A O no hydrogen 2.897 N/A SER 218.A OG TYR 422.A OH no hydrogen 2.978 N/A ILE 219.A N LEU 215.A O no hydrogen 2.998 N/A SER 220.A N MET 216.A O no hydrogen 3.328 N/A SER 220.A OG MET 216.A O no hydrogen 3.324 N/A ASN 221.A N SER 218.A O no hydrogen 3.134 N/A VAL 222.A N ILE 219.A O no hydrogen 3.168 N/A ASP 225.A N GLN 457.A O no hydrogen 2.893 N/A MET 231.A N GLN 227.A O no hydrogen 2.886 N/A LEU 232.A N HIS 228.A O no hydrogen 3.085 N/A THR 233.A N VAL 229.A O no hydrogen 2.951 N/A THR 233.A OG1 VAL 229.A O no hydrogen 2.453 N/A ASN 234.A N SER 230.A O no hydrogen 3.042 N/A ARG 235.A N MET 231.A O no hydrogen 3.249 N/A LEU 236.A N THR 233.A O no hydrogen 3.369 N/A THR 237.A N SER 450.A OG no hydrogen 3.269 N/A ASN 240.A ND2 ASP 447.A OD2 no hydrogen 2.921 N/A ALA 241.A N THR 238.A O no hydrogen 2.947 N/A VAL 244.A N ASN 240.A O no hydrogen 3.336 N/A ARG 245.A N ALA 241.A O no hydrogen 3.065 N/A ALA 246.A N PRO 242.A O no hydrogen 3.313 N/A ILE 247.A N THR 243.A O no hydrogen 3.088 N/A THR 248.A N VAL 244.A O no hydrogen 3.002 N/A THR 248.A OG1 VAL 244.A O no hydrogen 2.650 N/A VAL 249.A N ARG 245.A O no hydrogen 3.138 N/A LEU 250.A N ALA 246.A O no hydrogen 2.906 N/A THR 251.A N ILE 247.A O no hydrogen 3.029 N/A THR 251.A OG1 ILE 247.A O no hydrogen 3.093 N/A THR 251.A OG1 THR 248.A O no hydrogen 2.589 N/A CYS 252.A N THR 248.A O no hydrogen 3.377 N/A CYS 252.A SG THR 248.A O no hydrogen 3.850 N/A MET 253.A N LEU 250.A O no hydrogen 3.234 N/A PHE 254.A N LEU 250.A O no hydrogen 3.178 N/A LYS 255.A N PHE 431.A O no hydrogen 3.226 N/A ARG 258.A NE GLN 256.A OE1 no hydrogen 3.249 N/A ARG 258.A NH2 GLN 256.A OE1 no hydrogen 2.715 N/A ALA 264.A N ASP 271.A OD1 no hydrogen 3.426 N/A ASN 268.A N ASP 271.A OD2 no hydrogen 2.852 N/A ILE 269.A N ASN 268.A OD1 no hydrogen 2.314 N/A ASP 271.A N ASN 268.A O no hydrogen 2.744 N/A VAL 272.A N ASN 268.A O no hydrogen 3.297 N/A ALA 273.A N ILE 269.A O no hydrogen 3.323 N/A ALA 274.A N MET 270.A O no hydrogen 3.047 N/A ALA 275.A N ASP 271.A O no hydrogen 2.957 N/A THR 276.A N VAL 272.A O no hydrogen 2.959 N/A THR 276.A OG1 VAL 272.A O no hydrogen 2.724 N/A CYS 277.A N ALA 273.A O no hydrogen 2.988 N/A CYS 277.A SG ALA 273.A O no hydrogen 3.191 N/A MET 278.A N ALA 274.A O no hydrogen 3.039 N/A LEU 279.A N ALA 275.A O no hydrogen 3.040 N/A LEU 280.A N CYS 277.A O no hydrogen 3.318 N/A PHE 281.A N CYS 277.A O no hydrogen 2.751 N/A ARG 282.A NE GLU 448.A OE2 no hydrogen 3.035 N/A ALA 284.A N TYR 334.A O no hydrogen 3.119 N/A GLN 285.A N GLN 285.A OE1 no hydrogen 2.805 N/A SER 286.A N PRO 283.A O no hydrogen 3.217 N/A SER 286.A OG PRO 283.A O no hydrogen 3.057 N/A ILE 287.A N ALA 284.A O no hydrogen 3.294 N/A SER 288.A OG GLU 290.A OE1 no hydrogen 3.060 N/A GLN 291.A N SER 288.A OG no hydrogen 3.036 N/A TYR 292.A N SER 288.A O no hydrogen 2.915 N/A TYR 292.A OH VAL 331.A O no hydrogen 2.262 N/A ARG 293.A N ASP 289.A O no hydrogen 3.121 N/A ARG 293.A NE ASP 314.A O no hydrogen 3.282 N/A ARG 293.A NH2 ASN 312.A O no hydrogen 2.918 N/A ARG 293.A NH2 ASP 314.A O no hydrogen 3.192 N/A TYR 294.A N GLU 290.A O no hydrogen 3.010 N/A CYS 295.A N GLN 291.A O no hydrogen 2.970 N/A CYS 295.A SG TYR 263.A OH no hydrogen 3.172 N/A CYS 295.A SG GLN 291.A O no hydrogen 3.211 N/A LEU 296.A N TYR 292.A O no hydrogen 3.052 N/A GLN 297.A N ARG 293.A O no hydrogen 2.690 N/A THR 298.A N TYR 294.A O no hydrogen 3.133 N/A THR 298.A OG1 TYR 294.A O no hydrogen 2.847 N/A THR 298.A OG1 TYR 308.A OH no hydrogen 3.352 N/A MET 299.A N CYS 295.A O no hydrogen 3.226 N/A ALA 300.A N LEU 296.A O no hydrogen 3.081 N/A VAL 301.A N GLN 297.A O no hydrogen 2.909 N/A PHE 302.A N THR 298.A O no hydrogen 3.339 N/A LEU 303.A N MET 299.A O no hydrogen 3.023 N/A THR 304.A N ALA 300.A O no hydrogen 2.926 N/A THR 304.A OG1 ALA 300.A O no hydrogen 3.179 N/A ASN 305.A ND2 ARG 386.A O no hydrogen 3.518 N/A THR 306.A N VAL 301.A O no hydrogen 3.107 N/A THR 306.A OG1 THR 307.A O no hydrogen 3.300 N/A TYR 308.A OH THR 298.A OG1 no hydrogen 3.352 N/A ASN 312.A ND2 ASP 309.A O no hydrogen 2.313 N/A ASP 314.A N VAL 311.A O no hydrogen 3.378 N/A LEU 319.A N THR 315.A O no hydrogen 3.129 N/A LYS 320.A N ILE 316.A O no hydrogen 2.993 N/A LYS 320.A NZ TYR 292.A OH no hydrogen 3.017 N/A LYS 320.A NZ VAL 331.A O no hydrogen 3.034 N/A MET 321.A N ASP 317.A O no hydrogen 3.006 N/A LYS 322.A N VAL 318.A O no hydrogen 2.953 N/A LYS 322.A NZ ASP 314.A OD2 no hydrogen 2.780 N/A LEU 323.A N LEU 319.A O no hydrogen 2.939 N/A ARG 324.A N LYS 320.A O no hydrogen 2.905 N/A ASN 325.A N MET 321.A O no hydrogen 3.061 N/A GLN 326.A N LYS 322.A O no hydrogen 3.374 N/A GLY 327.A N LEU 323.A O no hydrogen 3.224 N/A TRP 328.A N LEU 323.A O no hydrogen 2.994 N/A VAL 331.A N PRO 329.A O no hydrogen 3.070 N/A TYR 334.A OH GLU 370.A OE2 no hydrogen 2.712 N/A ILE 339.A N TYR 355.A O no hydrogen 2.739 N/A MET 341.A N GLY 353.A O no hydrogen 2.832 N/A GLU 344.A N LEU 166.A O no hydrogen 3.290 N/A SER 348.A OG LEU 346.A O no hydrogen 3.035 N/A GLY 350.A N GLU 344.A OE1 no hydrogen 3.238 N/A TYR 355.A N ILE 339.A O no hydrogen 3.057 N/A TYR 356.A N CYS 252.A O no hydrogen 3.166 N/A TYR 356.A OH LYS 255.A O no hydrogen 3.101 N/A ASN 357.A N VAL 337.A O no hydrogen 2.919 N/A ASN 357.A ND2 ILE 361.A O no hydrogen 2.647 N/A ASN 360.A ND2 LEU 280.A O no hydrogen 2.889 N/A ASN 360.A ND2 ARG 282.A O no hydrogen 3.136 N/A ASN 360.A ND2 TYR 334.A O no hydrogen 3.391 N/A ASP 362.A N LYS 367.A O no hydrogen 3.071 N/A LEU 364.A N ASP 362.A OD2 no hydrogen 3.135 N/A THR 365.A N ASP 362.A OD2 no hydrogen 3.176 N/A LYS 366.A N ASP 362.A O no hydrogen 2.608 N/A LYS 366.A NZ PRO 363.A O no hydrogen 3.107 N/A HIS 368.A NE2 LEU 280.A O no hydrogen 3.066 N/A VAL 369.A N ASN 360.A O no hydrogen 3.184 N/A GLU 370.A N HIS 368.A ND1 no hydrogen 3.014 N/A PHE 376.A N ARG 372.A O no hydrogen 2.854 N/A ILE 377.A N LEU 373.A O no hydrogen 3.022 N/A ASN 378.A N GLU 374.A O no hydrogen 3.233 N/A GLN 379.A N GLU 375.A O no hydrogen 3.255 N/A VAL 380.A N PHE 376.A O no hydrogen 3.222 N/A GLN 381.A N ILE 377.A O no hydrogen 3.104 N/A VAL 382.A N ASN 378.A O no hydrogen 3.185 N/A ARG 384.A NE VAL 382.A O no hydrogen 3.570 N/A ARG 384.A NH1 SER 389.A O no hydrogen 3.042 N/A ARG 386.A N LEU 303.A O no hydrogen 2.885 N/A ASN 391.A ND2 GLN 381.A O no hydrogen 3.144 N/A THR 395.A N ASN 391.A O no hydrogen 3.095 N/A THR 395.A OG1 ASN 391.A O no hydrogen 3.450 N/A THR 395.A OG1 ALA 392.A O no hydrogen 3.470 N/A THR 396.A N ALA 392.A O no hydrogen 3.215 N/A LEU 397.A N VAL 393.A O no hydrogen 3.127 N/A ALA 398.A N GLY 394.A O no hydrogen 3.216 N/A ALA 399.A N THR 395.A O no hydrogen 3.092 N/A PHE 400.A N THR 396.A O no hydrogen 3.266 N/A LEU 401.A N LEU 397.A O no hydrogen 3.010 N/A ARG 402.A N ALA 398.A O no hydrogen 2.987 N/A ARG 402.A NH2 GLN 381.A OE1 no hydrogen 3.360 N/A ALA 403.A N ALA 399.A O no hydrogen 3.116 N/A CYS 404.A N PHE 400.A O no hydrogen 2.851 N/A CYS 404.A SG PHE 400.A O no hydrogen 3.197 N/A ARG 405.A N LEU 401.A O no hydrogen 2.872 N/A ASP 406.A N ARG 402.A O no hydrogen 2.945 N/A LYS 407.A N ALA 403.A O no hydrogen 2.898 N/A LYS 407.A NZ PHE 453.A O no hydrogen 3.280 N/A LYS 407.A NZ LEU 455.A O no hydrogen 2.881 N/A THR 408.A N CYS 404.A O no hydrogen 2.978 N/A THR 408.A OG1 CYS 404.A O no hydrogen 2.907 N/A THR 408.A OG1 ARG 405.A O no hydrogen 2.855 N/A SER 409.A N ARG 405.A O no hydrogen 3.052 N/A SER 409.A OG ARG 405.A O no hydrogen 2.732 N/A ALA 410.A N LYS 407.A O no hydrogen 3.391 N/A ASN 411.A N LYS 407.A O no hydrogen 3.220 N/A SER 416.A N TRP 412.A O no hydrogen 3.013 N/A SER 416.A OG ASN 357.A OD1 no hydrogen 2.775 N/A VAL 417.A N ARG 413.A O no hydrogen 3.088 N/A LEU 418.A N GLY 414.A O no hydrogen 3.303 N/A VAL 419.A N TYR 415.A O no hydrogen 2.930 N/A SER 420.A N SER 416.A O no hydrogen 2.937 N/A SER 420.A OG VAL 417.A O no hydrogen 2.814 N/A ARG 421.A N VAL 417.A O no hydrogen 3.005 N/A ARG 421.A NH1 ARG 421.A O no hydrogen 3.074 N/A TYR 422.A N LEU 418.A O no hydrogen 3.099 N/A TYR 422.A OH SER 218.A OG no hydrogen 2.978 N/A ARG 423.A N VAL 419.A O no hydrogen 2.833 N/A ARG 423.A NE ARG 354.A O no hydrogen 3.164 N/A ARG 423.A NH1 ARG 423.A O no hydrogen 3.015 N/A ARG 423.A NH2 ASN 428.A OD1 no hydrogen 3.006 N/A SER 424.A OG SER 420.A O no hydrogen 3.239 N/A LEU 425.A N TYR 422.A O no hydrogen 3.226 N/A ILE 426.A N ARG 423.A O no hydrogen 3.378 N/A ASN 428.A N SER 348.A OG no hydrogen 3.282 N/A ASN 428.A ND2 VAL 352.A O no hydrogen 3.673 N/A PHE 431.A N PRO 427.A O no hydrogen 3.328 N/A GLU 432.A N ASN 428.A O no hydrogen 3.169 N/A GLU 432.A N GLU 429.A O no hydrogen 3.240 N/A SER 433.A OG GLU 429.A O no hydrogen 2.893 N/A LEU 434.A N LEU 430.A O no hydrogen 3.205 N/A ARG 435.A N SER 208.A OG no hydrogen 3.350 N/A ARG 435.A NH1 GLU 432.A O no hydrogen 2.868 N/A ARG 435.A NH1 LEU 434.A O no hydrogen 3.145 N/A ARG 435.A NH2 GLU 432.A O no hydrogen 2.955 N/A ASN 436.A ND2 ARG 258.A O no hydrogen 2.888 N/A SER 438.A OG GLU 440.A OE1 no hydrogen 2.835 N/A GLU 440.A N SER 438.A O no hydrogen 2.739 N/A ILE 443.A N GLY 260.A O no hydrogen 3.193 N/A GLU 448.A N ASN 444.A O no hydrogen 2.997 N/A HIS 449.A N PRO 445.A O no hydrogen 3.329 N/A SER 450.A N GLN 446.A O no hydrogen 3.032 N/A SER 450.A OG ARG 235.A O no hydrogen 3.452 N/A SER 450.A OG GLN 446.A O no hydrogen 2.748 N/A PHE 451.A N ASP 447.A O no hydrogen 2.917 N/A PHE 452.A N GLU 448.A O no hydrogen 3.431 N/A PHE 453.A N HIS 449.A O no hydrogen 2.866 N/A ALA 454.A N SER 450.A O no hydrogen 2.967 N/A ASN 459.A N PRO 223.A O no hydrogen 3.207 N/A PHE 464.A N ASP 461.A OD1 no hydrogen 3.223 N/A ILE 465.A N ASP 461.A O no hydrogen 3.357 N/A GLY 466.A N ASP 462.A O no hydrogen 2.817 N/A ALA 467.A N GLU 463.A O no hydrogen 2.838 N/A ILE 468.A N PHE 464.A O no hydrogen 3.060 N/A ASP 469.A N ILE 465.A O no hydrogen 3.191 N/A LYS 470.A N GLY 466.A O no hydrogen 3.386 N/A GLU 471.A N ALA 467.A O no hydrogen 3.168 N/A SER 472.A N ILE 468.A O no hydrogen 2.796 N/A ALA 473.A N ASP 469.A O no hydrogen 3.399 N/A GLU 474.A N LYS 470.A O no hydrogen 3.181 N/A TYR 475.A N GLU 471.A O no hydrogen 2.738 N/A LEU 476.A N SER 472.A O no hydrogen 2.996 N/A ASP 477.A N ALA 473.A O no hydrogen 3.030 N/A GLU 478.A N GLU 474.A O no hydrogen 3.039 N/A TYR 479.A N TYR 475.A O no hydrogen 3.103 N/A ALA 480.A N LEU 476.A O no hydrogen 3.277 N/A THR 481.A N ASP 477.A O no hydrogen 3.103 N/A THR 481.A OG1 ASP 477.A O no hydrogen 3.393 N/A THR 481.A OG1 GLU 478.A O no hydrogen 2.664 N/A LEU 482.A N GLU 478.A O no hydrogen 3.075 N/A ALA 483.A N TYR 479.A O no hydrogen 3.071 N/A ARG 484.A N ALA 480.A O no hydrogen 3.143 N/A ASP 485.A N THR 481.A O no hydrogen 2.898 N/A ILE 486.A N LEU 482.A O no hydrogen 2.750 N/A SER 487.A N ALA 483.A O no hydrogen 2.984 N/A ASN 488.A N ARG 484.A O no hydrogen 2.958 N/A SER 489.A N ASP 485.A O no hydrogen 2.974 N/A SER 489.A OG ASP 485.A O no hydrogen 2.659 N/A SER 489.A OG TYR 547.A OH no hydrogen 2.669 N/A LEU 490.A N ILE 486.A O no hydrogen 2.900 N/A THR 491.A N SER 487.A O no hydrogen 3.184 N/A THR 491.A OG1 SER 487.A O no hydrogen 2.943 N/A LEU 492.A N ASN 488.A O no hydrogen 3.052 N/A VAL 493.A N SER 489.A O no hydrogen 3.168 N/A LYS 494.A N LEU 490.A O no hydrogen 3.485 N/A ALA 495.A N THR 491.A O no hydrogen 3.289 N/A ALA 496.A N LEU 492.A O no hydrogen 2.996 N/A PHE 497.A N VAL 493.A O no hydrogen 3.171 N/A GLU 501.A N SER 506.A OG no hydrogen 3.318 N/A ARG 502.A N GLU 501.A OE1 no hydrogen 2.929 N/A SER 506.A OG GLU 501.A O no hydrogen 3.082 N/A SER 506.A OG THR 503.A O no hydrogen 3.053 N/A ILE 507.A N THR 503.A O no hydrogen 3.215 N/A ILE 508.A N SER 504.A O no hydrogen 3.028 N/A ASN 509.A N GLY 505.A O no hydrogen 2.963 N/A HIS 510.A N SER 506.A O no hydrogen 2.916 N/A HIS 510.A NE2 ASP 552.A OD1 no hydrogen 2.840 N/A ALA 511.A N ILE 507.A O no hydrogen 2.960 N/A ASN 512.A N ILE 508.A O no hydrogen 3.041 N/A ASN 513.A N ASN 509.A O no hydrogen 3.062 N/A LEU 514.A N HIS 510.A O no hydrogen 2.975 N/A ASN 515.A N ALA 511.A O no hydrogen 3.137 N/A LYS 516.A N ASN 512.A O no hydrogen 3.148 N/A VAL 517.A N ASN 513.A O no hydrogen 3.071 N/A ILE 518.A N LEU 514.A O no hydrogen 3.043 N/A ASN 519.A N ASN 515.A O no hydrogen 2.946 N/A HIS 520.A N LYS 516.A O no hydrogen 3.046 N/A VAL 521.A N VAL 517.A O no hydrogen 2.805 N/A PHE 522.A N ILE 518.A O no hydrogen 3.059 N/A ALA 523.A N HIS 520.A O no hydrogen 3.357 N/A LEU 527.A N VAL 521.A O no hydrogen 3.329 N/A SER 529.A OG ASP 485.A OD2 no hydrogen 2.347 N/A LYS 534.A N GLU 530.A O no hydrogen 3.061 N/A LYS 534.A NZ TYR 210.A OH no hydrogen 2.656 N/A ILE 535.A N THR 531.A O no hydrogen 3.349 N/A LEU 536.A N MET 532.A O no hydrogen 3.037 N/A THR 537.A N LEU 533.A O no hydrogen 2.944 N/A THR 537.A OG1 LEU 533.A O no hydrogen 2.739 N/A THR 537.A OG1 LYS 534.A O no hydrogen 3.451 N/A ILE 538.A N ILE 535.A O no hydrogen 3.448 N/A LYS 544.A NZ ASN 519.A OD1 no hydrogen 3.385 N/A GLY 546.A N THR 542.A O no hydrogen 2.894 N/A TYR 547.A N GLY 543.A O no hydrogen 3.196 N/A TYR 547.A OH SER 489.A OG no hydrogen 2.669 N/A ARG 548.A N LYS 544.A O no hydrogen 3.122 N/A ARG 548.A NH1 ASN 515.A OD1 no hydrogen 3.400 N/A ARG 548.A NH2 ASP 545.A OD1 no hydrogen 2.363 N/A ASN 549.A N ASP 545.A O no hydrogen 3.203 N/A TRP 550.A N GLY 546.A O no hydrogen 3.446 N/A TRP 550.A NE1 PRO 198.A O no hydrogen 3.366 N/A LEU 551.A N TYR 547.A O no hydrogen 3.130 N/A ASP 552.A N ARG 548.A O no hydrogen 3.308 N/A LYS 553.A N ASN 549.A O no hydrogen 3.258 N/A LEU 554.A N TRP 550.A O no hydrogen 3.156 N/A VAL 555.A N ASP 552.A O no hydrogen 3.366 N/A HIS 557.A N LEU 554.A O no hydrogen 3.092 N/A TYR 559.A N HIS 557.A ND1 no hydrogen 3.308 N/A VAL 567.A N GLU 564.A O no hydrogen 3.025 N/A ASN 568.A N GLU 564.A O no hydrogen 3.464 N/A ASN 568.A ND2 GLN 149.A OE1 no hydrogen 2.847 N/A ILE 569.A N PRO 565.A O no hydrogen 3.078 N/A MET 570.A N VAL 566.A O no hydrogen 3.268 N/A ASN 571.A N VAL 567.A O no hydrogen 2.935 N/A PHE 572.A N ASN 568.A O no hydrogen 2.806 N/A ILE 573.A N ILE 569.A O no hydrogen 3.083 N/A SER 574.A N MET 570.A O no hydrogen 2.900 N/A SER 574.A OG MET 570.A O no hydrogen 2.749 N/A ALA 575.A N ASN 571.A O no hydrogen 3.067 N/A ARG 576.A N PHE 572.A O no hydrogen 3.202 N/A ARG 576.A NE ASP 580.A OD2 no hydrogen 3.077 N/A PHE 577.A N ILE 573.A O no hydrogen 2.876 N/A VAL 578.A N SER 574.A O no hydrogen 3.214 N/A ALA 579.A N ALA 575.A O no hydrogen 2.931 N/A ASP 580.A N ARG 576.A O no hydrogen 2.942 N/A SER 581.A OG TYR 586.A O no hydrogen 3.303 N/A PHE 584.A N SER 581.A O no hydrogen 3.044 N/A TYR 586.A N SER 581.A O no hydrogen 3.480 N/A TYR 586.A OH PHE 577.A O no hydrogen 2.728 N/A THR 587.A N PHE 654.A O no hydrogen 2.958 N/A THR 587.A OG1 GLU 589.A O no hydrogen 3.382 N/A ILE 590.A N LEU 649.A O no hydrogen 2.992 N/A MET 591.A N TYR 713.A O no hydrogen 2.877 N/A ILE 592.A N PHE 647.A O no hydrogen 3.204 N/A MET 593.A N ARG 711.A O no hydrogen 3.059 N/A ASN 595.A N SER 709.A O no hydrogen 2.962 N/A ASN 595.A ND2 SER 704.A O no hydrogen 2.658 N/A ASN 595.A ND2 VAL 708.A O no hydrogen 2.665 N/A ILE 597.A N PRO 594.A O no hydrogen 3.401 N/A ASP 602.A N PHE 612.A O no hydrogen 2.978 N/A ARG 604.A NE ASP 602.A OD2 no hydrogen 3.033 N/A ARG 604.A NH2 ASP 602.A OD2 no hydrogen 3.408 N/A ARG 608.A N TYR 691.A O no hydrogen 2.830 N/A ARG 608.A NH1 ASP 664.A OD1 no hydrogen 2.768 N/A ARG 608.A NH1 ASN 694.A O no hydrogen 3.395 N/A ARG 608.A NH2 ASN 694.A O no hydrogen 3.129 N/A SER 610.A OG ASP 602.A O no hydrogen 3.427 N/A SER 610.A OG PHE 612.A O no hydrogen 3.492 N/A PHE 612.A N SER 610.A OG no hydrogen 3.214 N/A CYS 613.A N ILE 714.A O no hydrogen 3.137 N/A CYS 613.A SG PRO 600.A O no hydrogen 3.703 N/A ILE 620.A N ASN 623.A O no hydrogen 2.791 N/A ASN 623.A N ILE 620.A O no hydrogen 3.225 N/A VAL 625.A N ARG 618.A O no hydrogen 3.255 N/A ILE 628.A N ILE 648.A O no hydrogen 2.872 N/A TYR 630.A N TYR 650.A O no hydrogen 3.086 N/A TYR 630.A OH ASP 682.A OD1 no hydrogen 2.794 N/A VAL 632.A N SER 629.A OG no hydrogen 3.373 N/A PHE 633.A N SER 629.A O no hydrogen 2.934 N/A SER 634.A N TYR 630.A O no hydrogen 2.835 N/A SER 634.A OG TYR 630.A O no hydrogen 2.815 N/A SER 634.A OG ASN 681.A O no hydrogen 3.470 N/A MET 635.A N VAL 632.A O no hydrogen 3.269 N/A MET 636.A N PHE 633.A O no hydrogen 3.405 N/A ASP 641.A N ASP 638.A O no hydrogen 3.232 N/A ASP 641.A N ASP 640.A OD1 no hydrogen 2.810 N/A VAL 642.A N ASP 638.A O no hydrogen 3.374 N/A ILE 643.A N ILE 639.A O no hydrogen 3.051 N/A SER 644.A OG ASP 641.A O no hydrogen 2.236 N/A GLU 645.A N VAL 642.A O no hydrogen 3.210 N/A GLY 646.A N VAL 642.A O no hydrogen 3.477 N/A PHE 647.A N ILE 592.A O no hydrogen 3.276 N/A ILE 648.A N ARG 626.A O no hydrogen 2.737 N/A LEU 649.A N ILE 590.A O no hydrogen 2.815 N/A TYR 650.A N ILE 628.A O no hydrogen 3.157 N/A PHE 654.A N THR 587.A O no hydrogen 2.904 N/A PHE 656.A N GLY 585.A O no hydrogen 3.020 N/A SER 657.A N ILE 686.A O no hydrogen 3.175 N/A SER 657.A OG HIS 687.A ND1 no hydrogen 3.244 N/A ASP 659.A N PHE 688.A O no hydrogen 2.901 N/A MET 661.A N ILE 690.A O no hydrogen 2.864 N/A THR 662.A OG1 ASP 18.A OD1 no hydrogen 2.838 N/A THR 667.A OG1 ARG 608.A O no hydrogen 2.601 N/A LYS 670.A N HIS 687.A O no hydrogen 2.997 N/A ILE 675.A N ASP 682.A O no hydrogen 2.986 N/A THR 677.A N GLY 680.A O no hydrogen 3.294 N/A THR 677.A OG1 GLY 680.A O no hydrogen 2.745 N/A THR 679.A OG1 ASP 678.A OD1 no hydrogen 2.784 N/A ASN 681.A N SER 634.A O no hydrogen 2.851 N/A ASN 681.A ND2 PHE 633.A O no hydrogen 3.389 N/A ASN 681.A ND2 MET 636.A O no hydrogen 2.856 N/A ASP 682.A N ILE 675.A O no hydrogen 3.188 N/A ILE 683.A N TYR 630.A OH no hydrogen 2.897 N/A LYS 684.A N ILE 673.A O no hydrogen 3.124 N/A PHE 688.A N SER 657.A O no hydrogen 2.939 N/A TYR 689.A N ARG 668.A O no hydrogen 3.095 N/A ILE 690.A N ASP 659.A O no hydrogen 3.244 N/A TYR 691.A N THR 667.A OG1 no hydrogen 3.301 N/A GLU 693.A N GLY 606.A O no hydrogen 3.222 N/A ASP 697.A N ASN 694.A O no hydrogen 3.412 N/A LYS 699.A NZ GLU 703.A OE2 no hydrogen 2.791 N/A ARG 701.A N ASP 697.A O no hydrogen 3.199 N/A TYR 702.A N LYS 698.A O no hydrogen 3.092 N/A GLU 703.A N LYS 699.A O no hydrogen 3.184 N/A SER 704.A N LEU 700.A O no hydrogen 3.249 N/A SER 704.A OG LEU 700.A O no hydrogen 2.809 N/A LYS 705.A N ARG 701.A O no hydrogen 3.236 N/A MET 706.A N TYR 702.A O no hydrogen 2.946 N/A ASN 707.A N GLU 703.A O no hydrogen 2.730 N/A ARG 711.A N MET 593.A O no hydrogen 2.920 N/A TYR 713.A N MET 591.A O no hydrogen 2.779 N/A ILE 714.A N PRO 611.A O no hydrogen 3.080 N/A THR 716.A N CYS 613.A O no hydrogen 2.867 N/A THR 716.A OG1 PRO 717.A O no hydrogen 3.474 N/A ALA 718.A N SER 582.A OG no hydrogen 3.265 N/A CYS 719.A SG TYR 658.A OH no hydrogen 3.346 N/A LEU 723.A N ALA 23.A O no hydrogen 3.351 N/A ASP 725.A N PRO 722.A O no hydrogen 3.147 N/A TYR 726.A N LEU 723.A O no hydrogen 3.206 N/A ARG 728.A N ASP 725.A O no hydrogen 3.095 N/A ALA 729.A N TYR 726.A O no hydrogen 3.149 N/A GLN 730.A N MET 727.A O no hydrogen 3.408 N/A GLN 730.A NE2 GLN 118.A OE1 no hydrogen 2.656 N/A HIS 731.A N ILE 133.A O no hydrogen 2.872 N/A TYR 733.A N SER 131.A O no hydrogen 2.766 N/A TYR 733.A OH SER 135.A OG no hydrogen 3.223 N/A SER 735.A N ASP 129.A O no hydrogen 2.995 N/A VAL 741.A N HIS 184.A O no hydrogen 2.853 N/A ILE 743.A N TYR 186.A O no hydrogen 3.153 N/A ALA 747.A N ASP 745.A OD1 no hydrogen 3.054 N/A TYR 750.A N ARG 173.A O no hydrogen 2.673 N/A SER 753.A OG ARG 752.A O no hydrogen 2.623 N/A