Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 8k42_R.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): THR 6.A N ASP 4.A OD1 no hydrogen 3.199 N/A THR 6.A OG1 ASP 4.A OD1 no hydrogen 2.641 N/A SER 9.A OG THR 6.A O no hydrogen 3.012 N/A MET 10.A N PHE 7.A O no hydrogen 2.959 N/A MET 12.A N SER 9.A O no hydrogen 3.410 N/A ASN 19.A N ALA 15.A O no hydrogen 3.103 N/A ASN 19.A ND2 GLU 22.A OE2 no hydrogen 3.164 N/A HIS 23.A N ASN 19.A O no hydrogen 3.111 N/A PHE 24.A N GLU 20.A O no hydrogen 2.579 N/A MET 25.A N ARG 21.A O no hydrogen 2.646 N/A LYS 26.A N GLU 22.A O no hydrogen 3.152 N/A LYS 26.A NZ ASP 30.A OD2 no hydrogen 3.111 N/A THR 27.A N HIS 23.A O no hydrogen 3.185 N/A THR 27.A OG1 HIS 23.A O no hydrogen 2.941 N/A ARG 28.A N PHE 24.A O no hydrogen 3.252 N/A ILE 29.A N MET 25.A O no hydrogen 3.317 N/A ASP 30.A N LYS 26.A O no hydrogen 3.089 N/A LYS 31.A N THR 27.A O no hydrogen 2.969 N/A ILE 32.A N ARG 28.A O no hydrogen 2.891 N/A GLU 33.A N ILE 29.A O no hydrogen 3.020 N/A HIS 34.A N ASP 30.A O no hydrogen 3.204 N/A ASP 35.A N LYS 31.A O no hydrogen 3.030 N/A LEU 36.A N ILE 32.A O no hydrogen 2.837 N/A ARG 38.A N HIS 34.A O no hydrogen 2.866 N/A ARG 38.A NH1 VAL 151.A O no hydrogen 2.890 N/A ARG 38.A NH2 VAL 151.A O no hydrogen 2.729 N/A GLU 43.A N SER 39.A O no hydrogen 2.948 N/A MET 44.A N ALA 40.A O no hydrogen 3.018 N/A MET 45.A N LYS 41.A O no hydrogen 3.256 N/A ASP 46.A N GLN 42.A O no hydrogen 3.104 N/A ARG 47.A NE LEU 67.A O no hydrogen 3.177 N/A ARG 47.A NH2 LEU 67.A O no hydrogen 3.262 N/A GLN 48.A NE2 GLN 48.A O no hydrogen 3.430 N/A SER 49.A OG ASP 46.A O no hydrogen 3.046 N/A LEU 50.A N ASP 46.A O no hydrogen 3.032 N/A ALA 51.A N ARG 47.A O no hydrogen 2.967 N/A GLU 52.A N GLN 48.A O no hydrogen 3.147 N/A ASP 53.A N SER 49.A O no hydrogen 3.054 N/A TYR 54.A N LEU 50.A O no hydrogen 2.971 N/A TYR 54.A OH HIS 439.A ND1 no hydrogen 3.058 N/A ASN 55.A N ALA 51.A O no hydrogen 3.048 N/A ALA 56.A N GLU 52.A O no hydrogen 2.901 N/A ALA 56.A N ASP 53.A O no hydrogen 3.183 N/A LEU 57.A N TYR 54.A O no hydrogen 3.424 N/A GLY 62.A N GLU 64.A OE1 no hydrogen 2.669 N/A GLN 63.A N ALA 60.A O no hydrogen 3.046 N/A GLN 63.A NE2 ILE 546.A O no hydrogen 3.278 N/A GLU 64.A N GLU 64.A OE1 no hydrogen 2.697 N/A LYS 66.A N GLN 72.A OE1 no hydrogen 3.119 N/A ILE 69.A N LYS 66.A O no hydrogen 3.445 N/A ALA 70.A N GLU 181.A O no hydrogen 2.868 N/A THR 71.A OG1 ILE 424.A O no hydrogen 2.947 N/A HIS 73.A N ILE 69.A O no hydrogen 3.145 N/A GLN 74.A N ALA 70.A O no hydrogen 3.025 N/A LEU 75.A N THR 71.A O no hydrogen 3.079 N/A ASN 76.A N GLN 72.A O no hydrogen 2.896 N/A ASN 76.A ND2 TYR 54.A OH no hydrogen 3.420 N/A ARG 77.A N HIS 73.A O no hydrogen 2.975 N/A ARG 77.A NH1 GLN 74.A OE1 no hydrogen 2.688 N/A ARG 77.A NH1 VAL 158.A O no hydrogen 2.929 N/A ARG 77.A NH2 GLU 43.A OE1 no hydrogen 3.274 N/A ARG 77.A NH2 VAL 158.A O no hydrogen 3.527 N/A LEU 78.A N GLN 74.A O no hydrogen 3.249 N/A GLY 79.A N LEU 75.A O no hydrogen 2.908 N/A SER 80.A N ASN 76.A O no hydrogen 2.774 N/A SER 80.A OG ASN 76.A O no hydrogen 2.623 N/A SER 80.A OG ARG 77.A O no hydrogen 3.271 N/A ALA 81.A N ARG 77.A O no hydrogen 3.374 N/A MET 82.A N LEU 78.A O no hydrogen 2.998 N/A TYR 83.A N GLY 79.A O no hydrogen 2.796 N/A TYR 83.A OH TYR 456.A OH no hydrogen 2.847 N/A LYS 84.A N SER 80.A O no hydrogen 2.945 N/A LYS 84.A NZ GLU 88.A OE2 no hydrogen 3.414 N/A LYS 84.A NZ LYS 441.A O no hydrogen 2.733 N/A LYS 84.A NZ GLU 443.A OE1 no hydrogen 3.228 N/A LYS 84.A NZ GLU 443.A OE2 no hydrogen 2.893 N/A ALA 85.A N ALA 81.A O no hydrogen 3.196 N/A ASP 86.A N MET 82.A O no hydrogen 3.239 N/A HIS 87.A N TYR 83.A O no hydrogen 2.957 N/A HIS 87.A NE2 LEU 457.A O no hydrogen 2.833 N/A GLU 88.A N LYS 84.A O no hydrogen 3.098 N/A ARG 89.A N ALA 85.A O no hydrogen 3.362 N/A ARG 89.A NH1 GLU 92.A OE1 no hydrogen 3.225 N/A ARG 89.A NH1 ASP 146.A OD1 no hydrogen 3.379 N/A ARG 89.A NH2 ASP 146.A OD1 no hydrogen 3.454 N/A GLU 90.A N ASP 86.A O no hydrogen 3.079 N/A THR 91.A N HIS 87.A O no hydrogen 2.965 N/A THR 91.A OG1 HIS 87.A O no hydrogen 2.696 N/A GLU 92.A N GLU 88.A O no hydrogen 2.802 N/A LEU 93.A N ARG 89.A O no hydrogen 2.925 N/A THR 94.A N GLU 90.A O no hydrogen 3.027 N/A THR 94.A OG1 GLU 90.A O no hydrogen 2.695 N/A ASP 95.A N THR 91.A O no hydrogen 3.098 N/A LEU 96.A N GLU 92.A O no hydrogen 2.977 N/A ILE 97.A N LEU 93.A O no hydrogen 2.929 N/A ASN 98.A N THR 94.A O no hydrogen 3.143 N/A ASN 98.A ND2 TYR 568.A O no hydrogen 2.951 N/A ARG 99.A N ASP 95.A O no hydrogen 3.184 N/A ARG 99.A NH2 GLU 102.A OE2 no hydrogen 2.458 N/A ARG 99.A NH2 ASP 572.A OD2 no hydrogen 3.248 N/A ILE 100.A N LEU 96.A O no hydrogen 3.125 N/A ARG 101.A N ILE 97.A O no hydrogen 3.242 N/A ARG 101.A NH1 TYR 566.A O no hydrogen 2.703 N/A GLU 102.A N ASN 98.A O no hydrogen 3.170 N/A ASN 103.A N ARG 99.A O no hydrogen 3.393 N/A ASN 103.A N ILE 100.A O no hydrogen 3.288 N/A VAL 107.A N ASN 103.A O no hydrogen 2.891 N/A ASN 108.A N GLU 104.A O no hydrogen 2.847 N/A GLY 109.A N VAL 105.A O no hydrogen 3.249 N/A ILE 110.A N THR 106.A O no hydrogen 3.253 N/A LEU 111.A N VAL 107.A O no hydrogen 3.058 N/A GLU 112.A N ASN 108.A O no hydrogen 3.098 N/A ASN 113.A N GLY 109.A O no hydrogen 3.102 N/A LYS 115.A NZ LEU 111.A O no hydrogen 2.757 N/A THR 118.A OG1 GLU 121.A OE1 no hydrogen 2.214 N/A ALA 119.A N ASP 373.A OD1 no hydrogen 3.052 N/A ARG 122.A N THR 118.A O no hydrogen 3.068 N/A ARG 122.A NE ALA 210.A O no hydrogen 3.228 N/A ARG 122.A NH1 GLN 114.A O no hydrogen 2.358 N/A ALA 123.A N ALA 119.A O no hydrogen 2.973 N/A ASP 124.A N ALA 120.A O no hydrogen 2.977 N/A LEU 125.A N GLU 121.A O no hydrogen 2.971 N/A LEU 126.A N ARG 122.A O no hydrogen 2.892 N/A LEU 127.A N ALA 123.A O no hydrogen 2.955 N/A GLU 128.A N LEU 125.A O no hydrogen 3.235 N/A VAL 129.A N LEU 125.A O no hydrogen 3.229 N/A VAL 130.A N LEU 126.A O no hydrogen 3.392 N/A SER 132.A OG ALA 134.A O no hydrogen 2.963 N/A GLY 141.A N SER 138.A OG no hydrogen 3.062 N/A ARG 142.A N SER 138.A O no hydrogen 2.971 N/A ARG 142.A NH1 VAL 137.A O no hydrogen 2.604 N/A ALA 143.A N ALA 139.A O no hydrogen 3.176 N/A ALA 144.A N ALA 140.A O no hydrogen 3.381 N/A ALA 145.A N GLY 141.A O no hydrogen 3.106 N/A ASP 146.A N ALA 143.A O no hydrogen 3.363 N/A VAL 151.A N SER 148.A O no hydrogen 3.515 N/A VAL 153.A N SER 197.A OG no hydrogen 2.925 N/A GLY 155.A N PHE 195.A O no hydrogen 3.124 N/A SER 157.A OG HIS 34.A ND1 no hydrogen 2.791 N/A SER 157.A OG PHE 154.A O no hydrogen 2.978 N/A VAL 158.A N GLY 155.A O no hydrogen 2.974 N/A ALA 159.A N GLY 155.A O no hydrogen 3.201 N/A LYS 163.A NZ GLY 165.A O no hydrogen 2.895 N/A ILE 177.A N ALA 173.A O no hydrogen 3.019 N/A ALA 178.A N GLU 174.A O no hydrogen 3.015 N/A VAL 179.A N ALA 175.A O no hydrogen 3.160 N/A LYS 180.A N ALA 176.A O no hydrogen 2.921 N/A LYS 180.A NZ ILE 166.A O no hydrogen 3.095 N/A GLU 181.A N ILE 177.A O no hydrogen 2.937 N/A SER 182.A N VAL 179.A O no hydrogen 3.166 N/A SER 182.A OG VAL 179.A O no hydrogen 2.816 N/A GLY 183.A N LYS 180.A O no hydrogen 3.319 N/A ILE 184.A N LYS 163.A O no hydrogen 3.190 N/A ASP 190.A N THR 186.A O no hydrogen 3.223 N/A VAL 191.A N GLN 187.A O no hydrogen 3.175 N/A TYR 192.A N LEU 188.A O no hydrogen 3.242 N/A TYR 192.A OH GLN 74.A O no hydrogen 2.324 N/A HIS 193.A N ASN 189.A O no hydrogen 3.295 N/A ALA 194.A N VAL 191.A O no hydrogen 3.312 N/A PHE 195.A N TYR 192.A O no hydrogen 3.211 N/A SER 197.A OG HIS 199.A NE2 no hydrogen 2.879 N/A VAL 198.A N GLN 273.A OE1 no hydrogen 2.627 N/A HIS 199.A ND1 ASP 86.A OD1 no hydrogen 3.186 N/A ASN 203.A ND2 ALA 134.A O no hydrogen 3.496 N/A ASN 203.A ND2 SER 136.A O no hydrogen 2.981 N/A ASP 204.A N ALA 201.A O no hydrogen 3.172 N/A VAL 205.A N ALA 201.A O no hydrogen 3.365 N/A VAL 205.A N PRO 202.A O no hydrogen 3.219 N/A ILE 206.A N PRO 202.A O no hydrogen 3.157 N/A LYS 207.A NZ ASP 204.A OD1 no hydrogen 3.024 N/A ALA 209.A N VAL 205.A O no hydrogen 3.140 N/A ALA 210.A N ILE 206.A O no hydrogen 2.933 N/A GLY 214.A N GLU 218.A OE1 no hydrogen 2.859 N/A THR 215.A OG1 THR 217.A OG1 no hydrogen 3.224 N/A SER 216.A N ASN 108.A OD1 no hydrogen 3.022 N/A SER 216.A OG GLU 104.A OE2 no hydrogen 3.026 N/A THR 217.A OG1 THR 215.A OG1 no hydrogen 3.224 N/A LEU 219.A N THR 215.A O no hydrogen 3.127 N/A ILE 220.A N SER 216.A O no hydrogen 3.008 N/A GLY 221.A N THR 217.A O no hydrogen 2.957 N/A ASN 222.A N GLU 218.A O no hydrogen 2.873 N/A ASN 222.A ND2 ALA 209.A O no hydrogen 3.174 N/A LEU 223.A N LEU 219.A O no hydrogen 3.094 N/A GLN 224.A N ILE 220.A O no hydrogen 2.958 N/A ALA 225.A N GLY 221.A O no hydrogen 2.895 N/A ILE 226.A N ASN 222.A O no hydrogen 3.160 N/A TYR 227.A N LEU 223.A O no hydrogen 3.279 N/A SER 228.A N GLN 224.A O no hydrogen 2.926 N/A SER 228.A OG GLN 224.A O no hydrogen 3.136 N/A SER 228.A OG HIS 561.A NE2 no hydrogen 3.075 N/A ARG 229.A N ALA 225.A O no hydrogen 3.215 N/A ARG 229.A NH1 ASN 392.A OD1 no hydrogen 3.090 N/A ARG 229.A NH1 ASP 395.A OD1 no hydrogen 2.758 N/A ARG 229.A NH2 ASN 392.A OD1 no hydrogen 2.815 N/A LEU 230.A N ILE 226.A O no hydrogen 2.785 N/A ARG 231.A N TYR 227.A O no hydrogen 2.953 N/A SER 232.A N SER 228.A O no hydrogen 3.282 N/A HIS 233.A N ARG 229.A O no hydrogen 3.181 N/A SER 234.A N LEU 230.A O no hydrogen 3.271 N/A SER 234.A OG LEU 230.A O no hydrogen 3.098 N/A ASP 235.A N ARG 231.A O no hydrogen 3.329 N/A ILE 236.A N SER 232.A O no hydrogen 3.406 N/A GLY 237.A N HIS 233.A O no hydrogen 3.107 N/A PHE 238.A N SER 234.A O no hydrogen 3.353 N/A LYS 239.A N ASP 235.A O no hydrogen 3.150 N/A LYS 239.A NZ HIS 399.A ND1 no hydrogen 2.950 N/A LYS 239.A NZ ASP 403.A OD1 no hydrogen 3.175 N/A LYS 240.A N ILE 236.A O no hydrogen 3.129 N/A LYS 240.A NZ VAL 272.A O no hydrogen 3.001 N/A LYS 240.A NZ GLY 274.A O no hydrogen 3.053 N/A ALA 241.A N PHE 238.A O no hydrogen 3.241 N/A THR 242.A N PHE 238.A O no hydrogen 3.354 N/A THR 242.A N LYS 239.A O no hydrogen 3.117 N/A THR 242.A OG1 PHE 238.A O no hydrogen 3.191 N/A THR 242.A OG1 ASN 431.A O no hydrogen 3.318 N/A VAL 243.A N LYS 239.A O no hydrogen 3.324 N/A TYR 251.A N VAL 268.A O no hydrogen 3.115 N/A TYR 251.A OH GLU 302.A OE2 no hydrogen 2.708 N/A MET 252.A N VAL 322.A O no hydrogen 2.708 N/A ILE 253.A N LEU 266.A O no hydrogen 2.862 N/A LYS 254.A N THR 320.A O no hydrogen 2.921 N/A SER 258.A OG THR 259.A O no hydrogen 3.514 N/A SER 258.A OG SER 263.A OG no hydrogen 2.730 N/A SER 263.A OG SER 258.A OG no hydrogen 2.730 N/A GLN 265.A N LEU 282.A O no hydrogen 2.985 N/A LEU 266.A N ILE 253.A O no hydrogen 3.111 N/A TYR 267.A N VAL 280.A O no hydrogen 2.718 N/A VAL 268.A N TYR 251.A O no hydrogen 3.009 N/A ILE 269.A N LEU 278.A O no hydrogen 2.831 N/A HIS 270.A N SER 250.A OG no hydrogen 2.955 N/A HIS 270.A NE2 GLU 302.A OE1 no hydrogen 3.169 N/A GLN 273.A NE2 VAL 198.A O no hydrogen 3.177 N/A SER 275.A OG ASP 395.A OD2 no hydrogen 2.969 N/A GLY 277.A N PHE 292.A O no hydrogen 2.676 N/A LEU 278.A N ILE 269.A O no hydrogen 3.325 N/A VAL 279.A N ASN 290.A O no hydrogen 2.949 N/A VAL 280.A N TYR 267.A O no hydrogen 2.817 N/A GLN 281.A N THR 288.A O no hydrogen 2.863 N/A LEU 282.A N GLN 265.A O no hydrogen 2.788 N/A MET 283.A N ALA 286.A O no hydrogen 3.165 N/A ALA 286.A N MET 283.A O no hydrogen 3.085 N/A THR 288.A N GLN 281.A O no hydrogen 3.085 N/A THR 288.A OG1 ALA 312.A O no hydrogen 3.332 N/A ASN 290.A N VAL 279.A O no hydrogen 2.957 N/A ASN 290.A ND2 GLY 311.A O no hydrogen 3.620 N/A ASN 290.A ND2 THR 313.A OG1 no hydrogen 2.521 N/A VAL 291.A N LEU 308.A O no hydrogen 2.858 N/A PHE 292.A N GLY 277.A O no hydrogen 2.973 N/A ALA 293.A N LYS 305.A O no hydrogen 2.900 N/A GLN 294.A N SER 275.A O no hydrogen 3.221 N/A GLN 294.A NE2 PRO 271.A O no hydrogen 3.357 N/A TYR 295.A OH HIS 394.A ND1 no hydrogen 2.630 N/A THR 298.A OG1 SER 301.A OG no hydrogen 3.397 N/A SER 301.A OG THR 298.A OG1 no hydrogen 3.397 N/A SER 301.A OG PHE 303.A O no hydrogen 3.483 N/A GLY 304.A N ALA 293.A O no hydrogen 3.175 N/A THR 306.A OG1 VAL 291.A O no hydrogen 2.890 N/A VAL 307.A N VAL 291.A O no hydrogen 2.737 N/A LEU 308.A N VAL 291.A O no hydrogen 3.337 N/A THR 309.A OG1 ASN 290.A OD1 no hydrogen 3.249 N/A THR 309.A OG1 GLY 311.A O no hydrogen 3.273 N/A GLY 310.A N TYR 289.A O no hydrogen 2.900 N/A ASN 314.A N GLN 281.A OE1 no hydrogen 2.777 N/A THR 320.A N LYS 254.A O no hydrogen 2.783 N/A VAL 322.A N MET 252.A O no hydrogen 2.786 N/A PHE 324.A N SER 250.A O no hydrogen 3.167 N/A GLN 325.A NE2 HIS 193.A O no hydrogen 3.681 N/A THR 326.A OG1 VAL 328.A O no hydrogen 2.896 N/A LYS 327.A N ILE 360.A O no hydrogen 2.664 N/A LYS 327.A NZ ASP 30.A OD2 no hydrogen 3.051 N/A LYS 327.A NZ ASN 361.A O no hydrogen 3.359 N/A VAL 328.A N THR 326.A OG1 no hydrogen 3.113 N/A THR 329.A N GLN 332.A OE1 no hydrogen 3.304 N/A THR 329.A OG1 GLN 332.A OE1 no hydrogen 3.109 N/A GLN 331.A N GLN 331.A OE1 no hydrogen 2.652 N/A GLN 331.A NE2 HIS 233.A ND1 no hydrogen 3.218 N/A ALA 333.A N THR 329.A O no hydrogen 2.924 N/A LEU 334.A N ALA 330.A O no hydrogen 2.848 N/A ALA 335.A N GLN 331.A O no hydrogen 3.003 N/A LEU 336.A N GLN 332.A O no hydrogen 3.404 N/A THR 337.A N ALA 333.A O no hydrogen 3.111 N/A THR 337.A OG1 ALA 333.A O no hydrogen 2.697 N/A MET 338.A N LEU 334.A O no hydrogen 2.996 N/A ALA 339.A N ALA 335.A O no hydrogen 3.116 N/A LEU 340.A N LEU 336.A O no hydrogen 2.651 N/A LYS 341.A N THR 337.A O no hydrogen 3.078 N/A LYS 341.A NZ GLY 310.A O no hydrogen 3.028 N/A ASP 342.A N MET 338.A O no hydrogen 3.341 N/A ALA 343.A N ALA 339.A O no hydrogen 3.275 N/A ALA 344.A N LYS 341.A O no hydrogen 3.470 N/A SER 348.A N GLU 351.A OE1 no hydrogen 3.133 N/A SER 348.A OG GLU 351.A OE1 no hydrogen 3.562 N/A GLU 351.A N SER 348.A OG no hydrogen 3.076 N/A LEU 352.A N SER 348.A O no hydrogen 3.016 N/A ILE 353.A N GLN 349.A O no hydrogen 3.113 N/A GLY 354.A N GLY 350.A O no hydrogen 2.919 N/A TYR 355.A N GLU 351.A O no hydrogen 2.976 N/A PHE 356.A N LEU 352.A O no hydrogen 3.426 N/A GLU 357.A N ILE 353.A O no hydrogen 3.146 N/A GLN 358.A N GLY 354.A O no hydrogen 3.101 N/A TYR 359.A N TYR 355.A O no hydrogen 3.390 N/A ILE 360.A N PHE 356.A O no hydrogen 3.271 N/A ASN 361.A N GLU 357.A O no hydrogen 3.132 N/A LEU 362.A N GLN 358.A O no hydrogen 2.886 N/A ALA 363.A N TYR 359.A O no hydrogen 3.032 N/A LEU 364.A N GLN 358.A O no hydrogen 3.440 N/A GLN 372.A N ASN 368.A O no hydrogen 3.058 N/A ASP 373.A N LEU 369.A O no hydrogen 3.054 N/A ASN 374.A N SER 370.A O no hydrogen 3.273 N/A MET 375.A N LEU 371.A O no hydrogen 3.148 N/A HIS 376.A N GLN 372.A O no hydrogen 3.240 N/A LYS 377.A N ASP 373.A O no hydrogen 3.005 N/A TYR 378.A N ASN 374.A O no hydrogen 2.877 N/A TYR 378.A OH ASP 342.A OD2 no hydrogen 2.969 N/A HIS 379.A N MET 375.A O no hydrogen 2.737 N/A HIS 380.A N HIS 376.A O no hydrogen 3.104 N/A LEU 381.A N LYS 377.A O no hydrogen 3.148 N/A LEU 382.A N TYR 378.A O no hydrogen 3.035 N/A THR 383.A N HIS 380.A O no hydrogen 3.284 N/A THR 383.A OG1 HIS 379.A O no hydrogen 2.932 N/A THR 383.A OG1 HIS 380.A O no hydrogen 3.217 N/A SER 384.A N LEU 381.A O no hydrogen 3.330 N/A SER 384.A OG HIS 380.A O no hydrogen 2.976 N/A SER 384.A OG LEU 381.A O no hydrogen 2.617 N/A SER 387.A N SER 384.A O no hydrogen 3.381 N/A SER 387.A OG LEU 382.A O no hydrogen 2.695 N/A SER 387.A OG ILE 389.A O no hydrogen 3.373 N/A ILE 389.A N SER 387.A OG no hydrogen 3.341 N/A TRP 391.A NE1 LEU 382.A O no hydrogen 3.065 N/A ASN 392.A ND2 THR 555.A O no hydrogen 3.531 N/A HIS 394.A N ASP 390.A O no hydrogen 3.324 N/A HIS 394.A ND1 TYR 295.A OH no hydrogen 2.630 N/A ASP 395.A N TRP 391.A O no hydrogen 2.812 N/A GLU 396.A N ASN 392.A O no hydrogen 3.103 N/A GLU 397.A N TYR 393.A O no hydrogen 3.098 N/A MET 398.A N HIS 394.A O no hydrogen 3.053 N/A HIS 399.A N ASP 395.A O no hydrogen 3.142 N/A LYS 400.A N GLU 396.A O no hydrogen 3.046 N/A LYS 400.A NZ GLU 397.A OE2 no hydrogen 3.283 N/A TRP 401.A N GLU 397.A O no hydrogen 2.903 N/A LEU 402.A N MET 398.A O no hydrogen 2.914 N/A ASP 403.A N HIS 399.A O no hydrogen 3.150 N/A SER 404.A N LYS 400.A O no hydrogen 3.206 N/A ARG 405.A N TRP 401.A O no hydrogen 3.176 N/A ARG 405.A NE ASP 245.A OD2 no hydrogen 2.580 N/A ARG 405.A NH2 ASP 245.A OD1 no hydrogen 2.794 N/A ARG 405.A NH2 ASP 245.A OD2 no hydrogen 3.039 N/A LYS 406.A N LEU 402.A O no hydrogen 3.168 N/A LYS 406.A NZ ASN 431.A OD1 no hydrogen 2.742 N/A THR 407.A N ASP 403.A O no hydrogen 3.256 N/A THR 407.A OG1 ASP 403.A O no hydrogen 3.105 N/A THR 408.A N SER 404.A O no hydrogen 2.996 N/A THR 408.A OG1 SER 404.A O no hydrogen 2.670 N/A ASN 409.A N ARG 405.A O no hydrogen 2.864 N/A TYR 410.A N LYS 406.A O no hydrogen 2.930 N/A ASP 411.A N THR 407.A O no hydrogen 2.968 N/A ALA 412.A N THR 408.A O no hydrogen 2.998 N/A MET 413.A N ASN 409.A O no hydrogen 2.958 N/A GLN 414.A N TYR 410.A O no hydrogen 2.895 N/A LYS 415.A N ASP 411.A O no hydrogen 3.203 N/A LYS 416.A N ALA 412.A O no hydrogen 3.343 N/A ASP 417.A N MET 413.A O no hydrogen 3.026 N/A THR 419.A OG1 GLN 414.A OE1 no hydrogen 3.180 N/A ALA 422.A N GLY 418.A O no hydrogen 3.104 N/A ASP 423.A N THR 419.A O no hydrogen 3.025 N/A ILE 424.A N VAL 420.A O no hydrogen 3.319 N/A HIS 425.A N ILE 421.A O no hydrogen 3.230 N/A ILE 426.A N ALA 422.A O no hydrogen 2.767 N/A ASN 431.A ND2 LYS 428.A O no hydrogen 3.082 N/A ARG 434.A NH2 PRO 460.A O no hydrogen 3.131 N/A ASN 435.A ND2 ASN 549.A OD1 no hydrogen 3.420 N/A ASN 435.A ND2 ALA 550.A O no hydrogen 3.348 N/A THR 436.A N ASP 432.A O no hydrogen 3.011 N/A HIS 439.A ND1 TYR 54.A OH no hydrogen 3.058 N/A CYS 440.A N VAL 541.A O no hydrogen 3.035 N/A LEU 442.A N VAL 539.A O no hydrogen 3.136 N/A ILE 448.A N TYR 451.A O no hydrogen 2.790 N/A TYR 451.A N ILE 448.A O no hydrogen 3.008 N/A THR 452.A N VAL 533.A O no hydrogen 2.789 N/A VAL 453.A N GLN 446.A O no hydrogen 2.823 N/A TYR 454.A N VAL 531.A O no hydrogen 2.851 N/A TYR 454.A OH SER 536.A OG no hydrogen 2.977 N/A TYR 456.A N LEU 529.A O no hydrogen 2.660 N/A ILE 458.A N LEU 527.A O no hydrogen 2.540 N/A TYR 464.A N PRO 551.A O no hydrogen 3.208 N/A GLY 465.A N VAL 511.A O no hydrogen 3.126 N/A ILE 467.A N LEU 509.A O no hydrogen 2.905 N/A ASP 468.A N ASN 544.A O no hydrogen 2.821 N/A TYR 469.A N LEU 507.A O no hydrogen 3.038 N/A SER 470.A N PHE 542.A O no hydrogen 2.853 N/A VAL 471.A N GLU 504.A O no hydrogen 3.084 N/A VAL 472.A N LYS 540.A O no hydrogen 2.711 N/A ASP 474.A N SER 538.A O no hydrogen 2.938 N/A THR 475.A OG1 ASN 477.A O no hydrogen 3.081 N/A ASN 477.A ND2 ASP 535.A OD2 no hydrogen 3.502 N/A GLU 479.A N GLU 478.A OE2 no hydrogen 2.509 N/A LYS 481.A NZ GLU 496.A OE2 no hydrogen 3.331 N/A TRP 482.A NE1 VAL 499.A O no hydrogen 2.786 N/A TYR 483.A N TYR 532.A O no hydrogen 3.062 N/A TYR 483.A OH GLU 496.A OE1 no hydrogen 3.400 N/A CYS 484.A N ILE 495.A O no hydrogen 2.837 N/A GLU 485.A N LYS 530.A O no hydrogen 2.779 N/A VAL 486.A N LEU 493.A O no hydrogen 3.089 N/A ILE 487.A N LYS 528.A O no hydrogen 2.829 N/A GLY 488.A N GLY 491.A O no hydrogen 2.876 N/A ILE 489.A N HIS 524.A NE2 no hydrogen 2.999 N/A HIS 492.A NE2 TYR 593.A OH no hydrogen 2.821 N/A LEU 493.A N VAL 486.A O no hydrogen 2.970 N/A LEU 494.A N GLY 586.A O no hydrogen 3.063 N/A ILE 495.A N CYS 484.A O no hydrogen 2.907 N/A LYS 497.A N TRP 482.A O no hydrogen 3.307 N/A LYS 497.A NZ GLU 504.A OE1 no hydrogen 2.373 N/A LYS 497.A NZ LYS 505.A O no hydrogen 2.920 N/A SER 498.A OG LYS 497.A O no hydrogen 2.672 N/A GLN 500.A NE2 ASN 477.A O no hydrogen 3.366 N/A HIS 501.A N VAL 473.A O no hydrogen 3.002 N/A HIS 501.A ND1 ASP 474.A OD1 no hydrogen 2.729 N/A GLU 504.A N VAL 471.A O no hydrogen 3.137 N/A ILE 506.A N TYR 469.A O no hydrogen 3.010 N/A LEU 509.A N ILE 467.A O no hydrogen 2.872 N/A THR 510.A OG1 ASP 466.A OD2 no hydrogen 2.647 N/A VAL 511.A N GLY 465.A O no hydrogen 2.967 N/A ASN 512.A N VAL 516.A O no hydrogen 3.189 N/A SER 514.A N ASN 512.A OD1 no hydrogen 3.280 N/A GLY 515.A N ASN 512.A O no hydrogen 2.916 N/A VAL 516.A N ASN 512.A OD1 no hydrogen 3.043 N/A THR 517.A N HIS 524.A O no hydrogen 3.116 N/A THR 517.A OG1 THR 510.A O no hydrogen 2.499 N/A SER 518.A OG ASN 523.A OD1 no hydrogen 3.408 N/A PHE 519.A N ARG 522.A O no hydrogen 2.921 N/A ARG 522.A NE ASP 490.A OD2 no hydrogen 3.381 N/A HIS 524.A N THR 517.A O no hydrogen 2.819 N/A HIS 524.A ND1 ARG 522.A O no hydrogen 3.118 N/A ARG 526.A NE ASP 525.A OD2 no hydrogen 3.273 N/A ARG 526.A NH1 GLU 90.A OE2 no hydrogen 3.373 N/A LEU 527.A N ILE 458.A O no hydrogen 2.884 N/A LYS 528.A N ILE 487.A O no hydrogen 3.457 N/A LYS 528.A NZ GLU 455.A OE1 no hydrogen 3.320 N/A LEU 529.A N TYR 456.A O no hydrogen 2.594 N/A LYS 530.A N GLU 485.A O no hydrogen 2.769 N/A LYS 530.A NZ PHE 571.A O no hydrogen 2.841 N/A LYS 530.A NZ LYS 573.A O no hydrogen 3.234 N/A VAL 531.A N TYR 454.A O no hydrogen 2.773 N/A TYR 532.A N TYR 483.A O no hydrogen 2.847 N/A TYR 532.A OH GLU 485.A OE1 no hydrogen 2.555 N/A VAL 533.A N THR 452.A O no hydrogen 3.116 N/A SER 536.A OG TYR 454.A OH no hydrogen 2.977 N/A LEU 537.A N ASP 474.A O no hydrogen 3.008 N/A SER 538.A N ASP 474.A O no hydrogen 3.401 N/A SER 538.A OG ASP 474.A OD2 no hydrogen 3.455 N/A LYS 540.A N VAL 472.A O no hydrogen 2.861 N/A LYS 540.A NZ ASP 53.A OD2 no hydrogen 2.791 N/A PHE 542.A N SER 470.A O no hydrogen 2.667 N/A ARG 543.A N LEU 438.A O no hydrogen 3.272 N/A ARG 543.A NH2 LEU 433.A O no hydrogen 2.848 N/A ASN 544.A N ASP 468.A O no hydrogen 2.986 N/A TRP 545.A NE1 ARG 434.A O no hydrogen 3.107 N/A ILE 546.A N ASP 466.A O no hydrogen 3.012 N/A ARG 552.A NH2 GLU 396.A OE2 no hydrogen 3.025 N/A VAL 553.A N ALA 462.A O no hydrogen 2.523 N/A LYS 556.A NZ SER 514.A O no hydrogen 3.116 N/A MET 557.A N ASP 560.A OD2 no hydrogen 3.242 N/A HIS 561.A N MET 557.A O no hydrogen 3.191 N/A HIS 561.A N PHE 558.A O no hydrogen 3.154 N/A HIS 561.A NE2 SER 228.A OG no hydrogen 3.075 N/A ILE 562.A N PHE 558.A O no hydrogen 3.240 N/A GLY 563.A N ASN 559.A O no hydrogen 3.170 N/A TYR 568.A OH ASP 525.A OD2 no hydrogen 2.388 N/A SER 569.A N ASP 567.A OD1 no hydrogen 3.364 N/A SER 569.A OG ASP 567.A OD1 no hydrogen 3.260 N/A SER 569.A OG ASP 567.A OD2 no hydrogen 3.118 N/A PHE 571.A N TYR 568.A O no hydrogen 3.201 N/A ILE 575.A N TYR 532.A OH no hydrogen 3.195 N/A SER 576.A N THR 599.A OG1 no hydrogen 2.872 N/A SER 576.A OG HIS 579.A ND1 no hydrogen 2.825 N/A HIS 579.A N SER 576.A O no hydrogen 3.171 N/A HIS 579.A ND1 SER 576.A OG no hydrogen 2.825 N/A LEU 580.A N PRO 577.A O no hydrogen 3.206 N/A THR 581.A N ASP 584.A OD2 no hydrogen 3.042 N/A THR 581.A OG1 ASP 584.A OD1 no hydrogen 2.997 N/A THR 581.A OG1 ASP 584.A OD2 no hydrogen 3.018 N/A ASP 584.A N THR 581.A O no hydrogen 3.070 N/A GLY 586.A N LEU 494.A O no hydrogen 3.281 N/A HIS 588.A N HIS 492.A O no hydrogen 3.247 N/A HIS 588.A ND1 GLN 592.A OE1 no hydrogen 3.120 N/A HIS 588.A NE2 LEU 585.A O no hydrogen 3.099 N/A TRP 590.A N ASP 490.A O no hydrogen 3.376 N/A TRP 590.A NE1 ILE 489.A O no hydrogen 2.939 N/A GLN 592.A N THR 589.A O no hydrogen 3.289 N/A ASN 597.A N ASN 594.A O no hydrogen 3.352 N/A ASN 597.A ND2 ASN 600.A OD1 no hydrogen 3.593 N/A THR 599.A N ASN 597.A OD1 no hydrogen 3.432 N/A ASN 600.A ND2 HIS 579.A O no hydrogen 2.872 N/A ASN 600.A ND2 ASP 584.A OD2 no hydrogen 3.034 N/A LYS 602.A NZ GLN 592.A O no hydrogen 3.260 N/A LYS 602.A NZ TYR 593.A O no hydrogen 3.026 N/A LYS 602.A NZ ASN 594.A OD1 no hydrogen 3.522 N/A