Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3s9l_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): TYR 3.A N ASP 6.A OD2 no hydrogen 3.234 N/A LEU 7.A N TYR 3.A O no hydrogen 3.031 N/A LEU 7.A N TRP 4.A O no hydrogen 2.589 N/A LYS 8.A N TRP 4.A O no hydrogen 2.726 N/A LYS 8.A NZ ASN 392.A OD1 no hydrogen 3.328 N/A ARG 9.A N ASP 5.A O no hydrogen 3.107 N/A LYS 10.A N ASP 6.A O no hydrogen 3.273 N/A LEU 11.A N LEU 7.A O no hydrogen 2.989 N/A LEU 11.A N LYS 8.A O no hydrogen 3.229 N/A SER 12.A N LYS 8.A O no hydrogen 3.033 N/A GLU 13.A N ARG 9.A O no hydrogen 3.044 N/A LYS 14.A N LYS 10.A O no hydrogen 3.309 N/A LYS 14.A NZ ASP 320.A OD2 no hydrogen 3.043 N/A LEU 15.A N LEU 11.A O no hydrogen 2.933 N/A ASP 16.A N SER 12.A O no hydrogen 2.896 N/A SER 17.A N GLU 13.A O no hydrogen 3.271 N/A SER 17.A OG LYS 14.A O no hydrogen 3.026 N/A THR 18.A N LEU 15.A O no hydrogen 3.013 N/A THR 18.A OG1 LYS 14.A O no hydrogen 2.675 N/A THR 21.A OG1 ASP 19.A OD1 no hydrogen 3.092 N/A SER 22.A N ASP 19.A OD1 no hydrogen 2.803 N/A SER 22.A OG ASP 19.A O no hydrogen 3.010 N/A SER 22.A OG ASP 19.A OD1 no hydrogen 2.620 N/A THR 23.A N PHE 20.A O no hydrogen 2.755 N/A THR 23.A OG1 ASP 19.A O no hydrogen 3.406 N/A ILE 24.A N PHE 20.A O no hydrogen 2.920 N/A LYS 25.A N THR 21.A O no hydrogen 2.873 N/A LEU 26.A N SER 22.A O no hydrogen 3.191 N/A LEU 27.A N THR 23.A O no hydrogen 3.098 N/A ASN 28.A N LYS 25.A O no hydrogen 2.949 N/A TYR 32.A N GLU 29.A O no hydrogen 3.003 N/A ARG 35.A NH1 ARG 289.A O no hydrogen 3.442 N/A ARG 35.A NH2 PRO 294.A O no hydrogen 3.198 N/A GLY 38.A N ASP 42.A OD1 no hydrogen 2.824 N/A SER 39.A N GLU 36.A O no hydrogen 2.755 N/A SER 39.A OG GLU 36.A O no hydrogen 2.730 N/A ASP 42.A N SER 39.A O no hydrogen 3.049 N/A ASP 42.A N SER 39.A OG no hydrogen 2.768 N/A GLU 43.A N SER 39.A O no hydrogen 3.097 N/A ASN 44.A N GLN 40.A O no hydrogen 3.108 N/A LEU 45.A N LYS 41.A O no hydrogen 3.369 N/A ALA 46.A N ASP 42.A O no hydrogen 3.102 N/A LEU 47.A N GLU 43.A O no hydrogen 2.851 N/A TYR 48.A N ASN 44.A O no hydrogen 3.101 N/A VAL 49.A N LEU 45.A O no hydrogen 3.087 N/A GLU 50.A N ALA 46.A O no hydrogen 3.054 N/A ASN 51.A N LEU 47.A O no hydrogen 2.850 N/A GLN 52.A N TYR 48.A O no hydrogen 2.751 N/A PHE 53.A N VAL 49.A O no hydrogen 2.838 N/A ARG 54.A N GLU 50.A O no hydrogen 2.872 N/A GLU 55.A N ASN 51.A O no hydrogen 2.890 N/A PHE 56.A N GLN 52.A O no hydrogen 2.975 N/A LYS 57.A N ARG 54.A O no hydrogen 3.027 N/A SER 59.A OG VAL 272.A O no hydrogen 2.398 N/A LYS 60.A N VAL 272.A O no hydrogen 3.181 N/A ARG 63.A NE GLU 50.A OE1 no hydrogen 2.886 N/A ARG 63.A NH2 GLU 50.A OE1 no hydrogen 2.744 N/A ASP 64.A N ASN 268.A O no hydrogen 2.959 N/A HIS 66.A N ILE 266.A O no hydrogen 3.073 N/A HIS 66.A ND1 SER 195.A O no hydrogen 2.705 N/A LYS 69.A N ASP 187.A OD2 no hydrogen 2.986 N/A ILE 70.A N LYS 262.A O no hydrogen 3.021 N/A GLN 71.A NE2 SER 103.A O no hydrogen 3.343 N/A VAL 72.A N VAL 260.A O no hydrogen 3.046 N/A LYS 73.A NZ PRO 96.A O no hydrogen 2.421 N/A LYS 73.A NZ GLY 98.A O no hydrogen 3.396 N/A ALA 76.A N ASP 74.A OD2 no hydrogen 3.271 N/A GLN 77.A N GLN 77.A OE1 no hydrogen 2.795 N/A ASN 78.A ND2 ASN 259.A OD1 no hydrogen 3.127 N/A SER 79.A N THR 256.A O no hydrogen 3.185 N/A VAL 80.A N GLU 94.A O no hydrogen 3.284 N/A ILE 81.A N LYS 254.A O no hydrogen 3.243 N/A VAL 83.A N ASN 252.A O no hydrogen 2.646 N/A ASP 84.A N GLY 87.A O no hydrogen 2.765 N/A VAL 93.A N VAL 80.A O no hydrogen 3.165 N/A GLU 94.A N VAL 80.A O no hydrogen 3.311 N/A TYR 99.A OH GLN 71.A O no hydrogen 2.661 N/A ALA 101.A N GLY 179.A O no hydrogen 2.646 N/A TYR 102.A OH LYS 69.A O no hydrogen 2.648 N/A SER 103.A N GLN 71.A OE1 no hydrogen 2.921 N/A SER 103.A OG VAL 214.A O no hydrogen 3.346 N/A LYS 104.A N ILE 212.A O no hydrogen 3.359 N/A THR 107.A OG1 THR 256.A OG1 no hydrogen 2.725 N/A VAL 108.A N LEU 255.A O no hydrogen 2.729 N/A THR 109.A OG1 VAL 253.A O no hydrogen 3.534 N/A GLY 110.A N VAL 253.A O no hydrogen 2.932 N/A LEU 112.A N THR 247.A OG1 no hydrogen 3.369 N/A VAL 113.A N ILE 134.A O no hydrogen 2.900 N/A HIS 114.A N MET 245.A O no hydrogen 3.067 N/A HIS 114.A NE2 TYR 162.A OH no hydrogen 3.000 N/A ALA 115.A N ILE 136.A O no hydrogen 3.035 N/A ASN 116.A N HIS 114.A ND1 no hydrogen 2.872 N/A ASN 116.A ND2 ASP 122.A OD2 no hydrogen 2.896 N/A PHE 117.A N ASP 122.A OD2 no hydrogen 3.278 N/A GLY 118.A N ALA 115.A O no hydrogen 3.175 N/A PHE 123.A N THR 119.A O no hydrogen 3.046 N/A GLU 124.A N LYS 120.A O no hydrogen 3.435 N/A ASP 125.A N LYS 121.A O no hydrogen 3.318 N/A ASP 125.A N ASP 122.A O no hydrogen 3.330 N/A LEU 126.A N PHE 123.A O no hydrogen 3.271 N/A ASN 131.A ND2 ASN 131.A O no hydrogen 2.072 N/A GLY 132.A N ASN 155.A O no hydrogen 2.871 N/A SER 133.A OG VAL 130.A O no hydrogen 2.895 N/A SER 133.A OG ASN 131.A O no hydrogen 3.556 N/A ILE 134.A N LYS 111.A O no hydrogen 2.832 N/A VAL 135.A N GLY 158.A O no hydrogen 3.054 N/A ILE 136.A N VAL 113.A O no hydrogen 2.835 N/A VAL 137.A N LEU 160.A O no hydrogen 2.609 N/A ARG 138.A N ASN 116.A O no hydrogen 2.704 N/A ARG 138.A NH1 ASN 116.A OD1 no hydrogen 2.845 N/A ARG 138.A NH2 LYS 238.A O no hydrogen 3.370 N/A ALA 139.A N TYR 162.A O no hydrogen 3.293 N/A THR 143.A OG1 GLU 146.A OE1 no hydrogen 2.728 N/A LYS 147.A N THR 143.A O no hydrogen 3.149 N/A LYS 147.A NZ PHE 117.A O no hydrogen 2.501 N/A LYS 147.A NZ ARG 138.A O no hydrogen 2.817 N/A VAL 148.A N PHE 144.A O no hydrogen 3.286 N/A ALA 149.A N ALA 145.A O no hydrogen 2.766 N/A ASN 150.A N GLU 146.A O no hydrogen 2.731 N/A ASN 150.A ND2 GLY 118.A O no hydrogen 3.049 N/A ALA 151.A N LYS 147.A O no hydrogen 3.143 N/A GLU 152.A N VAL 148.A O no hydrogen 2.906 N/A SER 153.A N ALA 149.A O no hydrogen 3.161 N/A SER 153.A OG ALA 149.A O no hydrogen 2.965 N/A LEU 154.A N ALA 151.A O no hydrogen 3.071 N/A ASN 155.A N GLU 152.A O no hydrogen 2.999 N/A ILE 157.A N SER 133.A O no hydrogen 3.175 N/A VAL 159.A N PRO 213.A O no hydrogen 2.989 N/A LEU 160.A N VAL 135.A O no hydrogen 2.836 N/A ILE 161.A N GLN 215.A O no hydrogen 2.924 N/A TYR 162.A N VAL 137.A O no hydrogen 2.953 N/A TYR 162.A OH HIS 114.A NE2 no hydrogen 3.000 N/A GLN 165.A N ASP 240.A OD1 no hydrogen 2.943 N/A GLN 165.A N ASP 240.A OD2 no hydrogen 3.112 N/A THR 166.A N ASP 240.A OD2 no hydrogen 3.034 N/A THR 166.A OG1 ASP 240.A OD2 no hydrogen 2.762 N/A PHE 168.A N ASP 164.A O no hydrogen 3.183 N/A ILE 170.A N PHE 168.A O no hydrogen 2.833 N/A GLU 174.A N ASN 172.A OD1 no hydrogen 2.772 N/A LEU 175.A N ASN 172.A O no hydrogen 3.431 N/A GLY 179.A N TYR 99.A O no hydrogen 3.341 N/A ALA 181.A N ALA 101.A O no hydrogen 3.055 N/A HIS 182.A N HIS 180.A ND1 no hydrogen 3.220 N/A HIS 182.A NE2 SER 206.A OG no hydrogen 2.662 N/A LEU 183.A N GLY 208.A O no hydrogen 2.824 N/A GLY 186.A N GLY 339.A O no hydrogen 2.505 N/A ASP 187.A N GLU 345.A OE1 no hydrogen 3.250 N/A TYR 189.A N ASP 187.A OD1 no hydrogen 2.405 N/A THR 190.A OG1 SER 195.A OG no hydrogen 2.394 N/A PHE 193.A N THR 190.A O no hydrogen 3.233 N/A SER 195.A N GLU 345.A OE2 no hydrogen 2.582 N/A SER 195.A OG THR 190.A OG1 no hydrogen 2.394 N/A SER 195.A OG GLU 345.A OE2 no hydrogen 2.968 N/A THR 199.A N PHE 196.A O no hydrogen 2.941 N/A THR 199.A OG1 PHE 196.A O no hydrogen 2.795 N/A GLN 200.A N ASN 197.A O no hydrogen 2.674 N/A SER 206.A N PRO 188.A O no hydrogen 2.826 N/A SER 206.A OG HIS 182.A NE2 no hydrogen 2.662 N/A GLY 208.A N SER 206.A OG no hydrogen 2.977 N/A LEU 209.A N SER 206.A O no hydrogen 3.418 N/A ASN 211.A N GLU 152.A OE1 no hydrogen 3.147 N/A ASN 211.A N GLU 152.A OE2 no hydrogen 3.180 N/A VAL 214.A N SER 103.A OG no hydrogen 2.620 N/A GLN 215.A N VAL 159.A O no hydrogen 3.063 N/A GLN 215.A NE2 GLY 98.A O no hydrogen 2.636 N/A GLN 215.A NE2 THR 216.A O no hydrogen 2.993 N/A THR 216.A OG1 PHE 177.A O no hydrogen 2.830 N/A ILE 217.A N ILE 161.A O no hydrogen 2.968 N/A SER 218.A N GLU 94.A OE1 no hydrogen 3.294 N/A SER 218.A N GLU 94.A OE2 no hydrogen 3.443 N/A SER 218.A OG GLU 94.A OE2 no hydrogen 2.569 N/A SER 218.A OG ALA 173.A O no hydrogen 3.320 N/A ARG 219.A NH1 ILE 170.A O no hydrogen 3.054 N/A ARG 219.A NH2 ILE 170.A O no hydrogen 2.818 N/A ARG 219.A NH2 VAL 171.A O no hydrogen 2.984 N/A ALA 220.A N ALA 173.A O no hydrogen 3.026 N/A ALA 221.A N SER 218.A OG no hydrogen 3.318 N/A ALA 222.A N SER 218.A O no hydrogen 3.076 N/A GLU 223.A N ARG 219.A O no hydrogen 2.925 N/A LYS 224.A N ALA 220.A O no hydrogen 2.911 N/A LYS 224.A NZ VAL 93.A O no hydrogen 3.518 N/A LEU 225.A N ALA 221.A O no hydrogen 3.195 N/A PHE 226.A N ALA 222.A O no hydrogen 2.807 N/A GLY 227.A N GLU 223.A O no hydrogen 3.067 N/A ASN 228.A N LEU 225.A O no hydrogen 3.174 N/A ASN 228.A ND2 TYR 91.A OH no hydrogen 3.027 N/A ASN 228.A ND2 LYS 224.A O no hydrogen 2.970 N/A MET 229.A N PHE 226.A O no hydrogen 3.026 N/A GLU 230.A N VAL 246.A O no hydrogen 2.578 N/A TRP 237.A N PRO 234.A O no hydrogen 3.369 N/A THR 242.A OG1 GLU 223.A OE2 no hydrogen 3.461 N/A ARG 244.A NH1 SER 241.A O no hydrogen 3.442 N/A ARG 244.A NH1 CYS 243.A O no hydrogen 2.653 N/A MET 245.A N GLY 231.A O no hydrogen 2.575 N/A VAL 246.A N GLU 230.A O no hydrogen 2.983 N/A SER 248.A OG SER 250.A OG no hydrogen 3.291 N/A SER 250.A OG SER 248.A OG no hydrogen 3.291 N/A LYS 251.A N SER 248.A O no hydrogen 3.128 N/A LYS 251.A NZ SER 248.A OG no hydrogen 3.119 N/A ASN 252.A N VAL 83.A O no hydrogen 3.083 N/A LYS 254.A N ILE 81.A O no hydrogen 2.583 N/A THR 256.A N SER 79.A O no hydrogen 3.149 N/A THR 256.A OG1 THR 107.A OG1 no hydrogen 2.725 N/A VAL 257.A N ALA 106.A O no hydrogen 2.819 N/A SER 258.A N ASN 78.A OD1 no hydrogen 2.526 N/A VAL 260.A N VAL 72.A O no hydrogen 3.130 N/A LYS 262.A N ILE 70.A O no hydrogen 3.124 N/A ILE 264.A N VAL 68.A O no hydrogen 3.067 N/A ILE 266.A N HIS 66.A O no hydrogen 2.881 N/A ASN 268.A N ASP 64.A O no hydrogen 2.827 N/A ASN 268.A ND2 GLY 342.A O no hydrogen 3.231 N/A ILE 269.A N SER 332.A O no hydrogen 3.251 N/A PHE 270.A N TRP 62.A O no hydrogen 2.850 N/A GLY 271.A N PHE 330.A O no hydrogen 3.032 N/A VAL 272.A N LYS 60.A O no hydrogen 2.836 N/A ILE 273.A N ILE 328.A O no hydrogen 2.965 N/A LYS 274.A N SER 59.A OG no hydrogen 2.978 N/A GLY 275.A N SER 327.A OG no hydrogen 3.068 N/A PHE 276.A N PRO 324.A O no hydrogen 2.655 N/A GLU 278.A N SER 325.A O no hydrogen 2.652 N/A HIS 281.A ND1 ASP 280.A OD2 no hydrogen 2.864 N/A TYR 282.A N LYS 357.A O no hydrogen 2.873 N/A VAL 283.A N SER 327.A O no hydrogen 3.302 N/A VAL 284.A N THR 360.A O no hydrogen 2.785 N/A VAL 285.A N ILE 329.A O no hydrogen 2.788 N/A GLY 286.A N ILE 362.A O no hydrogen 3.040 N/A ALA 287.A N ALA 331.A O no hydrogen 2.901 N/A GLN 288.A N ASP 365.A OD1 no hydrogen 2.562 N/A GLN 288.A NE2 ASP 290.A O no hydrogen 2.880 N/A GLN 288.A NE2 ASP 337.A OD1 no hydrogen 2.642 N/A ARG 289.A N TRP 333.A O no hydrogen 2.766 N/A ARG 289.A NE ASP 42.A O no hydrogen 3.435 N/A ARG 289.A NH1 LEU 267.A O no hydrogen 3.501 N/A ARG 289.A NH1 SER 332.A O no hydrogen 2.925 N/A ARG 289.A NH1 SER 332.A OG no hydrogen 3.136 N/A ARG 289.A NH2 LEU 267.A O no hydrogen 2.599 N/A ALA 291.A N ARG 35.A O no hydrogen 3.497 N/A ALA 296.A N ASP 451.A O no hydrogen 3.007 N/A ALA 297.A N ASP 451.A OD1 no hydrogen 2.872 N/A ALA 297.A N ASP 451.A OD2 no hydrogen 2.792 N/A LYS 298.A N ASP 451.A OD1 no hydrogen 2.923 N/A SER 299.A N GLY 295.A O no hydrogen 3.396 N/A SER 299.A OG ASP 290.A O no hydrogen 3.501 N/A SER 299.A OG GLY 295.A O no hydrogen 3.198 N/A GLY 300.A N GLY 295.A O no hydrogen 2.772 N/A VAL 301.A N ALA 296.A O no hydrogen 2.781 N/A THR 303.A N SER 299.A O no hydrogen 2.936 N/A THR 303.A OG1 GLN 288.A O no hydrogen 2.736 N/A THR 303.A OG1 SER 299.A O no hydrogen 3.134 N/A ALA 304.A N GLY 300.A O no hydrogen 3.146 N/A LEU 305.A N VAL 301.A O no hydrogen 2.856 N/A LEU 306.A N GLY 302.A O no hydrogen 2.884 N/A LEU 307.A N THR 303.A O no hydrogen 3.132 N/A LYS 308.A N ALA 304.A O no hydrogen 3.085 N/A LYS 308.A NZ GLN 311.A OE1 no hydrogen 3.255 N/A LEU 309.A N LEU 305.A O no hydrogen 2.993 N/A ALA 310.A N LEU 306.A O no hydrogen 2.948 N/A GLN 311.A N LEU 307.A O no hydrogen 3.007 N/A MET 312.A N LYS 308.A O no hydrogen 2.656 N/A PHE 313.A N LEU 309.A O no hydrogen 3.089 N/A SER 314.A N ALA 310.A O no hydrogen 3.154 N/A SER 314.A OG PHE 56.A O no hydrogen 2.520 N/A ASP 315.A N GLN 311.A O no hydrogen 2.948 N/A MET 316.A N MET 312.A O no hydrogen 3.074 N/A VAL 317.A N PHE 313.A O no hydrogen 3.212 N/A VAL 317.A N SER 314.A O no hydrogen 3.249 N/A LEU 318.A N SER 314.A O no hydrogen 2.801 N/A LYS 319.A N ASP 315.A O no hydrogen 2.754 N/A LYS 319.A NZ ASP 315.A OD2 no hydrogen 3.054 N/A ASP 320.A N ASP 315.A O no hydrogen 3.195 N/A PHE 322.A N MET 316.A O no hydrogen 2.484 N/A SER 325.A N THR 482.A O no hydrogen 2.796 N/A ARG 326.A NH1 ASP 484.A O no hydrogen 3.074 N/A ARG 326.A NH2 ASP 484.A O no hydrogen 2.769 N/A SER 327.A N HIS 281.A O no hydrogen 2.950 N/A SER 327.A OG PRO 279.A O no hydrogen 2.530 N/A ILE 328.A N ILE 273.A O no hydrogen 2.961 N/A ILE 329.A N VAL 283.A O no hydrogen 3.047 N/A PHE 330.A N GLY 271.A O no hydrogen 2.775 N/A ALA 331.A N VAL 285.A O no hydrogen 2.616 N/A SER 332.A N ILE 269.A O no hydrogen 2.885 N/A TRP 333.A N ALA 287.A O no hydrogen 3.092 N/A TRP 333.A NE1 TYR 361.A OH no hydrogen 2.902 N/A SER 334.A OG ASP 42.A OD1 no hydrogen 2.713 N/A GLY 336.A N ASP 290.A OD2 no hydrogen 2.614 N/A ASP 337.A N ASP 290.A OD1 no hydrogen 3.057 N/A PHE 338.A N ALA 335.A O no hydrogen 3.103 N/A GLY 339.A N GLY 336.A O no hydrogen 2.853 N/A SER 340.A N GLY 336.A O no hydrogen 3.205 N/A SER 340.A OG ASN 419.A O no hydrogen 3.505 N/A GLY 342.A N SER 334.A O no hydrogen 3.005 N/A THR 344.A N SER 340.A O no hydrogen 2.846 N/A THR 344.A OG1 SER 340.A O no hydrogen 2.994 N/A GLU 345.A N VAL 341.A O no hydrogen 2.948 N/A TRP 346.A N GLY 342.A O no hydrogen 3.404 N/A LEU 347.A N ALA 343.A O no hydrogen 3.029 N/A GLU 348.A N THR 344.A O no hydrogen 2.969 N/A GLY 349.A N GLU 345.A O no hydrogen 2.723 N/A TYR 350.A N TRP 346.A O no hydrogen 2.868 N/A TYR 350.A OH ASP 64.A OD1 no hydrogen 2.737 N/A LEU 354.A N LEU 351.A O no hydrogen 3.023 N/A LYS 357.A N LEU 354.A O no hydrogen 3.228 N/A ALA 358.A N LEU 354.A O no hydrogen 3.446 N/A PHE 359.A N TYR 282.A O no hydrogen 3.206 N/A THR 360.A OG1 PHE 359.A O no hydrogen 2.509 N/A TYR 361.A N PRO 431.A O no hydrogen 2.809 N/A ILE 362.A N VAL 284.A O no hydrogen 2.684 N/A ASN 363.A N VAL 433.A O no hydrogen 3.104 N/A ASN 363.A ND2 TYR 361.A OH no hydrogen 2.844 N/A ASN 363.A ND2 ASP 365.A OD2 no hydrogen 3.115 N/A LEU 364.A N GLY 286.A O no hydrogen 3.045 N/A ASP 365.A N ASN 363.A OD1 no hydrogen 3.222 N/A LEU 369.A N PHE 437.A O no hydrogen 3.449 N/A GLY 370.A N PHE 437.A O no hydrogen 2.855 N/A THR 371.A N GLU 439.A OE1 no hydrogen 3.163 N/A SER 372.A N GLU 439.A OE1 no hydrogen 3.297 N/A SER 372.A OG GLU 439.A OE1 no hydrogen 3.194 N/A SER 372.A OG GLU 439.A OE2 no hydrogen 2.233 N/A LYS 375.A N CYS 436.A O no hydrogen 2.696 N/A SER 377.A N SER 434.A O no hydrogen 2.996 N/A SER 377.A OG GLU 413.A O no hydrogen 2.794 N/A SER 379.A N ALA 432.A O no hydrogen 3.168 N/A SER 379.A OG GLU 562.A OE2 no hydrogen 2.493 N/A LEU 382.A N SER 379.A O no hydrogen 2.640 N/A TYR 383.A N PRO 380.A O no hydrogen 2.673 N/A THR 384.A OG1 ASP 490.A OD2 no hydrogen 2.762 N/A ILE 386.A N LEU 382.A O no hydrogen 2.788 N/A GLU 387.A N TYR 383.A O no hydrogen 2.820 N/A LYS 388.A N THR 384.A O no hydrogen 2.941 N/A THR 389.A N LEU 385.A O no hydrogen 3.302 N/A THR 389.A N ILE 386.A O no hydrogen 2.746 N/A THR 389.A OG1 LEU 385.A O no hydrogen 2.757 N/A MET 390.A N ILE 386.A O no hydrogen 2.740 N/A GLN 391.A N GLU 387.A O no hydrogen 3.316 N/A ASN 392.A N THR 389.A O no hydrogen 3.044 N/A VAL 393.A N THR 389.A O no hydrogen 2.959 N/A HIS 395.A N GLN 400.A O no hydrogen 2.970 N/A VAL 397.A N HIS 395.A ND1 no hydrogen 2.929 N/A LEU 402.A N VAL 393.A O no hydrogen 3.161 N/A SER 410.A OG ASN 407.A O no hydrogen 2.694 N/A LYS 411.A N TRP 408.A O no hydrogen 2.896 N/A THR 416.A OG1 ASP 418.A OD1 no hydrogen 2.616 N/A ASP 418.A N ASP 418.A OD1 no hydrogen 2.578 N/A ASN 419.A N THR 416.A O no hydrogen 3.212 N/A ASN 419.A ND2 SER 434.A OG no hydrogen 3.118 N/A ALA 421.A N ASN 419.A OD1 no hydrogen 2.918 N/A PHE 422.A N ASN 419.A O no hydrogen 3.225 N/A LEU 425.A N ALA 421.A O no hydrogen 3.313 N/A ALA 426.A N PHE 422.A O no hydrogen 2.944 N/A TYR 427.A N PRO 423.A O no hydrogen 2.969 N/A SER 428.A N PRO 423.A O no hydrogen 3.270 N/A ILE 430.A N PHE 424.A O no hydrogen 3.045 N/A VAL 433.A N TYR 361.A O no hydrogen 2.831 N/A SER 434.A N SER 377.A O no hydrogen 3.047 N/A CYS 436.A SG LYS 366.A O no hydrogen 3.443 N/A CYS 436.A SG ALA 367.A O no hydrogen 3.972 N/A PHE 437.A N ALA 367.A O no hydrogen 2.718 N/A ASP 451.A N THR 448.A O no hydrogen 3.196 N/A THR 452.A N MET 450.A O no hydrogen 2.687 N/A THR 452.A OG1 MET 450.A O no hydrogen 3.307 N/A GLU 455.A N THR 452.A OG1 no hydrogen 3.411 N/A LEU 456.A N THR 452.A O no hydrogen 3.153 N/A ILE 457.A N TYR 453.A O no hydrogen 2.857 N/A GLU 458.A N LYS 454.A O no hydrogen 2.986 N/A ARG 459.A N GLU 455.A O no hydrogen 3.086 N/A ILE 460.A N LEU 456.A O no hydrogen 2.898 N/A ASN 464.A ND2 THR 21.A OG1 no hydrogen 3.151 N/A VAL 466.A N GLU 462.A O no hydrogen 3.214 N/A ALA 467.A N LEU 463.A O no hydrogen 2.778 N/A ARG 468.A N ASN 464.A O no hydrogen 2.968 N/A ARG 468.A NH1 GLU 472.A OE2 no hydrogen 2.977 N/A ARG 468.A NH2 SER 12.A O no hydrogen 3.399 N/A ARG 468.A NH2 ASP 16.A OD1 no hydrogen 2.920 N/A ALA 469.A N LYS 465.A O no hydrogen 2.858 N/A ALA 470.A N VAL 466.A O no hydrogen 3.014 N/A ALA 471.A N ALA 467.A O no hydrogen 2.854 N/A GLU 472.A N ARG 468.A O no hydrogen 2.835 N/A VAL 473.A N ALA 469.A O no hydrogen 3.127 N/A ALA 474.A N ALA 470.A O no hydrogen 3.162 N/A GLY 475.A N ALA 471.A O no hydrogen 2.820 N/A GLN 476.A N GLU 472.A O no hydrogen 2.841 N/A PHE 477.A N VAL 473.A O no hydrogen 3.204 N/A VAL 478.A N ALA 474.A O no hydrogen 3.228 N/A ILE 479.A N GLY 475.A O no hydrogen 3.187 N/A LYS 480.A N GLN 476.A O no hydrogen 2.859 N/A LEU 481.A N PHE 477.A O no hydrogen 3.004 N/A THR 482.A N VAL 478.A O no hydrogen 3.061 N/A THR 482.A OG1 VAL 478.A O no hydrogen 2.459 N/A HIS 483.A N ILE 479.A O no hydrogen 2.857 N/A GLU 486.A N ASP 484.A OD2 no hydrogen 3.400 N/A ASN 488.A ND2 LYS 480.A O no hydrogen 2.516 N/A ASP 490.A N LEU 381.A O no hydrogen 3.010 N/A TYR 491.A OH THR 537.A OG1 no hydrogen 2.755 N/A ARG 493.A N ASP 490.A O no hydrogen 2.833 N/A ARG 493.A NH2 THR 384.A OG1 no hydrogen 2.941 N/A TYR 494.A OH GLU 562.A OE1 no hydrogen 2.800 N/A ASN 495.A N GLU 492.A O no hydrogen 3.222 N/A ASN 495.A ND2 GLU 492.A O no hydrogen 2.917 N/A SER 496.A N ARG 493.A O no hydrogen 3.252 N/A LEU 498.A N TYR 494.A O no hydrogen 2.781 N/A LEU 499.A N ASN 495.A O no hydrogen 2.828 N/A SER 500.A N SER 496.A O no hydrogen 2.834 N/A PHE 501.A N GLN 497.A O no hydrogen 3.154 N/A VAL 502.A N LEU 498.A O no hydrogen 2.996 N/A ARG 503.A N LEU 499.A O no hydrogen 2.925 N/A ASP 504.A N SER 500.A O no hydrogen 3.065 N/A LEU 505.A N PHE 501.A O no hydrogen 3.035 N/A ASN 506.A N VAL 502.A O no hydrogen 2.801 N/A ASN 506.A N ARG 503.A O no hydrogen 3.135 N/A ARG 509.A N ASN 506.A O no hydrogen 3.051 N/A ARG 509.A NH1 ASN 506.A O no hydrogen 3.293 N/A ASP 511.A N TYR 508.A O no hydrogen 3.233 N/A ILE 512.A N TYR 508.A O no hydrogen 3.234 N/A LYS 513.A N ARG 509.A O no hydrogen 3.087 N/A GLU 514.A N ALA 510.A O no hydrogen 3.130 N/A MET 515.A N ASP 511.A O no hydrogen 3.239 N/A LEU 517.A N MET 515.A O no hydrogen 2.391 N/A GLN 520.A N SER 518.A OG no hydrogen 3.355 N/A TYR 523.A N LEU 519.A O no hydrogen 3.437 N/A TYR 523.A OH ASN 506.A OD1 no hydrogen 2.541 N/A SER 524.A N GLN 520.A O no hydrogen 3.168 N/A SER 524.A OG GLN 520.A O no hydrogen 3.212 N/A ALA 525.A N TRP 521.A O no hydrogen 2.869 N/A ARG 526.A N LEU 522.A O no hydrogen 3.068 N/A GLY 527.A N TYR 523.A O no hydrogen 2.988 N/A ASP 528.A N SER 524.A O no hydrogen 2.664 N/A PHE 529.A N ALA 525.A O no hydrogen 3.244 N/A PHE 530.A N ARG 526.A O no hydrogen 3.026 N/A ARG 531.A N GLY 527.A O no hydrogen 3.013 N/A ALA 532.A N ASP 528.A O no hydrogen 3.100 N/A THR 533.A N PHE 529.A O no hydrogen 3.093 N/A THR 533.A OG1 PHE 530.A O no hydrogen 2.666 N/A SER 534.A N PHE 530.A O no hydrogen 2.913 N/A SER 534.A OG PHE 530.A O no hydrogen 2.922 N/A ARG 535.A N ARG 531.A O no hydrogen 3.023 N/A LEU 536.A N ALA 532.A O no hydrogen 3.105 N/A THR 537.A N THR 533.A O no hydrogen 2.641 N/A THR 537.A OG1 TYR 491.A OH no hydrogen 2.755 N/A THR 537.A OG1 THR 533.A O no hydrogen 3.069 N/A THR 538.A N SER 534.A O no hydrogen 2.863 N/A THR 538.A OG1 SER 534.A O no hydrogen 3.048 N/A THR 538.A OG1 ARG 535.A O no hydrogen 2.723 N/A ASP 539.A N ARG 535.A O no hydrogen 2.758 N/A PHE 540.A N LEU 536.A O no hydrogen 3.025 N/A PHE 540.A N THR 537.A O no hydrogen 3.105 N/A GLY 541.A N THR 537.A O no hydrogen 2.978 N/A ASN 542.A N THR 538.A O no hydrogen 2.694 N/A LYS 545.A NZ PHE 540.A O no hydrogen 3.166 N/A THR 546.A OG1 GLU 544.A OE2 no hydrogen 2.625 N/A ASP 547.A N GLU 544.A O no hydrogen 2.805 N/A MET 551.A N ASP 547.A O no hydrogen 3.412 N/A LYS 552.A N ARG 548.A O no hydrogen 3.218 N/A LYS 553.A N PHE 549.A O no hydrogen 3.349 N/A LEU 554.A N MET 551.A O no hydrogen 2.925 N/A ASN 555.A N MET 551.A O no hydrogen 2.582 N/A ASN 555.A ND2 VAL 485.A O no hydrogen 2.857 N/A ASP 556.A N LYS 552.A O no hydrogen 2.846 N/A ARG 557.A NH2 ASP 539.A OD1 no hydrogen 3.511 N/A VAL 558.A N LEU 554.A O no hydrogen 3.440 N/A MET 559.A N ASN 555.A O no hydrogen 3.101 N/A ARG 560.A NH1 HIS 564.A NE2 no hydrogen 3.494 N/A VAL 561.A N VAL 558.A O no hydrogen 3.167 N/A HIS 564.A N ARG 560.A O no hydrogen 2.930 N/A PHE 565.A N GLU 562.A O no hydrogen 3.073 N/A LEU 566.A N TYR 563.A O no hydrogen 2.882 N/A SER 567.A N ARG 578.A O no hydrogen 2.961 N/A SER 571.A OG GLU 574.A OE2 no hydrogen 2.741 N/A SER 575.A N SER 571.A O no hydrogen 2.937 N/A ARG 578.A N PRO 576.A O no hydrogen 2.758 N/A ARG 578.A NH1 SER 567.A O no hydrogen 3.477 N/A HIS 579.A N ALA 426.A O no hydrogen 3.122 N/A HIS 579.A NE2 GLU 562.A OE1 no hydrogen 2.836 N/A VAL 580.A N PHE 565.A O no hydrogen 2.824 N/A PHE 581.A N HIS 579.A ND1 no hydrogen 2.973 N/A TRP 582.A NE1 TYR 494.A OH no hydrogen 3.130 N/A GLY 583.A N HIS 579.A O no hydrogen 2.730 N/A SER 584.A N PHE 577.A O no hydrogen 3.241 N/A HIS 587.A NE2 PHE 577.A O no hydrogen 2.963 N/A THR 588.A OG1 GLY 585.A O no hydrogen 3.130 N/A LEU 589.A N VAL 580.A O no hydrogen 2.862 N/A ALA 591.A N THR 588.A OG1 no hydrogen 3.354 N/A LEU 592.A N THR 588.A O no hydrogen 3.266 N/A LEU 593.A N LEU 589.A O no hydrogen 3.392 N/A GLU 594.A N PRO 590.A O no hydrogen 2.728 N/A ASN 595.A N ALA 591.A O no hydrogen 2.951 N/A ASN 595.A ND2 ASN 607.A O no hydrogen 3.226 N/A LEU 596.A N LEU 592.A O no hydrogen 3.216 N/A LYS 597.A N LEU 593.A O no hydrogen 2.919 N/A LYS 597.A NZ TYR 508.A OH no hydrogen 3.107 N/A LEU 598.A N ASN 595.A O no hydrogen 3.261 N/A ARG 599.A N LEU 596.A O no hydrogen 2.946 N/A ARG 599.A NH2 GLU 514.A OE1 no hydrogen 3.238 N/A LYS 600.A N LYS 597.A O no hydrogen 3.306 N/A ASN 602.A N ARG 599.A O no hydrogen 3.270 N/A THR 609.A OG1 ASN 607.A OD1 no hydrogen 2.484 N/A LEU 610.A N ASN 607.A OD1 no hydrogen 3.056 N/A PHE 611.A N ASN 607.A O no hydrogen 3.119 N/A ARG 612.A N GLU 608.A O no hydrogen 2.921 N/A ARG 612.A NE GLU 608.A OE2 no hydrogen 3.307 N/A ARG 612.A NH1 GLY 516.A O no hydrogen 3.440 N/A ARG 612.A NH2 GLU 608.A OE2 no hydrogen 3.087 N/A ASN 613.A N LEU 610.A O no hydrogen 3.136 N/A ASN 613.A ND2 THR 609.A O no hydrogen 2.795 N/A GLN 614.A N LEU 610.A O no hydrogen 2.761 N/A LEU 615.A N PHE 611.A O no hydrogen 2.725 N/A ALA 616.A N ARG 612.A O no hydrogen 3.101 N/A LEU 617.A N ASN 613.A O no hydrogen 2.931 N/A ALA 618.A N GLN 614.A O no hydrogen 3.201 N/A THR 619.A N LEU 615.A O no hydrogen 2.884 N/A THR 619.A OG1 LEU 615.A O no hydrogen 2.914 N/A TRP 620.A N ALA 616.A O no hydrogen 3.409 N/A THR 621.A N LEU 617.A O no hydrogen 3.194 N/A THR 621.A OG1 LEU 617.A O no hydrogen 2.493 N/A ILE 622.A N ALA 618.A O no hydrogen 2.911 N/A GLN 623.A N THR 619.A O no hydrogen 2.861 N/A GLN 623.A NE2 ASP 528.A OD1 no hydrogen 3.238 N/A GLY 624.A N TRP 620.A O no hydrogen 2.226 N/A ALA 625.A N THR 621.A O no hydrogen 3.121 N/A ALA 626.A N ILE 622.A O no hydrogen 3.249 N/A ALA 626.A N GLN 623.A O no hydrogen 3.269 N/A ASN 627.A N GLN 623.A O no hydrogen 3.044 N/A ASN 627.A ND2 GLN 623.A OE1 no hydrogen 3.234 N/A ALA 628.A N GLY 624.A O no hydrogen 3.205 N/A SER 630.A OG ASN 627.A O no hydrogen 2.842 N/A GLY 631.A N SER 630.A OG no hydrogen 2.638 N/A