Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 2q1f_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLN 2.A NE2 VAL 4.A O no hydrogen 3.106 N/A ARG 8.A N ASP 6.A OD1 no hydrogen 2.802 N/A ARG 8.A NE ASP 6.A OD1 no hydrogen 2.899 N/A ARG 8.A NH2 ASP 6.A OD2 no hydrogen 3.036 N/A SER 10.A OG GLU 12.A OE1 no hydrogen 3.518 N/A SER 10.A OG ASP 36.A OD1 no hydrogen 2.577 N/A SER 10.A OG ASP 36.A OD2 no hydrogen 3.079 N/A ILE 20.A N PRO 17.A O no hydrogen 3.143 N/A THR 21.A N GLU 52.A O no hydrogen 2.802 N/A VAL 23.A N ARG 50.A O no hydrogen 2.895 N/A GLN 24.A NE2 PRO 47.A O no hydrogen 3.585 N/A SER 25.A OG VAL 23.A O no hydrogen 2.981 N/A SER 25.A OG ARG 50.A O no hydrogen 3.202 N/A GLN 26.A N THR 44.A O no hydrogen 2.839 N/A GLY 28.A N GLU 42.A O no hydrogen 3.081 N/A SER 30.A N SER 40.A O no hydrogen 2.897 N/A ALA 32.A N SER 30.A OG no hydrogen 3.094 N/A HIS 33.A NE2 GLU 81.A OE2 no hydrogen 2.846 N/A TYR 34.A OH GLY 242.A O no hydrogen 3.245 N/A LYS 35.A N ASP 145.A OD1 no hydrogen 2.809 N/A LYS 35.A NZ GLN 306.A O no hydrogen 2.891 N/A ASP 36.A N ASP 145.A OD1 no hydrogen 2.986 N/A LYS 38.A N GLU 12.A OE1 no hydrogen 3.244 N/A LYS 38.A N GLU 12.A OE2 no hydrogen 2.887 N/A HIS 39.A N GLU 12.A OE1 no hydrogen 3.025 N/A SER 40.A N SER 30.A O no hydrogen 2.878 N/A SER 40.A OG HIS 33.A O no hydrogen 2.691 N/A LEU 41.A N ILE 144.A O no hydrogen 2.789 N/A GLU 42.A N GLY 28.A O no hydrogen 2.726 N/A TRP 43.A N LEU 142.A O no hydrogen 2.832 N/A TRP 43.A NE1 SER 25.A OG no hydrogen 3.318 N/A THR 44.A N GLN 26.A O no hydrogen 3.003 N/A PHE 45.A N GLY 140.A O no hydrogen 3.021 N/A GLU 46.A N GLN 24.A O no hydrogen 3.251 N/A ASN 48.A N PRO 136.A O no hydrogen 2.981 N/A GLY 49.A N GLU 46.A O no hydrogen 3.028 N/A ARG 50.A N VAL 23.A O no hydrogen 3.008 N/A LEU 51.A N ILE 133.A O no hydrogen 3.254 N/A GLU 52.A N THR 21.A O no hydrogen 2.793 N/A LEU 53.A N LEU 131.A O no hydrogen 2.802 N/A ARG 54.A N CYS 19.A O no hydrogen 2.743 N/A ARG 54.A NH2 GLU 52.A OE2 no hydrogen 3.385 N/A LYS 55.A NZ GLU 7.A O no hydrogen 2.960 N/A LYS 58.A N ASP 56.A OD1 no hydrogen 3.257 N/A LYS 61.A N GLU 127.A OE1 no hydrogen 2.698 N/A LYS 62.A N GLU 119.A OE2 no hydrogen 2.963 N/A THR 65.A N ASP 63.A OD2 no hydrogen 3.063 N/A THR 65.A OG1 ASP 63.A OD1 no hydrogen 3.022 N/A THR 65.A OG1 ASP 63.A OD2 no hydrogen 2.762 N/A GLY 66.A N ASP 63.A O no hydrogen 3.283 N/A ASP 68.A N ASP 63.A OD1 no hydrogen 2.915 N/A TYR 70.A N ASP 68.A OD2 no hydrogen 3.087 N/A TYR 70.A OH GLU 254.A OE1 no hydrogen 2.545 N/A TYR 70.A OH GLU 254.A OE2 no hydrogen 3.350 N/A LEU 71.A N VAL 153.A O no hydrogen 2.978 N/A ALA 73.A N THR 151.A O no hydrogen 2.809 N/A PHE 74.A N VAL 116.A O no hydrogen 2.748 N/A ILE 75.A N ILE 148.A O no hydrogen 3.124 N/A VAL 76.A N ALA 114.A O no hydrogen 3.039 N/A TRP 77.A N ASP 145.A O no hydrogen 3.028 N/A ILE 78.A N ARG 112.A O no hydrogen 2.818 N/A TYR 79.A N PHE 143.A O no hydrogen 2.678 N/A TYR 79.A OH ASP 305.A OD1 no hydrogen 2.664 N/A TYR 79.A OH ASP 305.A OD2 no hydrogen 3.328 N/A ASN 80.A N GLY 110.A O no hydrogen 3.142 N/A ASN 80.A ND2 GLN 82.A O no hydrogen 3.002 N/A GLN 84.A N ILE 106.A O no hydrogen 3.102 N/A GLN 84.A NE2 LYS 139.A O no hydrogen 3.370 N/A ALA 86.A N GLN 84.A O no hydrogen 2.684 N/A ILE 88.A N PHE 104.A O no hydrogen 2.770 N/A GLU 89.A N VAL 134.A O no hydrogen 2.953 N/A PHE 90.A N PHE 102.A O no hydrogen 2.847 N/A GLU 91.A N ARG 132.A O no hydrogen 2.710 N/A PHE 92.A N ALA 100.A O no hydrogen 2.818 N/A LEU 93.A N GLU 130.A O no hydrogen 2.998 N/A LYS 94.A N ARG 97.A O no hydrogen 3.177 N/A LYS 94.A NZ GLU 127.A O no hydrogen 3.245 N/A ARG 97.A NH2 GLU 126.A OE1 no hydrogen 2.615 N/A LYS 98.A NZ SER 101.A OG no hydrogen 2.854 N/A CYS 99.A N PHE 92.A O no hydrogen 2.903 N/A CYS 99.A SG ARG 97.A O no hydrogen 3.793 N/A CYS 99.A SG GLU 126.A OE2 no hydrogen 3.568 N/A ALA 100.A N PHE 92.A O no hydrogen 3.420 N/A SER 101.A N GLN 122.A O no hydrogen 3.025 N/A PHE 102.A N PHE 90.A O no hydrogen 2.897 N/A PHE 104.A N ILE 88.A O no hydrogen 2.726 N/A GLY 105.A N GLN 163.A O no hydrogen 3.087 N/A ILE 106.A N ALA 86.A O no hydrogen 3.087 N/A ASN 107.A ND2 ASP 85.A OD1 no hydrogen 3.510 N/A GLY 110.A N ASN 80.A O no hydrogen 2.939 N/A TRP 111.A N ASP 305.A O no hydrogen 2.869 N/A ARG 112.A N ILE 78.A O no hydrogen 2.906 N/A ARG 112.A NE TRP 111.A O no hydrogen 2.835 N/A ALA 114.A N VAL 76.A O no hydrogen 2.941 N/A VAL 116.A N PHE 74.A O no hydrogen 2.828 N/A CYS 117.A N ASP 121.A OD2 no hydrogen 3.080 N/A CYS 117.A SG GLN 158.A OE1 no hydrogen 3.430 N/A TYR 118.A N SER 72.A O no hydrogen 3.117 N/A TYR 118.A OH THR 149.A O no hydrogen 2.737 N/A ARG 120.A NE ASP 121.A OD1 no hydrogen 2.887 N/A ARG 120.A NE ASP 121.A OD2 no hydrogen 3.498 N/A ARG 120.A NH1 ALA 155.A O no hydrogen 2.580 N/A ARG 120.A NH2 ASP 121.A OD2 no hydrogen 3.182 N/A ARG 120.A NH2 ALA 155.A O no hydrogen 3.359 N/A ASP 121.A N CYS 117.A O no hydrogen 3.000 N/A GLN 122.A N SER 101.A O no hydrogen 2.819 N/A THR 124.A N CYS 99.A O no hydrogen 2.958 N/A ASN 129.A N LEU 93.A O no hydrogen 3.020 N/A LEU 131.A N LEU 53.A O no hydrogen 2.836 N/A ARG 132.A N GLU 91.A O no hydrogen 2.765 N/A ILE 133.A N LEU 51.A O no hydrogen 2.919 N/A VAL 134.A N GLU 89.A O no hydrogen 2.793 N/A ALA 135.A N GLY 49.A O no hydrogen 3.027 N/A GLY 140.A N PHE 45.A O no hydrogen 3.364 N/A LEU 142.A N TRP 43.A O no hydrogen 3.125 N/A PHE 143.A N TYR 79.A O no hydrogen 2.843 N/A ILE 144.A N LEU 41.A O no hydrogen 2.790 N/A ASP 145.A N TRP 77.A O no hydrogen 3.086 N/A LEU 147.A N PHE 9.A O no hydrogen 2.972 N/A ILE 148.A N ILE 75.A O no hydrogen 2.855 N/A THR 149.A N ARG 8.A O no hydrogen 3.188 N/A THR 149.A OG1 LEU 57.A O no hydrogen 3.005 N/A THR 151.A N ALA 73.A O no hydrogen 3.156 N/A VAL 153.A N LEU 71.A O no hydrogen 2.887 N/A ARG 156.A N ASP 154.A OD1 no hydrogen 3.138 N/A ARG 156.A NE ASP 154.A OD1 no hydrogen 3.074 N/A ARG 156.A NE ASP 154.A OD2 no hydrogen 3.395 N/A ARG 156.A NH2 ASP 154.A OD2 no hydrogen 2.726 N/A GLN 157.A N ASP 154.A O no hydrogen 3.473 N/A THR 159.A N GLY 315.A O no hydrogen 3.100 N/A THR 159.A OG1 ALA 160.A O no hydrogen 3.236 N/A THR 159.A OG1 LEU 176.A O no hydrogen 3.498 N/A LEU 162.A N GLY 311.A O no hydrogen 3.326 N/A GLN 163.A N ASP 161.A OD2 no hydrogen 2.794 N/A GLN 163.A NE2 GLY 311.A O no hydrogen 2.916 N/A VAL 164.A N ASP 161.A OD2 no hydrogen 3.104 N/A VAL 167.A N VAL 164.A O no hydrogen 3.434 N/A ASN 168.A N ASP 121.A OD1 no hydrogen 2.945 N/A ASN 168.A ND2 ARG 156.A O no hydrogen 3.166 N/A ASN 168.A ND2 GLN 158.A O no hydrogen 3.159 N/A THR 171.A N ASN 168.A O no hydrogen 3.342 N/A ASN 173.A N THR 171.A OG1 no hydrogen 3.223 N/A TRP 175.A N ASN 173.A OD1 no hydrogen 3.360 N/A LEU 176.A N ASN 173.A O no hydrogen 2.954 N/A LYS 180.A NZ ALA 169.A O no hydrogen 3.470 N/A HIS 181.A N VAL 177.A O no hydrogen 3.039 N/A SER 182.A N LEU 178.A O no hydrogen 3.110 N/A SER 182.A N TYR 179.A O no hydrogen 3.185 N/A SER 182.A OG TYR 179.A O no hydrogen 2.648 N/A LEU 183.A N LYS 180.A O no hydrogen 3.451 N/A LEU 184.A N HIS 181.A O no hydrogen 3.347 N/A THR 191.A OG1 PRO 192.A O no hydrogen 3.563 N/A GLN 197.A N SER 194.A OG no hydrogen 3.292 N/A GLN 197.A NE2 PRO 192.A O no hydrogen 3.538 N/A ARG 198.A N SER 194.A O no hydrogen 2.819 N/A GLN 199.A N ASP 195.A O no hydrogen 3.086 N/A GLU 200.A N LYS 196.A O no hydrogen 3.014 N/A LEU 202.A N GLN 199.A O no hydrogen 3.062 N/A LEU 203.A N GLU 200.A O no hydrogen 2.955 N/A LYS 205.A N LYS 201.A O no hydrogen 3.249 N/A ARG 206.A N LEU 202.A O no hydrogen 2.943 N/A ARG 206.A NH1 LEU 444.A O no hydrogen 3.011 N/A ARG 206.A NH1 SER 446.A O no hydrogen 2.776 N/A ARG 206.A NH2 SER 446.A O no hydrogen 3.522 N/A PHE 207.A N LEU 203.A O no hydrogen 2.818 N/A ARG 208.A N GLU 204.A O no hydrogen 2.847 N/A ARG 208.A NH1 ASN 282.A OD1 no hydrogen 2.900 N/A ARG 208.A NH2 ASN 282.A OD1 no hydrogen 3.357 N/A ASP 209.A N LYS 205.A O no hydrogen 2.938 N/A THR 212.A OG1 GLN 528.A OE1 no hydrogen 2.737 N/A LYS 213.A NZ GLY 214.A O no hydrogen 3.391 N/A GLU 220.A N THR 217.A OG1 no hydrogen 3.108 N/A ALA 221.A N THR 217.A O no hydrogen 2.976 N/A GLU 222.A N GLU 218.A O no hydrogen 3.019 N/A THR 223.A N LYS 219.A O no hydrogen 3.022 N/A THR 223.A OG1 LYS 219.A O no hydrogen 2.976 N/A ILE 224.A N GLU 220.A O no hydrogen 3.131 N/A ARG 225.A N ALA 221.A O no hydrogen 3.173 N/A LYS 226.A N GLU 222.A O no hydrogen 3.091 N/A LYS 227.A N THR 223.A O no hydrogen 3.007 N/A TYR 228.A N ILE 224.A O no hydrogen 2.935 N/A ASP 229.A N ARG 225.A O no hydrogen 3.068 N/A TYR 231.A N TYR 228.A O no hydrogen 3.275 N/A GLN 232.A N ASP 229.A O no hydrogen 3.084 N/A THR 234.A N SER 241.A O no hydrogen 2.901 N/A TYR 235.A OH ASP 301.A OD2 no hydrogen 2.821 N/A LYS 236.A N GLN 239.A O no hydrogen 2.830 N/A GLN 239.A N LYS 236.A O no hydrogen 2.796 N/A SER 241.A N THR 234.A O no hydrogen 2.979 N/A VAL 243.A N TYR 231.A O no hydrogen 2.817 N/A PHE 246.A N ILE 267.A O no hydrogen 3.038 N/A SER 250.A N VAL 247.A O no hydrogen 3.276 N/A SER 250.A OG VAL 247.A O no hydrogen 3.213 N/A SER 250.A OG LYS 261.A O no hydrogen 2.999 N/A GLU 251.A N ARG 248.A O no hydrogen 2.980 N/A ALA 252.A N ALA 249.A O no hydrogen 3.419 N/A TYR 253.A N SER 250.A O no hydrogen 3.019 N/A ARG 255.A NH1 ASP 68.A OD1 no hydrogen 3.059 N/A ARG 255.A NH2 ASP 68.A OD1 no hydrogen 3.478 N/A ARG 255.A NH2 ASP 68.A OD2 no hydrogen 2.945 N/A TRP 259.A NE1 SER 250.A O no hydrogen 2.840 N/A LYS 261.A NZ ASP 262.A OD2 no hydrogen 3.099 N/A ASP 262.A N ASP 260.A OD2 no hydrogen 3.283 N/A LYS 265.A N ASP 262.A O no hydrogen 3.073 N/A ILE 267.A N LEU 263.A O no hydrogen 3.159 N/A ARG 269.A NH2 TYR 322.A O no hydrogen 3.042 N/A TYR 271.A OH HIS 302.A ND1 no hydrogen 3.322 N/A ASP 273.A N ARG 269.A O no hydrogen 2.858 N/A LEU 274.A N ALA 270.A O no hydrogen 3.047 N/A ARG 276.A N ASP 273.A O no hydrogen 2.977 N/A ARG 276.A NH1 GLU 220.A OE2 no hydrogen 3.357 N/A ILE 277.A N LEU 274.A O no hydrogen 2.799 N/A VAL 279.A N LYS 275.A O no hydrogen 2.774 N/A ALA 280.A N ARG 276.A O no hydrogen 3.070 N/A TYR 281.A N ILE 277.A O no hydrogen 2.920 N/A ASN 282.A N ALA 278.A O no hydrogen 3.282 N/A ASN 282.A ND2 ALA 278.A O no hydrogen 2.708 N/A ASN 282.A ND2 LEU 333.A O no hydrogen 3.117 N/A ASN 283.A N VAL 279.A O no hydrogen 3.057 N/A ASN 283.A N ALA 280.A O no hydrogen 3.306 N/A SER 284.A N TYR 281.A O no hydrogen 3.291 N/A SER 284.A OG ALA 280.A O no hydrogen 2.845 N/A SER 288.A N GLU 285.A O no hydrogen 3.133 N/A SER 288.A OG GLU 285.A O no hydrogen 2.571 N/A ARG 291.A NH1 SER 284.A O no hydrogen 3.211 N/A LYS 292.A N SER 288.A O no hydrogen 3.195 N/A GLU 293.A N PRO 289.A O no hydrogen 2.879 N/A ARG 294.A NH1 GLU 339.A OE1 no hydrogen 3.436 N/A ARG 294.A NH2 GLU 340.A OE2 no hydrogen 3.291 N/A ARG 295.A N LYS 292.A O no hydrogen 2.972 N/A LYS 296.A N GLU 293.A O no hydrogen 2.865 N/A LYS 296.A NZ GLU 293.A OE1 no hydrogen 2.930 N/A LEU 298.A N ARG 294.A O no hydrogen 3.217 N/A ALA 299.A N ARG 295.A O no hydrogen 3.110 N/A TYR 300.A OH GLU 345.A OE2 no hydrogen 2.954 N/A ASP 301.A N LEU 298.A O no hydrogen 2.776 N/A HIS 302.A N ALA 299.A O no hydrogen 3.185 N/A THR 304.A N TYR 300.A O no hydrogen 3.004 N/A THR 304.A OG1 TYR 300.A O no hydrogen 2.690 N/A ASP 305.A N ASP 301.A O no hydrogen 2.920 N/A GLN 306.A N HIS 302.A O no hydrogen 2.794 N/A GLY 307.A N ILE 303.A O no hydrogen 3.266 N/A GLY 307.A N THR 304.A O no hydrogen 3.221 N/A VAL 308.A N ILE 303.A O no hydrogen 3.055 N/A ALA 309.A N TYR 353.A OH no hydrogen 3.284 N/A SER 312.A OG GLY 307.A O no hydrogen 2.677 N/A CYS 313.A N ASP 161.A OD1 no hydrogen 3.151 N/A CYS 313.A SG ALA 160.A O no hydrogen 3.673 N/A TRP 314.A NE1 GLY 307.A O no hydrogen 2.924 N/A HIS 318.A ND1 HIS 319.A ND1 no hydrogen 2.915 N/A HIS 318.A NE2 GLU 251.A OE1 no hydrogen 3.189 N/A HIS 318.A NE2 GLU 251.A OE2 no hydrogen 2.716 N/A HIS 319.A ND1 HIS 318.A ND1 no hydrogen 2.915 N/A TYR 320.A N ILE 317.A O no hydrogen 3.198 N/A TYR 320.A OH TYR 353.A O no hydrogen 2.616 N/A SER 323.A OG GLU 268.A OE2 no hydrogen 2.655 N/A VAL 324.A N GLY 321.A O no hydrogen 3.252 N/A LEU 327.A N VAL 324.A O no hydrogen 3.132 N/A ALA 330.A N GLY 326.A O no hydrogen 3.177 N/A TYR 331.A N LEU 327.A O no hydrogen 3.048 N/A PHE 332.A N TYR 328.A O no hydrogen 3.061 N/A LEU 333.A N PRO 329.A O no hydrogen 3.000 N/A LYS 334.A NZ GLU 204.A OE1 no hydrogen 2.783 N/A LYS 334.A NZ LEU 384.A O no hydrogen 2.549 N/A ARG 338.A N LYS 334.A O no hydrogen 3.028 N/A ARG 338.A NE GLU 385.A OE1 no hydrogen 2.826 N/A ARG 338.A NH1 ASP 335.A OD2 no hydrogen 2.982 N/A ARG 338.A NH2 GLU 385.A OE1 no hydrogen 2.878 N/A GLU 339.A N ASP 335.A O no hydrogen 3.041 N/A GLU 340.A N VAL 336.A O no hydrogen 3.082 N/A GLY 341.A N ARG 338.A O no hydrogen 2.868 N/A LYS 342.A N LEU 337.A O no hydrogen 2.745 N/A LYS 342.A NZ ASP 301.A OD1 no hydrogen 3.004 N/A LYS 342.A NZ ASP 301.A OD2 no hydrogen 3.357 N/A ALA 346.A N LYS 342.A O no hydrogen 2.954 N/A GLU 347.A N LEU 343.A O no hydrogen 2.695 N/A ARG 348.A N LEU 344.A O no hydrogen 3.097 N/A THR 349.A N GLU 345.A O no hydrogen 3.126 N/A THR 349.A OG1 ALA 346.A O no hydrogen 3.457 N/A LEU 350.A N ALA 346.A O no hydrogen 3.186 N/A ARG 351.A N GLU 347.A O no hydrogen 3.028 N/A ARG 351.A NE GLU 347.A OE1 no hydrogen 3.280 N/A ARG 351.A NH2 GLU 347.A OE1 no hydrogen 2.848 N/A TRP 352.A N ARG 348.A O no hydrogen 2.936 N/A TRP 352.A NE1 SER 312.A O no hydrogen 3.094 N/A TYR 353.A N THR 349.A O no hydrogen 3.001 N/A TYR 353.A OH GLY 307.A O no hydrogen 3.236 N/A TYR 353.A OH ALA 309.A O no hydrogen 3.138 N/A TYR 353.A OH SER 312.A O no hydrogen 2.657 N/A ALA 354.A N LEU 350.A O no hydrogen 2.951 N/A ILE 355.A N TRP 352.A O no hydrogen 3.269 N/A THR 356.A N ARG 351.A O no hydrogen 3.168 N/A THR 356.A OG1 ARG 351.A O no hydrogen 3.370 N/A THR 356.A OG1 SER 382.A OG no hydrogen 2.802 N/A ASN 357.A ND2 LEU 184.A O no hydrogen 3.065 N/A GLU 358.A N ILE 355.A O no hydrogen 3.116 N/A VAL 359.A N THR 356.A O no hydrogen 2.940 N/A TYR 360.A N ASN 357.A O no hydrogen 3.020 N/A GLY 367.A N TYR 403.A O no hydrogen 2.706 N/A SER 371.A N ASP 369.A O no hydrogen 2.807 N/A THR 374.A N SER 371.A O no hydrogen 3.243 N/A THR 374.A OG1 ASP 370.A O no hydrogen 2.725 N/A GLN 375.A N SER 371.A O no hydrogen 2.786 N/A THR 376.A OG1 PHE 372.A O no hydrogen 3.360 N/A ARG 379.A NE ALA 354.A O no hydrogen 3.010 N/A ARG 379.A NH2 GLU 358.A OE1 no hydrogen 2.528 N/A ILE 380.A N THR 376.A O no hydrogen 3.075 N/A ALA 381.A N THR 377.A O no hydrogen 3.095 N/A SER 382.A N GLY 378.A O no hydrogen 3.038 N/A SER 382.A OG THR 356.A OG1 no hydrogen 2.802 N/A SER 382.A OG GLY 378.A O no hydrogen 3.428 N/A SER 382.A OG ARG 379.A O no hydrogen 2.615 N/A ILE 383.A N ARG 379.A O no hydrogen 3.261 N/A LEU 384.A N ILE 380.A O no hydrogen 3.017 N/A THR 387.A N GLU 385.A O no hydrogen 2.606 N/A THR 387.A OG1 GLU 385.A O no hydrogen 3.346 N/A THR 387.A OG1 GLU 389.A OE1 no hydrogen 3.442 N/A LYS 390.A N THR 387.A O no hydrogen 2.933 N/A LYS 390.A NZ GLU 204.A OE2 no hydrogen 3.282 N/A LYS 390.A NZ ASP 386.A OD1 no hydrogen 2.907 N/A LEU 391.A N THR 387.A O no hydrogen 3.312 N/A GLN 392.A N PRO 388.A O no hydrogen 3.123 N/A GLN 392.A NE2 ILE 188.A O no hydrogen 2.672 N/A TYR 393.A N GLU 389.A O no hydrogen 3.127 N/A TYR 393.A OH ASN 357.A OD1 no hydrogen 2.523 N/A LEU 394.A N LYS 390.A O no hydrogen 2.889 N/A LYS 395.A N LEU 391.A O no hydrogen 2.766 N/A LYS 395.A NZ THR 191.A OG1 no hydrogen 3.240 N/A SER 396.A N GLN 392.A O no hydrogen 3.008 N/A SER 396.A OG GLN 392.A O no hydrogen 2.681 N/A PHE 397.A N TYR 393.A O no hydrogen 2.767 N/A SER 398.A N LEU 394.A O no hydrogen 2.871 N/A SER 398.A OG LEU 450.A O no hydrogen 2.525 N/A ARG 399.A N LYS 395.A O no hydrogen 3.098 N/A ARG 399.A NH1 ASP 187.A OD2 no hydrogen 3.329 N/A ARG 399.A NH1 TYR 360.A O no hydrogen 3.082 N/A ARG 399.A NH2 ASP 187.A OD1 no hydrogen 3.102 N/A ARG 399.A NH2 ASP 187.A OD2 no hydrogen 2.789 N/A TRP 400.A N SER 396.A O no hydrogen 3.099 N/A ILE 401.A N PHE 397.A O no hydrogen 3.031 N/A ASP 402.A N SER 398.A O no hydrogen 2.798 N/A TYR 403.A N ARG 399.A O no hydrogen 3.138 N/A GLY 404.A N TRP 400.A O no hydrogen 3.075 N/A CYS 405.A N ILE 401.A O no hydrogen 2.983 N/A CYS 405.A N ASP 402.A O no hydrogen 3.127 N/A CYS 405.A SG ILE 401.A O no hydrogen 3.398 N/A ARG 406.A N TYR 403.A O no hydrogen 3.280 N/A ARG 406.A NE ASP 402.A OD1 no hydrogen 2.877 N/A ARG 406.A NH2 ASP 402.A OD1 no hydrogen 3.113 N/A ARG 406.A NH2 ASP 402.A OD2 no hydrogen 3.567 N/A ARG 406.A NH2 SER 453.A OG no hydrogen 3.186 N/A ALA 408.A N PHE 415.A O no hydrogen 2.813 N/A LEU 411.A N ILE 903.A O no hydrogen 2.866 N/A ALA 412.A N PRO 409.A O no hydrogen 3.058 N/A SER 414.A OG ILE 368.A O no hydrogen 2.753 N/A LYS 416.A N GLY 420.A O no hydrogen 2.854 N/A LYS 416.A NZ ALA 408.A O no hydrogen 2.988 N/A LYS 416.A NZ GLY 410.A O no hydrogen 2.763 N/A LYS 416.A NZ ALA 412.A O no hydrogen 3.008 N/A GLY 419.A N LYS 416.A O no hydrogen 3.226 N/A GLY 420.A N ASP 418.A OD2 no hydrogen 3.343 N/A ALA 421.A N ASN 427.A OD1 no hydrogen 2.988 N/A PHE 422.A N SER 414.A O no hydrogen 2.738 N/A HIS 423.A N ASN 426.A O no hydrogen 3.032 N/A HIS 424.A ND1 GLU 581.A OE1 no hydrogen 2.942 N/A ARG 425.A NH1 ASP 904.A OD2 no hydrogen 2.639 N/A ASN 426.A N HIS 423.A O no hydrogen 3.517 N/A ASN 427.A N ASN 426.A OD1 no hydrogen 2.646 N/A TYR 428.A N ALA 421.A O no hydrogen 3.039 N/A TYR 428.A OH GLU 581.A OE2 no hydrogen 2.545 N/A TYR 431.A N TYR 428.A O no hydrogen 3.032 N/A ALA 432.A N TYR 428.A O no hydrogen 2.873 N/A VAL 433.A N PRO 429.A O no hydrogen 2.831 N/A GLY 434.A N TYR 431.A O no hydrogen 3.098 N/A GLY 435.A N TYR 431.A O no hydrogen 3.101 N/A LEU 436.A N ALA 432.A O no hydrogen 2.691 N/A ASP 437.A N VAL 433.A O no hydrogen 3.476 N/A ALA 439.A N GLY 435.A O no hydrogen 3.146 N/A THR 440.A N LEU 436.A O no hydrogen 2.688 N/A THR 440.A OG1 HIS 492.A O no hydrogen 3.203 N/A ASN 441.A N ASP 437.A O no hydrogen 3.114 N/A TYR 443.A N THR 440.A O no hydrogen 3.205 N/A LEU 444.A N ASN 441.A O no hydrogen 3.003 N/A SER 446.A N TYR 443.A O no hydrogen 3.019 N/A SER 446.A OG TYR 443.A O no hydrogen 2.614 N/A SER 446.A OG ALA 498.A O no hydrogen 3.501 N/A THR 448.A OG1 SER 446.A O no hydrogen 3.531 N/A THR 448.A OG1 ARG 447.A O no hydrogen 3.049 N/A SER 449.A N GLU 200.A OE2 no hydrogen 2.775 N/A SER 449.A OG GLU 200.A OE1 no hydrogen 2.700 N/A ALA 451.A N THR 448.A O no hydrogen 2.913 N/A SER 453.A N ASP 402.A OD2 no hydrogen 2.826 N/A SER 453.A OG ASP 402.A OD1 no hydrogen 2.619 N/A SER 453.A OG ASP 402.A OD2 no hydrogen 3.178 N/A ALA 456.A N SER 453.A OG no hydrogen 3.415 N/A HIS 457.A N SER 453.A O no hydrogen 3.135 N/A ARG 458.A N GLU 454.A O no hydrogen 2.801 N/A ARG 458.A NE GLU 454.A OE1 no hydrogen 3.012 N/A ARG 458.A NH2 GLU 454.A OE1 no hydrogen 2.732 N/A THR 459.A N LEU 455.A O no hydrogen 3.009 N/A THR 459.A OG1 LEU 455.A O no hydrogen 2.608 N/A VAL 460.A N ALA 456.A O no hydrogen 3.389 N/A LYS 461.A N HIS 457.A O no hydrogen 3.152 N/A LYS 461.A NZ ASP 508.A OD1 no hydrogen 3.006 N/A LYS 461.A NZ ASP 508.A OD2 no hydrogen 2.884 N/A LYS 461.A NZ GLU 510.A OE1 no hydrogen 2.889 N/A ASP 462.A N ARG 458.A O no hydrogen 2.820 N/A VAL 463.A N THR 459.A O no hydrogen 2.938 N/A LEU 464.A N VAL 460.A O no hydrogen 2.954 N/A LEU 465.A N LYS 461.A O no hydrogen 2.917 N/A ALA 466.A N ASP 462.A O no hydrogen 2.901 N/A ARG 467.A NE LEU 465.A O no hydrogen 3.213 N/A ARG 467.A NH1 GLU 544.A OE1 no hydrogen 3.141 N/A ARG 467.A NH2 LEU 465.A O no hydrogen 3.284 N/A PHE 468.A N LEU 465.A O no hydrogen 3.268 N/A PHE 468.A N ALA 466.A O no hydrogen 2.933 N/A TYR 469.A N ALA 466.A O no hydrogen 2.875 N/A CYS 470.A SG LEU 473.A O no hydrogen 3.902 N/A ASN 471.A N ASN 474.A O no hydrogen 3.194 N/A ASN 471.A ND2 ASN 565.A O no hydrogen 3.434 N/A ASN 471.A ND2 SER 567.A OG no hydrogen 2.931 N/A ASN 471.A ND2 LEU 601.A O no hydrogen 3.430 N/A LYS 472.A N VAL 609.A O no hydrogen 2.785 N/A LYS 472.A NZ ARG 516.A O no hydrogen 3.036 N/A LYS 472.A NZ SER 519.A OG no hydrogen 2.844 N/A PHE 475.A N GLY 487.A O no hydrogen 3.033 N/A LEU 477.A N GLN 599.A OE1 no hydrogen 2.849 N/A SER 479.A OG PRO 476.A O no hydrogen 3.208 N/A SER 479.A OG LEU 477.A O no hydrogen 2.943 N/A ARG 481.A N TYR 428.A OH no hydrogen 2.792 N/A ARG 481.A NH1 TYR 431.A OH no hydrogen 2.711 N/A ARG 481.A NH1 GLU 581.A OE2 no hydrogen 2.791 N/A ARG 481.A NH2 TYR 431.A OH no hydrogen 3.000 N/A HIS 482.A N SER 479.A O no hydrogen 3.135 N/A ASP 484.A N HIS 482.A O no hydrogen 2.741 N/A LYS 486.A N ASP 484.A OD2 no hydrogen 2.903 N/A LEU 489.A N LEU 473.A O no hydrogen 2.846 N/A HIS 492.A NE2 ASP 437.A OD1 no hydrogen 2.875 N/A TYR 493.A N PRO 491.A O no hydrogen 2.912 N/A TYR 493.A OH LEU 464.A O no hydrogen 2.604 N/A ALA 494.A N PRO 491.A O no hydrogen 3.322 N/A ILE 497.A N ALA 494.A O no hydrogen 3.308 N/A THR 500.A N GLY 505.A O no hydrogen 3.273 N/A THR 500.A OG1 ASP 502.A OD1 no hydrogen 2.720 N/A GLY 503.A N THR 500.A O no hydrogen 2.810 N/A LYS 504.A N ASP 502.A OD1 no hydrogen 2.967 N/A GLY 505.A N THR 500.A OG1 no hydrogen 2.830 N/A ASP 508.A N ALA 496.A O no hydrogen 2.831 N/A SER 512.A N LYS 509.A O no hydrogen 3.150 N/A SER 512.A OG LYS 509.A O no hydrogen 2.499 N/A ALA 513.A N GLU 510.A O no hydrogen 3.091 N/A TYR 514.A OH GLU 529.A OE1 no hydrogen 2.805 N/A LEU 515.A N ALA 511.A O no hydrogen 3.010 N/A ARG 516.A N SER 512.A O no hydrogen 3.210 N/A ARG 516.A NH1 ASP 546.A OD1 no hydrogen 2.490 N/A LEU 517.A N ALA 513.A O no hydrogen 3.351 N/A LEU 517.A N TYR 514.A O no hydrogen 2.992 N/A VAL 518.A N TYR 514.A O no hydrogen 3.245 N/A SER 519.A N ARG 516.A O no hydrogen 3.323 N/A SER 519.A OG ARG 516.A O no hydrogen 2.633 N/A GLN 528.A NE2 ASN 526.A OD1 no hydrogen 2.893 N/A ARG 530.A N ASN 526.A O no hydrogen 3.068 N/A ARG 530.A NH1 VAL 524.A O no hydrogen 3.444 N/A ARG 530.A NH1 SER 525.A O no hydrogen 2.632 N/A LYS 531.A N ALA 527.A O no hydrogen 3.264 N/A ILE 532.A N GLN 528.A O no hydrogen 3.423 N/A ALA 533.A N GLU 529.A O no hydrogen 2.983 N/A LYS 534.A N ARG 530.A O no hydrogen 3.042 N/A ARG 535.A N LYS 531.A O no hydrogen 3.125 N/A LEU 536.A N ILE 532.A O no hydrogen 2.938 N/A VAL 537.A N ALA 533.A O no hydrogen 3.053 N/A GLU 538.A N LYS 534.A O no hydrogen 3.047 N/A ASN 539.A N ARG 535.A O no hydrogen 2.957 N/A GLY 540.A N VAL 537.A O no hydrogen 3.036 N/A PHE 541.A N LEU 536.A O no hydrogen 3.144 N/A GLU 544.A N SER 512.A O no hydrogen 2.877 N/A GLN 548.A NE2 ASP 546.A O no hydrogen 3.045 N/A GLN 548.A NE2 PRO 547.A O no hydrogen 3.326 N/A GLN 548.A NE2 GLU 564.A O no hydrogen 2.764 N/A GLY 549.A N ARG 562.A O no hydrogen 2.833 N/A ASN 550.A N LYS 668.A O no hydrogen 2.751 N/A ASN 550.A ND2 SER 665.A OG no hydrogen 2.726 N/A LEU 551.A N VAL 560.A O no hydrogen 2.803 N/A LEU 553.A N VAL 558.A O no hydrogen 2.626 N/A TYR 555.A N ASP 418.A OD1 no hydrogen 2.827 N/A TYR 555.A OH ASP 946.A OD1 no hydrogen 2.476 N/A CYS 557.A N GLY 554.A O no hydrogen 3.384 N/A VAL 558.A N LEU 553.A O no hydrogen 3.013 N/A SER 559.A N ALA 570.A O no hydrogen 2.974 N/A SER 559.A OG LEU 551.A O no hydrogen 3.338 N/A VAL 560.A N LEU 551.A O no hydrogen 2.732 N/A GLN 561.A N ALA 568.A O no hydrogen 2.956 N/A ARG 562.A N GLY 549.A O no hydrogen 2.750 N/A ARG 562.A NE PHE 468.A O no hydrogen 2.719 N/A ARG 562.A NH1 ASN 471.A OD1 no hydrogen 3.453 N/A ARG 562.A NH2 PHE 468.A O no hydrogen 3.162 N/A ARG 562.A NH2 CYS 470.A O no hydrogen 2.728 N/A ARG 563.A NE ASP 695.A OD2 no hydrogen 3.037 N/A ARG 563.A NH1 ARG 562.A O no hydrogen 3.086 N/A GLU 564.A N GLN 548.A OE1 no hydrogen 3.066 N/A ASN 565.A ND2 ALA 603.A O no hydrogen 2.755 N/A TRP 566.A N ARG 563.A O no hydrogen 3.147 N/A SER 567.A N LEU 601.A O no hydrogen 2.867 N/A ALA 568.A N GLN 561.A O no hydrogen 2.875 N/A VAL 569.A N GLN 599.A O no hydrogen 2.971 N/A ALA 570.A N SER 559.A O no hydrogen 2.742 N/A ARG 571.A N SER 597.A O no hydrogen 3.163 N/A ARG 571.A NH1 ALA 579.A O no hydrogen 2.870 N/A ARG 571.A NH2 ALA 579.A O no hydrogen 2.946 N/A GLY 572.A N CYS 557.A O no hydrogen 3.077 N/A HIS 573.A ND1 ALA 594.A O no hydrogen 3.048 N/A SER 574.A N LEU 577.A O no hydrogen 3.174 N/A ARG 575.A N GLU 658.A O no hydrogen 2.845 N/A ARG 575.A NE TYR 576.A OH no hydrogen 3.288 N/A ARG 575.A NH1 GLY 881.A O no hydrogen 3.290 N/A ARG 575.A NH2 TYR 576.A OH no hydrogen 3.457 N/A ARG 575.A NH2 TYR 879.A O no hydrogen 3.229 N/A ARG 575.A NH2 GLY 881.A O no hydrogen 2.933 N/A TYR 576.A N SER 574.A OG no hydrogen 3.107 N/A TYR 576.A OH ASP 875.A OD2 no hydrogen 2.693 N/A TYR 576.A OH TYR 879.A O no hydrogen 3.398 N/A LEU 577.A N SER 574.A OG no hydrogen 3.209 N/A TRP 578.A NE1 HIS 424.A O no hydrogen 2.815 N/A ALA 579.A N LEU 654.A O no hydrogen 2.855 N/A HIS 582.A N GLU 653.A O no hydrogen 2.862 N/A HIS 582.A ND1 ASN 587.A O no hydrogen 2.684 N/A TYR 583.A N HIS 586.A O no hydrogen 3.130 N/A HIS 586.A N TYR 583.A O no hydrogen 3.224 N/A ASN 587.A ND2 GLU 581.A O no hydrogen 2.900 N/A LEU 588.A N GLN 765.A O no hydrogen 3.008 N/A TYR 592.A OH ILE 632.A O no hydrogen 2.641 N/A LEU 593.A N GLY 590.A O no hydrogen 3.192 N/A HIS 595.A N TYR 592.A O no hydrogen 2.965 N/A SER 597.A N ARG 571.A O no hydrogen 3.091 N/A SER 597.A OG LEU 593.A O no hydrogen 2.892 N/A LEU 598.A N PRO 627.A O no hydrogen 2.795 N/A GLN 599.A N VAL 569.A O no hydrogen 3.076 N/A LEU 601.A N SER 567.A O no hydrogen 2.868 N/A THR 602.A N SER 614.A OG no hydrogen 2.942 N/A GLN 607.A N PRO 604.A O no hydrogen 2.922 N/A SER 614.A N THR 610.A O no hydrogen 2.765 N/A SER 614.A OG THR 602.A O no hydrogen 3.336 N/A SER 614.A OG THR 610.A O no hydrogen 2.899 N/A GLY 615.A N THR 612.A O no hydrogen 3.364 N/A TRP 616.A N PRO 611.A O no hydrogen 2.747 N/A GLN 617.A NE2 GLU 619.A O no hydrogen 3.034 N/A PHE 621.A N GLN 618.A O no hydrogen 3.233 N/A TRP 623.A NE1 ARG 764.A O no hydrogen 3.066 N/A ASN 624.A N ASP 622.A OD2 no hydrogen 3.211 N/A ASN 624.A ND2 ASP 622.A OD2 no hydrogen 3.300 N/A ASN 624.A ND2 LEU 634.A O no hydrogen 3.006 N/A ARG 625.A N ASP 622.A O no hydrogen 3.066 N/A ARG 625.A NE GLU 713.A OE2 no hydrogen 2.865 N/A ARG 625.A NH1 GLU 756.A OE1 no hydrogen 2.850 N/A ARG 625.A NH2 GLU 713.A OE1 no hydrogen 3.223 N/A ARG 625.A NH2 GLU 756.A OE2 no hydrogen 3.487 N/A GLY 628.A N THR 715.A O no hydrogen 2.837 N/A VAL 629.A N ILE 626.A O no hydrogen 3.083 N/A SER 631.A N GLU 713.A O no hydrogen 2.858 N/A SER 631.A OG ASN 624.A O no hydrogen 2.847 N/A HIS 633.A N PRO 711.A O no hydrogen 2.904 N/A HIS 633.A NE2 ASP 622.A OD1 no hydrogen 2.826 N/A LEU 634.A N ASN 624.A OD1 no hydrogen 2.549 N/A LEU 638.A N PRO 635.A O no hydrogen 2.820 N/A LEU 639.A N PRO 635.A O no hydrogen 2.926 N/A LYS 640.A N LEU 636.A O no hydrogen 2.855 N/A ALA 641.A N LEU 588.A O no hydrogen 2.796 N/A ASN 642.A N TYR 681.A OH no hydrogen 2.877 N/A ASN 645.A ND2 ASP 647.A O no hydrogen 3.519 N/A ASN 645.A ND2 SER 650.A O no hydrogen 2.773 N/A ASN 645.A ND2 GLY 651.A O no hydrogen 3.162 N/A PHE 649.A N ASP 647.A OD1 no hydrogen 3.270 N/A SER 650.A OG ASP 647.A OD1 no hydrogen 3.030 N/A GLY 651.A N GLU 652.A OE2 no hydrogen 3.016 N/A GLU 653.A N HIS 582.A O no hydrogen 2.842 N/A TYR 655.A OH ARG 895.A O no hydrogen 3.060 N/A SER 656.A N SER 574.A O no hydrogen 2.882 N/A SER 656.A OG GLU 658.A O no hydrogen 3.268 N/A GLU 658.A N SER 656.A OG no hydrogen 3.277 N/A GLY 662.A N GLY 673.A O no hydrogen 3.109 N/A LEU 664.A N ASN 671.A O no hydrogen 2.848 N/A SER 665.A N SER 949.A OG no hydrogen 2.809 N/A SER 665.A OG ASN 550.A O no hydrogen 2.888 N/A GLN 666.A N ASN 669.A O no hydrogen 2.621 N/A GLY 667.A N GLU 951.A OE2 no hydrogen 2.951 N/A GLY 670.A N PHE 693.A O no hydrogen 3.173 N/A ASN 671.A N LEU 664.A O no hydrogen 3.161 N/A ASN 671.A ND2 SER 833.A OG no hydrogen 2.974 N/A ASN 671.A ND2 TYR 834.A O no hydrogen 3.142 N/A ASN 671.A ND2 VAL 858.A O no hydrogen 3.465 N/A PHE 672.A N PHE 691.A O no hydrogen 2.769 N/A GLY 673.A N GLY 662.A O no hydrogen 2.951 N/A LYS 674.A N PHE 660.A O no hydrogen 2.975 N/A LYS 674.A NZ PHE 837.A O no hydrogen 3.430 N/A LYS 674.A NZ GLU 838.A OE2 no hydrogen 3.412 N/A LEU 675.A N ALA 687.A O no hydrogen 2.707 N/A GLU 677.A N HIS 685.A O no hydrogen 3.073 N/A LYS 680.A N HIS 678.A ND1 no hydrogen 3.277 N/A LYS 680.A NZ ASN 642.A O no hydrogen 2.738 N/A LYS 680.A NZ GLU 653.A OE1 no hydrogen 2.788 N/A LYS 680.A NZ TYR 681.A OH no hydrogen 2.752 N/A TYR 681.A N HIS 678.A O no hydrogen 3.227 N/A TYR 681.A OH GLU 653.A OE1 no hydrogen 2.535 N/A TYR 681.A OH GLU 653.A OE2 no hydrogen 3.169 N/A ASN 682.A N GLU 677.A OE2 no hydrogen 2.950 N/A GLY 683.A N TYR 681.A O no hydrogen 3.100 N/A THR 684.A OG1 THR 707.A OG1 no hydrogen 3.258 N/A HIS 685.A N ASN 682.A O no hydrogen 3.240 N/A ARG 686.A N GLU 705.A O no hydrogen 2.939 N/A ARG 686.A NH2 GLU 658.A OE1 no hydrogen 3.105 N/A ALA 687.A N LEU 675.A O no hydrogen 2.989 N/A ARG 688.A N SER 702.A O no hydrogen 2.961 N/A ARG 688.A NH2 GLU 838.A OE1 no hydrogen 3.522 N/A LYS 689.A NZ GLY 628.A O no hydrogen 2.796 N/A LYS 689.A NZ THR 630.A OG1 no hydrogen 2.851 N/A LYS 689.A NZ TYR 791.A OH no hydrogen 2.729 N/A SER 690.A N LEU 700.A O no hydrogen 2.831 N/A SER 690.A OG HIS 692.A NE2 no hydrogen 2.998 N/A SER 690.A OG LEU 700.A O no hydrogen 3.495 N/A SER 690.A OG HIS 822.A ND1 no hydrogen 2.935 N/A PHE 691.A N PHE 672.A O no hydrogen 2.727 N/A HIS 692.A N VAL 698.A O no hydrogen 2.904 N/A HIS 692.A ND1 SER 833.A OG no hydrogen 2.704 N/A HIS 692.A NE2 SER 690.A OG no hydrogen 2.998 N/A PHE 693.A N GLY 670.A O no hydrogen 2.768 N/A ASP 695.A N ASN 669.A OD1 no hydrogen 2.830 N/A VAL 698.A N HIS 692.A O no hydrogen 2.995 N/A CYS 699.A N TYR 793.A O no hydrogen 2.746 N/A CYS 699.A SG ILE 697.A O no hydrogen 4.029 N/A LEU 700.A N SER 690.A O no hydrogen 2.966 N/A GLY 701.A N TYR 791.A O no hydrogen 3.039 N/A SER 702.A N ARG 688.A O no hydrogen 2.949 N/A SER 702.A OG ASP 703.A OD2 no hydrogen 2.840 N/A SER 702.A OG HIS 822.A NE2 no hydrogen 2.797 N/A ILE 704.A N GLY 789.A O no hydrogen 3.037 N/A GLU 705.A N ARG 686.A O no hydrogen 3.020 N/A ASN 706.A N PRO 786.A O no hydrogen 3.279 N/A THR 707.A N THR 684.A OG1 no hydrogen 3.017 N/A THR 707.A OG1 THR 684.A OG1 no hydrogen 3.258 N/A TYR 710.A N ASN 708.A OD1 no hydrogen 3.096 N/A THR 712.A N GLY 783.A O no hydrogen 3.135 N/A THR 712.A OG1 ASN 706.A OD1 no hydrogen 2.585 N/A GLU 713.A N SER 631.A O no hydrogen 2.814 N/A THR 714.A N ILE 780.A O no hydrogen 3.295 N/A THR 715.A N VAL 629.A O no hydrogen 3.282 N/A ILE 716.A N LEU 778.A O no hydrogen 2.862 N/A PHE 717.A N LEU 778.A O no hydrogen 3.280 N/A LEU 719.A N VAL 776.A O no hydrogen 2.884 N/A ALA 720.A N GLY 615.A O no hydrogen 2.868 N/A VAL 721.A N ASP 774.A O no hydrogen 2.728 N/A LYS 724.A NZ ASP 728.A OD1 no hydrogen 3.334 N/A HIS 727.A N ASP 723.A O no hydrogen 3.449 N/A HIS 727.A ND1 ASP 723.A O no hydrogen 2.841 N/A HIS 727.A NE2 ASP 774.A OD2 no hydrogen 2.702 N/A ASP 728.A N LYS 724.A O no hydrogen 3.110 N/A TYR 729.A N ALA 725.A O no hydrogen 3.179 N/A TRP 730.A NE1 HIS 742.A ND1 no hydrogen 3.067 N/A LYS 731.A N ASP 728.A O no hydrogen 3.429 N/A ASN 733.A ND2 TYR 729.A O no hydrogen 3.586 N/A TRP 740.A N TYR 747.A O no hydrogen 2.741 N/A HIS 742.A NE2 ALA 720.A O no hydrogen 3.037 N/A LEU 743.A N ASP 741.A OD1 no hydrogen 2.912 N/A GLY 744.A N ASP 741.A O no hydrogen 3.483 N/A THR 745.A N ASP 741.A OD1 no hydrogen 2.963 N/A GLY 746.A N LEU 796.A O no hydrogen 2.766 N/A TYR 747.A N TRP 740.A O no hydrogen 2.728 N/A TYR 747.A OH ASP 741.A OD2 no hydrogen 2.996 N/A TYR 748.A N ALA 794.A O no hydrogen 2.801 N/A VAL 749.A N LYS 738.A O no hydrogen 2.775 N/A ARG 754.A N ILE 779.A O no hydrogen 2.702 N/A GLU 756.A N SER 777.A O no hydrogen 2.764 N/A LYS 757.A NZ TRP 730.A O no hydrogen 2.825 N/A ASN 758.A N TRP 775.A O no hydrogen 3.087 N/A GLN 761.A N GLY 773.A O no hydrogen 2.715 N/A SER 763.A N THR 771.A O no hydrogen 2.780 N/A SER 763.A OG PHE 621.A O no hydrogen 2.614 N/A SER 763.A OG ARG 764.A O no hydrogen 3.502 N/A ARG 764.A N SER 763.A OG no hydrogen 2.654 N/A ARG 764.A NE GLY 768.A O no hydrogen 2.787 N/A GLN 765.A NE2 ARG 481.A O no hydrogen 3.564 N/A THR 767.A N ASP 766.A OD1 no hydrogen 2.566 N/A THR 767.A OG1 ASP 766.A OD1 no hydrogen 3.000 N/A THR 771.A N SER 763.A O no hydrogen 2.793 N/A GLY 773.A N GLN 761.A O no hydrogen 3.130 N/A TRP 775.A N ASN 758.A O no hydrogen 3.218 N/A TRP 775.A NE1 GLU 619.A O no hydrogen 3.091 N/A VAL 776.A N LEU 719.A O no hydrogen 2.922 N/A SER 777.A N GLU 756.A O no hydrogen 2.908 N/A LEU 778.A N PHE 717.A O no hydrogen 2.955 N/A ILE 779.A N ARG 754.A O no hydrogen 2.822 N/A ILE 780.A N THR 714.A O no hydrogen 2.735 N/A HIS 782.A N ILE 780.A O no hydrogen 3.249 N/A GLY 789.A N ILE 704.A O no hydrogen 2.903 N/A TYR 791.A N GLY 701.A O no hydrogen 2.998 N/A TYR 793.A N CYS 699.A O no hydrogen 3.140 N/A ALA 794.A N TYR 748.A O no hydrogen 2.888 N/A ILE 795.A N ILE 697.A O no hydrogen 2.776 N/A LEU 796.A N GLY 746.A O no hydrogen 2.874 N/A THR 799.A N GLY 744.A O no hydrogen 2.887 N/A THR 799.A OG1 ASP 800.A O no hydrogen 3.325 N/A ASP 800.A N THR 799.A OG1 no hydrogen 2.543 N/A THR 803.A N ASP 800.A OD1 no hydrogen 2.788 N/A THR 803.A OG1 ASP 800.A OD1 no hydrogen 2.850 N/A THR 803.A OG1 ASP 800.A OD2 no hydrogen 3.254 N/A THR 804.A OG1 ARG 801.A O no hydrogen 3.514 N/A THR 804.A OG1 LYS 802.A O no hydrogen 2.961 N/A ALA 805.A N LYS 802.A O no hydrogen 3.146 N/A PHE 806.A N THR 803.A O no hydrogen 2.864 N/A LYS 808.A N THR 804.A O no hydrogen 3.233 N/A LYS 809.A N ALA 805.A O no hydrogen 3.022 N/A TYR 812.A OH GLU 792.A OE2 no hydrogen 2.788 N/A SER 813.A N GLU 825.A O no hydrogen 2.989 N/A LEU 815.A N ILE 823.A O no hydrogen 2.768 N/A GLN 816.A N ILE 823.A O no hydrogen 3.386 N/A GLN 816.A NE2 ASP 818.A OD2 no hydrogen 2.743 N/A ASP 818.A N ALA 821.A O no hydrogen 3.006 N/A ALA 821.A N ASP 818.A OD2 no hydrogen 3.171 N/A HIS 822.A N VAL 835.A O no hydrogen 2.911 N/A HIS 822.A NE2 SER 702.A OG no hydrogen 2.797 N/A ILE 823.A N GLN 816.A O no hydrogen 2.840 N/A LEU 824.A N SER 833.A O no hydrogen 3.039 N/A GLU 825.A N SER 813.A O no hydrogen 3.126 N/A SER 826.A N ILE 831.A O no hydrogen 2.741 N/A SER 826.A OG ALA 811.A O no hydrogen 3.061 N/A SER 826.A OG ASP 829.A OD2 no hydrogen 3.154 N/A ILE 831.A N SER 826.A O no hydrogen 3.093 N/A THR 832.A N VAL 859.A O no hydrogen 2.816 N/A SER 833.A N LEU 824.A O no hydrogen 2.599 N/A SER 833.A OG HIS 692.A ND1 no hydrogen 2.704 N/A TYR 834.A N VAL 858.A O no hydrogen 2.745 N/A TYR 834.A OH PRO 845.A O no hydrogen 2.685 N/A VAL 835.A N HIS 822.A O no hydrogen 3.141 N/A LEU 836.A N CYS 856.A O no hydrogen 2.929 N/A PHE 837.A N ASN 820.A O no hydrogen 2.905 N/A GLU 838.A N ASN 820.A O no hydrogen 3.289 N/A THR 839.A OG1 ASP 853.A O no hydrogen 3.442 N/A GLN 841.A N THR 839.A O no hydrogen 3.111 N/A LEU 844.A N GLN 850.A O no hydrogen 2.849 N/A GLN 850.A N THR 915.A O no hydrogen 2.751 N/A ARG 851.A N THR 915.A O no hydrogen 3.489 N/A ASP 853.A N THR 913.A O no hydrogen 2.917 N/A CYS 856.A N LEU 836.A O no hydrogen 2.910 N/A CYS 856.A SG THR 854.A O no hydrogen 3.396 N/A LEU 857.A N ALA 872.A O no hydrogen 2.913 N/A VAL 858.A N TYR 834.A O no hydrogen 2.922 N/A ARG 860.A N LEU 868.A O no hydrogen 2.998 N/A LYS 861.A N ARG 830.A O no hydrogen 2.951 N/A GLU 862.A N LYS 866.A O no hydrogen 2.858 N/A SER 863.A N LYS 866.A O no hydrogen 3.211 N/A ASP 865.A N SER 863.A OG no hydrogen 3.257 N/A LYS 866.A N SER 863.A OG no hydrogen 3.375 N/A VAL 867.A N LEU 954.A O no hydrogen 2.997 N/A LEU 868.A N ARG 860.A O no hydrogen 2.788 N/A LEU 869.A N VAL 952.A O no hydrogen 3.057 N/A THR 870.A OG1 TYR 950.A O no hydrogen 3.339 N/A VAL 871.A N TYR 950.A O no hydrogen 2.787 N/A ALA 872.A N LEU 857.A O no hydrogen 2.838 N/A ALA 877.A N ASP 875.A OD2 no hydrogen 2.889 N/A ARG 880.A NH1 GLU 909.A O no hydrogen 2.867 N/A ARG 880.A NH2 GLU 909.A O no hydrogen 3.166 N/A SER 883.A OG GLU 885.A OE1 no hydrogen 2.629 N/A ASP 884.A N TYR 879.A OH no hydrogen 2.975 N/A ASP 888.A N LYS 892.A O no hydrogen 2.901 N/A LYS 889.A N ASP 888.A OD2 no hydrogen 2.839 N/A ARG 893.A N ASP 679.A OD2 no hydrogen 2.614 N/A ARG 893.A NE GLU 885.A OE2 no hydrogen 2.796 N/A ARG 893.A NH2 TYR 655.A O no hydrogen 2.734 N/A ARG 893.A NH2 GLU 885.A OE2 no hydrogen 3.141 N/A ARG 895.A NH2 ASP 884.A OD1 no hydrogen 3.047 N/A SER 896.A N ASP 647.A OD2 no hydrogen 3.376 N/A SER 896.A OG ASP 647.A OD1 no hydrogen 3.174 N/A SER 896.A OG ASP 647.A OD2 no hydrogen 3.479 N/A SER 899.A N SER 896.A O no hydrogen 3.068 N/A SER 899.A OG ASP 647.A OD2 no hydrogen 3.484 N/A SER 899.A OG SER 896.A O no hydrogen 2.666 N/A ARG 900.A N ILE 897.A O no hydrogen 3.113 N/A ARG 900.A NE ASP 884.A OD2 no hydrogen 3.001 N/A ARG 900.A NH1 SER 899.A OG no hydrogen 3.412 N/A ARG 900.A NH2 ASP 884.A OD1 no hydrogen 3.303 N/A ARG 900.A NH2 ASP 884.A OD2 no hydrogen 2.748 N/A TRP 902.A NE1 ASP 884.A OD2 no hydrogen 3.074 N/A ASN 905.A N TRP 902.A O no hydrogen 3.084 N/A ASN 905.A ND2 LEU 878.A O no hydrogen 2.759 N/A SER 907.A OG LEU 876.A O no hydrogen 2.522 N/A GLY 908.A N ALA 877.A O no hydrogen 2.840 N/A ILE 910.A N CYS 944.A O no hydrogen 2.911 N/A VAL 912.A N PHE 942.A O no hydrogen 2.871 N/A THR 913.A OG1 ASP 853.A OD2 no hydrogen 3.311 N/A VAL 914.A N LEU 940.A O no hydrogen 2.942 N/A THR 915.A N ARG 851.A O no hydrogen 3.000 N/A LEU 916.A N THR 938.A O no hydrogen 2.928 N/A LYS 917.A N LEU 848.A O no hydrogen 2.979 N/A GLY 918.A N LYS 936.A O no hydrogen 2.657 N/A TRP 920.A N THR 938.A OG1 no hydrogen 3.126 N/A TRP 920.A NE1 LYS 917.A O no hydrogen 2.738 N/A LYS 921.A N GLU 955.A O no hydrogen 2.756 N/A THR 925.A N CYS 928.A O no hydrogen 3.074 N/A CYS 928.A N THR 925.A O no hydrogen 3.161 N/A LYS 929.A N ARG 941.A O no hydrogen 3.137 N/A VAL 931.A N VAL 939.A O no hydrogen 2.910 N/A ASP 934.A N GLN 937.A O no hydrogen 3.148 N/A GLN 937.A N ASP 934.A OD2 no hydrogen 2.737 N/A THR 938.A N LEU 916.A O no hydrogen 2.893 N/A THR 938.A OG1 GLY 918.A O no hydrogen 2.674 N/A VAL 939.A N SER 932.A O no hydrogen 3.026 N/A LEU 940.A N VAL 914.A O no hydrogen 3.017 N/A ARG 941.A N LYS 929.A O no hydrogen 2.769 N/A ARG 941.A NE THR 913.A OG1 no hydrogen 2.977 N/A ARG 941.A NH2 THR 913.A OG1 no hydrogen 3.261 N/A PHE 942.A N VAL 912.A O no hydrogen 2.761 N/A LEU 943.A N TYR 927.A O no hydrogen 2.835 N/A CYS 944.A N ILE 910.A O no hydrogen 3.073 N/A CYS 944.A SG PHE 942.A O no hydrogen 4.030 N/A LYS 945.A NZ ASP 946.A OD2 no hydrogen 3.550 N/A ASP 946.A N SER 907.A OG no hydrogen 2.890 N/A ALA 948.A N LYS 945.A O no hydrogen 2.927 N/A TYR 950.A N VAL 871.A O no hydrogen 2.874 N/A VAL 952.A N LEU 869.A O no hydrogen 2.858 N/A LEU 954.A N VAL 867.A O no hydrogen 2.718 N/A GLU 955.A N LYS 921.A O no hydrogen 3.110 N/A LYS 956.A N ASP 865.A O no hydrogen 2.925 N/A