Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4ui9_C.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): SER 2.A OG PHE 1.A O no hydrogen 2.386 N/A LYS 8.A N LEU 4.A O no hydrogen 2.724 N/A LYS 8.A NZ PRO 38.A O no hydrogen 3.170 N/A GLN 10.A N GLU 6.A O no hydrogen 2.914 N/A LEU 11.A N ILE 7.A O no hydrogen 2.764 N/A LEU 12.A N LYS 8.A O no hydrogen 2.851 N/A LEU 13.A N LYS 9.A O no hydrogen 3.074 N/A ILE 14.A N GLN 10.A O no hydrogen 3.423 N/A ALA 15.A N LEU 11.A O no hydrogen 3.100 N/A GLY 16.A N LEU 12.A O no hydrogen 3.111 N/A LEU 17.A N LEU 13.A O no hydrogen 2.917 N/A THR 18.A N ILE 14.A O no hydrogen 2.987 N/A THR 18.A OG1 ILE 14.A O no hydrogen 3.356 N/A THR 18.A OG1 ALA 15.A O no hydrogen 3.261 N/A THR 18.A OG1 SER 27.A OG no hydrogen 2.380 N/A ARG 19.A N ALA 15.A O no hydrogen 2.980 N/A GLU 20.A N GLY 16.A O no hydrogen 2.998 N/A ARG 21.A N LEU 17.A O no hydrogen 3.269 N/A GLY 22.A N THR 18.A O no hydrogen 2.877 N/A GLY 22.A N ARG 19.A O no hydrogen 3.142 N/A LEU 23.A N THR 18.A O no hydrogen 3.009 N/A SER 27.A N LEU 23.A O no hydrogen 3.161 N/A SER 27.A OG ALA 15.A O no hydrogen 3.559 N/A SER 27.A OG THR 18.A OG1 no hydrogen 2.380 N/A SER 27.A OG LEU 23.A O no hydrogen 3.025 N/A LYS 28.A N LEU 24.A O no hydrogen 2.837 N/A TRP 29.A N HIS 25.A O no hydrogen 3.089 N/A SER 30.A N SER 26.A O no hydrogen 2.974 N/A SER 30.A OG SER 26.A O no hydrogen 3.227 N/A SER 30.A OG SER 27.A O no hydrogen 3.048 N/A ALA 31.A N SER 27.A O no hydrogen 2.898 N/A GLU 32.A N LYS 28.A O no hydrogen 2.988 N/A LEU 33.A N TRP 29.A O no hydrogen 3.454 N/A ALA 34.A N SER 30.A O no hydrogen 3.193 N/A PHE 35.A N ALA 31.A O no hydrogen 2.982 N/A SER 36.A N GLU 32.A O no hydrogen 2.993 N/A SER 36.A OG PHE 234.A O no hydrogen 3.479 N/A LEU 37.A N LEU 33.A O no hydrogen 3.130 N/A THR 52.A N ASP 55.A OD2 no hydrogen 3.439 N/A GLU 53.A N GLU 53.A OE1 no hydrogen 3.273 N/A ALA 56.A N THR 52.A O no hydrogen 3.158 N/A GLN 57.A N GLU 53.A O no hydrogen 3.010 N/A ASP 58.A N GLU 54.A O no hydrogen 2.914 N/A MET 59.A N ALA 56.A O no hydrogen 3.393 N/A TYR 62.A N ASP 58.A O no hydrogen 2.751 N/A TYR 62.A OH GLU 20.A O no hydrogen 3.377 N/A THR 63.A N MET 59.A O no hydrogen 3.043 N/A THR 63.A OG1 MET 59.A O no hydrogen 3.003 N/A THR 63.A OG1 ASP 60.A O no hydrogen 3.120 N/A LEU 64.A N ASP 60.A O no hydrogen 3.163 N/A ALA 65.A N ALA 61.A O no hydrogen 2.833 N/A LYS 66.A N TYR 62.A O no hydrogen 2.767 N/A ALA 67.A N THR 63.A O no hydrogen 3.098 N/A TYR 68.A N LEU 64.A O no hydrogen 3.069 N/A PHE 69.A N ALA 65.A O no hydrogen 2.772 N/A ASP 70.A N LYS 66.A O no hydrogen 2.866 N/A VAL 71.A N TYR 68.A O no hydrogen 3.134 N/A GLU 73.A N TYR 68.A O no hydrogen 2.976 N/A ALA 77.A N GLU 73.A O no hydrogen 3.278 N/A ALA 78.A N TYR 74.A O no hydrogen 2.950 N/A HIS 79.A N ASP 75.A O no hydrogen 3.186 N/A PHE 80.A N ALA 77.A O no hydrogen 3.200 N/A LEU 81.A N ALA 77.A O no hydrogen 3.260 N/A HIS 82.A N HIS 79.A O no hydrogen 3.415 N/A CYS 84.A N LEU 81.A O no hydrogen 3.066 N/A SER 86.A N ASP 58.A OD2 no hydrogen 3.150 N/A TYR 90.A N SER 86.A O no hydrogen 2.835 N/A PHE 91.A N LYS 87.A O no hydrogen 3.117 N/A LEU 92.A N LYS 88.A O no hydrogen 3.129 N/A TYR 93.A N ALA 89.A O no hydrogen 2.830 N/A MET 94.A N TYR 90.A O no hydrogen 3.011 N/A TYR 95.A N PHE 91.A O no hydrogen 2.764 N/A SER 96.A N LEU 92.A O no hydrogen 2.807 N/A SER 96.A OG LEU 92.A O no hydrogen 3.078 N/A SER 96.A OG TYR 93.A O no hydrogen 2.681 N/A ARG 97.A N TYR 93.A O no hydrogen 2.947 N/A TYR 98.A N MET 94.A O no hydrogen 2.871 N/A LEU 99.A N TYR 95.A O no hydrogen 2.864 N/A SER 100.A N SER 96.A O no hydrogen 2.879 N/A SER 100.A OG ARG 97.A O no hydrogen 2.828 N/A GLY 101.A N ARG 97.A O no hydrogen 3.308 N/A GLU 102.A N TYR 98.A O no hydrogen 3.065 N/A LYS 103.A N LEU 99.A O no hydrogen 2.624 N/A LYS 104.A N SER 100.A O no hydrogen 3.225 N/A LYS 105.A N GLY 101.A O no hydrogen 2.950 N/A LYS 105.A NZ GLU 102.A OE2 no hydrogen 3.250 N/A LYS 105.A NZ ASP 106.A OD1 no hydrogen 3.532 N/A ASP 106.A N GLU 102.A O no hydrogen 2.899 N/A ASP 107.A N LYS 103.A O no hydrogen 2.908 N/A GLU 108.A N LYS 104.A O no hydrogen 2.873 N/A THR 109.A N LYS 105.A O no hydrogen 2.853 N/A THR 109.A OG1 LYS 105.A O no hydrogen 2.762 N/A ASP 111.A N GLU 108.A O no hydrogen 3.104 N/A SER 112.A N GLU 108.A O no hydrogen 3.036 N/A GLU 117.A N GLU 117.A OE1 no hydrogen 2.539 N/A LYS 118.A NZ THR 109.A O no hydrogen 3.226 N/A LYS 118.A NZ SER 112.A O no hydrogen 2.914 N/A ASN 123.A ND2 TYR 98.A O no hydrogen 3.656 N/A LEU 129.A N ALA 125.A O no hydrogen 2.970 N/A ARG 130.A N LEU 126.A O no hydrogen 2.997 N/A GLU 132.A N GLU 128.A O no hydrogen 3.114 N/A LEU 133.A N LEU 129.A O no hydrogen 2.789 N/A SER 134.A N ARG 130.A O no hydrogen 2.838 N/A SER 134.A OG ARG 130.A O no hydrogen 3.113 N/A SER 134.A OG VAL 131.A O no hydrogen 2.706 N/A LYS 135.A N VAL 131.A O no hydrogen 3.261 N/A LEU 136.A N GLU 132.A O no hydrogen 3.270 N/A HIS 137.A N LEU 133.A O no hydrogen 2.853 N/A GLN 138.A N SER 134.A O no hydrogen 2.948 N/A ALA 139.A N LYS 135.A O no hydrogen 3.145 N/A ARG 140.A N LEU 136.A O no hydrogen 2.950 N/A ARG 140.A N HIS 137.A O no hydrogen 3.021 N/A GLU 141.A N LEU 136.A O no hydrogen 3.236 N/A GLY 146.A N ASP 143.A O no hydrogen 3.120 N/A TYR 148.A N GLY 144.A O no hydrogen 3.242 N/A TYR 148.A OH GLU 183.A OE2 no hydrogen 3.164 N/A LEU 149.A N PHE 145.A O no hydrogen 2.733 N/A TYR 150.A N GLY 146.A O no hydrogen 2.819 N/A GLY 151.A N LEU 147.A O no hydrogen 2.806 N/A VAL 152.A N TYR 148.A O no hydrogen 2.934 N/A VAL 153.A N LEU 149.A O no hydrogen 3.143 N/A LEU 154.A N TYR 150.A O no hydrogen 2.977 N/A ARG 155.A N GLY 151.A O no hydrogen 2.927 N/A LYS 156.A N VAL 152.A O no hydrogen 2.991 N/A LYS 156.A NZ TYR 98.A OH no hydrogen 2.549 N/A LYS 156.A NZ GLU 102.A OE1 no hydrogen 2.640 N/A LEU 157.A N VAL 153.A O no hydrogen 3.092 N/A ASP 158.A N ARG 155.A O no hydrogen 2.840 N/A LEU 159.A N LEU 154.A O no hydrogen 2.967 N/A LYS 161.A NZ GLU 162.A OE1 no hydrogen 3.372 N/A LYS 161.A NZ GLU 162.A OE2 no hydrogen 2.947 N/A ALA 163.A N LEU 159.A O no hydrogen 2.802 N/A ILE 164.A N VAL 160.A O no hydrogen 3.074 N/A VAL 166.A N GLU 162.A O no hydrogen 3.172 N/A PHE 167.A N ALA 163.A O no hydrogen 2.721 N/A VAL 168.A N ILE 164.A O no hydrogen 2.850 N/A GLU 169.A N ASP 165.A O no hydrogen 3.226 N/A ALA 170.A N VAL 166.A O no hydrogen 2.888 N/A THR 171.A N PHE 167.A O no hydrogen 3.059 N/A THR 171.A OG1 VAL 168.A O no hydrogen 2.827 N/A HIS 172.A N VAL 168.A O no hydrogen 3.182 N/A VAL 173.A N GLU 169.A O no hydrogen 2.964 N/A LEU 174.A N ALA 170.A O no hydrogen 2.944 N/A ALA 180.A N HIS 177.A O no hydrogen 3.222 N/A LEU 182.A N TRP 178.A O no hydrogen 2.619 N/A GLU 183.A N GLY 179.A O no hydrogen 2.981 N/A LEU 184.A N ALA 180.A O no hydrogen 3.386 N/A CYS 185.A N TRP 181.A O no hydrogen 3.271 N/A CYS 185.A SG TRP 181.A O no hydrogen 3.555 N/A LEU 187.A N GLU 183.A O no hydrogen 3.257 N/A LEU 187.A N LEU 184.A O no hydrogen 3.229 N/A ILE 188.A N LEU 184.A O no hydrogen 3.006 N/A THR 189.A OG1 ASP 190.A OD1 no hydrogen 3.266 N/A LEU 194.A N ASP 190.A O no hydrogen 3.070 N/A LYS 195.A N LYS 191.A O no hydrogen 3.172 N/A PHE 196.A N GLU 192.A O no hydrogen 3.107 N/A LEU 197.A N MET 193.A O no hydrogen 3.371 N/A LYS 205.A N THR 202.A O no hydrogen 2.686 N/A LYS 205.A NZ LEU 199.A O no hydrogen 3.143 N/A GLU 206.A N TRP 203.A O no hydrogen 2.394 N/A PHE 207.A N TRP 203.A O no hydrogen 3.387 N/A PHE 208.A N MET 204.A O no hydrogen 2.951 N/A LEU 209.A N LYS 205.A O no hydrogen 2.780 N/A ALA 210.A N GLU 206.A O no hydrogen 2.990 N/A HIS 211.A N PHE 207.A O no hydrogen 2.853 N/A HIS 211.A ND1 TYR 239.A OH no hydrogen 3.133 N/A ILE 212.A N PHE 208.A O no hydrogen 2.875 N/A TYR 213.A N LEU 209.A O no hydrogen 2.880 N/A THR 214.A N ALA 210.A O no hydrogen 3.124 N/A GLU 215.A N HIS 211.A O no hydrogen 3.429 N/A LEU 216.A N ILE 212.A O no hydrogen 2.912 N/A GLN 217.A N THR 214.A O no hydrogen 3.357 N/A LEU 218.A N TYR 213.A O no hydrogen 2.987 N/A ALA 222.A N LEU 218.A O no hydrogen 3.025 N/A LEU 223.A N ILE 219.A O no hydrogen 2.798 N/A GLN 224.A N GLU 220.A O no hydrogen 3.167 N/A LYS 225.A N GLU 221.A O no hydrogen 3.081 N/A TYR 226.A N ALA 222.A O no hydrogen 2.947 N/A GLN 227.A N LEU 223.A O no hydrogen 2.806 N/A ASN 228.A N GLN 224.A O no hydrogen 3.133 N/A LEU 229.A N LYS 225.A O no hydrogen 3.282 N/A ILE 230.A N TYR 226.A O no hydrogen 3.013 N/A ASP 231.A N GLN 227.A O no hydrogen 3.258 N/A VAL 232.A N ASN 228.A O no hydrogen 3.192 N/A VAL 232.A N LEU 229.A O no hydrogen 3.252 N/A GLY 233.A N ILE 230.A O no hydrogen 3.379 N/A PHE 234.A N LEU 229.A O no hydrogen 3.295 N/A SER 237.A N PHE 234.A O no hydrogen 2.968 N/A TYR 239.A OH HIS 211.A ND1 no hydrogen 3.133 N/A ILE 240.A N SER 237.A OG no hydrogen 3.214 N/A VAL 241.A N SER 237.A O no hydrogen 3.255 N/A SER 242.A N SER 238.A O no hydrogen 2.834 N/A GLN 243.A N TYR 239.A O no hydrogen 2.981 N/A ILE 244.A N ILE 240.A O no hydrogen 2.997 N/A ALA 245.A N VAL 241.A O no hydrogen 3.083 N/A VAL 246.A N SER 242.A O no hydrogen 3.057 N/A ALA 247.A N GLN 243.A O no hydrogen 2.739 N/A TYR 248.A N ILE 244.A O no hydrogen 2.800 N/A HIS 249.A N ALA 245.A O no hydrogen 2.953 N/A ASN 250.A N VAL 246.A O no hydrogen 3.013 N/A ASN 250.A ND2 GLN 217.A OE1 no hydrogen 3.447 N/A ILE 251.A N ALA 247.A O no hydrogen 3.294 N/A ARG 252.A N HIS 249.A O no hydrogen 3.088 N/A ASP 253.A N TYR 248.A O no hydrogen 3.159 N/A LYS 256.A N ASP 253.A OD1 no hydrogen 3.043 N/A ALA 257.A N ASP 253.A O no hydrogen 3.149 N/A LEU 258.A N ILE 254.A O no hydrogen 2.856 N/A SER 259.A N ASP 255.A O no hydrogen 3.026 N/A SER 259.A OG LYS 256.A O no hydrogen 2.735 N/A PHE 261.A N ALA 257.A O no hydrogen 3.012 N/A ASN 262.A N LEU 258.A O no hydrogen 3.118 N/A GLU 263.A N SER 259.A O no hydrogen 3.111 N/A LEU 264.A N ILE 260.A O no hydrogen 2.942 N/A ARG 265.A N PHE 261.A O no hydrogen 3.155 N/A LYS 266.A N ASN 262.A O no hydrogen 3.402 N/A GLN 267.A N GLU 263.A O no hydrogen 2.935 N/A ASP 268.A N LEU 264.A O no hydrogen 2.802 N/A ARG 271.A NH1 SER 242.A OG no hydrogen 3.308 N/A MET 275.A N ILE 272.A O no hydrogen 3.368 N/A PHE 278.A N ASN 274.A O no hydrogen 3.410 N/A SER 279.A N MET 275.A O no hydrogen 2.951 N/A ASN 280.A N ASP 276.A O no hydrogen 3.239 N/A LEU 281.A N THR 277.A O no hydrogen 3.269 N/A LEU 282.A N PHE 278.A O no hydrogen 3.022 N/A TYR 283.A N SER 279.A O no hydrogen 2.860 N/A VAL 284.A N ASN 280.A O no hydrogen 3.123 N/A ARG 285.A N LEU 281.A O no hydrogen 3.318 N/A ARG 285.A NE ASP 255.A OD1 no hydrogen 3.343 N/A ARG 285.A NH2 ASP 255.A OD1 no hydrogen 2.867 N/A SER 286.A N TYR 283.A O no hydrogen 3.109 N/A MET 287.A N LEU 282.A O no hydrogen 3.461 N/A LEU 291.A N MET 287.A O no hydrogen 3.037 N/A SER 292.A N LYS 288.A O no hydrogen 2.843 N/A SER 292.A OG LYS 288.A O no hydrogen 2.904 N/A TYR 293.A N SER 289.A O no hydrogen 3.133 N/A LEU 294.A N GLU 290.A O no hydrogen 3.109 N/A ALA 295.A N LEU 291.A O no hydrogen 2.843 N/A HIS 296.A N SER 292.A O no hydrogen 3.273 N/A ASN 297.A N TYR 293.A O no hydrogen 3.097 N/A LEU 298.A N LEU 294.A O no hydrogen 2.985 N/A CYS 299.A N ALA 295.A O no hydrogen 3.125 N/A GLU 300.A N HIS 296.A O no hydrogen 3.257 N/A ILE 301.A N ASN 297.A O no hydrogen 3.203 N/A ASP 302.A N LEU 298.A O no hydrogen 2.888 N/A GLU 307.A N GLU 307.A OE1 no hydrogen 2.809 N/A CYS 309.A N ARG 305.A O no hydrogen 3.140 N/A CYS 310.A N VAL 306.A O no hydrogen 3.147 N/A CYS 310.A SG ASP 276.A OD1 no hydrogen 2.143 N/A CYS 310.A SG TYR 339.A OH no hydrogen 3.903 N/A VAL 311.A N GLU 307.A O no hydrogen 3.010 N/A ILE 312.A N THR 308.A O no hydrogen 2.803 N/A GLY 313.A N CYS 309.A O no hydrogen 3.037 N/A ASN 314.A N CYS 310.A O no hydrogen 2.832 N/A ASN 314.A ND2 SER 279.A OG no hydrogen 2.791 N/A TYR 315.A N VAL 311.A O no hydrogen 2.878 N/A TYR 316.A N ILE 312.A O no hydrogen 3.082 N/A SER 317.A N GLY 313.A O no hydrogen 2.982 N/A SER 317.A OG TYR 283.A OH no hydrogen 3.404 N/A SER 317.A OG ASN 314.A O no hydrogen 2.934 N/A LEU 318.A N ASN 314.A O no hydrogen 3.104 N/A ARG 319.A N TYR 315.A O no hydrogen 3.142 N/A ARG 319.A NE GLN 321.A OE1 no hydrogen 3.062 N/A ARG 319.A NH2 GLN 321.A OE1 no hydrogen 3.348 N/A SER 320.A N SER 317.A O no hydrogen 3.080 N/A GLN 321.A N TYR 316.A O no hydrogen 3.021 N/A ALA 325.A N GLN 321.A O no hydrogen 3.188 N/A ALA 326.A N HIS 322.A O no hydrogen 2.891 N/A LEU 327.A N GLU 323.A O no hydrogen 3.130 N/A TYR 328.A N LYS 324.A O no hydrogen 2.982 N/A PHE 329.A N ALA 325.A O no hydrogen 3.125 N/A GLN 330.A N ALA 326.A O no hydrogen 2.877 N/A ARG 331.A N LEU 327.A O no hydrogen 2.914 N/A ALA 332.A N TYR 328.A O no hydrogen 2.880 N/A LEU 333.A N PHE 329.A O no hydrogen 3.076 N/A LEU 333.A N GLN 330.A O no hydrogen 3.230 N/A LYS 334.A N GLN 330.A O no hydrogen 3.108 N/A LEU 335.A N ARG 331.A O no hydrogen 3.062 N/A ASN 336.A N LEU 333.A O no hydrogen 3.078 N/A ALA 342.A N TYR 339.A O no hydrogen 3.290 N/A TRP 343.A N LEU 340.A O no hydrogen 3.266 N/A LEU 345.A N GLY 341.A O no hydrogen 3.108 N/A MET 346.A N ALA 342.A O no hydrogen 2.845 N/A GLY 347.A N TRP 343.A O no hydrogen 3.052 N/A HIS 348.A N THR 344.A O no hydrogen 3.086 N/A GLU 349.A N LEU 345.A O no hydrogen 3.245 N/A TYR 350.A N MET 346.A O no hydrogen 3.241 N/A TYR 350.A OH GLN 330.A OE1 no hydrogen 3.043 N/A MET 351.A N GLY 347.A O no hydrogen 2.974 N/A GLU 352.A N HIS 348.A O no hydrogen 2.878 N/A MET 353.A N GLU 349.A O no hydrogen 3.027 N/A LYS 354.A N MET 351.A O no hydrogen 2.878 N/A ASN 355.A N TYR 350.A O no hydrogen 2.952 N/A ALA 359.A N ASN 355.A O no hydrogen 3.242 N/A ILE 360.A N THR 356.A O no hydrogen 2.999 N/A GLN 361.A N SER 357.A O no hydrogen 2.941 N/A ALA 362.A N ALA 358.A O no hydrogen 2.919 N/A TYR 363.A N ALA 359.A O no hydrogen 3.005 N/A ARG 364.A N ILE 360.A O no hydrogen 2.804 N/A HIS 365.A N GLN 361.A O no hydrogen 2.875 N/A ALA 366.A N ALA 362.A O no hydrogen 3.207 N/A ILE 367.A N TYR 363.A O no hydrogen 2.990 N/A GLU 368.A N ARG 364.A O no hydrogen 2.798 N/A VAL 369.A N HIS 365.A O no hydrogen 3.213 N/A ASN 370.A N ALA 366.A O no hydrogen 3.042 N/A ASP 373.A N ASN 370.A O no hydrogen 3.026 N/A ARG 375.A N ASP 373.A OD1 no hydrogen 3.051 N/A ALA 376.A N ASP 373.A O no hydrogen 3.161 N/A TRP 377.A NE1 LYS 371.A O no hydrogen 3.075 N/A TYR 378.A N TYR 374.A O no hydrogen 2.952 N/A GLY 379.A N ARG 375.A O no hydrogen 2.818 N/A LEU 380.A N ALA 376.A O no hydrogen 2.866 N/A GLY 381.A N TRP 377.A O no hydrogen 3.048 N/A GLN 382.A N TYR 378.A O no hydrogen 2.888 N/A THR 383.A N GLY 379.A O no hydrogen 2.883 N/A TYR 384.A N LEU 380.A O no hydrogen 3.333 N/A GLU 385.A N GLY 381.A O no hydrogen 2.965 N/A ILE 386.A N GLN 382.A O no hydrogen 3.071 N/A LEU 387.A N THR 383.A O no hydrogen 3.424 N/A LYS 388.A N GLU 385.A O no hydrogen 2.894 N/A MET 389.A N TYR 384.A O no hydrogen 3.310 N/A CYS 393.A N MET 389.A O no hydrogen 3.217 N/A CYS 393.A SG GLY 381.A O no hydrogen 3.348 N/A CYS 393.A SG MET 389.A O no hydrogen 3.440 N/A CYS 393.A SG PRO 390.A O no hydrogen 3.878 N/A LEU 394.A N PRO 390.A O no hydrogen 2.962 N/A TYR 397.A N CYS 393.A O no hydrogen 3.126 N/A TYR 397.A OH GLU 385.A OE1 no hydrogen 3.057 N/A ARG 398.A N LEU 394.A O no hydrogen 3.077 N/A ARG 398.A NH1 TYR 395.A O no hydrogen 3.545 N/A ARG 399.A N TYR 395.A O no hydrogen 3.089 N/A ALA 400.A N TYR 396.A O no hydrogen 2.861 N/A HIS 401.A N TYR 397.A O no hydrogen 2.792 N/A GLN 402.A N ARG 398.A O no hydrogen 2.958 N/A ARG 404.A N ALA 400.A O no hydrogen 3.211 N/A ARG 404.A N HIS 401.A O no hydrogen 3.157 N/A SER 408.A OG ASP 439.A OD1 no hydrogen 3.511 N/A VAL 412.A N SER 408.A O no hydrogen 2.909 N/A ALA 413.A N ARG 409.A O no hydrogen 3.109 N/A LEU 414.A N MET 410.A O no hydrogen 2.856 N/A GLY 415.A N LEU 411.A O no hydrogen 2.977 N/A GLU 416.A N VAL 412.A O no hydrogen 2.992 N/A CYS 417.A N ALA 413.A O no hydrogen 3.017 N/A CYS 417.A SG PRO 390.A O no hydrogen 3.951 N/A CYS 417.A SG ALA 413.A O no hydrogen 3.756 N/A TYR 418.A N LEU 414.A O no hydrogen 2.853 N/A GLU 419.A N GLY 415.A O no hydrogen 2.816 N/A LYS 420.A N GLU 416.A O no hydrogen 3.056 N/A LYS 420.A NZ GLU 385.A OE2 no hydrogen 3.154 N/A LEU 421.A N CYS 417.A O no hydrogen 2.856 N/A ASN 422.A N GLU 419.A O no hydrogen 3.165 N/A GLN 423.A N TYR 418.A O no hydrogen 3.025 N/A ALA 427.A N GLN 423.A O no hydrogen 3.176 N/A LYS 428.A N LEU 424.A O no hydrogen 2.910 N/A LYS 429.A N VAL 425.A O no hydrogen 3.139 N/A CYS 430.A N GLU 426.A O no hydrogen 2.932 N/A CYS 430.A SG GLU 426.A O no hydrogen 3.665 N/A TYR 431.A N ALA 427.A O no hydrogen 2.940 N/A TYR 431.A OH GLU 419.A OE1 no hydrogen 3.014 N/A TRP 432.A N LYS 428.A O no hydrogen 2.848 N/A ARG 433.A N LYS 429.A O no hydrogen 2.953 N/A ARG 433.A NH1 PRO 405.A O no hydrogen 3.395 N/A ALA 434.A N CYS 430.A O no hydrogen 2.868 N/A TYR 435.A N TYR 431.A O no hydrogen 2.830 N/A ALA 436.A N TRP 432.A O no hydrogen 3.089 N/A VAL 437.A N ARG 433.A O no hydrogen 2.860 N/A GLY 438.A N ALA 434.A O no hydrogen 3.064 N/A LYS 442.A N ASP 439.A OD1 no hydrogen 3.004 N/A ALA 444.A N ASP 439.A OD2 no hydrogen 2.776 N/A LYS 447.A N MET 443.A O no hydrogen 3.263 N/A LEU 448.A N ALA 444.A O no hydrogen 2.945 N/A ALA 449.A N LEU 445.A O no hydrogen 2.748 N/A LYS 450.A N VAL 446.A O no hydrogen 2.974 N/A LEU 451.A N LYS 447.A O no hydrogen 3.211 N/A HIS 452.A N LEU 448.A O no hydrogen 3.087 N/A GLU 453.A N ALA 449.A O no hydrogen 2.928 N/A GLN 454.A N LYS 450.A O no hydrogen 2.870 N/A LEU 455.A N LEU 451.A O no hydrogen 2.971 N/A GLN 460.A NE2 GLU 459.A OE1 no hydrogen 2.795 N/A ALA 462.A N SER 458.A O no hydrogen 2.995 N/A GLN 463.A N GLU 459.A O no hydrogen 3.120 N/A CYS 464.A N GLN 460.A O no hydrogen 3.235 N/A CYS 464.A SG HIS 452.A ND1 no hydrogen 3.296 N/A CYS 464.A SG GLN 460.A O no hydrogen 3.402 N/A TYR 465.A N ALA 461.A O no hydrogen 3.115 N/A ILE 466.A N ALA 462.A O no hydrogen 3.027 N/A LYS 467.A N GLN 463.A O no hydrogen 3.083 N/A TYR 468.A N CYS 464.A O no hydrogen 2.889 N/A ILE 469.A N TYR 465.A O no hydrogen 2.777 N/A GLN 470.A N ILE 466.A O no hydrogen 2.785 N/A GLN 470.A NE2 ILE 466.A O no hydrogen 3.457 N/A ASP 471.A N LYS 467.A O no hydrogen 3.037 N/A ILE 472.A N TYR 468.A O no hydrogen 3.158 N/A TYR 473.A N ILE 469.A O no hydrogen 3.305 N/A SER 474.A N GLN 470.A O no hydrogen 3.064 N/A CYS 475.A N ASP 471.A O no hydrogen 3.057 N/A PHE 480.A N GLU 476.A O no hydrogen 3.412 N/A ARG 481.A N SER 477.A O no hydrogen 2.930 N/A TYR 482.A N THR 478.A O no hydrogen 2.979 N/A TYR 482.A OH GLU 457.A O no hydrogen 3.170 N/A LEU 483.A N ALA 479.A O no hydrogen 2.763 N/A ALA 484.A N PHE 480.A O no hydrogen 2.901 N/A GLN 485.A N ARG 481.A O no hydrogen 2.926 N/A TYR 486.A N TYR 482.A O no hydrogen 2.868 N/A TYR 487.A N LEU 483.A O no hydrogen 2.864 N/A PHE 488.A N ALA 484.A O no hydrogen 2.845 N/A LYS 489.A N GLN 485.A O no hydrogen 3.068 N/A CYS 490.A N TYR 486.A O no hydrogen 2.837 N/A LYS 491.A N PHE 488.A O no hydrogen 3.110 N/A LEU 492.A N TYR 487.A O no hydrogen 2.962 N/A ALA 496.A N LEU 492.A O no hydrogen 3.253 N/A SER 497.A N TRP 493.A O no hydrogen 2.897 N/A SER 497.A OG TRP 493.A O no hydrogen 2.902 N/A THR 498.A N ASP 494.A O no hydrogen 3.235 N/A CYS 499.A N GLU 495.A O no hydrogen 3.423 N/A CYS 499.A SG GLU 495.A O no hydrogen 3.676 N/A ALA 500.A N ALA 496.A O no hydrogen 2.834 N/A GLN 501.A N SER 497.A O no hydrogen 3.099 N/A LYS 502.A N THR 498.A O no hydrogen 3.099 N/A CYS 503.A N CYS 499.A O no hydrogen 3.043 N/A CYS 503.A SG SER 477.A O no hydrogen 3.886 N/A CYS 504.A N ALA 500.A O no hydrogen 3.060 N/A CYS 504.A SG ALA 500.A O no hydrogen 3.784 N/A ALA 505.A N GLN 501.A O no hydrogen 2.999 N/A PHE 506.A N LYS 502.A O no hydrogen 3.204 N/A ASN 507.A N CYS 503.A O no hydrogen 2.829 N/A ASN 507.A ND2 SER 477.A OG no hydrogen 3.071 N/A ARG 510.A N ASN 507.A O no hydrogen 3.266 N/A ARG 510.A NH2 GLU 512.A OE1 no hydrogen 2.813 N/A LYS 514.A N ARG 510.A O no hydrogen 3.365 N/A ALA 515.A N GLU 511.A O no hydrogen 2.946 N/A LEU 516.A N GLU 512.A O no hydrogen 2.971 N/A LEU 517.A N GLY 513.A O no hydrogen 3.121 N/A ARG 518.A N LYS 514.A O no hydrogen 3.152 N/A GLN 519.A N ALA 515.A O no hydrogen 3.054 N/A ILE 520.A N LEU 516.A O no hydrogen 3.126 N/A LEU 521.A N LEU 517.A O no hydrogen 3.206 N/A GLN 522.A N ARG 518.A O no hydrogen 2.924 N/A LEU 523.A N GLN 519.A O no hydrogen 2.945 N/A