Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4wwn_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLN 5.A N SER 1.A O no hydrogen 3.301 N/A PHE 7.A N GLU 3.A O no hydrogen 2.848 N/A GLN 8.A N SER 4.A O no hydrogen 3.000 N/A ARG 9.A N GLN 5.A O no hydrogen 3.085 N/A GLN 10.A N ALA 6.A O no hydrogen 2.952 N/A LEU 11.A N PHE 7.A O no hydrogen 2.869 N/A THR 12.A N GLN 8.A O no hydrogen 2.833 N/A THR 12.A OG1 GLN 8.A O no hydrogen 3.087 N/A ALA 13.A N ARG 9.A O no hydrogen 3.071 N/A LEU 14.A N GLN 10.A O no hydrogen 3.055 N/A ILE 15.A N LEU 11.A O no hydrogen 2.880 N/A GLY 16.A N THR 12.A O no hydrogen 2.584 N/A THR 20.A N ASP 18.A OD1 no hydrogen 2.983 N/A THR 20.A OG1 ASP 18.A OD1 no hydrogen 2.713 N/A SER 23.A N ASP 21.A OD1 no hydrogen 2.898 N/A SER 23.A OG ASP 21.A OD1 no hydrogen 2.705 N/A ASN 24.A ND2 THR 278.A O no hydrogen 2.773 N/A GLU 29.A N ASP 27.A OD1 no hydrogen 2.582 N/A PHE 32.A N ASP 28.A O no hydrogen 2.826 N/A THR 33.A N GLU 29.A O no hydrogen 2.858 N/A THR 33.A OG1 GLU 29.A O no hydrogen 2.882 N/A ARG 34.A N LEU 30.A O no hydrogen 3.038 N/A ARG 34.A NE GLU 476.A OE2 no hydrogen 3.149 N/A ARG 34.A NH1 GLU 31.A OE1 no hydrogen 3.325 N/A ARG 34.A NH2 GLU 476.A OE1 no hydrogen 2.651 N/A ARG 35.A N GLU 31.A O no hydrogen 3.143 N/A GLY 36.A N PHE 32.A O no hydrogen 2.885 N/A LEU 37.A N THR 33.A O no hydrogen 2.930 N/A VAL 38.A N ARG 35.A O no hydrogen 3.430 N/A ARG 41.A N LEU 37.A O no hydrogen 3.213 N/A ARG 41.A NH1 GLU 154.A OE1 no hydrogen 2.675 N/A MET 42.A N VAL 38.A O no hydrogen 2.863 N/A ALA 43.A N THR 39.A O no hydrogen 2.877 N/A GLU 44.A N PRO 40.A O no hydrogen 3.171 N/A VAL 45.A N ARG 41.A O no hydrogen 2.921 N/A ALA 46.A N MET 42.A O no hydrogen 2.861 N/A SER 47.A N ALA 43.A O no hydrogen 2.871 N/A SER 47.A OG ALA 43.A O no hydrogen 3.288 N/A ARG 48.A NH1 LEU 444.A O no hydrogen 2.735 N/A ARG 48.A NH1 GLY 481.A O no hydrogen 3.106 N/A ARG 48.A NH2 GLY 481.A O no hydrogen 2.675 N/A LEU 52.A N ASP 49.A OD2 no hydrogen 3.278 N/A TYR 53.A N ASP 49.A O no hydrogen 2.867 N/A TYR 53.A OH CYS 482.A O no hydrogen 2.708 N/A ALA 54.A N PRO 50.A O no hydrogen 3.071 N/A MET 55.A N LYS 51.A O no hydrogen 3.321 N/A HIS 56.A N LEU 52.A O no hydrogen 2.783 N/A THR 60.A N ASN 122.A O no hydrogen 2.942 N/A THR 60.A OG1 GLU 410.A OE1 no hydrogen 3.414 N/A THR 60.A OG1 ASP 412.A OD2 no hydrogen 3.235 N/A SER 61.A N GLU 410.A OE2 no hydrogen 2.882 N/A SER 61.A OG GLU 410.A OE2 no hydrogen 3.504 N/A LYS 62.A N THR 60.A OG1 no hydrogen 3.058 N/A TRP 69.A N PRO 65.A O no hydrogen 3.060 N/A LYS 70.A N GLU 66.A O no hydrogen 3.308 N/A LYS 70.A NZ GLU 66.A OE1 no hydrogen 3.478 N/A LYS 71.A N LEU 68.A O no hydrogen 3.374 N/A LYS 71.A NZ LYS 131.A O no hydrogen 2.949 N/A ILE 72.A N TRP 69.A O no hydrogen 3.022 N/A CYS 76.A SG VAL 92.A O no hydrogen 3.778 N/A ILE 77.A N VAL 92.A O no hydrogen 2.738 N/A ILE 79.A N ILE 90.A O no hydrogen 3.011 N/A VAL 80.A N ILE 136.A O no hydrogen 3.172 N/A ILE 81.A N GLN 88.A O no hydrogen 2.854 N/A HIS 82.A N VAL 138.A O no hydrogen 2.891 N/A HIS 82.A NE2 HIS 137.A ND1 no hydrogen 3.221 N/A ARG 83.A N THR 86.A O no hydrogen 3.002 N/A SER 84.A OG ARG 83.A O no hydrogen 2.769 N/A GLN 88.A N ILE 81.A O no hydrogen 3.128 N/A THR 89.A N GLN 88.A OE1 no hydrogen 3.419 N/A ILE 90.A N ILE 79.A O no hydrogen 3.132 N/A VAL 92.A N ILE 77.A O no hydrogen 2.838 N/A SER 93.A OG ASP 96.A OD1 no hydrogen 3.039 N/A ASP 95.A N SER 93.A OG no hydrogen 3.243 N/A ASP 96.A N SER 93.A O no hydrogen 2.742 N/A GLY 99.A N THR 97.A OG1 no hydrogen 3.149 N/A ILE 101.A N PRO 98.A O no hydrogen 3.338 N/A ARG 106.A N VAL 139.A O no hydrogen 3.260 N/A ARG 106.A NE ASP 141.A OD2 no hydrogen 3.207 N/A ARG 106.A NH1 ARG 110.A O no hydrogen 2.577 N/A ARG 106.A NH1 ASP 573.A OD2 no hydrogen 2.855 N/A ARG 106.A NH2 ASP 573.A OD1 no hydrogen 3.470 N/A ARG 106.A NH2 THR 575.A OG1 no hydrogen 3.391 N/A VAL 107.A N GLU 112.A O no hydrogen 2.672 N/A CYS 108.A N HIS 137.A O no hydrogen 3.125 N/A ARG 110.A N VAL 107.A O no hydrogen 3.312 N/A ARG 110.A NH1 ASP 542.A OD1 no hydrogen 3.293 N/A ARG 110.A NH1 ASP 542.A OD2 no hydrogen 3.330 N/A ARG 110.A NH2 ASP 542.A OD2 no hydrogen 2.805 N/A ASP 111.A N GLY 544.A O no hydrogen 2.788 N/A LEU 114.A N LEU 105.A O no hydrogen 2.845 N/A THR 118.A N GLY 116.A O no hydrogen 2.798 N/A ILE 120.A N ASP 96.A O no hydrogen 2.945 N/A LYS 121.A N PRO 94.A O no hydrogen 3.015 N/A ASN 122.A N PRO 119.A O no hydrogen 2.865 N/A PHE 123.A N ILE 120.A O no hydrogen 3.067 N/A GLN 124.A N TRP 58.A O no hydrogen 3.110 N/A ARG 127.A N PHE 123.A O no hydrogen 2.987 N/A ARG 127.A NE LYS 121.A O no hydrogen 2.805 N/A ARG 127.A NH1 LYS 62.A O no hydrogen 3.377 N/A ARG 127.A NH1 PRO 63.A O no hydrogen 3.285 N/A ARG 127.A NH2 LYS 62.A O no hydrogen 2.687 N/A ARG 127.A NH2 ASN 122.A OD1 no hydrogen 2.972 N/A HIS 128.A N GLN 124.A O no hydrogen 2.692 N/A CYS 129.A N TRP 125.A O no hydrogen 2.946 N/A CYS 129.A SG TRP 125.A O no hydrogen 3.410 N/A LEU 130.A N VAL 126.A O no hydrogen 3.155 N/A LYS 131.A N ARG 127.A O no hydrogen 3.236 N/A LYS 131.A NZ ASP 615.A OD1 no hydrogen 3.516 N/A LYS 131.A NZ ASP 615.A OD2 no hydrogen 3.523 N/A ASN 132.A N HIS 128.A O no hydrogen 3.317 N/A GLU 134.A N CYS 129.A O no hydrogen 2.896 N/A HIS 137.A ND1 HIS 82.A NE2 no hydrogen 3.221 N/A HIS 137.A NE2 GLU 135.A OE1 no hydrogen 2.916 N/A VAL 138.A N VAL 80.A O no hydrogen 3.241 N/A VAL 139.A N ARG 106.A O no hydrogen 2.769 N/A LEU 140.A N HIS 82.A O no hydrogen 3.434 N/A ASP 141.A N VAL 104.A O no hydrogen 3.138 N/A THR 142.A N ASP 141.A OD1 no hydrogen 2.827 N/A ALA 147.A N ASP 145.A OD1 no hydrogen 3.003 N/A LEU 148.A N ASP 145.A O no hydrogen 3.017 N/A ASP 149.A N PRO 146.A O no hydrogen 2.859 N/A GLU 150.A N ALA 147.A O no hydrogen 3.194 N/A ARG 152.A NH1 LYS 153.A O no hydrogen 2.705 N/A ARG 152.A NH2 SER 4.A OG no hydrogen 3.264 N/A VAL 156.A N PRO 296.A O no hydrogen 2.970 N/A LEU 158.A N ALA 298.A O no hydrogen 2.812 N/A TRP 159.A N SER 157.A OG no hydrogen 3.266 N/A CYS 161.A N LEU 158.A O no hydrogen 3.297 N/A PHE 165.A N ILE 217.A O no hydrogen 3.073 N/A VAL 167.A N LEU 213.A O no hydrogen 3.267 N/A LYS 168.A N LEU 291.A O no hydrogen 3.121 N/A LYS 168.A NZ ASN 210.A OD1 no hydrogen 2.736 N/A ILE 169.A N VAL 211.A O no hydrogen 2.997 N/A ARG 170.A N SER 289.A O no hydrogen 2.762 N/A ARG 170.A NE GLU 258.A OE1 no hydrogen 3.078 N/A ARG 170.A NE GLU 258.A OE2 no hydrogen 3.042 N/A ARG 170.A NH1 GLU 258.A OE2 no hydrogen 2.758 N/A GLY 171.A N SER 289.A O no hydrogen 3.484 N/A ILE 172.A N VAL 207.A O no hydrogen 2.826 N/A ASP 173.A N SER 287.A O no hydrogen 3.075 N/A ILE 174.A N GLU 205.A O no hydrogen 2.749 N/A VAL 180.A N LYS 201.A O no hydrogen 2.749 N/A PHE 181.A N TYR 233.A O no hydrogen 2.947 N/A VAL 182.A N THR 198.A OG1 no hydrogen 2.989 N/A GLU 183.A N GLN 231.A O no hydrogen 2.756 N/A ALA 184.A N ARG 196.A O no hydrogen 2.731 N/A ASN 185.A N ASN 229.A O no hydrogen 2.753 N/A ASN 185.A ND2 GLU 183.A OE1 no hydrogen 2.771 N/A ASN 185.A ND2 ASN 229.A OD1 no hydrogen 3.469 N/A ILE 186.A N CYS 194.A O no hydrogen 2.769 N/A GLN 187.A N LEU 227.A O no hydrogen 2.747 N/A HIS 188.A N GLN 191.A O no hydrogen 2.821 N/A GLN 191.A N HIS 188.A O no hydrogen 2.831 N/A LEU 193.A N ILE 186.A O no hydrogen 2.782 N/A CYS 194.A N ILE 186.A O no hydrogen 3.377 N/A CYS 194.A SG SER 216.A OG no hydrogen 2.560 N/A GLN 195.A NE2 ASN 185.A OD1 no hydrogen 2.762 N/A ARG 196.A N ALA 184.A O no hydrogen 3.123 N/A ARG 196.A NH2 GLN 195.A O no hydrogen 2.754 N/A ARG 197.A NE GLU 183.A OE2 no hydrogen 2.586 N/A THR 198.A N VAL 182.A O no hydrogen 2.908 N/A THR 198.A OG1 VAL 182.A O no hydrogen 3.520 N/A THR 198.A OG1 SER 199.A O no hydrogen 3.245 N/A LYS 201.A N VAL 180.A O no hydrogen 3.071 N/A PHE 203.A N LEU 178.A O no hydrogen 2.946 N/A THR 204.A N PRO 202.A O no hydrogen 3.063 N/A GLU 206.A N THR 204.A OG1 no hydrogen 3.387 N/A VAL 207.A N ILE 172.A O no hydrogen 2.926 N/A TRP 209.A N ARG 170.A O no hydrogen 2.743 N/A TRP 209.A NE1 SER 199.A O no hydrogen 2.903 N/A ASN 210.A N ARG 170.A O no hydrogen 3.207 N/A LEU 213.A N VAL 167.A O no hydrogen 3.046 N/A PHE 215.A N PHE 165.A O no hydrogen 3.032 N/A ILE 219.A N ARG 163.A O no hydrogen 3.048 N/A LYS 220.A N CYS 161.A O no hydrogen 3.372 N/A LYS 220.A NZ ASP 162.A OD1 no hydrogen 2.865 N/A ASP 221.A N LYS 218.A O no hydrogen 2.828 N/A LEU 222.A N ILE 219.A O no hydrogen 2.816 N/A LYS 224.A NZ GLU 396.A OE1 no hydrogen 2.801 N/A LYS 224.A NZ GLU 396.A OE2 no hydrogen 2.879 N/A ALA 226.A N PRO 223.A O no hydrogen 3.050 N/A LEU 227.A N GLN 187.A O no hydrogen 2.868 N/A LEU 228.A N LEU 245.A O no hydrogen 2.767 N/A ASN 229.A N ASN 185.A O no hydrogen 2.617 N/A ASN 229.A ND2 ASN 244.A OD1 no hydrogen 2.422 N/A LEU 230.A N VAL 243.A O no hydrogen 2.803 N/A GLN 231.A N GLU 183.A O no hydrogen 2.833 N/A ILE 232.A N TYR 241.A O no hydrogen 2.827 N/A TYR 233.A N PHE 181.A O no hydrogen 2.966 N/A TYR 233.A OH GLU 183.A OE1 no hydrogen 3.210 N/A TYR 233.A OH GLN 231.A OE1 no hydrogen 2.818 N/A CYS 234.A N GLN 238.A O no hydrogen 3.330 N/A GLY 235.A N THR 179.A O no hydrogen 3.108 N/A LEU 240.A N ILE 232.A O no hydrogen 2.944 N/A TYR 241.A N ILE 232.A O no hydrogen 3.425 N/A TYR 242.A N TRP 264.A O no hydrogen 3.097 N/A VAL 243.A N LEU 230.A O no hydrogen 2.755 N/A ASN 244.A ND2 LYS 273.A O no hydrogen 2.576 N/A ASN 244.A ND2 THR 275.A O no hydrogen 2.939 N/A LEU 245.A N LEU 228.A O no hydrogen 2.883 N/A LEU 247.A N ALA 226.A O no hydrogen 2.934 N/A ASP 249.A N LEU 253.A O no hydrogen 2.951 N/A HIS 250.A NE2 ASP 28.A OD1 no hydrogen 2.745 N/A ARG 251.A NH1 ASP 28.A OD1 no hydrogen 2.984 N/A ARG 251.A NH1 ASP 28.A OD2 no hydrogen 3.368 N/A ARG 251.A NH2 ASP 28.A OD2 no hydrogen 3.333 N/A PHE 252.A N ASP 249.A O no hydrogen 2.958 N/A LEU 254.A N ILE 297.A O no hydrogen 2.654 N/A ARG 255.A N LEU 247.A O no hydrogen 2.734 N/A ARG 255.A NH1 LEU 246.A O no hydrogen 2.770 N/A GLY 257.A N LEU 292.A O no hydrogen 2.390 N/A TYR 259.A N ILE 290.A O no hydrogen 3.014 N/A TYR 259.A OH ARG 256.A O no hydrogen 3.203 N/A LEU 261.A N ILE 288.A O no hydrogen 2.945 N/A MET 263.A N MET 286.A O no hydrogen 2.715 N/A TRP 264.A N TYR 242.A O no hydrogen 3.003 N/A TRP 264.A NE1 ALA 277.A O no hydrogen 2.978 N/A ILE 266.A N LEU 240.A O no hydrogen 3.136 N/A PHE 269.A N THR 786.A O no hydrogen 2.724 N/A ALA 271.A N MET 779.A O no hydrogen 2.844 N/A ASP 272.A N ASN 270.A OD1 no hydrogen 2.798 N/A LYS 273.A N ASN 270.A O no hydrogen 3.008 N/A LEU 274.A N ALA 271.A O no hydrogen 2.954 N/A THR 275.A N ASP 272.A O no hydrogen 3.345 N/A THR 275.A OG1 HIS 466.A O no hydrogen 2.473 N/A ALA 277.A N THR 275.A OG1 no hydrogen 2.797 N/A THR 278.A OG1 ASN 24.A OD1 no hydrogen 2.465 N/A ASN 279.A N HIS 262.A O no hydrogen 2.973 N/A ASN 279.A ND2 MET 263.A O no hydrogen 2.815 N/A ASP 281.A N ASN 279.A OD1 no hydrogen 2.817 N/A SER 285.A N ASP 281.A O no hydrogen 2.913 N/A SER 285.A OG HIS 262.A ND1 no hydrogen 2.913 N/A SER 285.A OG ASP 281.A O no hydrogen 2.917 N/A SER 287.A N ASP 173.A O no hydrogen 3.037 N/A ILE 288.A N LEU 261.A O no hydrogen 2.893 N/A SER 289.A N GLY 171.A O no hydrogen 2.778 N/A ILE 290.A N TYR 259.A O no hydrogen 3.032 N/A LEU 291.A N LYS 168.A O no hydrogen 3.192 N/A LEU 292.A N GLY 257.A O no hydrogen 2.824 N/A ALA 298.A N VAL 156.A O no hydrogen 2.842 N/A LEU 299.A N PHE 252.A O no hydrogen 2.901 N/A ARG 310.A N PRO 306.A O no hydrogen 3.118 N/A ARG 310.A NH2 GLU 339.A OE1 no hydrogen 3.297 N/A LYS 311.A N ASN 307.A O no hydrogen 2.993 N/A GLN 312.A N GLN 308.A O no hydrogen 2.853 N/A LEU 313.A N LEU 309.A O no hydrogen 2.718 N/A GLU 314.A N ARG 310.A O no hydrogen 2.781 N/A ALA 315.A N LYS 311.A O no hydrogen 2.910 N/A ILE 316.A N GLN 312.A O no hydrogen 3.207 N/A ILE 317.A N LEU 313.A O no hydrogen 2.992 N/A ALA 318.A N GLU 314.A O no hydrogen 3.059 N/A THR 319.A N ALA 315.A O no hydrogen 3.111 N/A THR 319.A N ILE 316.A O no hydrogen 3.042 N/A THR 319.A OG1 ILE 316.A O no hydrogen 2.702 N/A LEU 322.A N ASP 320.A OD2 no hydrogen 3.077 N/A ASN 323.A N ASP 320.A O no hydrogen 3.025 N/A THR 326.A N ASP 329.A OD2 no hydrogen 3.128 N/A ASP 329.A N THR 326.A OG1 no hydrogen 2.969 N/A LYS 330.A N THR 326.A O no hydrogen 2.877 N/A GLU 331.A N ALA 327.A O no hydrogen 2.747 N/A LEU 332.A N GLU 328.A O no hydrogen 3.205 N/A LEU 333.A N ASP 329.A O no hydrogen 2.882 N/A TRP 334.A N LYS 330.A O no hydrogen 3.021 N/A HIS 335.A N GLU 331.A O no hydrogen 2.969 N/A PHE 336.A N LEU 332.A O no hydrogen 3.022 N/A ARG 337.A N TRP 334.A O no hydrogen 3.012 N/A ARG 337.A NH1 TRP 334.A O no hydrogen 3.122 N/A SER 340.A N PHE 336.A O no hydrogen 2.861 N/A SER 340.A OG LEU 333.A O no hydrogen 3.379 N/A SER 340.A OG PHE 336.A O no hydrogen 3.100 N/A LEU 341.A N ARG 337.A O no hydrogen 2.988 N/A LYS 342.A N GLU 339.A O no hydrogen 3.151 N/A LYS 342.A NZ GLU 339.A OE1 no hydrogen 3.179 N/A HIS 343.A N SER 340.A O no hydrogen 3.334 N/A ALA 346.A N HIS 343.A O no hydrogen 2.862 N/A TYR 347.A N PRO 344.A O no hydrogen 3.117 N/A TYR 347.A OH LEU 341.A O no hydrogen 2.908 N/A LYS 349.A NZ THR 319.A O no hydrogen 3.433 N/A LYS 349.A NZ ASP 320.A O no hydrogen 2.908 N/A LEU 350.A N ALA 346.A O no hydrogen 2.769 N/A PHE 351.A N TYR 347.A O no hydrogen 2.808 N/A SER 352.A N PRO 348.A O no hydrogen 3.028 N/A SER 352.A OG PRO 348.A O no hydrogen 2.600 N/A SER 353.A N LEU 350.A O no hydrogen 2.951 N/A SER 353.A OG LYS 349.A O no hydrogen 2.753 N/A TRP 356.A NE1 PHE 351.A O no hydrogen 3.244 N/A GLN 358.A N LYS 355.A O no hydrogen 3.205 N/A GLN 359.A N ASP 221.A OD1 no hydrogen 2.986 N/A VAL 362.A N GLN 358.A O no hydrogen 3.170 N/A ALA 363.A N GLN 359.A O no hydrogen 3.161 N/A LYS 364.A N GLU 360.A O no hydrogen 3.116 N/A THR 365.A N ILE 361.A O no hydrogen 2.943 N/A THR 365.A OG1 ILE 361.A O no hydrogen 2.813 N/A TYR 366.A N VAL 362.A O no hydrogen 3.016 N/A TYR 366.A OH ASP 395.A OD2 no hydrogen 2.299 N/A GLN 367.A N ALA 363.A O no hydrogen 3.043 N/A LEU 368.A N LYS 364.A O no hydrogen 3.112 N/A LEU 369.A N THR 365.A O no hydrogen 2.960 N/A ALA 370.A N TYR 366.A O no hydrogen 3.033 N/A ARG 371.A N LEU 368.A O no hydrogen 3.054 N/A GLU 373.A N ARG 371.A O no hydrogen 2.777 N/A TRP 375.A NE1 ILE 401.A O no hydrogen 2.921 N/A ASP 376.A N ARG 372.A O no hydrogen 3.015 N/A GLN 377.A N GLU 373.A O no hydrogen 3.213 N/A SER 378.A N TRP 375.A O no hydrogen 3.154 N/A SER 378.A OG TRP 375.A O no hydrogen 2.985 N/A LEU 384.A N ASP 381.A O no hydrogen 3.119 N/A LEU 384.A N ASP 381.A OD1 no hydrogen 3.115 N/A THR 385.A N ASP 381.A O no hydrogen 2.971 N/A THR 385.A OG1 ASP 381.A O no hydrogen 2.725 N/A MET 386.A N VAL 382.A O no hydrogen 2.721 N/A GLN 387.A NE2 GLY 383.A O no hydrogen 3.338 N/A LEU 388.A N THR 385.A O no hydrogen 3.163 N/A LEU 389.A N MET 386.A O no hydrogen 2.958 N/A ASP 390.A N GLN 387.A O no hydrogen 3.356 N/A ASN 392.A N ASP 390.A OD1 no hydrogen 2.632 N/A ASN 392.A ND2 ASP 390.A OD1 no hydrogen 3.198 N/A ASN 392.A ND2 ASP 390.A OD2 no hydrogen 2.969 N/A PHE 393.A N ASP 390.A O no hydrogen 3.298 N/A ASN 397.A N ASP 395.A OD1 no hydrogen 2.784 N/A VAL 398.A N ASP 395.A OD1 no hydrogen 3.051 N/A ARG 399.A N ASP 395.A O no hydrogen 2.896 N/A ARG 399.A NE GLU 428.A OE1 no hydrogen 2.655 N/A ARG 399.A NH1 LEU 389.A O no hydrogen 2.907 N/A ARG 399.A NH1 GLU 428.A OE1 no hydrogen 3.009 N/A ARG 399.A NH2 LEU 389.A O no hydrogen 3.011 N/A ARG 399.A NH2 ASP 390.A O no hydrogen 3.058 N/A ARG 399.A NH2 PHE 393.A O no hydrogen 2.715 N/A ALA 400.A N GLU 396.A O no hydrogen 2.748 N/A ILE 401.A N VAL 398.A O no hydrogen 3.132 N/A ALA 402.A N ARG 399.A O no hydrogen 3.000 N/A VAL 403.A N ARG 399.A O no hydrogen 3.298 N/A GLN 404.A N ALA 400.A O no hydrogen 2.848 N/A LYS 405.A N ALA 402.A O no hydrogen 2.875 N/A LYS 405.A NZ TRP 375.A O no hydrogen 3.017 N/A LYS 405.A NZ ASP 376.A O no hydrogen 3.174 N/A LYS 405.A NZ SER 378.A OG no hydrogen 3.220 N/A LEU 406.A N ALA 402.A O no hydrogen 3.109 N/A GLU 407.A N VAL 403.A O no hydrogen 3.234 N/A GLU 407.A N GLN 404.A O no hydrogen 3.385 N/A SER 408.A N LYS 405.A O no hydrogen 3.303 N/A SER 408.A OG LYS 405.A O no hydrogen 2.990 N/A LEU 409.A N LEU 406.A O no hydrogen 3.221 N/A ASP 413.A N GLU 410.A O no hydrogen 2.804 N/A VAL 414.A N GLU 410.A O no hydrogen 3.270 N/A VAL 414.A N ASP 411.A O no hydrogen 3.286 N/A LEU 415.A N ASP 411.A O no hydrogen 3.332 N/A HIS 416.A N ASP 412.A O no hydrogen 3.389 N/A HIS 416.A ND1 ASP 412.A O no hydrogen 2.621 N/A TYR 417.A N VAL 414.A O no hydrogen 2.641 N/A LEU 418.A N LEU 415.A O no hydrogen 3.408 N/A GLN 420.A NE2 LEU 773.A O no hydrogen 3.121 N/A LEU 421.A N TYR 417.A O no hydrogen 2.802 N/A VAL 422.A N LEU 418.A O no hydrogen 2.599 N/A GLN 423.A N LEU 419.A O no hydrogen 2.891 N/A GLN 423.A NE2 GLU 460.A OE2 no hydrogen 2.432 N/A ALA 424.A N LEU 421.A O no hydrogen 3.277 N/A VAL 425.A N VAL 422.A O no hydrogen 3.287 N/A LYS 426.A N GLN 423.A O no hydrogen 3.034 N/A LYS 426.A NZ GLN 423.A OE1 no hydrogen 2.912 N/A LYS 426.A NZ GLU 460.A OE1 no hydrogen 3.167 N/A LYS 426.A NZ GLU 460.A OE2 no hydrogen 3.274 N/A LYS 426.A NZ THR 780.A O no hydrogen 2.878 N/A PHE 427.A N ALA 424.A O no hydrogen 3.082 N/A GLU 428.A N VAL 425.A O no hydrogen 3.129 N/A TYR 430.A OH ILE 248.A O no hydrogen 2.401 N/A HIS 431.A N GLU 29.A OE2 no hydrogen 2.774 N/A ALA 436.A N SER 433.A OG no hydrogen 3.183 N/A ARG 437.A N SER 433.A O no hydrogen 3.171 N/A ARG 437.A NE ASP 432.A OD1 no hydrogen 2.923 N/A ARG 437.A NH2 ASP 432.A OD1 no hydrogen 3.364 N/A ARG 437.A NH2 ASP 432.A OD2 no hydrogen 2.570 N/A PHE 438.A N ALA 434.A O no hydrogen 2.967 N/A LEU 439.A N LEU 435.A O no hydrogen 3.010 N/A LEU 440.A N ALA 436.A O no hydrogen 2.922 N/A LYS 441.A N ARG 437.A O no hydrogen 2.925 N/A LYS 441.A NZ GLU 407.A OE1 no hydrogen 2.942 N/A LYS 441.A NZ GLU 407.A OE2 no hydrogen 3.548 N/A ARG 442.A N PHE 438.A O no hydrogen 2.829 N/A ARG 442.A NH1 LEU 409.A O no hydrogen 2.828 N/A ARG 442.A NH2 LEU 409.A O no hydrogen 2.776 N/A ARG 442.A NH2 ASP 411.A OD1 no hydrogen 3.105 N/A GLY 443.A N LEU 439.A O no hydrogen 2.784 N/A LEU 444.A N LEU 440.A O no hydrogen 2.832 N/A ARG 445.A N ARG 442.A O no hydrogen 3.366 N/A ARG 445.A NE GLU 44.A OE2 no hydrogen 3.111 N/A ARG 445.A NH2 GLU 44.A OE1 no hydrogen 3.286 N/A ASN 446.A N GLY 443.A O no hydrogen 3.365 N/A LYS 447.A NZ ASP 149.A OD1 no hydrogen 2.616 N/A LYS 447.A NZ ASP 149.A OD2 no hydrogen 3.555 N/A ILE 449.A N ASN 446.A OD1 no hydrogen 2.653 N/A GLY 450.A N ASN 446.A O no hydrogen 2.639 N/A HIS 451.A N LYS 447.A O no hydrogen 2.741 N/A HIS 451.A NE2 PRO 540.A O no hydrogen 2.569 N/A PHE 452.A N ARG 448.A O no hydrogen 3.266 N/A LEU 453.A N ILE 449.A O no hydrogen 2.876 N/A PHE 454.A N GLY 450.A O no hydrogen 3.077 N/A TRP 455.A N HIS 451.A O no hydrogen 3.296 N/A TRP 455.A NE1 GLN 493.A OE1 no hydrogen 3.041 N/A PHE 456.A N PHE 452.A O no hydrogen 2.761 N/A LEU 457.A N LEU 453.A O no hydrogen 3.014 N/A ARG 458.A N PHE 454.A O no hydrogen 2.759 N/A ARG 458.A NE LEU 14.A O no hydrogen 2.784 N/A ARG 458.A NH2 ALA 13.A O no hydrogen 3.121 N/A ARG 458.A NH2 LEU 14.A O no hydrogen 3.322 N/A SER 459.A N TRP 455.A O no hydrogen 2.951 N/A SER 459.A OG SER 625.A O no hydrogen 3.302 N/A ILE 461.A N LEU 457.A O no hydrogen 2.969 N/A ALA 462.A N ARG 458.A O no hydrogen 3.046 N/A GLN 463.A N GLU 460.A O no hydrogen 3.351 N/A GLN 463.A NE2 SER 459.A O no hydrogen 3.035 N/A GLN 463.A NE2 SER 625.A OG no hydrogen 2.896 N/A SER 464.A N GLU 460.A O no hydrogen 2.782 N/A ARG 465.A NH1 GLN 463.A O no hydrogen 3.060 N/A TYR 467.A N SER 464.A OG no hydrogen 2.867 N/A TYR 467.A OH ALA 271.A O no hydrogen 2.606 N/A TYR 467.A OH LYS 426.A O no hydrogen 2.945 N/A GLN 468.A N SER 464.A O no hydrogen 3.066 N/A GLN 468.A NE2 ILE 461.A O no hydrogen 3.122 N/A GLN 469.A NE2 ASN 24.A O no hydrogen 2.837 N/A ARG 470.A NE HIS 431.A ND1 no hydrogen 2.860 N/A ARG 470.A NH1 VAL 425.A O no hydrogen 2.944 N/A ARG 470.A NH1 GLU 428.A O no hydrogen 2.767 N/A ARG 470.A NH2 GLU 428.A O no hydrogen 3.065 N/A ARG 470.A NH2 HIS 431.A ND1 no hydrogen 3.398 N/A PHE 471.A N TYR 467.A O no hydrogen 3.121 N/A ALA 472.A N GLN 468.A O no hydrogen 2.794 N/A VAL 473.A N GLN 469.A O no hydrogen 2.997 N/A ILE 474.A N ARG 470.A O no hydrogen 3.038 N/A LEU 475.A N PHE 471.A O no hydrogen 2.876 N/A GLU 476.A N ALA 472.A O no hydrogen 2.951 N/A ALA 477.A N VAL 473.A O no hydrogen 3.242 N/A TYR 478.A N ILE 474.A O no hydrogen 3.196 N/A LEU 479.A N LEU 475.A O no hydrogen 2.801 N/A ARG 480.A N GLU 476.A O no hydrogen 2.802 N/A ARG 480.A NE GLU 476.A OE1 no hydrogen 2.771 N/A ARG 480.A NH1 GLU 154.A OE2 no hydrogen 3.444 N/A ARG 480.A NH2 GLN 8.A OE1 no hydrogen 2.560 N/A ARG 480.A NH2 GLU 476.A OE1 no hydrogen 3.320 N/A GLY 481.A N TYR 478.A O no hydrogen 2.944 N/A CYS 482.A N LEU 479.A O no hydrogen 3.451 N/A CYS 482.A SG TYR 478.A O no hydrogen 3.775 N/A CYS 482.A SG LEU 479.A O no hydrogen 3.042 N/A CYS 482.A SG GLY 483.A O no hydrogen 3.915 N/A THR 484.A N GLU 150.A O no hydrogen 2.989 N/A THR 484.A OG1 GLU 150.A O no hydrogen 2.908 N/A ALA 485.A N LEU 148.A O no hydrogen 3.120 N/A LEU 487.A N GLY 483.A O no hydrogen 3.076 N/A HIS 488.A N THR 484.A O no hydrogen 2.963 N/A ASP 489.A N ALA 485.A O no hydrogen 2.741 N/A PHE 490.A N MET 486.A O no hydrogen 2.543 N/A THR 491.A N LEU 487.A O no hydrogen 2.727 N/A THR 491.A OG1 LEU 487.A O no hydrogen 3.011 N/A GLN 492.A N HIS 488.A O no hydrogen 3.075 N/A GLN 493.A N ASP 489.A O no hydrogen 3.007 N/A GLN 493.A NE2 ASP 489.A OD1 no hydrogen 3.268 N/A VAL 494.A N PHE 490.A O no hydrogen 2.869 N/A GLN 495.A N THR 491.A O no hydrogen 3.126 N/A VAL 496.A N GLN 492.A O no hydrogen 3.163 N/A ILE 497.A N GLN 493.A O no hydrogen 3.256 N/A GLU 498.A N VAL 494.A O no hydrogen 2.952 N/A GLU 498.A N GLN 495.A O no hydrogen 3.153 N/A MET 499.A N GLN 495.A O no hydrogen 2.976 N/A LEU 500.A N VAL 496.A O no hydrogen 2.882 N/A GLN 501.A N ILE 497.A O no hydrogen 3.015 N/A LYS 502.A N GLU 498.A O no hydrogen 3.350 N/A VAL 503.A N MET 499.A O no hydrogen 3.285 N/A THR 504.A N LEU 500.A O no hydrogen 2.942 N/A THR 504.A OG1 LEU 500.A O no hydrogen 2.647 N/A LEU 505.A N GLN 501.A O no hydrogen 2.724 N/A ASP 506.A N LYS 502.A O no hydrogen 2.641 N/A ILE 507.A N VAL 503.A O no hydrogen 2.990 N/A LYS 508.A N THR 504.A O no hydrogen 3.104 N/A LYS 508.A NZ HIS 588.A ND1 no hydrogen 2.942 N/A LYS 508.A NZ HIS 588.A O no hydrogen 2.796 N/A SER 509.A N LEU 505.A O no hydrogen 3.160 N/A SER 509.A OG LEU 505.A O no hydrogen 2.951 N/A LEU 510.A N ILE 507.A O no hydrogen 3.009 N/A SER 511.A OG ILE 507.A O no hydrogen 2.893 N/A SER 511.A OG LYS 508.A O no hydrogen 3.000 N/A GLN 520.A N GLN 516.A O no hydrogen 3.287 N/A LEU 521.A N VAL 517.A O no hydrogen 2.684 N/A GLN 523.A N SER 519.A O no hydrogen 2.911 N/A LEU 525.A N LEU 521.A O no hydrogen 3.133 N/A GLU 526.A N LYS 522.A O no hydrogen 3.162 N/A ASN 527.A N GLN 523.A O no hydrogen 3.067 N/A LEU 528.A N LYS 524.A O no hydrogen 3.170 N/A GLN 529.A N LEU 525.A O no hydrogen 3.066 N/A GLN 529.A NE2 LEU 550.A O no hydrogen 3.164 N/A ASN 530.A N ASN 527.A O no hydrogen 3.030 N/A SER 531.A N ASN 527.A O no hydrogen 2.657 N/A SER 531.A OG ASN 527.A O no hydrogen 2.779 N/A GLN 532.A N LEU 528.A O no hydrogen 3.205 N/A LEU 533.A N LEU 528.A O no hydrogen 2.792 N/A PHE 537.A N ALA 547.A O no hydrogen 2.789 N/A ARG 538.A NE ASP 489.A OD2 no hydrogen 2.592 N/A ARG 538.A NH1 ASP 111.A OD2 no hydrogen 2.850 N/A ARG 538.A NH1 PRO 543.A O no hydrogen 2.978 N/A ARG 538.A NH2 ASP 111.A OD2 no hydrogen 3.283 N/A ARG 538.A NH2 ASP 489.A OD2 no hydrogen 3.024 N/A VAL 539.A N LEU 545.A O no hydrogen 3.025 N/A ASP 542.A N VAL 539.A O no hydrogen 2.693 N/A LEU 545.A N ASP 542.A O no hydrogen 3.137 N/A ALA 547.A N PHE 537.A O no hydrogen 2.674 N/A GLY 548.A N LYS 570.A O no hydrogen 2.673 N/A LEU 550.A N GLN 529.A OE1 no hydrogen 3.418 N/A ALA 551.A N GLU 568.A O no hydrogen 2.813 N/A LYS 554.A N ALA 551.A O no hydrogen 2.925 N/A CYS 555.A N ILE 552.A O no hydrogen 3.041 N/A CYS 555.A SG ALA 551.A O no hydrogen 3.260 N/A LYS 556.A N TRP 566.A O no hydrogen 2.979 N/A MET 558.A N PRO 564.A O no hydrogen 3.205 N/A LYS 562.A N SER 560.A OG no hydrogen 3.061 N/A LYS 562.A NZ ASP 590.A OD1 no hydrogen 2.806 N/A LYS 562.A NZ ASP 590.A OD2 no hydrogen 3.519 N/A LYS 563.A NZ SER 560.A O no hydrogen 3.060 N/A LEU 565.A N PHE 586.A O no hydrogen 2.553 N/A TRP 566.A N LYS 556.A O no hydrogen 2.961 N/A TRP 566.A NE1 GLU 568.A OE1 no hydrogen 2.679 N/A LEU 567.A N ILE 584.A O no hydrogen 2.784 N/A PHE 569.A N ILE 582.A O no hydrogen 2.850 N/A LYS 570.A N ALA 549.A O no hydrogen 2.638 N/A CYS 571.A SG GLY 109.A O no hydrogen 3.773 N/A CYS 571.A SG LYS 546.A O no hydrogen 3.599 N/A ALA 572.A N LYS 546.A O no hydrogen 3.204 N/A THR 575.A N ASP 573.A OD1 no hydrogen 3.024 N/A THR 575.A OG1 ASP 573.A OD1 no hydrogen 2.684 N/A ALA 576.A N ASP 573.A O no hydrogen 3.203 N/A THR 581.A OG1 GLU 568.A OE2 no hydrogen 2.712 N/A ILE 582.A N PHE 569.A O no hydrogen 2.609 N/A ILE 584.A N LEU 567.A O no hydrogen 3.001 N/A ILE 585.A N ILE 633.A O no hydrogen 2.925 N/A PHE 586.A N LEU 565.A O no hydrogen 2.766 N/A LYS 587.A N GLY 631.A O no hydrogen 3.113 N/A LYS 587.A NZ ASP 590.A OD2 no hydrogen 3.300 N/A GLY 589.A N LYS 629.A O no hydrogen 2.911 N/A ARG 593.A N ASP 591.A OD1 no hydrogen 3.393 N/A ARG 593.A NE ASP 591.A OD1 no hydrogen 3.228 N/A ARG 593.A NH1 ASP 591.A OD2 no hydrogen 3.270 N/A ARG 593.A NH2 GLU 460.A OE1 no hydrogen 3.444 N/A GLN 594.A NE2 ASP 591.A O no hydrogen 3.631 N/A MET 596.A N LEU 592.A O no hydrogen 2.860 N/A LEU 597.A N ARG 593.A O no hydrogen 3.120 N/A ILE 598.A N GLN 594.A O no hydrogen 3.150 N/A LEU 599.A N ASP 595.A O no hydrogen 3.019 N/A GLN 600.A N MET 596.A O no hydrogen 2.910 N/A ILE 601.A N LEU 597.A O no hydrogen 3.038 N/A LEU 602.A N ILE 598.A O no hydrogen 2.946 N/A ARG 603.A N LEU 599.A O no hydrogen 3.193 N/A ILE 604.A N GLN 600.A O no hydrogen 3.053 N/A MET 605.A N ILE 601.A O no hydrogen 2.837 N/A GLU 606.A N LEU 602.A O no hydrogen 3.058 N/A SER 607.A N ARG 603.A O no hydrogen 3.259 N/A SER 607.A OG ARG 603.A O no hydrogen 3.242 N/A SER 607.A OG ILE 604.A O no hydrogen 2.912 N/A ILE 608.A N ILE 604.A O no hydrogen 3.075 N/A TRP 609.A N MET 605.A O no hydrogen 2.945 N/A TRP 609.A NE1 ALA 759.A O no hydrogen 2.760 N/A GLU 610.A N GLU 606.A O no hydrogen 2.728 N/A THR 611.A N SER 607.A O no hydrogen 3.158 N/A THR 611.A OG1 ILE 608.A O no hydrogen 2.579 N/A GLU 612.A N TRP 609.A O no hydrogen 2.988 N/A SER 613.A N GLU 610.A O no hydrogen 2.973 N/A SER 613.A OG GLU 66.A OE2 no hydrogen 3.144 N/A LEU 614.A N TRP 609.A O no hydrogen 2.787 N/A CYS 617.A N ASP 615.A OD1 no hydrogen 2.615 N/A CYS 617.A SG ASP 615.A OD1 no hydrogen 3.289 N/A LEU 618.A N GLU 606.A OE2 no hydrogen 3.155 N/A LEU 619.A N TYR 689.A OH no hydrogen 2.580 N/A TYR 621.A N LEU 619.A O no hydrogen 2.853 N/A GLY 622.A N GLU 634.A OE2 no hydrogen 2.917 N/A CYS 623.A SG LEU 592.A O no hydrogen 3.997 N/A CYS 623.A SG MET 632.A O no hydrogen 4.029 N/A ILE 624.A N MET 632.A O no hydrogen 3.111 N/A SER 625.A OG ILE 630.A O no hydrogen 3.267 N/A THR 626.A N ILE 630.A O no hydrogen 3.237 N/A GLY 627.A N ILE 630.A O no hydrogen 3.416 N/A ILE 630.A N GLY 627.A O no hydrogen 3.263 N/A GLY 631.A N LYS 587.A O no hydrogen 3.211 N/A MET 632.A N ILE 624.A O no hydrogen 3.065 N/A ILE 633.A N ILE 585.A O no hydrogen 2.855 N/A GLU 634.A N GLY 622.A O no hydrogen 2.963 N/A ILE 635.A N GLY 583.A O no hydrogen 2.665 N/A LYS 637.A NZ THR 581.A OG1 no hydrogen 2.410 N/A THR 640.A N ILE 708.A O no hydrogen 2.980 N/A ILE 642.A N ILE 706.A O no hydrogen 2.804 N/A ALA 643.A N ASN 703.A O no hydrogen 3.135 N/A LYS 644.A N THR 641.A OG1 no hydrogen 3.084 N/A ILE 645.A N THR 641.A O no hydrogen 3.444 N/A GLN 646.A N ILE 642.A O no hydrogen 3.112 N/A GLN 646.A NE2 LYS 657.A O no hydrogen 2.798 N/A GLN 647.A N ALA 643.A O no hydrogen 2.816 N/A SER 648.A N ILE 645.A O no hydrogen 3.443 N/A SER 648.A OG LYS 644.A O no hydrogen 3.457 N/A SER 648.A OG ILE 645.A O no hydrogen 2.839 N/A SER 648.A OG THR 649.A OG1 no hydrogen 3.399 N/A THR 649.A N ILE 645.A O no hydrogen 3.425 N/A THR 649.A OG1 SER 648.A OG no hydrogen 3.399 N/A VAL 650.A N GLN 646.A O no hydrogen 3.186 N/A ASN 652.A ND2 VAL 650.A O no hydrogen 3.206 N/A ALA 655.A N ASN 652.A OD1 no hydrogen 3.412 N/A LYS 657.A N GLN 646.A OE1 no hydrogen 2.999 N/A HIS 663.A N GLU 659.A O no hydrogen 2.863 N/A TRP 664.A N VAL 660.A O no hydrogen 2.789 N/A LEU 665.A N LEU 661.A O no hydrogen 3.024 N/A LYS 666.A N ASN 662.A O no hydrogen 3.026 N/A LYS 666.A NZ GLU 672.A OE1 no hydrogen 2.851 N/A GLU 667.A N HIS 663.A O no hydrogen 3.297 N/A LYS 668.A N TRP 664.A O no hydrogen 3.210 N/A LYS 668.A N LEU 665.A O no hydrogen 3.045 N/A LYS 668.A NZ GLU 710.A OE2 no hydrogen 3.126 N/A SER 669.A N LYS 666.A O no hydrogen 3.079 N/A SER 669.A OG LEU 665.A O no hydrogen 2.792 N/A LYS 674.A N THR 671.A OG1 no hydrogen 3.238 N/A PHE 675.A N THR 671.A O no hydrogen 3.244 N/A GLN 676.A N GLU 672.A O no hydrogen 2.904 N/A ALA 677.A N GLU 673.A O no hydrogen 2.975 N/A ALA 678.A N LYS 674.A O no hydrogen 3.080 N/A VAL 679.A N PHE 675.A O no hydrogen 3.161 N/A GLU 680.A N GLN 676.A O no hydrogen 3.216 N/A ARG 681.A N ALA 677.A O no hydrogen 3.054 N/A ARG 681.A NH2 ASN 713.A OD1 no hydrogen 2.509 N/A PHE 682.A N ALA 678.A O no hydrogen 2.580 N/A VAL 683.A N VAL 679.A O no hydrogen 2.990 N/A TYR 684.A N GLU 680.A O no hydrogen 2.922 N/A SER 685.A N ARG 681.A O no hydrogen 2.832 N/A SER 685.A OG CYS 617.A O no hydrogen 2.921 N/A SER 685.A OG ARG 681.A O no hydrogen 3.257 N/A CYS 686.A N PHE 682.A O no hydrogen 2.749 N/A ALA 687.A N VAL 683.A O no hydrogen 2.969 N/A GLY 688.A N TYR 684.A O no hydrogen 2.675 N/A TYR 689.A N SER 685.A O no hydrogen 3.042 N/A CYS 690.A N CYS 686.A O no hydrogen 2.923 N/A CYS 690.A SG CYS 686.A O no hydrogen 2.973 N/A VAL 691.A N ALA 687.A O no hydrogen 3.002 N/A ALA 692.A N GLY 688.A O no hydrogen 2.833 N/A THR 693.A N TYR 689.A O no hydrogen 2.999 N/A THR 693.A OG1 TYR 689.A O no hydrogen 2.749 N/A THR 693.A OG1 CYS 690.A O no hydrogen 3.376 N/A PHE 694.A N CYS 690.A O no hydrogen 3.163 N/A VAL 695.A N VAL 691.A O no hydrogen 3.105 N/A LEU 696.A N ALA 692.A O no hydrogen 3.437 N/A GLY 697.A N PHE 694.A O no hydrogen 3.283 N/A ILE 698.A N THR 693.A O no hydrogen 2.783 N/A ARG 701.A NH2 ILE 717.A O no hydrogen 2.430 N/A ARG 701.A NH2 ASP 718.A O no hydrogen 2.879 N/A ASN 703.A N GLN 826.A OE1 no hydrogen 3.223 N/A ASN 705.A N HIS 702.A O no hydrogen 3.210 N/A ASN 705.A ND2 HIS 702.A ND1 no hydrogen 2.526 N/A MET 707.A N PHE 715.A O no hydrogen 2.855 N/A ILE 708.A N THR 640.A O no hydrogen 2.860 N/A THR 709.A N ASN 713.A O no hydrogen 3.048 N/A THR 709.A OG1 THR 711.A OG1 no hydrogen 3.269 N/A GLU 710.A N ASP 638.A O no hydrogen 2.972 N/A THR 711.A OG1 THR 709.A OG1 no hydrogen 3.269 N/A GLY 712.A N THR 709.A O no hydrogen 2.837 N/A ASN 713.A N THR 709.A OG1 no hydrogen 3.087 N/A ASN 713.A ND2 CYS 617.A O no hydrogen 2.952 N/A ASN 713.A ND2 LEU 714.A O no hydrogen 2.993 N/A PHE 715.A N MET 707.A O no hydrogen 2.678 N/A ILE 717.A N ASN 705.A O no hydrogen 2.951 N/A ASP 718.A N TYR 621.A OH no hydrogen 3.122 N/A LYS 723.A NZ ASN 828.A O no hydrogen 2.704 N/A THR 731.A OG1 ASP 733.A OD1 no hydrogen 2.676 N/A LEU 735.A N THR 731.A O no hydrogen 3.058 N/A PHE 736.A N PRO 732.A O no hydrogen 2.824 N/A VAL 737.A N ASP 733.A O no hydrogen 3.290 N/A VAL 737.A N PHE 734.A O no hydrogen 3.190 N/A GLY 739.A N PHE 736.A O no hydrogen 3.291 N/A THR 740.A OG1 MET 738.A O no hydrogen 3.269 N/A THR 740.A OG1 SER 746.A OG no hydrogen 3.214 N/A SER 746.A OG MET 738.A O no hydrogen 3.387 N/A SER 746.A OG GLY 739.A O no hydrogen 2.110 N/A SER 746.A OG THR 740.A OG1 no hydrogen 3.214 N/A GLN 750.A N SER 746.A O no hydrogen 2.906 N/A PHE 752.A N HIS 748.A O no hydrogen 2.740 N/A GLN 753.A N PHE 749.A O no hydrogen 2.938 N/A ASP 754.A N GLN 750.A O no hydrogen 2.925 N/A ILE 755.A N LYS 751.A O no hydrogen 2.665 N/A CYS 756.A N PHE 752.A O no hydrogen 2.819 N/A CYS 756.A SG PHE 752.A O no hydrogen 3.264 N/A VAL 757.A N GLN 753.A O no hydrogen 3.025 N/A VAL 757.A N ASP 754.A O no hydrogen 3.119 N/A LYS 758.A N ASP 754.A O no hydrogen 3.162 N/A ALA 759.A N ILE 755.A O no hydrogen 2.687 N/A TYR 760.A N CYS 756.A O no hydrogen 2.866 N/A TYR 760.A OH ALA 797.A O no hydrogen 2.586 N/A TYR 760.A OH THR 799.A OG1 no hydrogen 2.728 N/A LEU 761.A N VAL 757.A O no hydrogen 2.776 N/A ALA 762.A N LYS 758.A O no hydrogen 2.841 N/A LEU 763.A N ALA 759.A O no hydrogen 3.139 N/A ARG 764.A N TYR 760.A O no hydrogen 3.137 N/A ARG 764.A NE LEU 798.A O no hydrogen 2.921 N/A ARG 764.A NE THR 799.A OG1 no hydrogen 3.240 N/A ARG 764.A NH2 THR 799.A O no hydrogen 2.924 N/A ARG 764.A NH2 LYS 802.A O no hydrogen 2.921 N/A HIS 765.A N LEU 761.A O no hydrogen 3.020 N/A HIS 765.A ND1 GLU 612.A OE1 no hydrogen 2.978 N/A HIS 765.A NE2 GLU 804.A OE1 no hydrogen 2.644 N/A HIS 766.A N LEU 763.A O no hydrogen 2.807 N/A THR 767.A N ARG 764.A O no hydrogen 2.918 N/A THR 767.A OG1 ARG 764.A O no hydrogen 2.717 N/A LEU 770.A N HIS 766.A O no hydrogen 3.125 N/A ILE 771.A N THR 767.A O no hydrogen 2.882 N/A ILE 772.A N ASN 768.A O no hydrogen 2.907 N/A LEU 773.A N LEU 769.A O no hydrogen 3.124 N/A PHE 774.A N LEU 770.A O no hydrogen 2.983 N/A SER 775.A N ILE 771.A O no hydrogen 2.839 N/A MET 776.A N ILE 772.A O no hydrogen 2.789 N/A MET 777.A N LEU 773.A O no hydrogen 2.805 N/A LEU 778.A N PHE 774.A O no hydrogen 3.173 N/A MET 779.A N SER 775.A O no hydrogen 3.270 N/A THR 780.A N MET 776.A O no hydrogen 2.989 N/A THR 780.A OG1 GLN 423.A OE1 no hydrogen 3.377 N/A THR 780.A OG1 MET 776.A O no hydrogen 2.933 N/A GLY 781.A N MET 777.A O no hydrogen 2.651 N/A MET 782.A N LEU 778.A O no hydrogen 3.227 N/A GLN 784.A N MET 782.A O no hydrogen 2.658 N/A THR 786.A OG1 PHE 269.A O no hydrogen 2.421 N/A SER 787.A OG GLU 789.A OE1 no hydrogen 2.741 N/A SER 787.A OG ASP 790.A OD2 no hydrogen 3.308 N/A ILE 791.A N SER 787.A O no hydrogen 3.398 N/A GLU 792.A N LYS 788.A O no hydrogen 2.881 N/A TYR 793.A N ASP 790.A O no hydrogen 3.236 N/A TYR 793.A OH PHE 694.A O no hydrogen 2.552 N/A ILE 794.A N ILE 791.A O no hydrogen 3.470 N/A ARG 795.A NH2 ASP 320.A OD1 no hydrogen 3.211 N/A ALA 797.A N TYR 793.A O no hydrogen 2.858 N/A LEU 798.A N ILE 794.A O no hydrogen 2.757 N/A THR 799.A N ASP 796.A O no hydrogen 2.755 N/A THR 799.A OG1 TYR 760.A OH no hydrogen 2.728 N/A VAL 800.A N ARG 795.A O no hydrogen 3.104 N/A LYS 802.A N THR 799.A O no hydrogen 3.302 N/A GLU 805.A N ASN 803.A OD1 no hydrogen 3.299 N/A ALA 807.A N ASN 803.A O no hydrogen 3.117 N/A LYS 808.A N GLU 804.A O no hydrogen 2.834 N/A LYS 809.A N GLU 805.A O no hydrogen 2.931 N/A TYR 810.A N ASP 806.A O no hydrogen 2.848 N/A PHE 811.A N ALA 807.A O no hydrogen 3.064 N/A LEU 812.A N LYS 808.A O no hydrogen 3.429 N/A ASP 813.A N LYS 809.A O no hydrogen 3.171 N/A GLN 814.A N TYR 810.A O no hydrogen 3.278 N/A ILE 815.A N PHE 811.A O no hydrogen 2.944 N/A GLU 816.A N LEU 812.A O no hydrogen 3.079 N/A VAL 817.A N ASP 813.A O no hydrogen 2.763 N/A CYS 818.A N GLN 814.A O no hydrogen 3.286 N/A CYS 818.A SG PHE 728.A O no hydrogen 3.259 N/A CYS 818.A SG GLN 814.A O no hydrogen 3.558 N/A ARG 819.A N ILE 815.A O no hydrogen 3.265 N/A ASP 820.A N GLU 816.A O no hydrogen 2.785 N/A LYS 821.A N VAL 817.A O no hydrogen 3.107 N/A LYS 821.A N CYS 818.A O no hydrogen 3.129 N/A GLY 822.A N CYS 818.A O no hydrogen 3.003 N/A THR 824.A N LYS 821.A O no hydrogen 3.264 N/A THR 824.A OG1 LYS 821.A O no hydrogen 3.060 N/A GLN 826.A NE2 ARG 701.A O no hydrogen 3.304 N/A PHE 827.A N TRP 823.A O no hydrogen 2.740 N/A ASN 828.A N THR 824.A O no hydrogen 3.000 N/A TRP 829.A N GLN 826.A O no hydrogen 3.124 N/A PHE 830.A N PHE 827.A O no hydrogen 3.420 N/A