Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 8bcy_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ASN 1.A N ASN 1.A OD1 no hydrogen 2.506 N/A VAL 4.A N VAL 20.A O no hydrogen 2.813 N/A VAL 6.A N PHE 18.A O no hydrogen 2.907 N/A ASP 7.A N PRO 81.A O no hydrogen 2.981 N/A PHE 8.A N LEU 16.A O no hydrogen 2.622 N/A LEU 9.A N LEU 83.A O no hydrogen 3.053 N/A LEU 10.A N VAL 14.A O no hydrogen 2.814 N/A GLY 13.A N LEU 10.A O no hydrogen 2.999 N/A TYR 15.A OH ASP 7.A OD1 no hydrogen 2.643 N/A LEU 16.A N PHE 8.A O no hydrogen 2.847 N/A PHE 18.A N VAL 6.A O no hydrogen 3.282 N/A VAL 20.A N VAL 4.A O no hydrogen 2.934 N/A SER 21.A OG GLN 2.A OE1 no hydrogen 2.565 N/A SER 21.A OG ASN 23.A OD1 no hydrogen 2.714 N/A ARG 22.A N GLN 2.A O no hydrogen 3.095 N/A ARG 22.A NE ASN 1.A O no hydrogen 2.871 N/A ALA 24.A N SER 21.A O no hydrogen 3.086 N/A ASN 25.A ND2 GLN 70.A OE1 no hydrogen 2.956 N/A LEU 26.A N ARG 71.A O no hydrogen 2.906 N/A SER 27.A N GLU 69.A O no hydrogen 2.848 N/A THR 28.A N ASN 25.A OD1 no hydrogen 3.179 N/A THR 28.A OG1 ASN 25.A OD1 no hydrogen 2.770 N/A ILE 29.A N ASN 25.A O no hydrogen 3.091 N/A LYS 30.A N LEU 26.A O no hydrogen 2.903 N/A LYS 30.A NZ PRO 49.A O no hydrogen 2.961 N/A LYS 30.A NZ TYR 52.A O no hydrogen 2.906 N/A LYS 30.A NZ GLU 69.A OE1 no hydrogen 3.095 N/A LYS 30.A NZ GLU 69.A OE2 no hydrogen 2.858 N/A GLN 31.A N SER 27.A O no hydrogen 3.270 N/A LEU 32.A N THR 28.A O no hydrogen 3.063 N/A LEU 33.A N ILE 29.A O no hydrogen 2.868 N/A TRP 34.A N LYS 30.A O no hydrogen 2.852 N/A HIS 35.A N GLN 31.A O no hydrogen 3.009 N/A ARG 36.A N LEU 32.A O no hydrogen 3.267 N/A ARG 36.A N LEU 33.A O no hydrogen 3.107 N/A ALA 37.A N LEU 33.A O no hydrogen 2.822 N/A GLN 38.A N TRP 34.A O no hydrogen 3.302 N/A GLN 38.A NE2 HIS 35.A O no hydrogen 2.726 N/A TYR 39.A N ARG 36.A O no hydrogen 3.286 N/A GLU 40.A N ALA 37.A O no hydrogen 3.001 N/A LEU 46.A N PHE 43.A O no hydrogen 2.996 N/A SER 47.A N TYR 52.A OH no hydrogen 2.888 N/A ALA 51.A N GLY 48.A O no hydrogen 2.969 N/A TYR 52.A N PRO 49.A O no hydrogen 3.249 N/A VAL 53.A N VAL 86.A O no hydrogen 2.948 N/A CYS 56.A N GLN 64.A O no hydrogen 3.205 N/A ASN 58.A N GLU 62.A O no hydrogen 2.881 N/A ASN 58.A ND2 GLN 64.A OE1 no hydrogen 3.019 N/A GLN 59.A NE2 GLN 77.A O no hydrogen 3.006 N/A THR 60.A OG1 THR 60.A O no hydrogen 2.644 N/A ALA 61.A N ASN 58.A O no hydrogen 3.071 N/A GLU 62.A N ASN 58.A OD1 no hydrogen 3.343 N/A GLN 64.A N CYS 56.A O no hydrogen 2.880 N/A LEU 66.A N PHE 54.A O no hydrogen 2.923 N/A GLU 67.A N GLU 65.A O no hydrogen 3.095 N/A GLN 70.A N ASP 68.A OD1 no hydrogen 3.149 N/A ARG 71.A NH2 GLU 608.A OE2 no hydrogen 2.918 N/A ARG 72.A NH1 ASP 75.A OD2 no hydrogen 3.342 N/A LEU 73.A N ALA 24.A O no hydrogen 2.964 N/A CYS 74.A N ARG 22.A O no hydrogen 2.860 N/A CYS 74.A SG ASP 75.A OD1 no hydrogen 3.844 N/A VAL 76.A N ARG 72.A O no hydrogen 2.974 N/A GLN 77.A N LEU 73.A O no hydrogen 3.177 N/A PHE 79.A N ILE 57.A O no hydrogen 2.580 N/A LEU 83.A N ASP 7.A O no hydrogen 2.878 N/A ARG 84.A N THR 55.A O no hydrogen 2.869 N/A LEU 85.A N LEU 9.A O no hydrogen 3.091 N/A VAL 86.A N VAL 53.A O no hydrogen 3.071 N/A ARG 88.A NE GLU 50.A O no hydrogen 2.655 N/A LYS 94.A N ASP 91.A OD1 no hydrogen 3.526 N/A LYS 94.A NZ GLU 132.A OE2 no hydrogen 3.535 N/A LYS 95.A N ASP 91.A O no hydrogen 3.015 N/A LYS 95.A NZ GLU 65.A OE2 no hydrogen 3.181 N/A LYS 95.A NZ GLU 89.A O no hydrogen 3.038 N/A LEU 96.A N ARG 92.A O no hydrogen 2.736 N/A ILE 97.A N VAL 93.A O no hydrogen 3.025 N/A ASN 98.A N LYS 94.A O no hydrogen 3.077 N/A SER 99.A N LYS 95.A O no hydrogen 3.234 N/A GLN 100.A N LEU 96.A O no hydrogen 3.066 N/A ILE 101.A N ILE 97.A O no hydrogen 2.973 N/A SER 102.A N ASN 98.A O no hydrogen 3.417 N/A SER 102.A OG GLU 62.A OE1 no hydrogen 2.985 N/A SER 102.A OG GLU 62.A OE2 no hydrogen 3.430 N/A SER 102.A OG ASN 98.A O no hydrogen 3.547 N/A LEU 103.A N SER 99.A O no hydrogen 3.215 N/A LEU 104.A N GLN 100.A O no hydrogen 2.837 N/A ILE 105.A N ILE 101.A O no hydrogen 2.814 N/A LEU 109.A N SER 102.A OG no hydrogen 2.769 N/A HIS 110.A N GLU 62.A OE2 no hydrogen 2.661 N/A HIS 110.A ND1 GLU 62.A OE2 no hydrogen 2.951 N/A GLU 111.A N GLY 108.A O no hydrogen 2.953 N/A PHE 112.A N LEU 109.A O no hydrogen 2.995 N/A SER 114.A N HIS 110.A O no hydrogen 2.960 N/A SER 114.A OG HIS 110.A O no hydrogen 2.940 N/A CYS 116.A N ASP 113.A O no hydrogen 2.936 N/A CYS 116.A SG ASP 113.A O no hydrogen 4.005 N/A GLU 119.A N ASP 117.A OD1 no hydrogen 3.040 N/A ASN 121.A N ASP 117.A O no hydrogen 2.944 N/A ASP 122.A N PRO 118.A O no hydrogen 2.719 N/A PHE 123.A N GLU 119.A O no hydrogen 2.989 N/A ARG 124.A N VAL 120.A O no hydrogen 2.972 N/A ARG 124.A NE GLU 590.A OE1 no hydrogen 2.905 N/A ARG 124.A NE GLU 590.A OE2 no hydrogen 3.371 N/A ARG 124.A NH2 GLU 590.A OE2 no hydrogen 2.958 N/A ALA 125.A N ASN 121.A O no hydrogen 3.002 N/A LYS 126.A N ASP 122.A O no hydrogen 2.838 N/A LYS 126.A NZ ASP 547.A OD2 no hydrogen 2.704 N/A MET 127.A N PHE 123.A O no hydrogen 2.759 N/A CYS 128.A N ARG 124.A O no hydrogen 3.086 N/A CYS 128.A SG ARG 124.A O no hydrogen 3.049 N/A GLN 129.A N.A ALA 125.A O no hydrogen 3.423 N/A GLN 129.A N.B ALA 125.A O no hydrogen 3.429 N/A GLN 129.A NE2.A GLU 133.A OE1 no hydrogen 3.244 N/A PHE 130.A N LYS 126.A O no hydrogen 3.225 N/A CYS 131.A N MET 127.A O no hydrogen 2.978 N/A CYS 131.A SG MET 127.A O no hydrogen 3.164 N/A CYS 131.A SG ALA 591.A O no hydrogen 3.396 N/A GLU 132.A N CYS 128.A O no hydrogen 2.929 N/A GLU 133.A N GLN 129.A O.A no hydrogen 3.003 N/A GLU 133.A N GLN 129.A O.B no hydrogen 2.978 N/A ALA 134.A N PHE 130.A O no hydrogen 3.033 N/A ALA 135.A N CYS 131.A O no hydrogen 3.043 N/A ALA 136.A N GLU 132.A O no hydrogen 2.962 N/A ARG 137.A N GLU 133.A O no hydrogen 2.970 N/A ARG 138.A N ALA 134.A O no hydrogen 2.957 N/A ARG 138.A NH1 GLY 595.A O no hydrogen 2.822 N/A ARG 138.A NH2 LEU 559.A O no hydrogen 2.960 N/A ARG 138.A NH2 GLY 595.A O no hydrogen 2.836 N/A GLN 139.A N ALA 135.A O no hydrogen 3.131 N/A GLN 139.A NE2 ARG 256.A O no hydrogen 3.054 N/A GLN 140.A N ARG 137.A O no hydrogen 2.955 N/A LEU 141.A N ARG 138.A O no hydrogen 3.156 N/A TRP 146.A N GLY 142.A O no hydrogen 2.793 N/A LEU 147.A N TRP 143.A O no hydrogen 2.916 N/A GLN 148.A N GLU 144.A O no hydrogen 2.940 N/A TYR 149.A N ALA 145.A O no hydrogen 2.861 N/A SER 150.A N TRP 146.A O no hydrogen 2.814 N/A PHE 151.A N LEU 147.A O no hydrogen 2.708 N/A GLN 154.A NE2 GLN 230.A OE1 no hydrogen 3.522 N/A GLU 156.A N GLN 228.A O no hydrogen 2.756 N/A ALA 159.A N GLU 156.A O no hydrogen 3.224 N/A ARG 164.A N THR 185.A OG1 no hydrogen 3.340 N/A LEU 166.A N VAL 183.A O no hydrogen 3.134 N/A VAL 168.A N PHE 181.A O no hydrogen 3.023 N/A ASN 169.A N PRO 242.A O no hydrogen 2.945 N/A VAL 170.A N PHE 179.A O no hydrogen 2.709 N/A LYS 171.A N LEU 244.A O no hydrogen 3.237 N/A PHE 179.A N VAL 170.A O no hydrogen 2.594 N/A PHE 181.A N VAL 168.A O no hydrogen 3.269 N/A VAL 183.A N LEU 166.A O no hydrogen 3.094 N/A SER 184.A N ASP 187.A OD2 no hydrogen 2.741 N/A THR 185.A N ARG 164.A O no hydrogen 3.093 N/A THR 185.A OG1 PRO 162.A O no hydrogen 3.546 N/A LYS 186.A N SER 184.A OG no hydrogen 3.241 N/A ASP 187.A N SER 184.A O no hydrogen 3.165 N/A ALA 191.A N VAL 188.A O no hydrogen 3.268 N/A MET 193.A N PRO 189.A O no hydrogen 3.078 N/A ALA 194.A N LEU 190.A O no hydrogen 3.125 N/A CYS 195.A N ALA 191.A O no hydrogen 3.226 N/A CYS 195.A SG ALA 191.A O no hydrogen 3.856 N/A ALA 196.A N LEU 192.A O no hydrogen 3.297 N/A LEU 197.A N MET 193.A O no hydrogen 3.192 N/A ARG 198.A N ALA 194.A O no hydrogen 3.097 N/A LYS 199.A N CYS 195.A O no hydrogen 3.006 N/A LYS 200.A N ALA 196.A O no hydrogen 3.072 N/A ALA 201.A N LEU 197.A O no hydrogen 2.613 N/A THR 202.A N ARG 198.A O no hydrogen 3.338 N/A THR 202.A OG1 ARG 198.A O no hydrogen 2.748 N/A THR 202.A OG1 LYS 199.A O no hydrogen 3.379 N/A GLU 207.A N GLU 207.A OE1 no hydrogen 2.594 N/A ASP 208.A N GLN 205.A O no hydrogen 2.999 N/A THR 210.A N VAL 247.A O no hydrogen 2.893 N/A GLN 212.A N THR 245.A O no hydrogen 2.808 N/A GLN 212.A NE2 ARG 216.A O no hydrogen 2.874 N/A VAL 213.A N GLU 218.A O no hydrogen 2.817 N/A ASN 214.A ND2 THR 245.A OG1 no hydrogen 2.598 N/A ARG 216.A N VAL 213.A O no hydrogen 3.004 N/A ARG 216.A NE GLU 218.A OE1 no hydrogen 3.108 N/A ARG 216.A NH1 ASP 657.A OD2 no hydrogen 3.354 N/A ARG 216.A NH2 GLU 218.A OE1 no hydrogen 3.123 N/A ARG 216.A NH2 ASP 657.A OD2 no hydrogen 3.181 N/A HIS 217.A N SER 659.A O no hydrogen 2.980 N/A LEU 220.A N LEU 211.A O no hydrogen 2.814 N/A TYR 221.A OH PHE 151.A O no hydrogen 2.833 N/A LEU 226.A N ASP 187.A O no hydrogen 3.170 N/A CYS 227.A N THR 185.A O no hydrogen 3.288 N/A CYS 227.A SG THR 185.A O no hydrogen 3.552 N/A GLN 228.A N PRO 225.A O no hydrogen 3.161 N/A PHE 229.A N LEU 226.A O no hydrogen 3.084 N/A GLN 230.A N GLN 154.A O no hydrogen 3.188 N/A GLN 230.A NE2 LEU 155.A O no hydrogen 2.977 N/A CYS 233.A N PHE 229.A O no hydrogen 2.896 N/A SER 234.A N GLN 230.A O no hydrogen 2.807 N/A CYS 235.A N TYR 231.A O no hydrogen 3.075 N/A CYS 235.A SG TYR 231.A O no hydrogen 3.187 N/A LEU 236.A N ILE 232.A O no hydrogen 2.707 N/A HIS 237.A N CYS 233.A O no hydrogen 3.237 N/A HIS 237.A NE2 GLU 777.A OE2 no hydrogen 2.820 N/A SER 238.A N SER 234.A O no hydrogen 3.235 N/A SER 238.A OG SER 234.A O no hydrogen 3.068 N/A GLY 239.A N LEU 236.A O no hydrogen 3.323 N/A LEU 240.A N CYS 235.A O no hydrogen 2.999 N/A HIS 243.A N TYR 231.A OH no hydrogen 2.803 N/A LEU 244.A N ASN 169.A O no hydrogen 2.814 N/A THR 245.A N GLN 212.A O no hydrogen 2.939 N/A MET 246.A N LYS 171.A O no hydrogen 2.989 N/A VAL 247.A N THR 210.A O no hydrogen 2.815 N/A SER 249.A N ASP 208.A O no hydrogen 3.169 N/A SER 249.A OG ASP 208.A O no hydrogen 3.406 N/A SER 249.A OG HIS 248.A ND1 no hydrogen 3.264 N/A SER 250.A OG HIS 248.A ND1 no hydrogen 3.073 N/A SER 251.A OG GLU 173.A OE1 no hydrogen 3.142 N/A SER 251.A OG GLU 173.A OE2 no hydrogen 3.112 N/A LEU 253.A N SER 249.A O no hydrogen 2.884 N/A ALA 254.A N SER 250.A O no hydrogen 2.813 N/A MET 255.A N SER 251.A O no hydrogen 3.437 N/A ARG 256.A N ILE 252.A O no hydrogen 3.047 N/A ARG 256.A NE ASP 257.A OD1 no hydrogen 3.030 N/A ARG 256.A NH1 LEU 141.A O no hydrogen 3.443 N/A ARG 256.A NH2 ASP 257.A OD1 no hydrogen 2.831 N/A ASP 257.A N LEU 253.A O no hydrogen 2.968 N/A GLU 258.A N ALA 254.A O no hydrogen 2.982 N/A SER 264.A OG SER 261.A O no hydrogen 2.494 N/A LEU 265.A N LEU 262.A O no hydrogen 3.284 N/A PHE 269.A N ILE 325.A O no hydrogen 2.713 N/A ILE 271.A N LEU 321.A O no hydrogen 3.032 N/A GLU 272.A N CYS 405.A O no hydrogen 2.969 N/A LEU 273.A N GLN 319.A O no hydrogen 2.973 N/A ILE 274.A N LEU 403.A O no hydrogen 3.095 N/A GLN 275.A N LEU 403.A O no hydrogen 3.203 N/A GLN 275.A NE2 GLY 276.A O no hydrogen 3.156 N/A GLY 276.A N PRO 315.A O no hydrogen 2.813 N/A SER 277.A N ALA 401.A O no hydrogen 2.710 N/A LYS 278.A N GLU 314.A OE2 no hydrogen 3.335 N/A LYS 278.A NZ ASP 397.A O no hydrogen 2.847 N/A VAL 279.A N SER 313.A O no hydrogen 3.067 N/A ARG 284.A N ASP 282.A OD1 no hydrogen 3.180 N/A MET 285.A N ASP 282.A O no hydrogen 3.044 N/A LYS 286.A N VAL 343.A O no hydrogen 2.975 N/A LYS 286.A NZ SER 310.A OG no hydrogen 3.007 N/A LEU 287.A N VAL 309.A O no hydrogen 2.609 N/A VAL 288.A N TYR 341.A O no hydrogen 2.961 N/A VAL 289.A N SER 306.A OG no hydrogen 2.853 N/A GLN 290.A N ALA 339.A O no hydrogen 2.813 N/A ALA 291.A N VAL 304.A O no hydrogen 3.069 N/A GLY 292.A N CYS 337.A O no hydrogen 3.010 N/A PHE 294.A N ARG 335.A O no hydrogen 2.638 N/A HIS 295.A N GLU 298.A O no hydrogen 3.088 N/A LEU 300.A N LEU 293.A O no hydrogen 3.394 N/A CYS 301.A SG LYS 302.A O no hydrogen 3.498 N/A VAL 304.A N ALA 291.A O no hydrogen 3.200 N/A SER 305.A OG GLN 290.A OE1 no hydrogen 2.547 N/A SER 306.A N VAL 289.A O no hydrogen 3.102 N/A SER 306.A OG SER 307.A O no hydrogen 3.071 N/A SER 307.A N GLN 319.A OE1 no hydrogen 2.719 N/A SER 307.A OG GLN 319.A OE1 no hydrogen 2.863 N/A VAL 309.A N SER 307.A O no hydrogen 3.129 N/A SER 313.A OG GLU 314.A OE2 no hydrogen 2.705 N/A TRP 317.A N ILE 274.A O no hydrogen 2.884 N/A LYS 318.A N ILE 274.A O no hydrogen 3.181 N/A GLN 319.A N LEU 273.A O no hydrogen 3.288 N/A LEU 321.A N ILE 271.A O no hydrogen 2.980 N/A PHE 323.A N PHE 269.A O no hydrogen 2.832 N/A ILE 325.A N PHE 323.A O no hydrogen 2.803 N/A ILE 327.A N GLN 267.A O no hydrogen 2.889 N/A CYS 328.A N LEU 265.A O no hydrogen 3.206 N/A ASP 329.A N ASN 326.A O no hydrogen 3.010 N/A LEU 330.A N ILE 327.A O no hydrogen 3.202 N/A ARG 332.A NE ASP 361.A OD1 no hydrogen 2.972 N/A ARG 332.A NH1 ARG 332.A O no hydrogen 2.816 N/A ARG 332.A NH1 TYR 545.A OH no hydrogen 2.664 N/A ARG 332.A NH2 ASP 361.A OD1 no hydrogen 2.741 N/A ALA 334.A N PRO 331.A O no hydrogen 2.945 N/A ARG 335.A N PHE 294.A O no hydrogen 2.729 N/A ARG 335.A NH1 PRO 386.A O no hydrogen 2.785 N/A LEU 336.A N LEU 354.A O no hydrogen 2.637 N/A CYS 337.A N GLY 292.A O no hydrogen 2.884 N/A CYS 337.A SG ARG 335.A O no hydrogen 3.713 N/A PHE 338.A N ALA 352.A O no hydrogen 2.824 N/A ALA 339.A N GLN 290.A O no hydrogen 2.885 N/A LEU 340.A N ALA 350.A O no hydrogen 2.729 N/A TYR 341.A N VAL 288.A O no hydrogen 2.754 N/A TYR 341.A OH LEU 383.A O no hydrogen 2.686 N/A ALA 342.A N CYS 347.A O no hydrogen 2.729 N/A VAL 343.A N LYS 286.A O no hydrogen 3.049 N/A CYS 347.A N ALA 342.A O no hydrogen 3.098 N/A ILE 349.A N LEU 340.A O no hydrogen 2.738 N/A ALA 350.A N LEU 340.A O no hydrogen 3.365 N/A TRP 351.A N TRP 373.A O no hydrogen 2.744 N/A ALA 352.A N PHE 338.A O no hydrogen 3.106 N/A ASN 353.A ND2 ASN 385.A O no hydrogen 2.832 N/A ASN 353.A ND2 GLY 388.A O no hydrogen 3.174 N/A LEU 354.A N LEU 336.A O no hydrogen 2.702 N/A LEU 356.A N ALA 334.A O no hydrogen 3.137 N/A ASP 358.A N GLN 362.A O no hydrogen 2.856 N/A TYR 359.A OH ASP 122.A OD2 no hydrogen 2.605 N/A LYS 360.A N ASP 358.A OD1 no hydrogen 3.168 N/A ASP 361.A N ASP 358.A O no hydrogen 2.977 N/A GLN 362.A N ASP 358.A OD1 no hydrogen 2.738 N/A GLN 362.A NE2 TYR 415.A OH no hydrogen 3.455 N/A LEU 363.A N VAL 414.A O no hydrogen 2.870 N/A LYS 364.A N LEU 356.A O no hydrogen 2.867 N/A LYS 364.A NZ MET 355.A O no hydrogen 3.279 N/A GLY 366.A N LEU 406.A O no hydrogen 2.701 N/A ARG 368.A N ILE 404.A O no hydrogen 2.804 N/A LEU 370.A N LEU 402.A O no hydrogen 2.878 N/A TYR 371.A N SER 392.A OG no hydrogen 3.262 N/A MET 372.A N ALA 400.A O no hydrogen 2.763 N/A TRP 373.A N TRP 351.A O no hydrogen 2.853 N/A TRP 373.A NE1 ARG 391.A O no hydrogen 3.154 N/A SER 375.A N ILE 349.A O no hydrogen 3.119 N/A THR 387.A OG1 ASN 385.A OD1 no hydrogen 3.383 N/A GLY 388.A N ASN 385.A O no hydrogen 3.263 N/A SER 392.A OG TYR 371.A O no hydrogen 3.526 N/A ASN 393.A N TYR 371.A O no hydrogen 3.370 N/A ASN 393.A ND2 MET 372.A O no hydrogen 3.044 N/A ASN 395.A N ASN 393.A OD1 no hydrogen 2.999 N/A SER 398.A N ASN 395.A OD1 no hydrogen 3.378 N/A ALA 399.A N ASN 395.A O no hydrogen 3.047 N/A ALA 401.A N SER 277.A O no hydrogen 2.828 N/A LEU 402.A N LEU 370.A O no hydrogen 2.994 N/A LEU 403.A N GLN 275.A O no hydrogen 2.683 N/A ILE 404.A N ARG 368.A O no hydrogen 2.884 N/A CYS 405.A N GLU 272.A O no hydrogen 2.917 N/A CYS 405.A SG LEU 406.A O no hydrogen 3.794 N/A LEU 406.A N GLY 366.A O no hydrogen 2.823 N/A TYR 416.A N ASP 361.A O no hydrogen 2.844 N/A ILE 422.A N ALA 418.A O no hydrogen 3.063 N/A LEU 423.A N LEU 419.A O no hydrogen 2.897 N/A GLU 424.A N GLU 420.A O no hydrogen 3.107 N/A LEU 425.A N LYS 421.A O no hydrogen 3.147 N/A GLY 426.A N ILE 422.A O no hydrogen 2.758 N/A ARG 427.A N GLU 424.A O no hydrogen 3.273 N/A GLU 432.A N GLU 432.A OE1 no hydrogen 3.160 N/A GLN 433.A NE2 GLU 458.A OE1 no hydrogen 3.547 N/A LEU 434.A N GLU 431.A O no hydrogen 3.361 N/A GLN 435.A N GLN 435.A OE1 no hydrogen 3.142 N/A LEU 436.A N GLU 432.A O no hydrogen 3.492 N/A ARG 437.A N GLN 433.A O no hydrogen 2.982 N/A ARG 437.A NH1 GLU 441.A OE1 no hydrogen 3.495 N/A ARG 437.A NH1 GLU 441.A OE2 no hydrogen 3.498 N/A GLU 438.A N LEU 434.A O no hydrogen 3.225 N/A ILE 439.A N GLN 435.A O no hydrogen 3.158 N/A LEU 440.A N LEU 436.A O no hydrogen 2.955 N/A GLU 441.A N ARG 437.A O no hydrogen 2.620 N/A ARG 442.A NE ILE 439.A O no hydrogen 2.953 N/A TYR 445.A N GLU 448.A OE1 no hydrogen 3.073 N/A LYS 449.A N TYR 445.A O no hydrogen 2.980 N/A ASP 450.A N GLU 446.A O no hydrogen 3.334 N/A LEU 451.A N GLU 448.A O no hydrogen 3.149 N/A VAL 452.A N GLU 448.A O no hydrogen 3.050 N/A TRP 453.A N LYS 449.A O no hydrogen 3.016 N/A LYS 454.A N ASP 450.A O no hydrogen 3.038 N/A LEU 455.A N LEU 451.A O no hydrogen 2.744 N/A ARG 456.A N TRP 453.A O no hydrogen 3.269 N/A ARG 456.A NH1 TRP 453.A O no hydrogen 2.838 N/A VAL 459.A N LEU 455.A O no hydrogen 3.027 N/A GLN 460.A N ARG 456.A O no hydrogen 3.199 N/A GLU 461.A N HIS 457.A O no hydrogen 3.116 N/A HIS 462.A N GLU 458.A O no hydrogen 2.932 N/A PHE 463.A N VAL 459.A O no hydrogen 2.861 N/A ALA 466.A N PHE 463.A O no hydrogen 2.797 N/A LEU 467.A N PRO 464.A O no hydrogen 3.271 N/A ARG 469.A N ALA 466.A O no hydrogen 2.758 N/A LEU 470.A N ALA 466.A O no hydrogen 3.155 N/A LEU 471.A N LEU 467.A O no hydrogen 2.835 N/A LEU 472.A N ALA 468.A O no hydrogen 3.220 N/A VAL 473.A N ARG 469.A O no hydrogen 3.160 N/A THR 474.A N LEU 470.A O no hydrogen 3.212 N/A THR 474.A OG1 LEU 470.A O no hydrogen 2.792 N/A THR 474.A OG1 LEU 471.A O no hydrogen 3.555 N/A TRP 476.A NE1 LEU 471.A O no hydrogen 2.824 N/A ASN 477.A ND2 LEU 300.A O no hydrogen 2.652 N/A LYS 478.A N LYS 475.A O no hydrogen 3.204 N/A HIS 479.A ND1 ASP 329.A OD1 no hydrogen 3.201 N/A VAL 482.A N LYS 478.A O no hydrogen 3.217 N/A ALA 483.A N HIS 479.A O no hydrogen 3.079 N/A GLN 484.A N GLU 480.A O no hydrogen 3.105 N/A MET 485.A N ASP 481.A O no hydrogen 2.841 N/A LEU 486.A N VAL 482.A O no hydrogen 2.942 N/A TYR 487.A N ALA 483.A O no hydrogen 2.920 N/A LEU 488.A N GLN 484.A O no hydrogen 3.285 N/A LEU 489.A N MET 485.A O no hydrogen 2.958 N/A CYS 490.A N LEU 486.A O no hydrogen 3.138 N/A CYS 490.A SG LEU 486.A O no hydrogen 3.235 N/A SER 491.A N LEU 488.A O no hydrogen 3.069 N/A SER 491.A OG TYR 487.A O no hydrogen 3.500 N/A SER 491.A OG LEU 488.A O no hydrogen 2.940 N/A TRP 492.A N LEU 489.A O no hydrogen 3.352 N/A TRP 492.A NE1 PRO 464.A O no hydrogen 3.012 N/A ALA 500.A N PRO 496.A O no hydrogen 3.078 N/A LEU 501.A N VAL 497.A O no hydrogen 2.927 N/A LEU 503.A N SER 499.A O no hydrogen 3.183 N/A LEU 504.A N LEU 501.A O no hydrogen 3.399 N/A ASP 505.A N GLU 502.A O no hydrogen 3.140 N/A SER 507.A OG ASP 505.A OD2 no hydrogen 3.091 N/A PHE 508.A N ASP 505.A O no hydrogen 3.156 N/A CYS 511.A SG HIS 512.A ND1 no hydrogen 3.878 N/A HIS 512.A N ASP 510.A OD2 no hydrogen 3.148 N/A HIS 512.A ND1 ASP 510.A OD2 no hydrogen 2.891 N/A VAL 513.A N ASP 510.A O no hydrogen 2.974 N/A GLY 514.A N ASP 510.A O no hydrogen 3.234 N/A SER 515.A N CYS 511.A O no hydrogen 2.979 N/A PHE 516.A N HIS 512.A O no hydrogen 2.957 N/A ALA 517.A N VAL 513.A O no hydrogen 2.823 N/A ILE 518.A N GLY 514.A O no hydrogen 3.026 N/A LYS 519.A N SER 515.A O no hydrogen 3.035 N/A SER 520.A N PHE 516.A O no hydrogen 3.128 N/A SER 520.A OG LEU 495.A O no hydrogen 3.221 N/A SER 520.A OG PHE 516.A O no hydrogen 3.443 N/A LEU 521.A N ALA 517.A O no hydrogen 2.871 N/A ARG 522.A NH2 GLU 549.A OE1 no hydrogen 3.480 N/A LYS 523.A NZ GLU 494.A OE2 no hydrogen 2.707 N/A LYS 523.A NZ LEU 495.A O no hydrogen 3.069 N/A LYS 523.A NZ SER 520.A O no hydrogen 3.056 N/A LEU 524.A N LEU 521.A O no hydrogen 3.215 N/A GLU 528.A N THR 525.A OG1 no hydrogen 3.267 N/A LEU 529.A N THR 525.A O no hydrogen 2.922 N/A PHE 530.A N ASP 526.A O no hydrogen 2.935 N/A GLN 531.A N GLU 528.A O no hydrogen 2.911 N/A TYR 532.A N LEU 529.A O no hydrogen 3.098 N/A TYR 532.A OH GLU 528.A OE2 no hydrogen 2.596 N/A LEU 533.A N PHE 530.A O no hydrogen 3.377 N/A GLN 535.A N TYR 532.A O no hydrogen 3.016 N/A GLN 535.A NE2 GLN 706.A OE1 no hydrogen 3.305 N/A LEU 536.A N TYR 532.A O no hydrogen 3.158 N/A VAL 537.A N LEU 533.A O no hydrogen 3.088 N/A GLN 538.A N LEU 534.A O no hydrogen 3.346 N/A GLN 538.A NE2 GLU 575.A OE1 no hydrogen 2.991 N/A VAL 539.A N GLN 535.A O no hydrogen 3.082 N/A LEU 540.A N VAL 537.A O no hydrogen 3.296 N/A LYS 541.A N GLN 538.A O no hydrogen 3.117 N/A LYS 541.A NZ GLN 538.A OE1 no hydrogen 2.864 N/A LYS 541.A NZ GLU 575.A OE1 no hydrogen 3.023 N/A LYS 541.A NZ GLU 575.A OE2 no hydrogen 2.854 N/A TYR 542.A N VAL 539.A O no hydrogen 2.936 N/A GLU 543.A N LEU 540.A O no hydrogen 3.209 N/A TYR 545.A OH PHE 357.A O no hydrogen 2.686 N/A LEU 546.A N GLU 119.A OE1 no hydrogen 2.967 N/A CYS 548.A SG LEU 546.A O no hydrogen 3.921 N/A CYS 548.A SG THR 551.A OG1 no hydrogen 3.203 N/A LYS 552.A N CYS 548.A O no hydrogen 3.287 N/A PHE 553.A N GLU 549.A O no hydrogen 2.903 N/A LEU 554.A N LEU 550.A O no hydrogen 2.933 N/A LEU 555.A N THR 551.A O no hydrogen 2.902 N/A ASP 556.A N LYS 552.A O no hydrogen 2.817 N/A ARG 557.A N PHE 553.A O no hydrogen 3.035 N/A ARG 557.A NE ASP 526.A OD1 no hydrogen 3.394 N/A ARG 557.A NH1 LEU 524.A O no hydrogen 2.911 N/A ARG 557.A NH2 LEU 524.A O no hydrogen 2.699 N/A ARG 557.A NH2 ASP 526.A OD1 no hydrogen 2.577 N/A ALA 558.A N LEU 554.A O no hydrogen 2.858 N/A LEU 559.A N LEU 555.A O no hydrogen 2.822 N/A LEU 559.A N ASP 556.A O no hydrogen 3.178 N/A ALA 560.A N ASP 556.A O no hydrogen 3.067 N/A ASN 561.A N ARG 557.A O no hydrogen 2.922 N/A ASN 561.A ND2 ASP 526.A OD2 no hydrogen 2.881 N/A ARG 562.A N TYR 149.A O no hydrogen 2.976 N/A ARG 562.A NE HIS 599.A ND1 no hydrogen 3.101 N/A ARG 562.A NH1 SER 150.A OG no hydrogen 2.814 N/A ILE 564.A N ASN 561.A OD1 no hydrogen 3.037 N/A GLY 565.A N ASN 561.A O no hydrogen 3.032 N/A HIS 566.A N ARG 562.A O no hydrogen 2.882 N/A HIS 566.A ND1 HIS 599.A NE2 no hydrogen 3.215 N/A HIS 566.A NE2 PRO 655.A O no hydrogen 2.642 N/A PHE 567.A N LYS 563.A O no hydrogen 3.129 N/A LEU 568.A N ILE 564.A O no hydrogen 2.743 N/A PHE 569.A N GLY 565.A O no hydrogen 2.814 N/A TRP 570.A N HIS 566.A O no hydrogen 3.157 N/A TRP 570.A NE1 GLN 606.A OE1 no hydrogen 2.970 N/A HIS 571.A N PHE 567.A O no hydrogen 2.915 N/A LEU 572.A N LEU 568.A O no hydrogen 3.131 N/A ARG 573.A N PHE 569.A O no hydrogen 2.729 N/A ARG 573.A NE LEU 104.A O no hydrogen 2.852 N/A ARG 573.A NH1 ARG 573.A O no hydrogen 3.163 N/A SER 574.A N TRP 570.A O no hydrogen 2.924 N/A SER 574.A OG TRP 570.A O no hydrogen 3.131 N/A SER 574.A OG HIS 571.A O no hydrogen 2.948 N/A GLU 575.A N LEU 572.A O no hydrogen 3.119 N/A MET 576.A N ARG 573.A O no hydrogen 3.247 N/A VAL 578.A N GLU 575.A O no hydrogen 2.943 N/A VAL 581.A N VAL 578.A O no hydrogen 3.093 N/A ALA 582.A N VAL 578.A O no hydrogen 3.044 N/A ARG 584.A NH1 TYR 545.A O no hydrogen 2.885 N/A ARG 584.A NH2 TYR 545.A O no hydrogen 2.945 N/A PHE 585.A N VAL 581.A O no hydrogen 2.814 N/A GLY 586.A N ALA 582.A O no hydrogen 2.840 N/A LEU 587.A N LEU 583.A O no hydrogen 3.034 N/A ILE 588.A N ARG 584.A O no hydrogen 3.221 N/A LEU 589.A N PHE 585.A O no hydrogen 2.859 N/A GLU 590.A N GLY 586.A O no hydrogen 2.999 N/A ALA 591.A N LEU 587.A O no hydrogen 3.165 N/A TYR 592.A N ILE 588.A O no hydrogen 2.796 N/A CYS 593.A N LEU 589.A O no hydrogen 2.828 N/A CYS 593.A SG LEU 589.A O no hydrogen 3.209 N/A ARG 594.A N GLU 590.A O no hydrogen 3.171 N/A ARG 594.A NE GLU 590.A OE2 no hydrogen 3.294 N/A ARG 594.A NH1 ASN 98.A OD1 no hydrogen 3.086 N/A ARG 594.A NH2 ASN 98.A OD1 no hydrogen 2.601 N/A ARG 594.A NH2 GLU 590.A OE2 no hydrogen 2.820 N/A GLY 595.A N ALA 591.A O no hydrogen 3.330 N/A SER 596.A N CYS 593.A O no hydrogen 3.069 N/A SER 596.A OG TYR 592.A O no hydrogen 2.816 N/A HIS 598.A NE2 ARG 256.A O no hydrogen 2.650 N/A HIS 599.A NE2 HIS 566.A ND1 no hydrogen 3.215 N/A MET 600.A N SER 596.A O no hydrogen 3.006 N/A LYS 601.A N HIS 598.A O no hydrogen 3.050 N/A LEU 603.A N HIS 599.A O no hydrogen 2.821 N/A MET 604.A N MET 600.A O no hydrogen 2.852 N/A LYS 605.A N LYS 601.A O no hydrogen 3.175 N/A LYS 605.A NZ GLU 647.A O no hydrogen 2.833 N/A GLN 606.A N VAL 602.A O no hydrogen 3.115 N/A GLN 606.A NE2 GLN 653.A O.A no hydrogen 2.837 N/A GLN 606.A NE2 GLN 653.A O.B no hydrogen 2.765 N/A GLY 607.A N LEU 603.A O no hydrogen 2.869 N/A GLU 608.A N MET 604.A O no hydrogen 3.034 N/A ALA 609.A N LYS 605.A O no hydrogen 2.994 N/A LEU 610.A N GLN 606.A O no hydrogen 2.870 N/A SER 611.A N GLY 607.A O no hydrogen 3.147 N/A LYS 612.A N GLU 608.A O no hydrogen 3.069 N/A LYS 612.A NZ ASP 75.A OD1 no hydrogen 3.436 N/A LYS 612.A NZ ALA 644.A O no hydrogen 3.128 N/A LEU 613.A N ALA 609.A O no hydrogen 3.045 N/A LYS 614.A N LEU 610.A O no hydrogen 3.125 N/A LYS 614.A NZ ASP 618.A OD2 no hydrogen 2.985 N/A ALA 615.A N SER 611.A O no hydrogen 3.233 N/A LEU 616.A N LYS 612.A O no hydrogen 2.646 N/A ASN 617.A N LEU 613.A O no hydrogen 2.603 N/A ASN 617.A ND2 ASN 617.A O no hydrogen 2.874 N/A ASN 617.A ND2 LYS 678.A O no hydrogen 2.739 N/A ASP 618.A N LYS 614.A O no hydrogen 2.948 N/A PHE 619.A N ALA 615.A O no hydrogen 3.013 N/A VAL 620.A N LEU 616.A O no hydrogen 3.050 N/A LYS 621.A N ASN 617.A O no hydrogen 3.005 N/A LYS 621.A NZ ASN 694.A O no hydrogen 3.166 N/A LEU 622.A N ASP 618.A O no hydrogen 3.218 N/A SER 623.A N PHE 619.A O no hydrogen 3.113 N/A SER 623.A OG THR 627.A OG1 no hydrogen 3.098 N/A SER 623.A OG THR 632.A OG1 no hydrogen 3.037 N/A SER 624.A N VAL 620.A O no hydrogen 2.737 N/A SER 624.A OG VAL 620.A O no hydrogen 3.170 N/A GLN 625.A N LYS 621.A O no hydrogen 3.423 N/A LYS 626.A N SER 623.A O no hydrogen 3.138 N/A THR 627.A N SER 623.A O no hydrogen 2.777 N/A THR 627.A OG1 SER 623.A O no hydrogen 2.953 N/A THR 627.A OG1 THR 632.A OG1 no hydrogen 3.065 N/A LYS 629.A NZ PHE 672.A O no hydrogen 2.774 N/A THR 632.A N PRO 628.A O no hydrogen 3.109 N/A THR 632.A OG1 SER 623.A OG no hydrogen 3.037 N/A THR 632.A OG1 THR 627.A O no hydrogen 3.293 N/A THR 632.A OG1 THR 627.A OG1 no hydrogen 3.065 N/A THR 632.A OG1 PRO 628.A O no hydrogen 3.255 N/A LYS 633.A N LYS 629.A O no hydrogen 2.738 N/A GLU 634.A N PRO 630.A O no hydrogen 3.235 N/A LEU 635.A N GLN 631.A O no hydrogen 3.146 N/A MET 636.A N THR 632.A O no hydrogen 2.817 N/A HIS 637.A N LYS 633.A O no hydrogen 3.179 N/A HIS 637.A NE2 CYS 670.A O no hydrogen 2.744 N/A LEU 638.A N GLU 634.A O no hydrogen 3.080 N/A CYS 639.A N LEU 635.A O no hydrogen 3.112 N/A MET 640.A N MET 636.A O no hydrogen 2.968 N/A ARG 641.A N HIS 637.A O no hydrogen 3.039 N/A ARG 641.A N LEU 638.A O no hydrogen 3.278 N/A GLN 642.A NE2 CYS 639.A O no hydrogen 3.494 N/A LEU 646.A N GLN 642.A O no hydrogen 2.794 N/A GLU 647.A N GLU 643.A O no hydrogen 3.054 N/A ALA 648.A N ALA 644.A O no hydrogen 3.253 N/A LEU 649.A N TYR 645.A O no hydrogen 2.759 N/A SER 650.A N GLU 647.A O no hydrogen 3.361 N/A SER 650.A OG LEU 646.A O no hydrogen 2.516 N/A HIS 651.A N ALA 663.A O no hydrogen 2.923 N/A LEU 652.A N LEU 662.A O no hydrogen 3.146 N/A GLN 653.A NE2.B PRO 658.A O no hydrogen 2.631 N/A SER 654.A N THR 660.A O no hydrogen 2.881 N/A LEU 656.A N SER 654.A OG no hydrogen 3.004 N/A SER 659.A N ASP 657.A OD1 no hydrogen 3.228 N/A SER 659.A OG GLN 154.A OE1 no hydrogen 3.307 N/A SER 659.A OG HIS 217.A O no hydrogen 2.794 N/A THR 660.A N ASP 657.A O no hydrogen 2.903 N/A THR 660.A OG1 ASP 657.A OD2 no hydrogen 3.462 N/A LEU 662.A N LEU 652.A O no hydrogen 2.818 N/A CYS 666.A N MET 683.A O no hydrogen 2.940 N/A CYS 666.A SG GLN 669.A OE1 no hydrogen 3.619 N/A CYS 666.A SG SER 685.A OG no hydrogen 3.003 N/A CYS 670.A N CYS 666.A O no hydrogen 3.125 N/A CYS 670.A N VAL 667.A O no hydrogen 3.145 N/A CYS 670.A SG CYS 666.A O no hydrogen 3.236 N/A THR 671.A N TRP 681.A O no hydrogen 2.928 N/A THR 671.A OG1 PHE 672.A O no hydrogen 3.267 N/A PHE 672.A N THR 671.A OG1 no hydrogen 2.538 N/A MET 673.A N PRO 679.A O no hydrogen 3.444 N/A SER 675.A N MET 673.A O no hydrogen 2.921 N/A LYS 676.A N SER 675.A OG no hydrogen 2.661 N/A LYS 678.A NZ SER 675.A O no hydrogen 3.233 N/A LEU 680.A N PHE 692.A O no hydrogen 2.907 N/A TRP 681.A N THR 671.A O no hydrogen 2.715 N/A ILE 682.A N ILE 690.A O no hydrogen 2.845 N/A TYR 684.A N VAL 688.A O no hydrogen 2.885 N/A TYR 684.A OH LEU 649.A O no hydrogen 2.615 N/A SER 685.A N GLU 664.A O no hydrogen 2.910 N/A SER 687.A OG TYR 684.A O no hydrogen 3.230 N/A ILE 690.A N ILE 682.A O no hydrogen 2.928 N/A ILE 691.A N ILE 739.A O no hydrogen 2.826 N/A PHE 692.A N LEU 680.A O no hydrogen 2.878 N/A LYS 693.A N GLY 737.A O no hydrogen 3.159 N/A LYS 693.A NZ ASP 696.A OD2 no hydrogen 2.712 N/A ASN 694.A ND2 ARG 735.A O no hydrogen 3.245 N/A ASN 694.A ND2 THR 736.A OG1 no hydrogen 2.884 N/A GLY 695.A N ARG 735.A O no hydrogen 2.945 N/A ARG 699.A NE ASP 697.A OD1 no hydrogen 3.465 N/A ARG 699.A NE ASP 697.A OD2 no hydrogen 3.321 N/A ARG 699.A NH1 ALA 878.A O no hydrogen 3.356 N/A ARG 699.A NH2 ALA 878.A O no hydrogen 3.291 N/A GLN 700.A NE2 GLU 882.A OE1 no hydrogen 3.075 N/A MET 702.A N LEU 698.A O no hydrogen 3.121 N/A LEU 703.A N ARG 699.A O no hydrogen 2.932 N/A THR 704.A N GLN 700.A O no hydrogen 2.926 N/A THR 704.A OG1 GLN 700.A O no hydrogen 2.911 N/A LEU 705.A N ASP 701.A O no hydrogen 2.825 N/A GLN 706.A N MET 702.A O no hydrogen 2.753 N/A MET 707.A N LEU 703.A O no hydrogen 2.944 N/A ILE 708.A N THR 704.A O no hydrogen 2.980 N/A GLN 709.A N LEU 705.A O no hydrogen 2.906 N/A LEU 710.A N GLN 706.A O no hydrogen 2.848 N/A MET 711.A N MET 707.A O no hydrogen 2.876 N/A ASP 712.A N ILE 708.A O no hydrogen 2.906 N/A VAL 713.A N GLN 709.A O no hydrogen 3.012 N/A LEU 714.A N LEU 710.A O no hydrogen 3.010 N/A TRP 715.A N MET 711.A O no hydrogen 2.820 N/A TRP 715.A NE1 ALA 857.A O no hydrogen 2.841 N/A LYS 716.A N ASP 712.A O no hydrogen 2.763 N/A LYS 716.A NZ ASP 712.A OD2 no hydrogen 2.733 N/A GLN 717.A N VAL 713.A O no hydrogen 2.756 N/A GLU 718.A N TRP 715.A O no hydrogen 3.069 N/A GLY 719.A N LYS 716.A O no hydrogen 3.461 N/A LEU 720.A N TRP 715.A O no hydrogen 3.131 N/A ARG 723.A N ASP 721.A OD1 no hydrogen 2.841 N/A ARG 723.A NE GLU 777.A OE1 no hydrogen 3.236 N/A ARG 723.A NH1 ASP 721.A OD2 no hydrogen 2.923 N/A THR 725.A N TYR 785.A OH no hydrogen 2.733 N/A GLY 728.A N GLU 740.A OE1 no hydrogen 2.710 N/A CYS 729.A SG LEU 698.A O no hydrogen 4.045 N/A LEU 730.A N LEU 738.A O no hydrogen 2.923 N/A THR 732.A N THR 736.A O no hydrogen 2.846 N/A GLY 733.A N THR 736.A O no hydrogen 3.277 N/A THR 736.A OG1 ASP 734.A O no hydrogen 2.634 N/A GLY 737.A N LYS 693.A O no hydrogen 3.252 N/A LEU 738.A N LEU 730.A O no hydrogen 2.979 N/A ILE 739.A N ILE 691.A O no hydrogen 2.951 N/A GLU 740.A N GLY 728.A O no hydrogen 2.942 N/A VAL 741.A N GLY 689.A O no hydrogen 3.431 N/A SER 745.A OG VAL 742.A O no hydrogen 2.891 N/A ASP 746.A N ILE 804.A O no hydrogen 3.039 N/A THR 747.A N ASP 746.A OD1 no hydrogen 2.952 N/A ILE 748.A N ILE 802.A O no hydrogen 3.033 N/A ALA 749.A N SER 799.A O no hydrogen 3.258 N/A ASN 750.A ND2 ASP 746.A OD1 no hydrogen 3.233 N/A ILE 751.A N THR 747.A O no hydrogen 3.114 N/A GLN 752.A N ILE 748.A O no hydrogen 2.967 N/A ASN 760.A N ASP 756.A O no hydrogen 3.036 N/A TRP 761.A N ALA 757.A O no hydrogen 2.664 N/A LEU 762.A N LEU 758.A O no hydrogen 2.929 N/A LYS 763.A N LEU 759.A O no hydrogen 2.723 N/A SER 764.A N ASN 760.A O no hydrogen 2.734 N/A SER 764.A OG ASN 760.A O no hydrogen 3.420 N/A SER 764.A OG TRP 761.A O no hydrogen 2.533 N/A LYS 765.A N TRP 761.A O no hydrogen 2.974 N/A LYS 765.A NZ GLU 806.A OE2 no hydrogen 2.962 N/A ASN 766.A N LEU 762.A O no hydrogen 2.626 N/A ASN 766.A ND2 LEU 762.A O no hydrogen 3.453 N/A ASN 766.A ND2 GLU 806.A O no hydrogen 2.665 N/A LEU 771.A N GLY 768.A O no hydrogen 3.444 N/A ALA 774.A N ALA 770.A O no hydrogen 3.177 N/A ILE 775.A N LEU 771.A O no hydrogen 2.935 N/A GLU 776.A N ASP 772.A O no hydrogen 3.153 N/A GLU 777.A N ARG 773.A O no hydrogen 2.786 N/A PHE 778.A N ALA 774.A O no hydrogen 2.885 N/A THR 779.A N ILE 775.A O no hydrogen 2.820 N/A THR 779.A OG1 ILE 775.A O no hydrogen 2.610 N/A LEU 780.A N GLU 776.A O no hydrogen 2.885 N/A SER 781.A N GLU 777.A O no hydrogen 3.100 N/A SER 781.A OG GLU 777.A O no hydrogen 2.608 N/A SER 781.A OG PHE 778.A O no hydrogen 3.314 N/A CYS 782.A N PHE 778.A O no hydrogen 2.781 N/A ALA 783.A N THR 779.A O no hydrogen 3.022 N/A GLY 784.A N LEU 780.A O no hydrogen 3.140 N/A TYR 785.A N SER 781.A O no hydrogen 2.928 N/A CYS 786.A N CYS 782.A O no hydrogen 2.766 N/A CYS 786.A SG CYS 782.A O no hydrogen 3.127 N/A CYS 786.A SG ILE 827.A O no hydrogen 3.525 N/A VAL 787.A N ALA 783.A O no hydrogen 3.016 N/A ALA 788.A N GLY 784.A O no hydrogen 2.963 N/A THR 789.A N TYR 785.A O no hydrogen 3.097 N/A THR 789.A OG1 TYR 785.A O no hydrogen 2.611 N/A THR 789.A OG1 CYS 786.A O no hydrogen 3.281 N/A TYR 790.A N CYS 786.A O no hydrogen 3.197 N/A VAL 791.A N VAL 787.A O no hydrogen 2.811 N/A LEU 792.A N ALA 788.A O no hydrogen 2.972 N/A GLY 793.A N TYR 790.A O no hydrogen 3.305 N/A ILE 794.A N THR 789.A O no hydrogen 2.905 N/A ARG 797.A NE GLY 795.A O no hydrogen 3.230 N/A ARG 797.A NH1 HIS 812.A ND1 no hydrogen 3.418 N/A ARG 797.A NH1 ILE 813.A O no hydrogen 3.169 N/A ARG 797.A NH2 ILE 813.A O no hydrogen 3.325 N/A ARG 797.A NH2 ASP 814.A O no hydrogen 2.967 N/A HIS 798.A N ASN 801.A OD1 no hydrogen 2.850 N/A ASN 801.A N HIS 798.A O no hydrogen 3.192 N/A ASN 801.A ND2 ASP 796.A O no hydrogen 2.548 N/A MET 803.A N PHE 811.A O no hydrogen 2.802 N/A ILE 804.A N ASP 746.A O no hydrogen 2.964 N/A ARG 805.A N GLN 809.A O no hydrogen 2.701 N/A ARG 805.A NH1 THR 725.A OG1 no hydrogen 2.727 N/A GLU 806.A N ARG 744.A O no hydrogen 2.909 N/A SER 807.A OG GLN 809.A OE1 no hydrogen 2.852 N/A GLY 808.A N ARG 805.A O no hydrogen 2.833 N/A GLN 809.A N SER 807.A OG no hydrogen 3.334 N/A GLN 809.A NE2 ARG 723.A O no hydrogen 3.065 N/A LEU 810.A N SER 781.A OG no hydrogen 2.780 N/A PHE 811.A N MET 803.A O no hydrogen 2.855 N/A ILE 813.A N ASN 801.A O no hydrogen 3.067 N/A PHE 815.A N ASP 701.A OD2 no hydrogen 3.098 N/A HIS 817.A ND1 GLU 882.A OE2 no hydrogen 2.720 N/A PHE 818.A N GLU 882.A OE1 no hydrogen 2.927 N/A LEU 819.A N LEU 792.A O no hydrogen 2.721 N/A GLY 820.A N GLY 793.A O no hydrogen 3.247 N/A ASN 821.A N PHE 818.A O no hydrogen 3.211 N/A ASN 821.A ND2 PHE 818.A O no hydrogen 3.100 N/A VAL 824.A N TYR 891.A OH no hydrogen 2.851 N/A PHE 832.A N THR 829.A O no hydrogen 2.969 N/A VAL 833.A N THR 829.A O no hydrogen 2.998 N/A HIS 834.A N TYR 830.A O no hydrogen 2.853 N/A VAL 835.A N ASP 831.A O no hydrogen 3.344 N/A ILE 836.A N PHE 832.A O no hydrogen 2.875 N/A GLN 837.A N VAL 833.A O no hydrogen 2.851 N/A GLN 837.A NE2 LYS 840.A O no hydrogen 3.183 N/A GLN 837.A NE2 THR 841.A O no hydrogen 3.243 N/A GLN 838.A N VAL 835.A O no hydrogen 3.117 N/A GLY 839.A N HIS 834.A O no hydrogen 2.912 N/A ASN 843.A ND2 GLN 837.A O no hydrogen 3.170 N/A ASN 843.A ND2 GLN 838.A OE1 no hydrogen 2.856 N/A LYS 846.A N ASN 843.A OD1 no hydrogen 3.273 N/A PHE 847.A N ASN 843.A O no hydrogen 2.964 N/A GLU 848.A N SER 844.A O no hydrogen 3.077 N/A ARG 849.A N GLU 845.A O no hydrogen 3.355 N/A PHE 850.A N LYS 846.A O no hydrogen 3.008 N/A ARG 851.A N PHE 847.A O no hydrogen 2.945 N/A ARG 851.A NE GLU 848.A OE2 no hydrogen 2.837 N/A ARG 851.A NH1 ASN 914.A OD1 no hydrogen 3.022 N/A ARG 851.A NH2 GLU 848.A OE2 no hydrogen 3.324 N/A GLY 852.A N GLU 848.A O no hydrogen 2.941 N/A TYR 853.A N ARG 849.A O no hydrogen 3.047 N/A TYR 853.A OH GLU 776.A OE2 no hydrogen 2.681 N/A CYS 854.A N PHE 850.A O no hydrogen 3.081 N/A CYS 854.A SG PHE 850.A O no hydrogen 3.359 N/A GLU 855.A N ARG 851.A O no hydrogen 2.974 N/A ARG 856.A N GLY 852.A O no hydrogen 2.765 N/A ALA 857.A N TYR 853.A O no hydrogen 2.977 N/A TYR 858.A N CYS 854.A O no hydrogen 3.052 N/A TYR 858.A OH SER 895.A O no hydrogen 2.708 N/A THR 859.A N GLU 855.A O no hydrogen 3.010 N/A THR 859.A OG1 GLU 855.A O no hydrogen 2.571 N/A ILE 860.A N ARG 856.A O no hydrogen 3.080 N/A LEU 861.A N ALA 857.A O no hydrogen 3.347 N/A ARG 862.A N TYR 858.A O no hydrogen 3.219 N/A ARG 862.A NE LEU 896.A O no hydrogen 2.749 N/A ARG 862.A NE ALA 897.A O no hydrogen 3.248 N/A ARG 862.A NH2 ALA 897.A O no hydrogen 2.726 N/A ARG 863.A N THR 859.A O no hydrogen 3.311 N/A HIS 864.A N LEU 861.A O no hydrogen 3.118 N/A HIS 864.A ND1 ILE 860.A O no hydrogen 3.114 N/A GLY 865.A N ARG 862.A O no hydrogen 3.128 N/A LEU 869.A N GLY 865.A O no hydrogen 3.092 N/A HIS 870.A N LEU 866.A O no hydrogen 2.934 N/A LEU 871.A N LEU 867.A O no hydrogen 2.984 N/A PHE 872.A N PHE 868.A O no hydrogen 2.955 N/A ALA 873.A N LEU 869.A O no hydrogen 2.838 N/A LEU 874.A N HIS 870.A O no hydrogen 3.083 N/A MET 875.A N LEU 871.A O no hydrogen 3.211 N/A ARG 876.A N ALA 873.A O no hydrogen 3.344 N/A ARG 876.A NH1 SER 886.A OG no hydrogen 3.372 N/A ALA 877.A N LEU 874.A O no hydrogen 3.256 N/A ALA 878.A N MET 875.A O no hydrogen 3.145 N/A GLY 879.A N ARG 876.A O no hydrogen 3.229 N/A LEU 883.A N LEU 880.A O no hydrogen 3.082 N/A SER 884.A N ASP 888.A OD2 no hydrogen 2.837 N/A CYS 885.A N ASP 888.A OD2 no hydrogen 3.128 N/A CYS 885.A SG ASP 888.A OD2 no hydrogen 3.289 N/A ASP 888.A N CYS 885.A O no hydrogen 3.151 N/A ILE 889.A N CYS 885.A O no hydrogen 3.462 N/A GLN 890.A N SER 886.A O no hydrogen 2.771 N/A GLN 890.A NE2 GLN 890.A O no hydrogen 3.581 N/A GLN 890.A NE2 ASP 894.A OD1 no hydrogen 3.237 N/A TYR 891.A N LYS 887.A O no hydrogen 3.230 N/A LEU 892.A N ILE 889.A O no hydrogen 3.058 N/A LYS 893.A N ILE 889.A O no hydrogen 3.415 N/A ASP 894.A N GLN 890.A O no hydrogen 3.107 N/A SER 895.A N TYR 891.A O no hydrogen 2.959 N/A SER 895.A OG VAL 791.A O no hydrogen 2.869 N/A SER 895.A OG LEU 892.A O no hydrogen 3.297 N/A LEU 896.A N LEU 892.A O no hydrogen 3.055 N/A ALA 897.A N ASP 894.A O no hydrogen 3.033 N/A LEU 898.A N LYS 893.A O no hydrogen 3.051 N/A THR 901.A N GLU 904.A OE1 no hydrogen 3.398 N/A GLU 904.A N THR 901.A OG1 no hydrogen 3.148 N/A ALA 905.A N THR 901.A O no hydrogen 2.845 N/A LEU 906.A N GLU 902.A O no hydrogen 3.187 N/A LYS 907.A N GLU 903.A O no hydrogen 2.967 N/A HIS 908.A N GLU 904.A O no hydrogen 2.976 N/A HIS 908.A ND1 HIS 908.A O no hydrogen 3.123 N/A PHE 909.A N ALA 905.A O no hydrogen 2.805 N/A ARG 910.A N LEU 906.A O no hydrogen 2.920 N/A ARG 910.A NE GLU 855.A OE2 no hydrogen 3.451 N/A VAL 911.A N LYS 907.A O no hydrogen 3.298 N/A LYS 912.A N HIS 908.A O no hydrogen 2.980 N/A PHE 913.A N PHE 909.A O no hydrogen 2.645 N/A ASN 914.A N ARG 910.A O no hydrogen 2.778 N/A GLU 915.A N VAL 911.A O no hydrogen 2.967 N/A ALA 916.A N LYS 912.A O no hydrogen 2.926 N/A LEU 917.A N PHE 913.A O no hydrogen 3.000 N/A ARG 918.A N ASN 914.A O no hydrogen 2.954 N/A GLU 919.A N GLU 915.A O no hydrogen 2.856 N/A SER 920.A N ALA 916.A O no hydrogen 2.848 N/A SER 920.A OG LEU 828.A O no hydrogen 3.297 N/A