Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 8szi_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ARG 6.A NE PRO 3.A O no hydrogen 3.279 N/A ARG 6.A NH2 TYR 1.A O no hydrogen 3.161 N/A ARG 6.A NH2 PRO 3.A O no hydrogen 2.587 N/A ALA 7.A N ILE 78.A O no hydrogen 3.315 N/A GLN 8.A N HIS 311.A O no hydrogen 3.265 N/A LYS 9.A N TYR 76.A O no hydrogen 3.231 N/A ASP 12.A N THR 73.A O no hydrogen 3.100 N/A ILE 13.A N THR 73.A O no hydrogen 3.363 N/A LEU 15.A N GLY 75.A O no hydrogen 3.028 N/A GLY 16.A N ALA 107.A O no hydrogen 2.995 N/A GLY 17.A N ARG 77.A O no hydrogen 3.280 N/A PHE 19.A N PHE 79.A O no hydrogen 3.446 N/A ILE 21.A N PHE 19.A O no hydrogen 3.123 N/A ILE 21.A N ASP 80.A OD1 no hydrogen 2.960 N/A HIS 22.A ND1 ASP 80.A OD2 no hydrogen 3.269 N/A PHE 23.A N ARG 43.A O no hydrogen 2.900 N/A ALA 26.A N GLU 40.A O no hydrogen 2.884 N/A LYS 28.A N ALA 26.A O no hydrogen 3.094 N/A ILE 42.A N GLY 24.A O no hydrogen 3.192 N/A ARG 43.A NH1 GLU 244.A OE1 no hydrogen 2.996 N/A ARG 43.A NH1 GLU 244.A OE2 no hydrogen 3.511 N/A ARG 43.A NH2 GLU 244.A OE1 no hydrogen 3.119 N/A ASN 45.A N ILE 21.A O no hydrogen 2.883 N/A ASN 45.A ND2 PRO 20.A O no hydrogen 2.918 N/A ARG 50.A N ARG 47.A O no hydrogen 3.198 N/A TRP 51.A N ARG 47.A O no hydrogen 3.405 N/A GLN 53.A N PHE 49.A O no hydrogen 3.377 N/A ALA 54.A N TRP 51.A O no hydrogen 3.182 N/A PHE 57.A N GLN 53.A O no hydrogen 2.898 N/A ALA 58.A N ALA 54.A O no hydrogen 2.908 N/A ILE 59.A N MET 55.A O no hydrogen 2.958 N/A GLU 60.A N ILE 56.A O no hydrogen 2.923 N/A GLU 61.A N PHE 57.A O no hydrogen 2.894 N/A ILE 62.A N ALA 58.A O no hydrogen 2.920 N/A ASN 63.A N ILE 59.A O no hydrogen 2.933 N/A ASN 63.A ND2 LEU 74.A O no hydrogen 3.661 N/A SER 65.A N ILE 62.A O no hydrogen 3.031 N/A LEU 68.A N SER 65.A O no hydrogen 3.412 N/A LEU 69.A N GLN 371.A OE1 no hydrogen 3.076 N/A THR 73.A N ASP 12.A OD2 no hydrogen 3.219 N/A GLY 75.A N ILE 13.A O no hydrogen 2.675 N/A ARG 77.A N LEU 15.A O no hydrogen 2.871 N/A ARG 77.A NH2 PRO 103.A O no hydrogen 3.405 N/A ILE 78.A N ALA 7.A O no hydrogen 3.015 N/A PHE 79.A N GLY 17.A O no hydrogen 3.237 N/A THR 81.A N PHE 19.A O no hydrogen 3.318 N/A CYS 82.A N ASP 80.A OD1 no hydrogen 3.115 N/A CYS 82.A SG HIS 22.A ND1 no hydrogen 3.918 N/A CYS 82.A SG ASP 80.A OD2 no hydrogen 3.293 N/A ASN 83.A N THR 81.A OG1 no hydrogen 3.283 N/A ASN 83.A ND2 PHE 23.A O no hydrogen 2.660 N/A THR 84.A N THR 81.A O no hydrogen 3.154 N/A THR 84.A OG1 CYS 82.A O no hydrogen 2.638 N/A LYS 87.A NZ VAL 39.A O no hydrogen 3.035 N/A ALA 88.A N THR 84.A O no hydrogen 3.503 N/A LEU 89.A N VAL 85.A O no hydrogen 2.882 N/A GLU 90.A N SER 86.A O no hydrogen 2.937 N/A ALA 91.A N LYS 87.A O no hydrogen 2.989 N/A THR 92.A N ALA 88.A O no hydrogen 2.869 N/A THR 92.A OG1 ALA 88.A O no hydrogen 2.665 N/A LEU 93.A N LEU 89.A O no hydrogen 2.881 N/A SER 94.A N GLU 90.A O no hydrogen 2.978 N/A SER 94.A OG TYR 1.A O no hydrogen 3.106 N/A PHE 95.A N ALA 91.A O no hydrogen 2.934 N/A VAL 96.A N THR 92.A O no hydrogen 3.101 N/A ILE 102.A N GLN 98.A OE1 no hydrogen 2.577 N/A SER 104.A OG ASN 99.A OD1 no hydrogen 2.997 N/A ILE 106.A N ILE 14.A O no hydrogen 3.404 N/A VAL 108.A N PRO 130.A O no hydrogen 3.170 N/A VAL 109.A N GLY 16.A O no hydrogen 3.079 N/A GLY 110.A N VAL 132.A O no hydrogen 2.419 N/A THR 112.A OG1 TYR 134.A OH no hydrogen 3.341 N/A SER 117.A N GLY 113.A O no hydrogen 2.971 N/A SER 117.A OG GLY 113.A O no hydrogen 3.139 N/A SER 117.A OG SER 136.A OG no hydrogen 2.687 N/A THR 118.A N SER 114.A O no hydrogen 2.888 N/A THR 118.A OG1 SER 114.A O no hydrogen 2.813 N/A ALA 119.A N GLY 115.A O no hydrogen 2.947 N/A VAL 120.A N VAL 116.A O no hydrogen 2.923 N/A ALA 121.A N SER 117.A O no hydrogen 2.874 N/A ASN 122.A N THR 118.A O no hydrogen 2.962 N/A LEU 123.A N VAL 120.A O no hydrogen 3.243 N/A LEU 124.A N VAL 120.A O no hydrogen 2.914 N/A GLY 125.A N ALA 121.A O no hydrogen 2.908 N/A ILE 129.A N LEU 124.A O no hydrogen 3.448 N/A GLN 131.A N SER 149.A O no hydrogen 3.074 N/A VAL 132.A N VAL 108.A O no hydrogen 2.933 N/A SER 133.A N LEU 151.A O no hydrogen 2.808 N/A SER 133.A OG ALA 111.A O no hydrogen 3.150 N/A TYR 134.A OH LEU 18.A O no hydrogen 2.908 N/A TYR 134.A OH THR 112.A OG1 no hydrogen 3.341 N/A SER 136.A N SER 133.A OG no hydrogen 3.328 N/A SER 136.A OG THR 112.A O no hydrogen 3.167 N/A SER 136.A OG GLY 113.A O no hydrogen 3.288 N/A SER 136.A OG SER 117.A OG no hydrogen 2.687 N/A SER 136.A OG SER 133.A OG no hydrogen 3.407 N/A SER 137.A OG ASP 157.A OD1 no hydrogen 3.480 N/A SER 137.A OG ASP 157.A OD2 no hydrogen 3.095 N/A SER 138.A OG ASP 184.A O no hydrogen 2.948 N/A LEU 140.A N SER 138.A OG no hydrogen 3.418 N/A SER 142.A N ARG 139.A O no hydrogen 3.337 N/A SER 142.A OG ASP 423.A OD2 no hydrogen 3.080 N/A LYS 144.A NZ PHE 147.A O no hydrogen 3.447 N/A LYS 144.A NZ CYS 421.A O no hydrogen 3.563 N/A ASN 145.A N ASN 143.A OD1 no hydrogen 3.322 N/A ASN 145.A ND2 ASN 143.A OD1 no hydrogen 3.038 N/A PHE 147.A N ASN 143.A O no hydrogen 3.071 N/A SER 149.A OG ILE 129.A O no hydrogen 2.969 N/A LEU 151.A N GLN 131.A O no hydrogen 2.825 N/A ARG 152.A N GLY 422.A O no hydrogen 3.273 N/A ARG 152.A NE ASP 423.A OD1 no hydrogen 2.946 N/A ARG 152.A NH1 SER 136.A O no hydrogen 3.340 N/A ARG 152.A NH1 SER 138.A O no hydrogen 2.716 N/A ARG 152.A NH2 SER 138.A O no hydrogen 2.936 N/A ARG 152.A NH2 SER 142.A OG no hydrogen 2.874 N/A THR 153.A N SER 133.A O no hydrogen 2.936 N/A THR 153.A OG1 THR 153.A O no hydrogen 2.605 N/A ALA 161.A N ASP 157.A O no hydrogen 3.522 N/A THR 162.A N GLU 158.A O no hydrogen 3.055 N/A THR 162.A OG1 GLU 158.A O no hydrogen 2.964 N/A ALA 163.A N HIS 159.A O no hydrogen 2.818 N/A MET 164.A N GLN 160.A O no hydrogen 2.912 N/A ALA 165.A N ALA 161.A O no hydrogen 3.025 N/A ASP 166.A N THR 162.A O no hydrogen 2.901 N/A ILE 167.A N ALA 163.A O no hydrogen 2.866 N/A ILE 168.A N MET 164.A O no hydrogen 2.993 N/A GLU 169.A N ALA 165.A O no hydrogen 2.947 N/A TYR 170.A N ASP 166.A O no hydrogen 2.840 N/A PHE 171.A N ILE 167.A O no hydrogen 2.990 N/A ARG 172.A N GLU 169.A O no hydrogen 3.266 N/A TRP 173.A N ILE 168.A O no hydrogen 3.291 N/A TRP 173.A NE1 PRO 477.A O no hydrogen 3.300 N/A VAL 176.A N CYS 203.A O no hydrogen 3.271 N/A GLY 177.A N VAL 233.A O no hydrogen 3.044 N/A THR 178.A N PHE 206.A O no hydrogen 2.993 N/A THR 178.A OG1 PHE 206.A O no hydrogen 3.002 N/A ILE 179.A N VAL 235.A O no hydrogen 2.952 N/A ALA 180.A N GLU 208.A O no hydrogen 3.088 N/A ALA 181.A N PHE 237.A O no hydrogen 3.023 N/A ASP 182.A N ILE 210.A O no hydrogen 3.084 N/A ASP 183.A N ALA 181.A O no hydrogen 2.976 N/A TYR 185.A N ASP 183.A OD1 no hydrogen 3.342 N/A TYR 185.A OH SER 263.A OG no hydrogen 3.037 N/A GLY 186.A N ASP 183.A OD1 no hydrogen 3.104 N/A ARG 187.A NH1 ASP 182.A OD1 no hydrogen 2.680 N/A ILE 190.A N GLY 186.A O no hydrogen 2.921 N/A GLU 191.A N ARG 187.A O no hydrogen 2.943 N/A LYS 192.A N PRO 188.A O no hydrogen 2.948 N/A LYS 192.A NZ GLU 196.A OE2 no hydrogen 3.496 N/A PHE 193.A N GLY 189.A O no hydrogen 2.951 N/A ARG 194.A N ILE 190.A O no hydrogen 2.997 N/A ARG 194.A N GLU 191.A O no hydrogen 3.121 N/A GLU 195.A N GLU 191.A O no hydrogen 3.288 N/A GLU 196.A N LYS 192.A O no hydrogen 3.289 N/A ALA 197.A N PHE 193.A O no hydrogen 3.175 N/A GLU 198.A N ARG 194.A O no hydrogen 3.039 N/A GLU 199.A N GLU 195.A O no hydrogen 3.089 N/A ARG 200.A N ALA 197.A O no hydrogen 2.793 N/A ARG 200.A NH1 GLU 196.A O no hydrogen 3.071 N/A ARG 200.A NH1 GLU 196.A OE1 no hydrogen 3.079 N/A ASP 201.A N GLU 198.A O no hydrogen 3.061 N/A ILE 202.A N ALA 197.A O no hydrogen 3.049 N/A ASP 205.A N VAL 176.A O no hydrogen 2.791 N/A SER 207.A OG THR 178.A OG1 no hydrogen 2.872 N/A GLU 208.A N THR 178.A O no hydrogen 3.194 N/A ILE 210.A N ALA 180.A O no hydrogen 3.016 N/A GLU 218.A N ASP 215.A OD1 no hydrogen 3.429 N/A ILE 219.A N ASP 215.A O no hydrogen 3.405 N/A GLN 220.A N GLU 216.A O no hydrogen 2.911 N/A HIS 221.A N GLU 217.A O no hydrogen 2.902 N/A VAL 222.A N GLU 218.A O no hydrogen 2.929 N/A VAL 223.A N ILE 219.A O no hydrogen 2.911 N/A GLU 224.A N GLN 220.A O no hydrogen 2.891 N/A VAL 225.A N HIS 221.A O no hydrogen 2.926 N/A ILE 226.A N VAL 222.A O no hydrogen 3.057 N/A GLN 227.A N VAL 223.A O no hydrogen 3.131 N/A SER 229.A OG ASP 205.A OD2 no hydrogen 2.739 N/A ALA 231.A N SER 229.A OG no hydrogen 3.179 N/A LYS 232.A NZ PHE 478.A O no hydrogen 3.144 N/A ILE 234.A N ILE 259.A O no hydrogen 2.812 N/A VAL 235.A N GLY 177.A O no hydrogen 2.940 N/A VAL 236.A N LEU 261.A O no hydrogen 3.186 N/A PHE 237.A N ILE 179.A O no hydrogen 3.158 N/A SER 238.A OG SER 239.A O no hydrogen 2.821 N/A LEU 243.A N GLY 240.A O no hydrogen 3.130 N/A GLU 244.A N GLY 240.A O no hydrogen 2.927 N/A ILE 247.A N LEU 243.A O no hydrogen 3.175 N/A LYS 248.A N GLU 244.A O no hydrogen 2.937 N/A LYS 248.A NZ GLU 244.A OE2 no hydrogen 3.561 N/A GLU 249.A N PRO 245.A O no hydrogen 2.948 N/A ILE 250.A N LEU 246.A O no hydrogen 2.915 N/A VAL 251.A N ILE 247.A O no hydrogen 2.890 N/A ARG 252.A N LYS 248.A O no hydrogen 2.957 N/A ARG 253.A N GLU 249.A O no hydrogen 3.345 N/A ARG 253.A N ILE 250.A O no hydrogen 3.267 N/A ASN 254.A N VAL 251.A O no hydrogen 3.024 N/A LYS 258.A NZ ALA 231.A O no hydrogen 3.047 N/A ILE 259.A N LYS 232.A O no hydrogen 2.852 N/A TRP 260.A NE1 VAL 280.A O no hydrogen 2.860 N/A LEU 261.A N ILE 234.A O no hydrogen 2.938 N/A ALA 262.A N ILE 285.A O no hydrogen 2.999 N/A SER 263.A OG TYR 185.A OH no hydrogen 3.037 N/A TRP 266.A N SER 263.A O no hydrogen 3.315 N/A TRP 266.A NE1 VAL 236.A O no hydrogen 3.371 N/A ALA 267.A N SER 263.A O no hydrogen 2.922 N/A SER 269.A N TRP 266.A O no hydrogen 3.473 N/A LEU 271.A N SER 269.A OG no hydrogen 3.287 N/A ALA 273.A N SER 269.A O no hydrogen 3.128 N/A MET 274.A N ILE 272.A O no hydrogen 2.913 N/A TYR 277.A N MET 274.A O no hydrogen 3.150 N/A VAL 280.A N TYR 277.A O no hydrogen 2.938 N/A VAL 281.A N TYR 277.A O no hydrogen 2.924 N/A GLY 282.A N PHE 278.A O no hydrogen 2.947 N/A THR 284.A OG1 VAL 281.A O no hydrogen 2.608 N/A ILE 285.A N TRP 260.A O no hydrogen 3.323 N/A GLY 286.A N ILE 431.A O no hydrogen 3.170 N/A ALA 288.A N SER 429.A O no hydrogen 2.657 N/A GLY 292.A N LEU 353.A O no hydrogen 3.064 N/A GLN 293.A NE2 GLY 292.A O no hydrogen 3.504 N/A ARG 298.A NH2 ILE 348.A O no hydrogen 2.836 N/A LEU 301.A N PHE 297.A O no hydrogen 2.920 N/A LYS 302.A N ARG 298.A O no hydrogen 2.922 N/A LYS 303.A N PHE 300.A O no hydrogen 3.506 N/A HIS 305.A NE2 GLY 336.A O no hydrogen 3.189 N/A ARG 307.A N HIS 305.A ND1 no hydrogen 3.047 N/A ARG 307.A NH2 GLY 336.A O no hydrogen 3.410 N/A SER 309.A N HIS 305.A O no hydrogen 3.222 N/A SER 309.A OG HIS 305.A O no hydrogen 3.164 N/A VAL 310.A N LYS 308.A O no hydrogen 2.932 N/A ASN 312.A N SER 309.A O no hydrogen 3.253 N/A ASN 312.A ND2 GLN 53.A OE1 no hydrogen 3.087 N/A LYS 316.A NZ GLU 320.A OE2 no hydrogen 3.202 N/A PHE 318.A N PHE 314.A O no hydrogen 2.961 N/A TRP 319.A N ALA 315.A O no hydrogen 2.877 N/A GLU 320.A N LYS 316.A O no hydrogen 2.973 N/A GLU 321.A N GLU 317.A O no hydrogen 2.882 N/A THR 322.A N PHE 318.A O no hydrogen 2.903 N/A THR 322.A OG1 PHE 318.A O no hydrogen 2.973 N/A PHE 323.A N TRP 319.A O no hydrogen 2.947 N/A HIS 326.A N PRO 332.A O no hydrogen 2.963 N/A LEU 327.A N GLU 320.A OE2 no hydrogen 2.968 N/A TYR 347.A OH LEU 301.A O no hydrogen 3.263 N/A ILE 348.A N THR 345.A O no hydrogen 3.437 N/A ASP 349.A N THR 345.A O no hydrogen 3.252 N/A THR 351.A OG1 HIS 352.A ND1 no hydrogen 3.408 N/A ARG 354.A NH1 LEU 289.A O no hydrogen 2.699 N/A TYR 357.A OH ASN 411.A OD1 no hydrogen 3.337 N/A ASN 358.A ND2 TYR 134.A O no hydrogen 2.854 N/A VAL 359.A N ILE 355.A O no hydrogen 2.963 N/A TYR 360.A N SER 356.A O no hydrogen 2.946 N/A TYR 360.A OH GLU 61.A OE1 no hydrogen 2.763 N/A TYR 360.A OH TYR 364.A OH no hydrogen 2.502 N/A LEU 361.A N TYR 357.A O no hydrogen 2.910 N/A ALA 362.A N ASN 358.A O no hydrogen 2.903 N/A VAL 363.A N VAL 359.A O no hydrogen 2.991 N/A TYR 364.A N TYR 360.A O no hydrogen 3.024 N/A TYR 364.A OH TYR 360.A OH no hydrogen 2.502 N/A SER 365.A N LEU 361.A O no hydrogen 2.899 N/A SER 365.A OG LEU 361.A O no hydrogen 2.757 N/A ALA 367.A N VAL 363.A O no hydrogen 3.031 N/A HIS 368.A N TYR 364.A O no hydrogen 2.868 N/A HIS 368.A ND1 TYR 364.A O no hydrogen 3.264 N/A ALA 369.A N SER 365.A O no hydrogen 2.968 N/A LEU 370.A N ILE 366.A O no hydrogen 2.967 N/A GLN 371.A N ALA 367.A O no hydrogen 2.922 N/A ASP 372.A N HIS 368.A O no hydrogen 2.896 N/A ILE 373.A N ALA 369.A O no hydrogen 2.976 N/A TYR 374.A N LEU 370.A O no hydrogen 2.920 N/A THR 375.A N GLN 371.A O no hydrogen 2.917 N/A THR 375.A OG1 GLN 371.A O no hydrogen 3.155 N/A CYS 376.A SG ILE 373.A O no hydrogen 3.449 N/A GLY 379.A N GLY 386.A O no hydrogen 3.142 N/A ARG 380.A N LEU 377.A O no hydrogen 3.315 N/A ARG 380.A NH1 PRO 378.A O no hydrogen 2.871 N/A GLY 381.A N GLY 386.A O no hydrogen 2.928 N/A GLY 386.A N PHE 383.A O no hydrogen 3.361 N/A CYS 388.A SG LEU 377.A O no hydrogen 3.537 N/A GLU 395.A N GLN 398.A OE1 no hydrogen 2.872 N/A TRP 397.A NE1 GLU 395.A OE1 no hydrogen 2.365 N/A VAL 399.A N GLU 395.A O no hydrogen 3.414 N/A LEU 400.A N ALA 396.A O no hydrogen 2.936 N/A LYS 401.A N TRP 397.A O no hydrogen 2.893 N/A LYS 401.A NZ HIS 405.A NE2 no hydrogen 3.283 N/A HIS 402.A N GLN 398.A O no hydrogen 2.989 N/A HIS 402.A ND1 GLN 398.A O no hydrogen 3.290 N/A LEU 403.A N VAL 399.A O no hydrogen 2.867 N/A ARG 404.A N LEU 400.A O no hydrogen 2.941 N/A ARG 404.A NH2 LYS 148.A O no hydrogen 3.090 N/A HIS 405.A N HIS 402.A O no hydrogen 3.343 N/A LEU 406.A N LEU 403.A O no hydrogen 3.384 N/A PHE 408.A N VAL 416.A O no hydrogen 3.414 N/A THR 409.A OG1 ASN 410.A O no hydrogen 3.472 N/A THR 409.A OG1 GLU 414.A O no hydrogen 3.041 N/A ASN 410.A N GLU 414.A O no hydrogen 3.016 N/A ASN 411.A ND2 GLN 293.A O no hydrogen 3.254 N/A MET 412.A N ASN 410.A OD1 no hydrogen 3.365 N/A GLU 414.A N ASN 410.A OD1 no hydrogen 2.807 N/A VAL 416.A N PHE 408.A O no hydrogen 2.855 N/A GLY 422.A N ASP 419.A O no hydrogen 3.115 N/A ASP 423.A N ASP 419.A OD1 no hydrogen 2.515 N/A TYR 428.A N TYR 450.A O no hydrogen 3.280 N/A SER 429.A N ALA 288.A O no hydrogen 2.793 N/A ILE 430.A N GLY 448.A O no hydrogen 3.175 N/A ILE 431.A N GLY 286.A O no hydrogen 3.109 N/A ASN 432.A N LYS 445.A O no hydrogen 2.735 N/A ASN 432.A ND2 HIS 434.A NE2 no hydrogen 2.978 N/A ASN 432.A ND2 LEU 468.A O no hydrogen 3.608 N/A TRP 433.A N THR 284.A O no hydrogen 3.093 N/A TRP 433.A NE1 ALA 267.A O no hydrogen 2.956 N/A HIS 434.A N VAL 443.A O no hydrogen 2.828 N/A SER 436.A N SER 441.A O no hydrogen 2.798 N/A ASP 439.A N SER 436.A OG no hydrogen 3.398 N/A VAL 443.A N HIS 434.A O no hydrogen 3.151 N/A LYS 445.A N ASN 432.A O no hydrogen 2.872 N/A VAL 447.A N ILE 430.A O no hydrogen 2.984 N/A TYR 449.A N PHE 461.A O no hydrogen 3.039 N/A TYR 450.A N TYR 428.A O no hydrogen 3.145 N/A ASN 451.A N ARG 459.A O no hydrogen 2.799 N/A TYR 453.A N ASN 451.A OD1 no hydrogen 3.041 N/A GLU 458.A N LYS 455.A O no hydrogen 3.131 N/A ARG 459.A NE ALA 454.A O no hydrogen 3.525 N/A PHE 461.A N TYR 449.A O no hydrogen 3.075 N/A ASN 463.A N VAL 447.A O no hydrogen 2.859 N/A ILE 467.A N GLU 464.A O no hydrogen 3.378 N/A TRP 469.A N SER 473.A O no hydrogen 3.276 N/A SER 470.A OG TRP 469.A O no hydrogen 3.153 N/A GLY 471.A N LEU 468.A O no hydrogen 3.451 N/A ARG 474.A NH1 GLU 464.A O no hydrogen 3.526 N/A SER 479.A OG TRP 175.A O no hydrogen 2.898 N/A SER 482.A OG CYS 500.A O no hydrogen 3.272 N/A CYS 485.A SG ARG 490.A O no hydrogen 3.768 N/A CYS 485.A SG GLU 503.A O no hydrogen 4.046 N/A THR 489.A OG1 LEU 486.A O no hydrogen 3.472 N/A ARG 490.A N VAL 505.A O no hydrogen 2.639 N/A ARG 490.A NH1 LYS 491.A O no hydrogen 2.982 N/A LYS 491.A N ALA 518.A O no hydrogen 3.336 N/A CYS 500.A SG ASN 174.A O no hydrogen 3.691 N/A CYS 501.A N PRO 498.A O no hydrogen 3.269 N/A GLU 503.A N GLY 492.A O no hydrogen 3.342 N/A VAL 505.A N ARG 490.A O no hydrogen 2.688 N/A CYS 507.A SG SER 513.A OG no hydrogen 3.675 N/A GLY 510.A N SER 530.A OG no hydrogen 3.320 N/A GLU 511.A N PRO 508.A O no hydrogen 3.291 N/A TYR 512.A N ASN 522.A O no hydrogen 3.049 N/A SER 513.A N HIS 534.A O no hydrogen 3.140 N/A SER 513.A OG ALA 487.A O no hydrogen 2.527 N/A ASP 527.A N ASP 526.A OD1 no hydrogen 2.856 N/A PHE 528.A N PRO 525.A O no hydrogen 3.160 N/A TRP 529.A N ILE 538.A O no hydrogen 2.679 N/A SER 530.A OG ASN 531.A O no hydrogen 3.406 N/A ASN 531.A N SER 536.A O no hydrogen 3.290 N/A GLU 532.A N GLU 532.A OE1 no hydrogen 2.808 N/A HIS 534.A N ASN 531.A O no hydrogen 3.374 N/A HIS 534.A NE2 ASP 509.A OD1 no hydrogen 2.975 N/A SER 536.A OG CYS 537.A O no hydrogen 3.564 N/A ILE 538.A N TRP 529.A O no hydrogen 2.832 N/A LYS 540.A N ASP 527.A O no hydrogen 3.321 N/A LYS 540.A NZ ASP 697.A O no hydrogen 3.364 N/A GLU 543.A N ILE 700.A O no hydrogen 2.927 N/A SER 546.A OG THR 548.A OG1 no hydrogen 3.374 N/A THR 548.A OG1 SER 546.A OG no hydrogen 3.374 N/A GLU 549.A N SER 546.A O no hydrogen 3.432 N/A THR 556.A N GLY 552.A O no hydrogen 2.947 N/A THR 556.A OG1 GLY 552.A O no hydrogen 3.130 N/A LEU 557.A N ILE 553.A O no hydrogen 2.910 N/A PHE 558.A N ALA 554.A O no hydrogen 2.915 N/A ALA 559.A N LEU 555.A O no hydrogen 2.921 N/A VAL 560.A N THR 556.A O no hydrogen 2.949 N/A LEU 561.A N LEU 557.A O no hydrogen 2.916 N/A GLY 562.A N PHE 558.A O no hydrogen 2.904 N/A ILE 563.A N ALA 559.A O no hydrogen 2.949 N/A PHE 564.A N VAL 560.A O no hydrogen 2.932 N/A LEU 565.A N LEU 561.A O no hydrogen 2.949 N/A THR 566.A N GLY 562.A O no hydrogen 2.910 N/A THR 566.A OG1 GLY 562.A O no hydrogen 2.529 N/A ALA 567.A N ILE 563.A O no hydrogen 2.931 N/A PHE 568.A N PHE 564.A O no hydrogen 2.930 N/A VAL 569.A N LEU 565.A O no hydrogen 3.291 N/A LEU 570.A N THR 566.A O no hydrogen 3.440 N/A GLY 571.A N ALA 567.A O no hydrogen 2.951 N/A VAL 572.A N PHE 568.A O no hydrogen 2.984 N/A PHE 573.A N VAL 569.A O no hydrogen 3.033 N/A ILE 574.A N LEU 570.A O no hydrogen 3.104 N/A LYS 575.A N GLY 571.A O no hydrogen 3.118 N/A PHE 576.A N VAL 572.A O no hydrogen 3.066 N/A ARG 577.A NE ILE 574.A O no hydrogen 2.995 N/A ARG 577.A NH2 ILE 574.A O no hydrogen 3.377 N/A THR 579.A OG1 PHE 576.A O no hydrogen 2.785 N/A LYS 583.A N THR 579.A O no hydrogen 3.089 N/A ALA 584.A N PRO 580.A O no hydrogen 2.889 N/A THR 585.A OG1 VAL 582.A O no hydrogen 2.769 N/A SER 590.A N ASN 586.A O no hydrogen 2.942 N/A SER 590.A OG ASN 586.A O no hydrogen 2.760 N/A TYR 591.A N ARG 587.A O no hydrogen 2.965 N/A LEU 592.A N GLU 588.A O no hydrogen 2.975 N/A LEU 593.A N LEU 589.A O no hydrogen 2.859 N/A LEU 594.A N SER 590.A O no hydrogen 2.897 N/A PHE 595.A N TYR 591.A O no hydrogen 2.938 N/A SER 596.A N LEU 592.A O no hydrogen 2.928 N/A LEU 597.A N LEU 593.A O no hydrogen 2.855 N/A LEU 598.A N LEU 594.A O no hydrogen 2.918 N/A CYS 599.A N PHE 595.A O no hydrogen 2.981 N/A CYS 599.A SG PHE 595.A O no hydrogen 3.595 N/A CYS 600.A N SER 596.A O no hydrogen 2.862 N/A CYS 600.A SG SER 784.A OG no hydrogen 3.300 N/A PHE 601.A N LEU 597.A O no hydrogen 2.907 N/A SER 602.A N LEU 598.A O no hydrogen 2.933 N/A SER 603.A N CYS 599.A O no hydrogen 2.909 N/A SER 604.A OG PHE 601.A O no hydrogen 3.486 N/A LEU 605.A N SER 602.A O no hydrogen 3.418 N/A GLY 609.A N LEU 545.A O no hydrogen 3.035 N/A GLN 612.A N GLU 610.A O no hydrogen 2.877 N/A THR 615.A N GLN 612.A O no hydrogen 3.136 N/A THR 615.A OG1 GLN 612.A O no hydrogen 2.568 N/A CYS 616.A N GLN 612.A O no hydrogen 3.386 N/A CYS 616.A SG GLN 612.A O no hydrogen 3.244 N/A LEU 618.A N THR 615.A O no hydrogen 3.167 N/A GLY 624.A N GLN 620.A O no hydrogen 2.980 N/A ILE 625.A N PRO 621.A O no hydrogen 2.922 N/A SER 626.A N ALA 622.A O no hydrogen 2.927 N/A SER 626.A OG ALA 622.A O no hydrogen 2.765 N/A PHE 627.A N PHE 623.A O no hydrogen 2.933 N/A VAL 628.A N GLY 624.A O no hydrogen 2.970 N/A LEU 629.A N ILE 625.A O no hydrogen 2.933 N/A CYS 630.A N SER 626.A O no hydrogen 3.413 N/A CYS 630.A SG SER 596.A OG no hydrogen 3.051 N/A CYS 630.A SG SER 626.A O no hydrogen 3.300 N/A ILE 631.A N PHE 627.A O no hydrogen 2.999 N/A SER 632.A N VAL 628.A O no hydrogen 2.907 N/A SER 632.A OG VAL 628.A O no hydrogen 2.871 N/A CYS 633.A N LEU 629.A O no hydrogen 2.928 N/A CYS 633.A SG LEU 629.A O no hydrogen 3.201 N/A ILE 634.A N CYS 630.A O no hydrogen 2.977 N/A LEU 635.A N ILE 631.A O no hydrogen 2.944 N/A VAL 636.A N SER 632.A O no hydrogen 2.945 N/A LYS 637.A N CYS 633.A O no hydrogen 2.918 N/A THR 638.A N ILE 634.A O no hydrogen 3.072 N/A THR 638.A N LEU 635.A O no hydrogen 3.262 N/A THR 638.A OG1 ILE 634.A O no hydrogen 2.993 N/A ASN 639.A N LEU 635.A O no hydrogen 3.106 N/A ARG 640.A N VAL 636.A O no hydrogen 3.210 N/A ARG 640.A NH2 TRP 658.A O no hydrogen 3.223 N/A LEU 642.A N THR 638.A O no hydrogen 3.207 N/A LEU 643.A N ASN 639.A O no hydrogen 3.044 N/A VAL 644.A N ARG 640.A O no hydrogen 3.076 N/A PHE 645.A N VAL 641.A O no hydrogen 2.986 N/A GLU 646.A N LEU 642.A O no hydrogen 3.038 N/A ALA 647.A N VAL 644.A O no hydrogen 3.357 N/A LYS 648.A N GLU 646.A O no hydrogen 2.742 N/A TRP 658.A N HIS 654.A O no hydrogen 3.100 N/A GLY 659.A N LYS 656.A O no hydrogen 3.111 N/A GLN 663.A N LEU 660.A O no hydrogen 3.254 N/A PHE 664.A N ASN 661.A O no hydrogen 3.159 N/A LEU 666.A N LEU 662.A O no hydrogen 3.030 N/A VAL 667.A N GLN 663.A O no hydrogen 2.946 N/A PHE 668.A N PHE 664.A O no hydrogen 2.922 N/A LEU 669.A N LEU 665.A O no hydrogen 2.910 N/A CYS 670.A N LEU 666.A O no hydrogen 2.953 N/A CYS 670.A SG LEU 666.A O no hydrogen 3.507 N/A THR 671.A N PHE 668.A O no hydrogen 2.981 N/A THR 671.A OG1 PHE 668.A O no hydrogen 3.291 N/A PHE 672.A N LEU 669.A O no hydrogen 3.413 N/A GLN 674.A NE2 LEU 715.A O no hydrogen 3.226 N/A ILE 675.A N THR 671.A O no hydrogen 2.950 N/A VAL 676.A N PHE 672.A O no hydrogen 2.912 N/A ILE 677.A N MET 673.A O no hydrogen 3.081 N/A CYS 678.A N GLN 674.A O no hydrogen 3.215 N/A CYS 678.A SG GLN 674.A O no hydrogen 3.025 N/A VAL 679.A N ILE 675.A O no hydrogen 3.017 N/A ILE 680.A N VAL 676.A O no hydrogen 3.051 N/A TRP 681.A N ILE 677.A O no hydrogen 2.810 N/A LEU 682.A N CYS 678.A O no hydrogen 2.833 N/A TYR 683.A N VAL 679.A O no hydrogen 2.934 N/A THR 684.A N ILE 680.A O no hydrogen 3.248 N/A THR 684.A OG1 ILE 680.A O no hydrogen 3.128 N/A ALA 685.A N TRP 681.A O no hydrogen 3.160 N/A SER 688.A N HIS 705.A O no hydrogen 3.362 N/A SER 689.A N ASP 613.A OD1 no hydrogen 2.887 N/A SER 689.A OG PRO 611.A O no hydrogen 3.279 N/A TYR 690.A N THR 703.A O no hydrogen 2.760 N/A TYR 690.A OH TYR 768.A OH no hydrogen 2.790 N/A ASN 692.A N PHE 701.A O no hydrogen 2.895 N/A GLN 693.A N GLN 693.A OE1 no hydrogen 2.877 N/A GLU 694.A N ASN 692.A OD1 no hydrogen 3.254 N/A ILE 700.A N GLU 541.A O no hydrogen 2.964 N/A PHE 701.A N ASN 692.A O no hydrogen 3.123 N/A THR 703.A N TYR 690.A O no hydrogen 3.106 N/A THR 703.A OG1 TYR 768.A OH no hydrogen 2.839 N/A HIS 705.A N SER 688.A O no hydrogen 2.925 N/A ALA 711.A N SER 708.A OG no hydrogen 3.144 N/A GLY 713.A N LEU 709.A O no hydrogen 3.102 N/A PHE 714.A N MET 710.A O no hydrogen 3.024 N/A LEU 715.A N ALA 711.A O no hydrogen 3.276 N/A ILE 716.A N LEU 712.A O no hydrogen 3.219 N/A GLY 717.A N GLY 713.A O no hydrogen 2.877 N/A TYR 718.A N PHE 714.A O no hydrogen 2.903 N/A THR 719.A N LEU 715.A O no hydrogen 2.991 N/A THR 719.A OG1 LEU 715.A O no hydrogen 2.969 N/A CYS 720.A N ILE 716.A O no hydrogen 2.917 N/A CYS 720.A SG ILE 716.A O no hydrogen 3.211 N/A LEU 721.A N GLY 717.A O no hydrogen 2.863 N/A LEU 722.A N TYR 718.A O no hydrogen 2.995 N/A ALA 723.A N THR 719.A O no hydrogen 2.957 N/A ALA 724.A N CYS 720.A O no hydrogen 3.013 N/A ILE 725.A N LEU 721.A O no hydrogen 3.203 N/A CYS 726.A N LEU 722.A O no hydrogen 3.141 N/A PHE 727.A N ALA 724.A O no hydrogen 2.893 N/A PHE 729.A N ILE 725.A O no hydrogen 3.142 N/A ALA 730.A N CYS 726.A O no hydrogen 3.277 N/A PHE 731.A N PHE 727.A O no hydrogen 2.866 N/A LYS 732.A N PHE 728.A O no hydrogen 2.959 N/A SER 733.A N ALA 730.A O no hydrogen 3.265 N/A SER 733.A OG ALA 730.A O no hydrogen 3.056 N/A ARG 734.A N PHE 731.A O no hydrogen 3.471 N/A ARG 734.A NH1 PHE 731.A O no hydrogen 3.459 N/A LEU 736.A N SER 733.A O no hydrogen 3.334 N/A PHE 740.A N PRO 737.A O no hydrogen 3.276 N/A ASN 741.A ND2 ARG 734.A O no hydrogen 2.945 N/A THR 747.A OG1 ALA 743.A O no hydrogen 3.505 N/A SER 749.A N PHE 745.A O no hydrogen 2.927 N/A SER 749.A OG PHE 745.A O no hydrogen 3.401 N/A SER 749.A OG ILE 746.A O no hydrogen 2.689 N/A MET 750.A N ILE 746.A O no hydrogen 2.961 N/A LEU 751.A N THR 747.A O no hydrogen 2.908 N/A ILE 752.A N PHE 748.A O no hydrogen 2.816 N/A PHE 753.A N SER 749.A O no hydrogen 3.080 N/A PHE 754.A N MET 750.A O no hydrogen 2.883 N/A ILE 755.A N LEU 751.A O no hydrogen 2.912 N/A VAL 756.A N ILE 752.A O no hydrogen 3.001 N/A TRP 757.A N.A PHE 753.A O no hydrogen 3.129 N/A TRP 757.A N.B PHE 753.A O no hydrogen 3.134 N/A ILE 758.A N PHE 754.A O no hydrogen 2.847 N/A SER 759.A N ILE 755.A O no hydrogen 2.852 N/A PHE 760.A N VAL 756.A O no hydrogen 2.972 N/A ILE 761.A N ILE 758.A O no hydrogen 3.299 N/A TYR 764.A N PHE 760.A O no hydrogen 3.406 N/A ALA 765.A N ILE 761.A O no hydrogen 3.162 N/A SER 766.A N PRO 762.A O no hydrogen 3.028 N/A SER 766.A N ALA 763.A O no hydrogen 3.164 N/A THR 767.A N ALA 763.A O no hydrogen 2.758 N/A TYR 768.A OH TYR 690.A OH no hydrogen 2.790 N/A TYR 768.A OH THR 703.A OG1 no hydrogen 2.839 N/A SER 773.A OG LYS 770.A O no hydrogen 2.767 N/A VAL 775.A N PHE 771.A O no hydrogen 2.980 N/A GLU 776.A N VAL 772.A O no hydrogen 3.001 N/A VAL 777.A N SER 773.A O no hydrogen 2.899 N/A ILE 778.A N ALA 774.A O no hydrogen 2.917 N/A ALA 779.A N VAL 775.A O no hydrogen 2.926 N/A ILE 780.A N GLU 776.A O no hydrogen 2.959 N/A LEU 781.A N VAL 777.A O no hydrogen 2.917 N/A ALA 782.A N ILE 778.A O no hydrogen 2.899 N/A ALA 783.A N ALA 779.A O no hydrogen 2.967 N/A SER 784.A N ILE 780.A O no hydrogen 2.984 N/A SER 784.A OG ILE 780.A O no hydrogen 3.149 N/A PHE 785.A N LEU 781.A O no hydrogen 2.921 N/A GLY 786.A N ALA 782.A O no hydrogen 2.912 N/A LEU 787.A N ALA 783.A O no hydrogen 2.994 N/A LEU 788.A N SER 784.A O no hydrogen 2.950 N/A ALA 789.A N PHE 785.A O no hydrogen 2.894 N/A CYS 790.A N GLY 786.A O no hydrogen 2.976 N/A CYS 790.A SG GLY 786.A O no hydrogen 3.242 N/A ILE 791.A N LEU 787.A O no hydrogen 2.978 N/A PHE 792.A N LEU 788.A O no hydrogen 2.945 N/A PHE 792.A N ALA 789.A O no hydrogen 3.206 N/A PHE 793.A N ALA 789.A O no hydrogen 3.002 N/A LYS 795.A NZ GLU 742.A OE1 no hydrogen 3.455 N/A LYS 795.A NZ GLU 742.A OE2 no hydrogen 3.299 N/A LYS 795.A NZ ILE 791.A O no hydrogen 3.054 N/A ILE 796.A N PHE 792.A O no hydrogen 3.072 N/A TYR 797.A N PHE 793.A O no hydrogen 3.190 N/A ILE 798.A N ASN 794.A O no hydrogen 2.951 N/A ILE 799.A N LYS 795.A O no hydrogen 2.925 N/A LEU 800.A N ILE 796.A O no hydrogen 2.909 N/A PHE 801.A N TYR 797.A O no hydrogen 2.656 N/A ASN 806.A N PRO 803.A O no hydrogen 3.246 N/A THR 807.A N ARG 805.A O no hydrogen 2.650 N/A ARG 812.A N ILE 808.A O no hydrogen 2.894 N/A CYS 813.A N GLU 809.A O no hydrogen 2.932 N/A SER 814.A N GLU 810.A O no hydrogen 2.895 N/A SER 814.A OG GLU 810.A O no hydrogen 2.878 N/A THR 815.A N VAL 811.A O no hydrogen 2.934 N/A THR 815.A OG1 VAL 811.A O no hydrogen 3.103 N/A ALA 816.A N ARG 812.A O no hydrogen 3.064 N/A ALA 817.A N SER 814.A O no hydrogen 3.118 N/A HIS 818.A N THR 815.A O no hydrogen 3.082 N/A ALA 819.A N ALA 816.A O no hydrogen 2.826 N/A