Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 6msu_B.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ASN 3.A N GLY 1.A O no hydrogen 3.020 N/A ASN 3.A ND2 ASP 39.A OD1 no hydrogen 2.604 N/A CYS 5.A N ASN 3.A OD1 no hydrogen 2.998 N/A CYS 5.A SG CYS 38.A O no hydrogen 3.734 N/A CYS 5.A SG ASP 39.A O no hydrogen 3.229 N/A THR 6.A N ASN 3.A O no hydrogen 2.937 N/A THR 6.A OG1 GLY 1.A O no hydrogen 2.753 N/A THR 6.A OG1 ASN 3.A O no hydrogen 3.279 N/A THR 7.A N ILE 4.A O no hydrogen 3.410 N/A THR 7.A OG1 ILE 4.A O no hydrogen 2.541 N/A SER 11.A OG ARG 8.A O no hydrogen 3.392 N/A GLN 14.A N SER 12.A OG no hydrogen 3.216 N/A GLN 14.A NE2 ASP 434.A OD1 no hydrogen 2.362 N/A CYS 16.A N CYS 13.A O no hydrogen 2.984 N/A LEU 17.A N CYS 13.A O no hydrogen 3.233 N/A ALA 18.A N GLN 14.A O no hydrogen 3.172 N/A VAL 19.A N CYS 16.A O no hydrogen 3.414 N/A MET 22.A N SER 20.A OG no hydrogen 3.014 N/A CYS 23.A N SER 20.A O no hydrogen 3.488 N/A TRP 25.A N GLU 55.A O no hydrogen 3.235 N/A CYS 26.A N ARG 37.A O no hydrogen 3.130 N/A SER 27.A N SER 53.A O no hydrogen 2.975 N/A SER 27.A OG SER 27.A O no hydrogen 2.622 N/A SER 35.A OG PRO 36.A O no hydrogen 3.275 N/A CYS 38.A SG CYS 5.A O no hydrogen 4.047 N/A CYS 38.A SG ALA 24.A O no hydrogen 3.932 N/A LEU 45.A N GLU 42.A O no hydrogen 2.971 N/A CYS 49.A SG ASP 47.A O no hydrogen 3.423 N/A SER 53.A OG ASP 28.A O no hydrogen 3.216 N/A GLU 55.A N TRP 25.A O no hydrogen 2.772 N/A SER 59.A OG ASP 96.A OD2 no hydrogen 3.121 N/A GLU 60.A N ARG 91.A O no hydrogen 3.048 N/A ARG 62.A N ALA 89.A O no hydrogen 2.874 N/A ARG 62.A NH1 GLU 60.A OE1 no hydrogen 3.359 N/A LEU 64.A N ARG 87.A O no hydrogen 2.930 N/A ARG 67.A N GLN 86.A OE1 no hydrogen 2.647 N/A ARG 67.A NE GLU 65.A OE1 no hydrogen 2.982 N/A SER 70.A N THR 81.A O no hydrogen 2.930 N/A SER 70.A OG ASP 76.A OD2 no hydrogen 3.024 N/A ASP 71.A N ASP 71.A OD1 no hydrogen 2.400 N/A LYS 72.A N ASP 71.A OD1 no hydrogen 3.049 N/A GLY 73.A N GLU 108.A O no hydrogen 2.965 N/A THR 81.A N SER 70.A OG no hydrogen 3.180 N/A THR 81.A OG1 GLN 79.A O no hydrogen 2.714 N/A GLN 82.A N ASP 423.A OD2 no hydrogen 2.806 N/A GLN 82.A NE2 ASP 423.A OD1 no hydrogen 3.289 N/A SER 84.A N GLN 103.A O no hydrogen 2.928 N/A SER 84.A OG ARG 67.A O no hydrogen 3.348 N/A GLN 86.A N GLU 65.A O no hydrogen 2.652 N/A GLN 86.A NE2 ARG 67.A O no hydrogen 3.607 N/A GLN 86.A NE2 VAL 83.A O no hydrogen 2.245 N/A ARG 87.A NE GLN 428.A OE1 no hydrogen 2.467 N/A ARG 87.A NH2 GLN 428.A OE1 no hydrogen 2.981 N/A ILE 88.A N ILE 426.A O no hydrogen 2.950 N/A ALA 89.A N ARG 62.A O no hydrogen 2.561 N/A LEU 90.A N GLN 428.A O no hydrogen 2.614 N/A ARG 91.A N GLU 60.A O no hydrogen 3.138 N/A LEU 92.A N THR 430.A O no hydrogen 2.971 N/A ARG 93.A N SER 59.A OG no hydrogen 3.352 N/A ARG 93.A NH2 CYS 23.A O no hydrogen 3.210 N/A ASP 96.A N ARG 93.A O no hydrogen 3.252 N/A SER 97.A N ASP 96.A OD1 no hydrogen 3.057 N/A SER 97.A OG ALA 401.A O no hydrogen 2.932 N/A LYS 98.A N ALA 401.A O no hydrogen 3.285 N/A PHE 100.A N ILE 399.A O no hydrogen 2.811 N/A ILE 102.A N PHE 397.A O no hydrogen 2.819 N/A GLN 103.A N SER 84.A O no hydrogen 2.702 N/A VAL 104.A N VAL 395.A O no hydrogen 2.857 N/A ARG 105.A N GLN 82.A O no hydrogen 2.858 N/A GLN 106.A N ASP 393.A O no hydrogen 3.381 N/A GLN 106.A NE2 ARG 352.A O no hydrogen 2.779 N/A ASP 113.A N SER 243.A O no hydrogen 2.854 N/A ILE 114.A N ARG 150.A O no hydrogen 2.895 N/A TYR 115.A N LEU 245.A O no hydrogen 2.968 N/A TYR 115.A OH TYR 190.A OH no hydrogen 2.555 N/A TYR 115.A OH HIS 192.A ND1 no hydrogen 2.475 N/A TYR 116.A N GLY 152.A O no hydrogen 2.840 N/A LEU 117.A N VAL 247.A O no hydrogen 2.778 N/A MET 118.A N GLY 154.A O no hydrogen 3.051 N/A ASP 119.A N THR 249.A O no hydrogen 3.113 N/A LEU 120.A N PHE 156.A O no hydrogen 3.154 N/A SER 121.A N ASP 119.A OD1 no hydrogen 2.861 N/A SER 121.A OG ASP 119.A OD1 no hydrogen 2.723 N/A SER 121.A OG SER 123.A OG no hydrogen 2.954 N/A SER 121.A OG GLU 220.A OE1 no hydrogen 2.601 N/A SER 123.A OG SER 121.A OG no hydrogen 2.954 N/A MET 124.A N SER 121.A O no hydrogen 2.996 N/A LYS 125.A N TYR 122.A O no hydrogen 2.961 N/A ASP 127.A N MET 124.A O no hydrogen 3.104 N/A SER 130.A N ASP 127.A O no hydrogen 3.468 N/A SER 130.A OG ASP 127.A O no hydrogen 3.122 N/A ILE 131.A N LEU 128.A O no hydrogen 3.272 N/A GLN 132.A N TRP 129.A O no hydrogen 3.378 N/A GLN 132.A NE2 LEU 128.A O no hydrogen 3.500 N/A LYS 137.A N ASN 133.A O no hydrogen 2.977 N/A LYS 137.A NZ SER 130.A O no hydrogen 3.359 N/A LEU 138.A N GLY 135.A O no hydrogen 3.121 N/A ALA 139.A N GLY 135.A O no hydrogen 2.876 N/A THR 140.A N THR 136.A O no hydrogen 3.378 N/A THR 140.A OG1 THR 136.A O no hydrogen 2.398 N/A GLN 141.A NE2 LEU 341.A O no hydrogen 2.513 N/A MET 142.A N LEU 138.A O no hydrogen 3.086 N/A ARG 143.A N ALA 139.A O no hydrogen 3.039 N/A LEU 145.A N MET 142.A O no hydrogen 2.776 N/A THR 146.A N MET 142.A O no hydrogen 2.806 N/A THR 146.A OG1 ASP 109.A OD1 no hydrogen 3.361 N/A THR 146.A OG1 TYR 110.A O no hydrogen 2.653 N/A THR 146.A OG1 SER 147.A O no hydrogen 2.372 N/A SER 147.A N ASP 109.A OD1 no hydrogen 3.206 N/A SER 147.A OG ASP 109.A OD1 no hydrogen 3.199 N/A SER 147.A OG ASP 109.A OD2 no hydrogen 3.053 N/A ARG 150.A N VAL 112.A O no hydrogen 3.144 N/A ARG 150.A NH1 ASP 198.A OD1 no hydrogen 3.163 N/A ILE 151.A N THR 197.A O no hydrogen 3.017 N/A GLY 152.A N ILE 114.A O no hydrogen 2.966 N/A PHE 153.A N LEU 194.A O no hydrogen 3.122 N/A GLY 154.A N TYR 116.A O no hydrogen 2.682 N/A ALA 155.A N LYS 191.A O no hydrogen 2.990 N/A PHE 156.A N MET 118.A O no hydrogen 3.231 N/A VAL 157.A N PHE 188.A O no hydrogen 3.115 N/A VAL 157.A N GLY 189.A O no hydrogen 3.352 N/A ASP 158.A N PHE 188.A O no hydrogen 3.367 N/A LYS 159.A N ASP 158.A OD1 no hydrogen 2.925 N/A LYS 159.A NZ ASP 224.A OD2 no hydrogen 2.953 N/A LYS 159.A NZ SER 284.A O no hydrogen 2.605 N/A LYS 159.A NZ MET 287.A O no hydrogen 2.514 N/A VAL 161.A N LYS 159.A O no hydrogen 2.740 N/A MET 165.A N VAL 161.A O no hydrogen 2.613 N/A ALA 172.A N PRO 169.A O no hydrogen 2.465 N/A LEU 173.A N PRO 170.A O no hydrogen 3.084 N/A ASN 175.A ND2 THR 182.A O no hydrogen 3.258 N/A CYS 177.A N ASN 175.A OD1 no hydrogen 3.158 N/A TYR 178.A N ASN 175.A O no hydrogen 2.895 N/A LYS 181.A N TYR 178.A O no hydrogen 2.820 N/A THR 182.A N CYS 177.A O no hydrogen 3.327 N/A THR 183.A N THR 182.A OG1 no hydrogen 2.558 N/A CYS 184.A N ASN 175.A OD1 no hydrogen 3.189 N/A TYR 190.A OH TYR 115.A OH no hydrogen 2.555 N/A LYS 191.A N ALA 155.A O no hydrogen 2.754 N/A HIS 192.A N ASN 279.A O no hydrogen 3.022 N/A HIS 192.A ND1 TYR 115.A OH no hydrogen 2.475 N/A HIS 192.A NE2 THR 195.A OG1 no hydrogen 3.258 N/A VAL 193.A N PHE 153.A O no hydrogen 3.311 N/A LEU 194.A N PHE 153.A O no hydrogen 3.113 N/A THR 195.A OG1 HIS 192.A NE2 no hydrogen 3.258 N/A LEU 196.A N ILE 236.A O no hydrogen 3.367 N/A THR 197.A N ILE 151.A O no hydrogen 2.904 N/A ASP 198.A N ASP 198.A OD1 no hydrogen 2.607 N/A GLN 199.A N THR 197.A OG1 no hydrogen 3.298 N/A PHE 203.A N GLN 199.A O no hydrogen 3.174 N/A ASN 204.A N VAL 200.A O no hydrogen 3.054 N/A ASN 204.A ND2 THR 136.A OG1 no hydrogen 3.208 N/A GLU 205.A N THR 201.A O no hydrogen 3.143 N/A GLU 206.A N ARG 202.A O no hydrogen 2.905 N/A VAL 207.A N PHE 203.A O no hydrogen 2.832 N/A LYS 208.A N ASN 204.A O no hydrogen 2.998 N/A GLN 210.A N VAL 207.A O no hydrogen 2.933 N/A GLN 210.A NE2 GLU 206.A O no hydrogen 3.198 N/A SER 213.A N LEU 120.A O no hydrogen 2.668 N/A SER 213.A OG LEU 185.A O no hydrogen 2.412 N/A ARG 214.A NH1 PRO 176.A O no hydrogen 3.188 N/A ASN 215.A ND2 GLU 220.A OE1 no hydrogen 3.243 N/A ASN 215.A ND2 GLU 220.A OE2 no hydrogen 3.323 N/A ARG 216.A N TYR 164.A O no hydrogen 3.013 N/A ILE 226.A N GLY 222.A O no hydrogen 2.793 N/A MET 227.A N PHE 223.A O no hydrogen 3.141 N/A GLN 228.A N ASP 224.A O no hydrogen 3.301 N/A GLN 228.A NE2 GLN 272.A O no hydrogen 3.066 N/A ALA 229.A N ALA 225.A O no hydrogen 2.792 N/A THR 230.A N ILE 226.A O no hydrogen 3.087 N/A THR 230.A N MET 227.A O no hydrogen 3.072 N/A THR 230.A OG1 ILE 226.A O no hydrogen 2.542 N/A VAL 231.A N MET 227.A O no hydrogen 3.014 N/A CYS 232.A N GLN 228.A O no hydrogen 2.998 N/A CYS 232.A SG GLN 228.A OE1 no hydrogen 3.405 N/A ILE 236.A N CYS 232.A O no hydrogen 3.039 N/A GLY 237.A N ASP 233.A O no hydrogen 3.038 N/A TRP 238.A N ASP 233.A O no hydrogen 3.391 N/A TRP 238.A NE1 ALA 229.A O no hydrogen 3.075 N/A ARG 239.A N ASP 113.A OD2 no hydrogen 3.180 N/A ARG 239.A NH1 ASN 148.A OD1 no hydrogen 2.626 N/A ARG 239.A NH2 ASP 113.A OD1 no hydrogen 2.684 N/A ARG 239.A NH2 ASN 148.A O no hydrogen 3.304 N/A SER 243.A N PRO 111.A O no hydrogen 2.828 N/A SER 243.A OG PRO 111.A O no hydrogen 3.402 N/A SER 243.A OG TYR 348.A OH no hydrogen 2.923 N/A HIS 244.A ND1 ASN 303.A O no hydrogen 2.803 N/A HIS 244.A NE2 ARG 239.A O no hydrogen 2.555 N/A LEU 245.A N ASP 113.A O no hydrogen 2.827 N/A LEU 246.A N ASN 305.A O no hydrogen 2.730 N/A VAL 247.A N TYR 115.A O no hydrogen 2.906 N/A PHE 248.A N ILE 307.A O no hydrogen 2.722 N/A THR 249.A N LEU 117.A O no hydrogen 2.973 N/A THR 249.A OG1 LEU 117.A O no hydrogen 2.837 N/A THR 250.A OG1 ASP 119.A OD2 no hydrogen 2.788 N/A THR 250.A OG1 ALA 252.A O no hydrogen 3.520 N/A THR 254.A OG1 HIS 255.A O no hydrogen 3.049 N/A HIS 255.A ND1 ASP 259.A OD2 no hydrogen 2.753 N/A HIS 255.A NE2 ASP 217.A OD2 no hydrogen 2.893 N/A ILE 256.A N ASP 259.A OD2 no hydrogen 3.072 N/A LEU 258.A N ASP 288.A OD2 no hydrogen 2.955 N/A ASP 259.A N ILE 256.A O no hydrogen 3.240 N/A GLY 260.A N ASP 288.A OD1 no hydrogen 3.259 N/A ALA 263.A N GLY 260.A O no hydrogen 2.982 N/A GLY 264.A N ARG 261.A O no hydrogen 3.050 N/A ILE 265.A N GLY 260.A O no hydrogen 2.859 N/A GLY 271.A N ASN 269.A OD1 no hydrogen 2.446 N/A GLN 272.A N ASP 270.A OD1 no hydrogen 3.273 N/A GLN 272.A NE2 ASP 270.A O no hydrogen 3.398 N/A CYS 273.A SG VAL 275.A O no hydrogen 3.737 N/A HIS 274.A N GLN 228.A OE1 no hydrogen 2.801 N/A HIS 274.A NE2 ASP 270.A OD1 no hydrogen 3.092 N/A HIS 274.A NE2 ASP 270.A OD2 no hydrogen 3.117 N/A ASP 278.A N ASP 278.A OD1 no hydrogen 2.420 N/A ASN 279.A N GLY 276.A O no hydrogen 3.161 N/A TYR 281.A N TYR 190.A O no hydrogen 3.120 N/A SER 282.A OG HIS 274.A O no hydrogen 3.475 N/A SER 284.A N TYR 281.A O no hydrogen 3.175 N/A THR 286.A N ALA 283.A O no hydrogen 3.069 N/A ASP 288.A N GLN 267.A O no hydrogen 2.916 N/A TYR 289.A N ASP 288.A OD1 no hydrogen 2.508 N/A TYR 289.A OH ASP 158.A OD1 no hydrogen 2.589 N/A MET 295.A N SER 291.A O no hydrogen 2.901 N/A THR 296.A N LEU 292.A O no hydrogen 2.891 N/A THR 296.A OG1 LEU 292.A O no hydrogen 2.630 N/A GLU 297.A N GLY 293.A O no hydrogen 3.020 N/A LYS 298.A N LEU 294.A O no hydrogen 2.930 N/A LEU 299.A N MET 295.A O no hydrogen 2.860 N/A SER 300.A N THR 296.A O no hydrogen 2.958 N/A SER 300.A OG THR 296.A O no hydrogen 3.182 N/A GLN 301.A N GLU 297.A O no hydrogen 2.876 N/A LYS 302.A N LYS 298.A O no hydrogen 3.232 N/A LYS 302.A NZ ASP 233.A OD2 no hydrogen 2.389 N/A ASN 303.A N SER 300.A O no hydrogen 3.405 N/A ILE 304.A N LEU 299.A O no hydrogen 3.042 N/A ASN 305.A N HIS 244.A O no hydrogen 2.745 N/A ILE 307.A N LEU 246.A O no hydrogen 2.706 N/A PHE 308.A N THR 329.A O no hydrogen 2.823 N/A ALA 309.A N PHE 248.A O no hydrogen 2.602 N/A VAL 310.A N GLY 331.A O no hydrogen 3.329 N/A THR 311.A OG1 ASP 251.A O no hydrogen 3.195 N/A THR 311.A OG1 ASN 313.A OD1 no hydrogen 2.288 N/A ASN 313.A ND2 ASP 251.A O no hydrogen 3.124 N/A VAL 314.A N THR 311.A O no hydrogen 3.094 N/A VAL 315.A N GLU 312.A O no hydrogen 3.069 N/A TYR 318.A N VAL 314.A O no hydrogen 3.256 N/A TYR 318.A OH ALA 252.A O no hydrogen 2.891 N/A GLN 319.A N VAL 315.A O no hydrogen 3.022 N/A ASN 320.A N ASN 316.A O no hydrogen 3.190 N/A TYR 321.A N LEU 317.A O no hydrogen 2.959 N/A SER 322.A N TYR 318.A O no hydrogen 2.800 N/A SER 322.A OG TYR 318.A O no hydrogen 3.012 N/A SER 322.A OG GLN 319.A O no hydrogen 2.495 N/A GLU 323.A N GLN 319.A O no hydrogen 3.319 N/A LEU 324.A N TYR 321.A O no hydrogen 2.873 N/A ILE 325.A N SER 322.A O no hydrogen 3.094 N/A THR 328.A OG1 SER 322.A O no hydrogen 3.310 N/A THR 328.A OG1 ILE 325.A O no hydrogen 2.784 N/A GLY 331.A N PHE 308.A O no hydrogen 2.881 N/A SER 334.A OG ASP 336.A OD1 no hydrogen 2.622 N/A ASP 336.A N SER 334.A O no hydrogen 2.591 N/A SER 337.A N SER 334.A O no hydrogen 3.213 N/A SER 338.A OG SER 337.A O no hydrogen 2.312 N/A ASN 339.A ND2 ASP 346.A OD2 no hydrogen 2.893 N/A GLN 342.A N ASN 339.A O no hydrogen 2.827 N/A LEU 343.A N ASN 339.A OD1 no hydrogen 3.430 N/A TYR 348.A N ILE 344.A O no hydrogen 2.440 N/A TYR 348.A OH SER 243.A OG no hydrogen 2.923 N/A GLY 349.A N VAL 345.A O no hydrogen 2.846 N/A LYS 350.A N ASP 346.A O no hydrogen 3.074 N/A ILE 351.A N ALA 347.A O no hydrogen 2.880 N/A ARG 352.A N TYR 348.A O no hydrogen 3.052 N/A SER 353.A N LYS 350.A O no hydrogen 2.734 N/A SER 353.A OG LYS 350.A O no hydrogen 2.350 N/A LYS 354.A NZ GLU 356.A OE1 no hydrogen 3.306 N/A VAL 355.A N CYS 386.A O no hydrogen 3.274 N/A LEU 357.A N LYS 384.A O no hydrogen 2.997 N/A GLU 358.A N LYS 417.A O no hydrogen 2.991 N/A ARG 360.A N THR 415.A O no hydrogen 3.016 N/A LEU 366.A N PRO 363.A O no hydrogen 3.090 N/A SER 367.A N LYS 402.A O no hydrogen 2.793 N/A SER 369.A N GLU 400.A O no hydrogen 2.877 N/A ASN 371.A N SER 398.A O no hydrogen 2.973 N/A ALA 372.A N ILE 380.A O no hydrogen 2.699 N/A THR 373.A N SER 396.A O no hydrogen 2.927 N/A CYS 374.A SG SER 385.A O no hydrogen 3.887 N/A GLU 378.A N LEU 375.A O no hydrogen 3.026 N/A ILE 380.A N ALA 372.A O no hydrogen 2.520 N/A GLY 382.A N PHE 370.A O no hydrogen 2.589 N/A SER 385.A OG VAL 355.A O no hydrogen 3.354 N/A CYS 386.A N VAL 355.A O no hydrogen 2.945 N/A LEU 389.A N SER 353.A O no hydrogen 2.890 N/A LYS 390.A N ASP 393.A OD2 no hydrogen 2.650 N/A ASP 393.A N LYS 390.A O no hydrogen 3.092 N/A VAL 395.A N VAL 104.A O no hydrogen 2.814 N/A SER 396.A N THR 373.A O no hydrogen 3.422 N/A PHE 397.A N ILE 102.A O no hydrogen 2.925 N/A ILE 399.A N PHE 100.A O no hydrogen 2.833 N/A GLU 400.A N SER 369.A O no hydrogen 3.444 N/A ALA 401.A N LYS 98.A O no hydrogen 3.484 N/A LYS 402.A N SER 367.A O no hydrogen 2.780 N/A ARG 404.A N GLU 365.A O no hydrogen 3.251 N/A ARG 404.A NE GLN 541.A OE1 no hydrogen 3.412 N/A GLY 405.A N ASP 95.A OD1 no hydrogen 2.403 N/A LYS 412.A N VAL 429.A O no hydrogen 2.941 N/A LYS 412.A NZ GLU 409.A OE1 no hydrogen 3.520 N/A SER 413.A OG GLU 411.A OE2 no hydrogen 2.860 N/A PHE 414.A N VAL 427.A O no hydrogen 3.072 N/A THR 415.A N ARG 360.A O no hydrogen 2.945 N/A ILE 416.A N LEU 425.A O no hydrogen 2.852 N/A LYS 417.A N GLU 358.A O no hydrogen 3.259 N/A LYS 417.A NZ ASN 303.A OD1 no hydrogen 3.478 N/A LYS 417.A NZ PRO 418.A O no hydrogen 2.581 N/A LYS 417.A NZ PHE 421.A O no hydrogen 2.298 N/A VAL 419.A N GLU 356.A O no hydrogen 2.961 N/A LEU 425.A N ILE 416.A O no hydrogen 2.698 N/A ILE 426.A N GLN 86.A O no hydrogen 3.124 N/A VAL 427.A N PHE 414.A O no hydrogen 2.887 N/A GLN 428.A N ILE 88.A O no hydrogen 2.880 N/A VAL 429.A N LYS 412.A O no hydrogen 2.670 N/A THR 430.A N LEU 90.A O no hydrogen 2.795 N/A ASP 432.A N LEU 92.A O no hydrogen 2.899 N/A ALA 436.A N GLU 55.A OE1 no hydrogen 3.330 N/A CYS 437.A SG SER 27.A OG no hydrogen 3.086 N/A CYS 437.A SG CYS 437.A O no hydrogen 2.967 N/A SER 445.A OG SER 445.A O no hydrogen 2.592 N/A CYS 448.A SG CYS 460.A O no hydrogen 3.245 N/A CYS 448.A SG GLY 468.A O no hydrogen 3.783 N/A CYS 448.A SG SER 469.A O no hydrogen 3.134 N/A THR 454.A N ARG 461.A O no hydrogen 2.521 N/A THR 454.A OG1 ARG 461.A O no hydrogen 2.793 N/A CYS 457.A N GLU 456.A OE1 no hydrogen 3.236 N/A CYS 457.A SG SER 27.A OG no hydrogen 3.499 N/A CYS 460.A SG ARG 447.A O no hydrogen 3.269 N/A ARG 461.A N THR 454.A O no hydrogen 2.828 N/A CYS 462.A SG GLY 468.A O no hydrogen 3.143 N/A CYS 471.A SG GLY 468.A O no hydrogen 3.606 N/A GLU 472.A N GLN 470.A O no hydrogen 2.634 N/A CYS 473.A SG CYS 503.A O no hydrogen 3.871 N/A SER 474.A OG GLU 476.A OE2 no hydrogen 2.902 N/A SER 481.A OG SER 481.A O no hydrogen 2.213 N/A GLN 482.A NE2 TYR 478.A O no hydrogen 2.538 N/A CYS 486.A SG GLN 483.A O no hydrogen 3.047 N/A SER 487.A OG GLU 485.A OE2 no hydrogen 2.663 N/A SER 496.A N TYR 520.A O no hydrogen 3.203 N/A CYS 501.A SG GLN 483.A O no hydrogen 3.957 N/A CYS 503.A SG CYS 473.A O no hydrogen 3.405 N/A GLN 505.A N LEU 502.A O no hydrogen 2.707 N/A SER 510.A OG ARG 498.A O no hydrogen 3.103 N/A SER 510.A OG CYS 508.A O no hydrogen 2.440 N/A SER 511.A N HIS 509.A O no hydrogen 3.163 N/A ASP 512.A N ASP 512.A OD1 no hydrogen 2.434 N/A PHE 513.A N ASP 512.A OD1 no hydrogen 2.928 N/A LYS 519.A N THR 7.A O no hydrogen 3.047 N/A CYS 521.A N GLY 518.A O no hydrogen 2.963 N/A CYS 521.A SG THR 517.A O no hydrogen 3.888 N/A CYS 521.A SG GLY 518.A O no hydrogen 3.933 N/A GLU 522.A N GLU 522.A OE2 no hydrogen 2.411 N/A SER 527.A N ASP 524.A OD1 no hydrogen 3.118 N/A CYS 536.A N VAL 529.A O no hydrogen 2.971 N/A CYS 536.A SG GLN 541.A O no hydrogen 3.837 N/A SER 537.A N GLU 534.A O no hydrogen 3.086 N/A SER 537.A OG TYR 557.A O no hydrogen 2.995 N/A SER 537.A OG CYS 558.A O no hydrogen 3.518 N/A GLY 538.A N MET 535.A O no hydrogen 3.059 N/A HIS 539.A N CYS 536.A O no hydrogen 3.095 N/A GLN 541.A N LEU 548.A O no hydrogen 3.116 N/A SER 543.A N ASP 546.A O no hydrogen 3.333 N/A ASP 546.A N SER 543.A O no hydrogen 3.168 N/A LEU 548.A N GLN 541.A O no hydrogen 2.701 N/A CYS 549.A SG GLY 555.A O no hydrogen 3.329 N/A ASP 550.A N HIS 539.A O no hydrogen 2.830 N/A SER 551.A OG LEU 366.A O no hydrogen 3.252 N/A TRP 553.A N ASP 550.A O no hydrogen 3.502 N/A THR 554.A N CYS 560.A O no hydrogen 2.679 N/A THR 554.A OG1 CYS 560.A O no hydrogen 2.910 N/A CYS 558.A N GLY 555.A O no hydrogen 3.108 N/A CYS 558.A SG GLY 555.A O no hydrogen 3.986 N/A CYS 560.A N THR 554.A O no hydrogen 2.967 N/A CYS 560.A SG THR 554.A OG1 no hydrogen 3.769 N/A CYS 560.A SG THR 561.A O no hydrogen 3.901 N/A THR 562.A N ASP 552.A O no hydrogen 3.179 N/A THR 562.A OG1 ASP 552.A O no hydrogen 3.361 N/A ARG 563.A N THR 561.A OG1 no hydrogen 3.090 N/A ARG 563.A NE ASP 565.A OD1 no hydrogen 2.943 N/A ARG 563.A NH2 ASP 565.A OD2 no hydrogen 3.123 N/A THR 566.A OG1 GLY 584.A O no hydrogen 2.820 N/A CYS 567.A N THR 564.A O no hydrogen 3.284 N/A MET 568.A N ASP 565.A O no hydrogen 2.923 N/A SER 569.A N LEU 573.A O no hydrogen 3.001 N/A SER 569.A OG SER 576.A OG no hydrogen 2.524 N/A SER 569.A OG THR 597.A OG1 no hydrogen 2.949 N/A GLY 572.A N SER 569.A O no hydrogen 3.361 N/A LEU 573.A N ASN 571.A OD1 no hydrogen 3.086 N/A CYS 575.A N CYS 567.A O no hydrogen 2.734 N/A SER 576.A OG SER 569.A OG no hydrogen 2.524 N/A SER 576.A OG THR 597.A O no hydrogen 2.825 N/A GLY 577.A N LEU 574.A O no hydrogen 3.097 N/A ARG 578.A N CYS 575.A O no hydrogen 3.021 N/A ARG 578.A NE CYS 598.A O no hydrogen 3.028 N/A ARG 578.A NH2 CYS 598.A O no hydrogen 3.230 N/A LYS 580.A N VAL 587.A O no hydrogen 3.041 N/A CYS 581.A SG ARG 563.A O no hydrogen 3.838 N/A GLU 582.A N SER 585.A O no hydrogen 3.310 N/A SER 585.A N GLU 582.A O no hydrogen 3.371 N/A CYS 586.A SG CYS 567.A O no hydrogen 3.525 N/A VAL 587.A N LYS 580.A O no hydrogen 2.658 N/A CYS 588.A SG GLY 595.A O no hydrogen 4.036 N/A ILE 589.A N ARG 578.A O no hydrogen 3.412 N/A GLN 590.A N ARG 578.A O no hydrogen 3.208 N/A SER 593.A N GLN 590.A O no hydrogen 3.318 N/A SER 593.A OG GLN 590.A O no hydrogen 2.301 N/A TYR 594.A N LYS 600.A O no hydrogen 2.909 N/A THR 597.A N GLU 599.A OE2 no hydrogen 2.763 N/A THR 597.A OG1 SER 569.A OG no hydrogen 2.949 N/A THR 597.A OG1 GLU 599.A OE2 no hydrogen 2.814 N/A CYS 598.A N GLY 595.A O no hydrogen 3.340 N/A GLU 599.A N GLU 599.A OE2 no hydrogen 2.512 N/A LYS 600.A N TYR 594.A O no hydrogen 3.129 N/A CYS 601.A SG PRO 591.A O no hydrogen 3.909 N/A CYS 608.A SG ASN 654.A O no hydrogen 3.759 N/A THR 609.A N ASP 606.A O no hydrogen 2.983 N/A PHE 610.A N ALA 607.A O no hydrogen 3.046 N/A LYS 611.A N ALA 607.A O no hydrogen 3.089 N/A LYS 611.A NZ SER 677.A OG no hydrogen 3.022 N/A LYS 612.A N CYS 608.A O no hydrogen 3.273 N/A CYS 614.A N LYS 611.A O no hydrogen 2.952 N/A VAL 615.A N LYS 611.A O no hydrogen 3.191 N/A GLU 616.A N LYS 612.A O no hydrogen 3.129 N/A CYS 617.A N GLU 613.A O no hydrogen 3.408 N/A CYS 617.A SG GLU 613.A O no hydrogen 3.335 N/A CYS 617.A SG CYS 614.A O no hydrogen 3.366 N/A LYS 618.A N CYS 614.A O no hydrogen 2.899 N/A LYS 619.A N VAL 615.A O no hydrogen 3.058 N/A PHE 620.A N GLU 616.A O no hydrogen 3.169 N/A ARG 622.A N GLU 616.A O no hydrogen 2.751 N/A ARG 622.A NH1 GLU 660.A OE2 no hydrogen 3.544 N/A ARG 622.A NH1 ASP 661.A OD1 no hydrogen 3.137 N/A ARG 622.A NH1 ASP 661.A OD2 no hydrogen 3.068 N/A ARG 622.A NH2 ASP 661.A OD2 no hydrogen 3.092 N/A ASP 627.A N GLY 623.A O no hydrogen 3.401 N/A GLU 628.A N ALA 624.A O no hydrogen 3.173 N/A ASN 629.A N HIS 626.A O no hydrogen 3.297 N/A THR 630.A N LEU 625.A O no hydrogen 2.895 N/A ARG 633.A NH1 CYS 374.A O no hydrogen 2.974 N/A ARG 633.A NH2 CYS 374.A O no hydrogen 3.192 N/A TYR 634.A N THR 630.A O no hydrogen 2.928 N/A CYS 635.A N CYS 631.A O no hydrogen 2.926 N/A GLU 640.A N LEU 679.A O no hydrogen 3.399 N/A VAL 642.A N VAL 681.A O no hydrogen 2.529 N/A THR 648.A OG1 TYR 670.A OH no hydrogen 2.798 N/A CYS 655.A N PHE 667.A O no hydrogen 2.642 N/A THR 656.A OG1 CYS 655.A O no hydrogen 2.670 N/A TYR 657.A N VAL 665.A O no hydrogen 2.920 N/A TYR 657.A OH GLU 616.A OE2 no hydrogen 2.691 N/A ASN 659.A N CYS 663.A O no hydrogen 3.128 N/A ASP 662.A N ASN 659.A O no hydrogen 3.142 N/A CYS 663.A N ASN 659.A OD1 no hydrogen 2.742 N/A CYS 663.A SG ASP 661.A O no hydrogen 3.542 N/A VAL 664.A N GLU 686.A O no hydrogen 2.849 N/A ARG 666.A NH1 GLU 686.A OE1 no hydrogen 3.070 N/A PHE 667.A N CYS 655.A O no hydrogen 3.097 N/A GLN 668.A N TYR 680.A O no hydrogen 2.974 N/A TYR 669.A N VAL 653.A O no hydrogen 3.039 N/A TYR 670.A OH THR 648.A OG1 no hydrogen 2.798 N/A SER 673.A N GLU 671.A O no hydrogen 2.465 N/A LEU 679.A N GLU 638.A O no hydrogen 3.293 N/A TYR 680.A N GLN 668.A O no hydrogen 2.766 N/A VAL 681.A N GLU 640.A O no hydrogen 3.077 N/A VAL 682.A N ARG 666.A O no hydrogen 3.232 N/A GLU 686.A N VAL 664.A O no hydrogen 3.159 N/A CYS 687.A SG PRO 685.A O no hydrogen 4.044 N/A