Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 5es4_B.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LYS 5.A NZ CYS 40.A O no hydrogen 3.148 N/A PHE 6.A N SER 17.A OG no hydrogen 3.026 N/A LYS 7.A NZ GLU 13.A OE1 no hydrogen 3.052 N/A LYS 7.A NZ GLU 13.A OE2 no hydrogen 2.890 N/A SER 9.A N GLU 13.A OE1 no hydrogen 2.868 N/A SER 9.A OG GLU 13.A OE1 no hydrogen 2.724 N/A ARG 12.A NE GLU 16.A OE2 no hydrogen 2.647 N/A ARG 12.A NH1 GLU 424.A OE2 no hydrogen 3.286 N/A ARG 12.A NH2 GLU 16.A OE2 no hydrogen 3.031 N/A GLU 13.A N SER 10.A OG no hydrogen 3.407 N/A CYS 14.A N SER 10.A O no hydrogen 3.124 N/A CYS 14.A SG THR 22.A O no hydrogen 3.215 N/A ILE 15.A N CYS 11.A O no hydrogen 2.933 N/A GLU 16.A N ARG 12.A O no hydrogen 2.835 N/A SER 17.A N CYS 14.A O no hydrogen 3.089 N/A SER 17.A OG GLU 13.A O no hydrogen 3.045 N/A GLY 18.A N ILE 15.A O no hydrogen 3.095 N/A CYS 21.A N GLY 18.A O no hydrogen 3.267 N/A CYS 21.A SG THR 4.A O no hydrogen 3.869 N/A THR 22.A N ASP 41.A O no hydrogen 2.722 N/A THR 22.A OG1 ASP 41.A O no hydrogen 2.675 N/A TRP 23.A N MET 57.A O no hydrogen 3.385 N/A TRP 23.A NE1 CYS 445.A O no hydrogen 2.981 N/A CYS 24.A N ARG 39.A O no hydrogen 3.028 N/A GLN 25.A N ASP 55.A O no hydrogen 2.845 N/A GLN 25.A NE2 ASP 55.A OD1 no hydrogen 2.867 N/A PHE 29.A N LYS 26.A O no hydrogen 3.240 N/A ASP 34.A N GLY 31.A O no hydrogen 2.771 N/A SER 37.A OG GLN 510.A OE1 no hydrogen 2.555 N/A ILE 38.A N PRO 35.A O no hydrogen 3.092 N/A ARG 39.A N ASP 36.A O no hydrogen 3.036 N/A ARG 39.A NE THR 30.A OG1 no hydrogen 2.764 N/A ARG 39.A NH1 CYS 24.A O no hydrogen 3.056 N/A ARG 39.A NH1 LYS 26.A O no hydrogen 2.667 N/A ARG 39.A NH2 LYS 26.A O no hydrogen 2.977 N/A ARG 39.A NH2 THR 30.A OG1 no hydrogen 3.010 N/A CYS 40.A N SER 37.A O no hydrogen 3.048 N/A CYS 40.A SG THR 22.A O no hydrogen 3.976 N/A ASP 41.A N THR 22.A O no hydrogen 3.081 N/A THR 42.A N ASP 41.A OD1 no hydrogen 2.814 N/A GLN 45.A N THR 42.A OG1 no hydrogen 3.086 N/A LEU 46.A N THR 42.A O no hydrogen 3.066 N/A LEU 47.A N ARG 43.A O no hydrogen 3.047 N/A MET 48.A N PRO 44.A O no hydrogen 2.946 N/A ARG 49.A N GLN 45.A O no hydrogen 2.913 N/A ARG 49.A NH1 ASP 41.A OD2 no hydrogen 3.078 N/A ARG 49.A NH2 ASP 41.A OD2 no hydrogen 2.645 N/A GLY 50.A N LEU 47.A O no hydrogen 2.994 N/A CYS 51.A N LEU 46.A O no hydrogen 2.818 N/A CYS 51.A SG ALA 52.A O no hydrogen 3.419 N/A ASP 55.A N ALA 52.A O no hydrogen 2.916 N/A ILE 56.A N ALA 53.A O no hydrogen 3.171 N/A MET 57.A N TRP 23.A O no hydrogen 2.811 N/A SER 61.A OG GLN 89.A O no hydrogen 2.986 N/A LEU 62.A N TYR 84.A O no hydrogen 3.161 N/A GLU 64.A N THR 82.A O no hydrogen 2.863 N/A GLN 66.A N LYS 80.A O no hydrogen 2.857 N/A GLN 66.A NE2 GLU 64.A OE2 no hydrogen 2.802 N/A ASP 68.A N GLN 79.A OE1 no hydrogen 2.817 N/A GLN 75.A N GLN 73.A OE1 no hydrogen 2.605 N/A SER 77.A N THR 96.A O no hydrogen 2.977 N/A GLN 79.A NE2 LEU 76.A O no hydrogen 2.782 N/A VAL 81.A N THR 416.A O no hydrogen 3.148 N/A THR 82.A N GLU 64.A O no hydrogen 2.971 N/A THR 82.A OG1 GLN 418.A OE1 no hydrogen 3.277 N/A LEU 83.A N GLN 418.A O no hydrogen 2.593 N/A TYR 84.A N LEU 62.A O no hydrogen 3.017 N/A TYR 84.A OH GLU 64.A OE1 no hydrogen 2.608 N/A LEU 85.A N LEU 420.A O no hydrogen 2.803 N/A ARG 86.A N SER 61.A OG no hydrogen 2.870 N/A ARG 86.A NH1 PRO 59.A O no hydrogen 3.038 N/A ARG 86.A NH2 GLY 18.A O no hydrogen 2.544 N/A ARG 86.A NH2 CYS 21.A O no hydrogen 2.765 N/A GLY 88.A N ALA 395.A O no hydrogen 3.160 N/A GLN 89.A N ARG 86.A O no hydrogen 2.881 N/A ALA 91.A N VAL 393.A O no hydrogen 2.721 N/A PHE 93.A N VAL 391.A O no hydrogen 2.961 N/A VAL 95.A N PHE 389.A O no hydrogen 3.026 N/A THR 96.A N SER 77.A O no hydrogen 2.640 N/A PHE 97.A N ILE 387.A O no hydrogen 3.349 N/A ARG 98.A N GLN 75.A O no hydrogen 2.690 N/A ARG 98.A NH1 ASN 384.A OD1 no hydrogen 2.707 N/A ARG 99.A NE LYS 101.A O no hydrogen 3.389 N/A ARG 99.A NH1 TYR 338.A OH no hydrogen 3.281 N/A ARG 99.A NH2 TYR 338.A OH no hydrogen 2.977 N/A TYR 103.A OH GLN 75.A OE1 no hydrogen 2.818 N/A ASP 106.A N THR 234.A O no hydrogen 2.682 N/A LEU 107.A N ARG 143.A O no hydrogen 2.968 N/A TYR 108.A N LEU 236.A O no hydrogen 3.154 N/A TYR 109.A N GLY 145.A O no hydrogen 3.123 N/A LEU 110.A N VAL 238.A O no hydrogen 2.784 N/A MET 111.A N GLY 147.A O no hydrogen 3.056 N/A ASP 112.A N ALA 240.A O no hydrogen 3.237 N/A LEU 113.A N PHE 149.A O no hydrogen 3.091 N/A SER 114.A N ASP 112.A OD1 no hydrogen 3.103 N/A SER 116.A N SER 114.A OG no hydrogen 3.173 N/A SER 116.A OG SER 114.A OG no hydrogen 2.837 N/A MET 117.A N SER 114.A O no hydrogen 2.978 N/A ASP 120.A N MET 117.A O no hydrogen 2.988 N/A LEU 121.A N MET 117.A O no hydrogen 2.771 N/A ARG 122.A N LEU 118.A O no hydrogen 3.142 N/A ARG 122.A NH2 ASP 119.A OD1 no hydrogen 3.217 N/A ASN 123.A ND2 ASP 326.A O no hydrogen 2.822 N/A VAL 124.A N ASP 120.A O no hydrogen 3.096 N/A LYS 125.A N LEU 121.A O no hydrogen 3.104 N/A LYS 125.A NZ GLY 200.A O no hydrogen 3.018 N/A LYS 126.A N ASN 123.A O no hydrogen 3.206 N/A LEU 127.A N VAL 124.A O no hydrogen 3.413 N/A LEU 131.A N LEU 127.A O no hydrogen 3.195 N/A LEU 132.A N GLY 128.A O no hydrogen 3.412 N/A ARG 133.A N GLY 129.A O no hydrogen 2.977 N/A ARG 133.A NH1 ASP 130.A OD1 no hydrogen 2.877 N/A ALA 134.A N ASP 130.A O no hydrogen 2.974 N/A LEU 135.A N LEU 131.A O no hydrogen 3.111 N/A ASN 136.A N LEU 132.A O no hydrogen 3.179 N/A GLU 137.A N ALA 134.A O no hydrogen 3.213 N/A ILE 138.A N LEU 135.A O no hydrogen 3.346 N/A THR 139.A N LEU 135.A O no hydrogen 3.198 N/A THR 139.A OG1 LEU 135.A O no hydrogen 3.101 N/A GLY 142.A N ASN 136.A OD1 no hydrogen 2.650 N/A ARG 143.A N ILE 105.A O no hydrogen 3.217 N/A ILE 144.A N THR 189.A O no hydrogen 3.362 N/A GLY 145.A N LEU 107.A O no hydrogen 2.873 N/A GLY 147.A N TYR 109.A O no hydrogen 2.920 N/A SER 148.A N ARG 183.A O no hydrogen 3.091 N/A PHE 149.A N MET 111.A O no hydrogen 2.851 N/A VAL 150.A N ALA 181.A O no hydrogen 3.163 N/A ASP 151.A N PHE 180.A O no hydrogen 3.268 N/A LYS 152.A N ASP 151.A OD1 no hydrogen 2.829 N/A LYS 152.A NZ ASP 216.A OD1 no hydrogen 3.552 N/A LYS 152.A NZ ASP 216.A OD2 no hydrogen 2.649 N/A LYS 152.A NZ SER 274.A O no hydrogen 2.686 N/A LYS 152.A NZ PHE 277.A O no hydrogen 2.583 N/A THR 153.A N ASN 275.A OD1 no hydrogen 3.028 N/A PHE 157.A N VAL 154.A O no hydrogen 2.959 N/A HIS 161.A N ASN 159.A OD1 no hydrogen 2.839 N/A ASP 163.A N HIS 161.A ND1 no hydrogen 3.431 N/A LYS 164.A NZ ASN 167.A O no hydrogen 2.730 N/A LYS 164.A NZ PRO 168.A O no hydrogen 2.707 N/A LEU 165.A N HIS 161.A O no hydrogen 2.769 N/A ARG 166.A N PRO 162.A O no hydrogen 2.919 N/A ARG 166.A NH1 ASP 163.A OD1 no hydrogen 2.954 N/A ARG 166.A NH2 ASP 163.A OD1 no hydrogen 3.272 N/A ASN 167.A N ASP 163.A O no hydrogen 3.174 N/A CYS 169.A SG ILE 204.A O no hydrogen 4.041 N/A CYS 169.A SG SER 205.A O no hydrogen 3.330 N/A GLU 173.A N PRO 170.A O no hydrogen 3.040 N/A CYS 176.A SG GLU 175.A O no hydrogen 3.368 N/A CYS 176.A SG ILE 204.A O no hydrogen 3.548 N/A GLN 177.A N ILE 204.A O no hydrogen 2.995 N/A GLN 177.A NE2 LEU 203.A O no hydrogen 2.619 N/A ARG 183.A N SER 148.A O no hydrogen 3.077 N/A HIS 184.A N ASN 269.A O no hydrogen 2.777 N/A VAL 185.A N PHE 146.A O no hydrogen 2.975 N/A THR 189.A N ILE 144.A O no hydrogen 3.051 N/A ASN 190.A N THR 189.A OG1 no hydrogen 2.501 N/A PHE 195.A N ASN 191.A O no hydrogen 3.192 N/A GLN 196.A N SER 192.A O no hydrogen 3.037 N/A GLN 196.A NE2 LYS 125.A O no hydrogen 2.558 N/A THR 197.A N ASN 193.A O no hydrogen 2.801 N/A THR 197.A OG1 ASN 193.A O no hydrogen 2.764 N/A GLU 198.A N GLN 194.A O no hydrogen 3.337 N/A VAL 199.A N PHE 195.A O no hydrogen 2.808 N/A GLY 200.A N GLN 196.A O no hydrogen 3.256 N/A SER 205.A N LEU 113.A O no hydrogen 2.828 N/A SER 205.A OG GLN 177.A O no hydrogen 2.708 N/A ASN 207.A ND2 ASP 209.A O no hydrogen 3.279 N/A LEU 208.A N PHE 157.A O no hydrogen 2.897 N/A ASP 209.A N PHE 157.A O no hydrogen 2.640 N/A GLU 212.A N GLY 244.A O no hydrogen 2.910 N/A GLY 213.A N VAL 150.A O no hydrogen 3.073 N/A ASP 216.A N GLY 213.A O no hydrogen 3.240 N/A MET 218.A N GLY 214.A O no hydrogen 3.289 N/A MET 219.A N LEU 215.A O no hydrogen 3.153 N/A GLN 220.A N ASP 216.A O no hydrogen 3.021 N/A GLN 220.A NE2 ARG 263.A O no hydrogen 3.311 N/A VAL 221.A N ALA 217.A O no hydrogen 2.637 N/A ALA 222.A N MET 218.A O no hydrogen 3.033 N/A ALA 223.A N GLN 220.A O no hydrogen 3.104 N/A CYS 224.A N VAL 221.A O no hydrogen 3.351 N/A CYS 224.A SG GLN 220.A O no hydrogen 2.996 N/A CYS 224.A SG GLN 220.A OE1 no hydrogen 3.240 N/A ILE 228.A N CYS 224.A O no hydrogen 2.847 N/A ARG 231.A N ASP 106.A OD2 no hydrogen 2.728 N/A ARG 231.A NE ASP 106.A OD1 no hydrogen 2.774 N/A ARG 231.A NH2 ILE 105.A O no hydrogen 3.209 N/A ARG 231.A NH2 ASP 106.A OD1 no hydrogen 2.751 N/A THR 234.A N PRO 104.A O no hydrogen 3.111 N/A THR 234.A OG1 PRO 104.A O no hydrogen 3.510 N/A ARG 235.A NE ARG 231.A O no hydrogen 3.415 N/A ARG 235.A NH1 ASN 292.A O no hydrogen 3.226 N/A LEU 236.A N ASP 106.A O no hydrogen 2.954 N/A LEU 237.A N GLN 295.A O no hydrogen 3.294 N/A VAL 238.A N TYR 108.A O no hydrogen 3.170 N/A PHE 239.A N ILE 297.A O no hydrogen 2.786 N/A ALA 240.A N LEU 110.A O no hydrogen 3.243 N/A THR 241.A N ALA 299.A O no hydrogen 3.124 N/A THR 241.A OG1 ASP 112.A OD2 no hydrogen 2.564 N/A THR 241.A OG1 GLU 212.A OE1 no hydrogen 2.760 N/A ASP 243.A N THR 241.A OG1 no hydrogen 2.742 N/A HIS 246.A N GLU 212.A O no hydrogen 2.851 N/A HIS 246.A NE2 ASP 151.A OD2 no hydrogen 2.980 N/A PHE 247.A N ASP 250.A OD2 no hydrogen 3.076 N/A GLY 249.A N ASP 278.A OD2 no hydrogen 2.812 N/A ASP 250.A N PHE 247.A O no hydrogen 3.241 N/A GLY 251.A N ASP 278.A OD1 no hydrogen 3.026 N/A LEU 253.A N ASP 250.A O no hydrogen 2.947 N/A GLY 254.A N GLY 251.A O no hydrogen 3.029 N/A ALA 255.A N LYS 252.A O no hydrogen 3.016 N/A ILE 256.A N GLY 251.A O no hydrogen 3.229 N/A CYS 264.A SG GLN 220.A OE1 no hydrogen 3.682 N/A CYS 264.A SG GLU 227.A OE1 no hydrogen 3.536 N/A HIS 265.A NE2 ASP 261.A OD2 no hydrogen 2.898 N/A TYR 271.A N PHE 182.A O no hydrogen 3.015 N/A LYS 272.A NZ GLU 267.A OE1 no hydrogen 2.852 N/A LYS 272.A NZ ASP 268.A OD2 no hydrogen 3.455 N/A ARG 273.A NH1 GLU 276.A OE1 no hydrogen 3.218 N/A SER 274.A OG TYR 271.A O no hydrogen 3.476 N/A SER 274.A OG ASN 275.A OD1 no hydrogen 3.451 N/A ASN 275.A ND2 THR 153.A OG1 no hydrogen 2.435 N/A GLU 276.A N ARG 273.A O no hydrogen 2.860 N/A ASP 278.A N THR 258.A O no hydrogen 2.744 N/A TYR 279.A N ASP 278.A OD1 no hydrogen 2.473 N/A TYR 279.A OH ASP 151.A OD1 no hydrogen 3.035 N/A SER 281.A N GLN 284.A OE1 no hydrogen 2.933 N/A GLN 284.A N SER 281.A OG no hydrogen 2.936 N/A GLN 284.A NE2 ASN 260.A O no hydrogen 3.576 N/A LEU 285.A N VAL 282.A O no hydrogen 3.345 N/A ALA 286.A N VAL 282.A O no hydrogen 3.276 N/A HIS 287.A N GLY 283.A O no hydrogen 3.000 N/A LYS 288.A N GLN 284.A O no hydrogen 3.173 N/A LEU 289.A N LEU 285.A O no hydrogen 2.740 N/A ALA 290.A N ALA 286.A O no hydrogen 3.294 N/A GLU 291.A N HIS 287.A O no hydrogen 2.812 N/A ASN 292.A N LYS 288.A O no hydrogen 3.295 N/A ASN 292.A ND2 LYS 288.A O no hydrogen 3.242 N/A ASN 293.A N ALA 290.A O no hydrogen 3.164 N/A ASN 293.A ND2 GLY 410.A O no hydrogen 3.182 N/A ILE 294.A N LEU 289.A O no hydrogen 2.729 N/A GLN 295.A N ARG 235.A O no hydrogen 3.036 N/A GLN 295.A NE2 GLY 410.A O no hydrogen 3.392 N/A ILE 297.A N LEU 237.A O no hydrogen 2.558 N/A PHE 298.A N ALA 319.A O no hydrogen 2.806 N/A ALA 299.A N PHE 239.A O no hydrogen 2.701 N/A THR 301.A N THR 241.A O no hydrogen 3.114 N/A THR 301.A OG1 THR 241.A O no hydrogen 3.498 N/A MET 304.A N THR 301.A O no hydrogen 2.962 N/A LYS 306.A NZ GLU 309.A OE1 no hydrogen 2.972 N/A THR 307.A OG1 MET 304.A O no hydrogen 2.652 N/A TYR 308.A N MET 304.A O no hydrogen 2.949 N/A GLU 309.A N VAL 305.A O no hydrogen 2.513 N/A LEU 311.A N TYR 308.A O no hydrogen 2.986 N/A THR 312.A N GLU 309.A O no hydrogen 3.303 N/A THR 312.A OG1 GLU 309.A O no hydrogen 2.800 N/A ILE 315.A N LEU 311.A O no hydrogen 3.375 N/A LYS 317.A NZ LEU 341.A O no hydrogen 3.335 N/A SER 318.A OG ILE 315.A O no hydrogen 2.780 N/A ALA 319.A N PRO 296.A O no hydrogen 3.063 N/A GLY 321.A N PHE 298.A O no hydrogen 3.313 N/A SER 324.A N ASN 329.A OD1 no hydrogen 3.483 N/A ASP 326.A N SER 324.A OG no hydrogen 2.831 N/A SER 327.A N SER 324.A O no hydrogen 3.113 N/A SER 327.A OG ASP 120.A OD1 no hydrogen 2.510 N/A LEU 333.A N ASN 329.A O no hydrogen 2.683 N/A ILE 334.A N VAL 330.A O no hydrogen 3.053 N/A LYS 335.A N VAL 331.A O no hydrogen 2.876 N/A ASN 336.A N GLN 332.A O no hydrogen 3.011 N/A ALA 337.A N LEU 333.A O no hydrogen 2.770 N/A TYR 338.A N ILE 334.A O no hydrogen 3.077 N/A ASN 339.A N LYS 335.A O no hydrogen 3.081 N/A LYS 340.A N ASN 336.A O no hydrogen 3.154 N/A LEU 341.A N ALA 337.A O no hydrogen 2.665 N/A SER 342.A N TYR 338.A O no hydrogen 2.937 N/A SER 342.A OG TYR 338.A O no hydrogen 3.193 N/A SER 343.A OG LYS 340.A O no hydrogen 2.732 N/A SER 343.A OG ASP 379.A OD1 no hydrogen 3.301 N/A ARG 344.A N LEU 341.A O no hydrogen 3.360 N/A ARG 344.A NH2 ASP 377.A OD1 no hydrogen 2.650 N/A VAL 345.A N CYS 378.A O no hydrogen 3.085 N/A LEU 347.A N GLY 376.A O no hydrogen 2.880 N/A ASP 348.A N ARG 407.A O no hydrogen 3.096 N/A HIS 349.A N ASP 348.A OD1 no hydrogen 2.523 N/A HIS 349.A ND1 ASN 350.A O no hydrogen 2.667 N/A ASN 350.A N VAL 405.A O no hydrogen 2.949 N/A ALA 351.A N ASN 350.A OD1 no hydrogen 2.309 N/A LEU 356.A N PRO 353.A O no hydrogen 3.003 N/A LYS 357.A N THR 394.A O no hydrogen 3.076 N/A LYS 357.A NZ ASP 354.A O no hydrogen 3.316 N/A THR 359.A N LYS 392.A O no hydrogen 2.986 N/A TYR 360.A N GLN 373.A O no hydrogen 3.255 N/A ASP 361.A N GLN 390.A O no hydrogen 3.059 N/A SER 362.A N HIS 370.A O no hydrogen 3.417 N/A SER 362.A OG ASP 377.A O no hydrogen 2.873 N/A PHE 363.A N THR 388.A O no hydrogen 3.141 N/A GLY 367.A N CYS 364.A O no hydrogen 2.937 N/A VAL 368.A N CYS 364.A O no hydrogen 3.351 N/A HIS 370.A NE2 GLN 373.A OE1 no hydrogen 2.703 N/A ASN 372.A N ASP 361.A OD1 no hydrogen 2.799 N/A GLN 373.A N TYR 360.A O no hydrogen 2.800 N/A ARG 375.A N GLN 373.A O no hydrogen 2.540 N/A GLY 376.A N LEU 347.A O no hydrogen 3.127 N/A ASP 377.A N SER 362.A OG no hydrogen 3.377 N/A CYS 378.A N VAL 345.A O no hydrogen 3.318 N/A CYS 378.A SG SER 362.A OG no hydrogen 2.854 N/A CYS 378.A SG ASP 377.A O no hydrogen 3.392 N/A VAL 381.A N SER 343.A O no hydrogen 3.373 N/A ASN 384.A N ARG 99.A O no hydrogen 2.900 N/A ILE 387.A N PHE 97.A O no hydrogen 2.981 N/A PHE 389.A N VAL 95.A O no hydrogen 3.149 N/A GLN 390.A NE2 ASN 94.A OD1 no hydrogen 3.128 N/A VAL 391.A N PHE 93.A O no hydrogen 2.706 N/A LYS 392.A N THR 359.A O no hydrogen 2.970 N/A LYS 392.A NZ ASN 372.A OD1 no hydrogen 3.492 N/A VAL 393.A N ALA 91.A O no hydrogen 2.905 N/A THR 394.A N LYS 357.A O no hydrogen 3.114 N/A THR 396.A N THR 355.A O no hydrogen 3.204 N/A THR 396.A OG1 THR 355.A O no hydrogen 3.231 N/A CYS 398.A SG GLU 16.A OE2 no hydrogen 3.666 N/A PHE 404.A N VAL 417.A O no hydrogen 3.120 N/A ILE 406.A N VAL 415.A O no hydrogen 3.083 N/A ARG 407.A N ASP 348.A O no hydrogen 2.971 N/A ARG 407.A NH2 PHE 411.A O no hydrogen 3.238 N/A LEU 409.A N PHE 346.A O no hydrogen 2.975 N/A PHE 411.A N ALA 408.A O no hydrogen 3.327 N/A VAL 415.A N ILE 406.A O no hydrogen 3.139 N/A THR 416.A N GLN 79.A O no hydrogen 3.378 N/A VAL 417.A N PHE 404.A O no hydrogen 2.988 N/A GLN 418.A N VAL 81.A O no hydrogen 3.005 N/A GLN 418.A NE2 GLU 401.A OE2 no hydrogen 2.706 N/A VAL 419.A N GLN 402.A O no hydrogen 2.913 N/A LEU 420.A N LEU 83.A O no hydrogen 2.841 N/A GLN 422.A N LEU 85.A O no hydrogen 2.882 N/A GLN 422.A NE2 THR 60.A O no hydrogen 2.782 N/A GLN 430.A N GLN 430.A OE1 no hydrogen 2.881 N/A SER 431.A N ASP 429.A OD1 no hydrogen 2.850 N/A SER 431.A OG ASP 429.A OD1 no hydrogen 2.535 N/A ARG 432.A N ASP 429.A O no hydrogen 3.105 N/A ARG 434.A NE GLN 430.A O no hydrogen 2.851 N/A SER 435.A N ASP 433.A OD1 no hydrogen 3.162 N/A SER 435.A OG ASP 433.A OD1 no hydrogen 2.536 N/A LEU 436.A N ASP 433.A OD1 no hydrogen 3.090 N/A CYS 437.A SG PHE 442.A O no hydrogen 2.926 N/A HIS 438.A N SER 435.A O no hydrogen 2.765 N/A LYS 440.A N CYS 437.A O no hydrogen 2.965 N/A PHE 442.A N ARG 449.A O no hydrogen 2.975 N/A GLU 444.A N ILE 447.A O no hydrogen 3.489 N/A CYS 445.A SG GLN 25.A OE1 no hydrogen 3.941 N/A CYS 445.A SG ARG 426.A O no hydrogen 3.494 N/A ARG 449.A N PHE 442.A O no hydrogen 2.768 N/A ARG 449.A NH1 GLU 444.A OE1 no hydrogen 2.791 N/A CYS 450.A SG GLY 456.A O no hydrogen 3.846 N/A ASP 451.A N LYS 440.A O no hydrogen 3.051 N/A TYR 454.A N ASP 451.A O no hydrogen 3.062 N/A ILE 455.A N CYS 461.A O no hydrogen 3.387 N/A ASN 458.A ND2 GLU 460.A OE1 no hydrogen 2.993 N/A CYS 459.A N GLY 456.A O no hydrogen 2.854 N/A GLU 460.A N ASN 458.A OD1 no hydrogen 3.204 N/A GLN 462.A NE2 GLN 464.A O no hydrogen 2.970 N/A THR 463.A N GLY 453.A O no hydrogen 2.981 N/A THR 463.A OG1 GLY 453.A O no hydrogen 3.388 N/A ARG 466.A NE SER 467.A O no hydrogen 2.767 N/A ARG 466.A NH2 SER 467.A O no hydrogen 3.224 N/A SER 467.A OG GLU 472.A OE2 no hydrogen 2.704 N/A GLU 472.A N SER 468.A O no hydrogen 2.759 N/A GLY 473.A N GLU 470.A O no hydrogen 3.143 N/A SER 474.A N LEU 471.A O no hydrogen 3.041 N/A SER 474.A OG LEU 471.A O no hydrogen 2.643 N/A CYS 475.A N LEU 471.A O no hydrogen 2.918 N/A CYS 475.A SG GLN 494.A O no hydrogen 3.129 N/A ASP 478.A N SER 481.A OG no hydrogen 3.045 N/A ASN 480.A N ASP 478.A OD1 no hydrogen 2.874 N/A SER 481.A N ASP 478.A O no hydrogen 3.341 N/A SER 481.A OG ASP 478.A O no hydrogen 3.008 N/A CYS 484.A N CYS 475.A O no hydrogen 3.289 N/A SER 485.A N ILE 482.A O no hydrogen 2.814 N/A SER 485.A OG TYR 511.A O no hydrogen 2.581 N/A GLY 486.A N ILE 483.A O no hydrogen 3.362 N/A CYS 490.A SG GLN 494.A O no hydrogen 3.408 N/A VAL 491.A N GLN 494.A O no hydrogen 3.040 N/A GLN 494.A N VAL 491.A O no hydrogen 3.053 N/A GLN 494.A NE2 ASP 36.A OD2 no hydrogen 3.154 N/A CYS 495.A SG CYS 475.A O no hydrogen 3.518 N/A CYS 497.A SG GLY 509.A O no hydrogen 3.954 N/A HIS 498.A N LEU 487.A O no hydrogen 2.607 N/A LYS 505.A N VAL 502.A O no hydrogen 3.401 N/A LEU 506.A N THR 516.A OG1 no hydrogen 2.996 N/A TYR 508.A N CYS 514.A O no hydrogen 3.135 N/A TYR 511.A N GLU 513.A OE1 no hydrogen 2.850 N/A CYS 512.A N GLY 509.A O no hydrogen 3.147 N/A CYS 512.A SG LEU 487.A O no hydrogen 3.744 N/A GLU 513.A N GLU 513.A OE1 no hydrogen 2.490 N/A CYS 514.A N TYR 508.A O no hydrogen 3.020 N/A THR 516.A N LEU 506.A O no hydrogen 3.208 N/A THR 516.A OG1 GLY 504.A O no hydrogen 2.538 N/A ILE 517.A N ASP 515.A OD1 no hydrogen 2.696 N/A ASN 518.A N ASP 515.A OD1 no hydrogen 2.509 N/A CYS 519.A N ILE 517.A O no hydrogen 2.637 N/A CYS 519.A SG LYS 539.A O no hydrogen 3.093 N/A ARG 521.A NH2 GLY 524.A O no hydrogen 3.028 N/A TYR 522.A N GLN 525.A O no hydrogen 3.095 N/A GLN 525.A N TYR 522.A O no hydrogen 2.851 N/A CYS 527.A N GLU 520.A O no hydrogen 3.041 N/A CYS 527.A SG LEU 534.A O no hydrogen 3.166 N/A GLY 528.A N GLN 525.A O no hydrogen 3.141 N/A GLY 529.A N VAL 526.A O no hydrogen 2.807 N/A ARG 532.A N GLY 529.A O no hydrogen 3.123 N/A ARG 532.A NE CYS 551.A O no hydrogen 2.987 N/A ARG 532.A NH2 CYS 551.A O no hydrogen 3.246 N/A GLY 533.A N GLY 529.A O no hydrogen 3.076 N/A LEU 534.A N ARG 541.A O no hydrogen 3.019 N/A PHE 536.A N LYS 539.A O no hydrogen 2.785 N/A CYS 537.A N ASP 515.A O no hydrogen 2.929 N/A LYS 539.A N PHE 536.A O no hydrogen 3.154 N/A CYS 540.A SG GLU 520.A O no hydrogen 3.606 N/A CYS 540.A SG SER 549.A O no hydrogen 3.371 N/A ARG 541.A N LEU 534.A O no hydrogen 2.773 N/A CYS 542.A SG GLY 548.A O no hydrogen 3.450 N/A HIS 543.A N ARG 532.A O no hydrogen 2.971 N/A HIS 543.A ND1 GLY 531.A O no hydrogen 2.870 N/A PHE 546.A N HIS 543.A O no hydrogen 3.052 N/A GLU 547.A N CYS 553.A O no hydrogen 3.111 N/A CYS 551.A N GLY 548.A O no hydrogen 3.078 N/A CYS 551.A SG CYS 527.A O no hydrogen 3.486 N/A CYS 551.A SG ARG 532.A O no hydrogen 3.413 N/A CYS 553.A N GLU 547.A O no hydrogen 3.023 N/A ARG 555.A N GLY 545.A O no hydrogen 3.033 N/A ARG 555.A NE PHE 546.A O no hydrogen 3.254 N/A CYS 560.A N THR 557.A O no hydrogen 2.720 N/A CYS 560.A SG VAL 578.A O no hydrogen 3.206 N/A ASN 562.A N VAL 566.A O no hydrogen 3.363 N/A ASN 562.A ND2 ASP 658.A OD2 no hydrogen 2.780 N/A ARG 564.A NH1 GLN 591.A OE1 no hydrogen 2.965 N/A ARG 564.A NH1 ASP 658.A OD2 no hydrogen 3.319 N/A ARG 564.A NH2 GLN 591.A OE1 no hydrogen 3.436 N/A ARG 565.A N ASN 562.A O no hydrogen 2.709 N/A VAL 566.A N ASN 562.A OD1 no hydrogen 2.863 N/A CYS 568.A N CYS 560.A O no hydrogen 2.692 N/A CYS 568.A SG CYS 560.A O no hydrogen 3.765 N/A SER 569.A OG CYS 568.A O no hydrogen 2.408 N/A SER 569.A OG CYS 590.A O no hydrogen 2.931 N/A ARG 571.A N CYS 568.A O no hydrogen 2.947 N/A ARG 571.A NE CYS 590.A O no hydrogen 3.437 N/A ARG 571.A NH1 GLN 657.A O no hydrogen 3.278 N/A ARG 571.A NH1 GLY 659.A O no hydrogen 2.389 N/A ARG 571.A NH2 CYS 590.A O no hydrogen 3.371 N/A ARG 571.A NH2 GLN 591.A O no hydrogen 2.620 N/A ARG 575.A N VAL 578.A O no hydrogen 2.775 N/A ARG 575.A NH1 CYS 574.A O no hydrogen 2.648 N/A CYS 579.A SG CYS 560.A O no hydrogen 3.513 N/A GLU 580.A N ARG 573.A O no hydrogen 3.056 N/A CYS 581.A SG GLN 586.A O no hydrogen 3.897 N/A CYS 581.A SG PRO 588.A O no hydrogen 3.821 N/A SER 583.A OG HIS 582.A ND1.A no hydrogen 3.044 N/A TYR 585.A N HIS 582.A O no hydrogen 3.204 N/A TYR 585.A OH GLN 656.A OE1 no hydrogen 2.913 N/A GLN 586.A N GLU 592.A O no hydrogen 2.777 N/A GLN 586.A NE2 GLY 584.A O no hydrogen 3.102 N/A CYS 590.A N GLN 586.A O no hydrogen 3.181 N/A CYS 590.A SG ARG 571.A O no hydrogen 3.241 N/A GLN 591.A NE2 GLN 656.A O no hydrogen 3.075 N/A CYS 596.A N CYS 593.A O no hydrogen 3.124 N/A CYS 600.A SG THR 639.A O no hydrogen 3.833 N/A TYR 603.A N CYS 600.A O no hydrogen 2.683 N/A CYS 606.A SG ALA 624.A O no hydrogen 3.429 N/A ALA 607.A N TYR 603.A O no hydrogen 3.018 N/A GLU 608.A N ILE 604.A O no hydrogen 3.243 N/A CYS 609.A N SER 605.A O no hydrogen 2.953 N/A CYS 609.A SG PHE 617.A O no hydrogen 3.255 N/A LEU 610.A N CYS 606.A O no hydrogen 3.261 N/A LEU 610.A N ALA 607.A O no hydrogen 3.173 N/A LYS 611.A N ALA 607.A O no hydrogen 3.293 N/A LYS 614.A N GLU 608.A O no hydrogen 3.041 N/A GLY 618.A N GLY 615.A O no hydrogen 3.321 N/A ASN 620.A N PHE 617.A O no hydrogen 3.046 N/A ALA 624.A N ASN 620.A O no hydrogen 3.049 N/A CYS 625.A N SER 622.A O no hydrogen 3.242 N/A CYS 625.A SG CYS 621.A O no hydrogen 3.927 N/A LEU 628.A N CYS 625.A O no hydrogen 3.290 N/A GLN 629.A N TYR 663.A O no hydrogen 3.050 N/A SER 631.A N ILE 665.A O no hydrogen 2.710 N/A SER 631.A OG ASN 633.A O no hydrogen 2.788 N/A ASN 633.A N SER 631.A OG no hydrogen 3.019 N/A LYS 636.A N GLU 655.A OE1 no hydrogen 3.152 N/A ARG 638.A N LEU 654.A O no hydrogen 2.619 N/A CYS 640.A N TYR 652.A O no hydrogen 2.855 N/A CYS 640.A SG ARG 638.A O no hydrogen 3.816 N/A GLU 642.A N VAL 650.A O no hydrogen 3.251 N/A ARG 643.A NH1 GLY 647.A O no hydrogen 2.920 N/A ASP 644.A N CYS 648.A O no hydrogen 3.378 N/A SER 645.A N GLU 608.A OE1 no hydrogen 2.979 N/A SER 645.A OG GLU 608.A OE1 no hydrogen 3.243 N/A SER 645.A OG GLU 608.A OE2 no hydrogen 2.849 N/A GLU 646.A N ASP 644.A OD1 no hydrogen 3.048 N/A GLY 647.A N ASP 644.A OD1 no hydrogen 2.795 N/A CYS 648.A N ASP 644.A OD1 no hydrogen 2.816 N/A TRP 649.A N GLU 672.A O no hydrogen 2.806 N/A VAL 650.A N GLU 642.A O no hydrogen 3.019 N/A TYR 652.A N CYS 640.A O no hydrogen 3.089 N/A TYR 652.A OH GLU 642.A OE2 no hydrogen 2.247 N/A THR 653.A N TYR 666.A O no hydrogen 2.909 N/A LEU 654.A N ARG 638.A O no hydrogen 2.934 N/A GLU 655.A N LEU 664.A O no hydrogen 2.907 N/A GLN 656.A NE2 TYR 585.A OH no hydrogen 3.170 N/A GLN 656.A NE2 GLY 659.A O no hydrogen 3.002 N/A GLN 657.A N ARG 662.A O no hydrogen 3.295 N/A TYR 663.A N GLY 627.A O no hydrogen 2.870 N/A LEU 664.A N GLU 655.A O no hydrogen 2.801 N/A ILE 665.A N GLN 629.A O no hydrogen 2.907 N/A TYR 666.A N THR 653.A O no hydrogen 3.040 N/A ASP 668.A N ALA 651.A O no hydrogen 3.103 N/A GLU 669.A N GLU 669.A OE1 no hydrogen 2.972 N/A SER 670.A N ASP 668.A OD1 no hydrogen 3.107 N/A SER 670.A OG ARG 671.A O no hydrogen 2.660 N/A ARG 671.A NH1 GLU 646.A OE1 no hydrogen 3.029 N/A ARG 671.A NH2 ASP 644.A OD1 no hydrogen 3.535 N/A ARG 671.A NH2 ASP 644.A OD2 no hydrogen 2.662 N/A ARG 671.A NH2 GLU 646.A OE1 no hydrogen 2.747 N/A