Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 2hko_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLY 4.A N GLY 1.A O no hydrogen 2.632 N/A ALA 5.A N VAL 2.A O no hydrogen 3.073 N/A GLN 8.A N GLY 4.A O no hydrogen 2.957 N/A GLN 8.A NE2 LEU 165.A O no hydrogen 2.347 N/A SER 9.A N ALA 6.A O no hydrogen 3.200 N/A SER 9.A OG ALA 5.A O no hydrogen 2.925 N/A ARG 10.A N PHE 7.A O no hydrogen 2.807 N/A ARG 10.A NE GLY 167.A O no hydrogen 2.840 N/A LEU 11.A N ALA 6.A O no hydrogen 2.732 N/A ALA 21.A N THR 17.A O no hydrogen 2.986 N/A ALA 21.A N SER 18.A O no hydrogen 3.216 N/A ALA 22.A N SER 18.A O no hydrogen 3.152 N/A ALA 22.A N GLN 19.A O no hydrogen 2.534 N/A CYS 23.A N GLN 19.A O no hydrogen 3.137 N/A CYS 23.A SG GLN 19.A O no hydrogen 3.946 N/A PHE 24.A N GLU 20.A O no hydrogen 3.072 N/A ILE 28.A N PHE 24.A O no hydrogen 3.194 N/A SER 29.A N PRO 25.A O no hydrogen 3.387 N/A SER 29.A OG PRO 25.A O no hydrogen 3.007 N/A SER 29.A OG ASP 26.A O no hydrogen 2.973 N/A GLY 30.A N ASP 26.A O no hydrogen 2.569 N/A GLN 35.A NE2 ILE 27.A O no hydrogen 3.318 N/A GLN 35.A NE2 GLY 30.A O no hydrogen 3.525 N/A GLN 35.A NE2 PRO 31.A O no hydrogen 3.118 N/A LYS 36.A N GLN 32.A O no hydrogen 2.867 N/A VAL 37.A N GLN 33.A O no hydrogen 2.838 N/A PHE 38.A N THR 34.A O no hydrogen 2.875 N/A LEU 39.A N GLN 35.A O no hydrogen 2.783 N/A PHE 40.A N LYS 36.A O no hydrogen 3.115 N/A ILE 41.A N VAL 37.A O no hydrogen 2.944 N/A ARG 42.A N PHE 38.A O no hydrogen 2.783 N/A ARG 42.A NH1 PRO 12.A O no hydrogen 3.349 N/A ARG 42.A NH2 PRO 12.A O no hydrogen 2.803 N/A ASN 43.A N LEU 39.A O no hydrogen 2.822 N/A ARG 44.A N PHE 40.A O no hydrogen 2.646 N/A ARG 44.A NE GLN 47.A OE1 no hydrogen 3.352 N/A THR 45.A N ILE 41.A O no hydrogen 2.826 N/A THR 45.A OG1 ILE 41.A O no hydrogen 2.443 N/A LEU 46.A N ARG 42.A O no hydrogen 3.183 N/A GLN 47.A N ASN 43.A O no hydrogen 2.992 N/A LEU 48.A N ARG 44.A O no hydrogen 2.942 N/A TRP 49.A N THR 45.A O no hydrogen 3.112 N/A LEU 50.A N LEU 46.A O no hydrogen 2.657 N/A ASP 51.A N GLN 47.A O no hydrogen 2.587 N/A ASN 52.A N LEU 48.A O no hydrogen 3.406 N/A ASN 52.A N TRP 49.A O no hydrogen 3.243 N/A GLN 56.A N LYS 96.A O no hydrogen 2.811 N/A LEU 57.A N ASN 91.A OD1 no hydrogen 3.344 N/A ALA 61.A N THR 58.A OG1 no hydrogen 3.161 N/A THR 62.A N THR 58.A O no hydrogen 2.885 N/A THR 62.A OG1 THR 58.A O no hydrogen 3.336 N/A LEU 63.A N GLU 60.A O no hydrogen 2.963 N/A ASN 71.A N GLU 67.A O no hydrogen 3.436 N/A SER 72.A OG PRO 69.A O no hydrogen 2.697 N/A ASP 73.A N TYR 70.A O no hydrogen 3.024 N/A LEU 76.A N ASP 73.A OD1 no hydrogen 2.458 N/A VAL 77.A N ASP 73.A O no hydrogen 3.277 N/A HIS 78.A N THR 74.A O no hydrogen 3.022 N/A ARG 79.A N VAL 75.A O no hydrogen 2.950 N/A ARG 79.A NH1 ASP 26.A OD1 no hydrogen 3.305 N/A ARG 79.A NH1 ASP 26.A OD2 no hydrogen 2.795 N/A ARG 79.A NH2 ASP 26.A OD1 no hydrogen 3.078 N/A VAL 80.A N LEU 76.A O no hydrogen 2.784 N/A HIS 81.A N VAL 77.A O no hydrogen 2.641 N/A HIS 81.A NE2 LEU 57.A O no hydrogen 2.674 N/A SER 82.A N HIS 78.A O no hydrogen 2.804 N/A SER 82.A OG HIS 78.A O no hydrogen 3.228 N/A SER 82.A OG ARG 79.A O no hydrogen 2.741 N/A TYR 83.A N ARG 79.A O no hydrogen 2.942 N/A LEU 84.A N VAL 80.A O no hydrogen 2.886 N/A GLU 85.A N HIS 81.A O no hydrogen 2.895 N/A ARG 86.A N SER 82.A O no hydrogen 2.713 N/A ARG 86.A NE ASP 642.A OD1 no hydrogen 2.437 N/A ARG 86.A NH2 ASP 642.A OD1 no hydrogen 3.010 N/A HIS 87.A N TYR 83.A O no hydrogen 3.166 N/A GLY 88.A N GLU 85.A O no hydrogen 3.164 N/A LEU 89.A N LEU 84.A O no hydrogen 2.968 N/A ASN 91.A ND2 LEU 57.A O no hydrogen 3.490 N/A ASN 91.A ND2 GLU 85.A OE2 no hydrogen 3.016 N/A ILE 94.A N GLN 176.A OE1 no hydrogen 2.726 N/A LYS 96.A N LYS 54.A O no hydrogen 3.142 N/A LYS 105.A NZ PRO 102.A O no hydrogen 3.029 N/A THR 106.A N GLY 129.A O no hydrogen 3.038 N/A LYS 108.A N ASP 439.A OD2 no hydrogen 2.948 N/A LYS 108.A NZ ASP 131.A OD1 no hydrogen 3.297 N/A LYS 108.A NZ THR 133.A OG1 no hydrogen 2.811 N/A VAL 109.A N ASP 131.A O no hydrogen 2.833 N/A ILE 110.A N ALA 440.A O no hydrogen 2.923 N/A ILE 111.A N THR 133.A O no hydrogen 2.902 N/A ILE 112.A N LEU 442.A O no hydrogen 2.951 N/A GLY 113.A N LEU 135.A O no hydrogen 2.843 N/A SER 114.A N GLU 136.A OE1 no hydrogen 2.529 N/A LEU 119.A N GLY 115.A O no hydrogen 2.854 N/A ALA 120.A N VAL 116.A O no hydrogen 2.940 N/A ALA 121.A N SER 117.A O no hydrogen 3.135 N/A ALA 122.A N GLY 118.A O no hydrogen 2.886 N/A ARG 123.A N LEU 119.A O no hydrogen 2.901 N/A ARG 123.A NE GLY 93.A O no hydrogen 3.163 N/A ARG 123.A NH1 LEU 398.A O no hydrogen 3.056 N/A ARG 123.A NH1 GLU 400.A O no hydrogen 2.659 N/A GLN 124.A N ALA 120.A O no hydrogen 3.164 N/A GLN 124.A NE2 ASN 91.A O no hydrogen 2.942 N/A LEU 125.A N ALA 121.A O no hydrogen 2.832 N/A GLN 126.A N ALA 122.A O no hydrogen 2.820 N/A GLN 126.A NE2 GLY 401.A O no hydrogen 2.832 N/A SER 127.A N ARG 123.A O no hydrogen 3.378 N/A SER 127.A OG ARG 123.A O no hydrogen 3.512 N/A SER 127.A OG GLN 124.A O no hydrogen 2.820 N/A PHE 128.A N GLN 124.A O no hydrogen 2.992 N/A PHE 128.A N LEU 125.A O no hydrogen 3.097 N/A GLY 129.A N GLN 126.A O no hydrogen 3.227 N/A MET 130.A N LEU 125.A O no hydrogen 2.948 N/A ASP 131.A N GLY 107.A O no hydrogen 2.856 N/A THR 133.A N VAL 109.A O no hydrogen 3.368 N/A LEU 134.A N ASP 403.A O no hydrogen 2.841 N/A LEU 135.A N ILE 111.A O no hydrogen 2.943 N/A GLU 136.A N LYS 405.A O no hydrogen 2.843 N/A ARG 138.A N GLU 136.A OE2 no hydrogen 3.217 N/A ARG 138.A NH1 ASP 574.A OD2 no hydrogen 2.891 N/A ARG 138.A NH2 ASP 574.A OD2 no hydrogen 3.218 N/A ARG 140.A NE VAL 141.A O no hydrogen 3.119 N/A GLY 142.A N SER 114.A O no hydrogen 2.900 N/A ARG 144.A NH1 SER 580.A O no hydrogen 2.872 N/A ARG 144.A NH1 GLU 616.A OE1 no hydrogen 2.784 N/A THR 147.A OG1 ASP 156.A OD1 no hydrogen 2.567 N/A PHE 148.A N ALA 155.A O no hydrogen 2.563 N/A ARG 149.A NH2 ASN 389.A O no hydrogen 3.522 N/A LYS 150.A N TYR 153.A O no hydrogen 2.954 N/A TYR 153.A N LYS 150.A O no hydrogen 2.620 N/A ALA 155.A N PHE 148.A O no hydrogen 2.788 N/A ASP 156.A N TYR 518.A OH no hydrogen 3.229 N/A LEU 157.A N ALA 146.A O no hydrogen 3.048 N/A ALA 159.A N ARG 144.A O no hydrogen 3.101 N/A VAL 162.A N LEU 385.A O no hydrogen 3.106 N/A GLY 164.A N VAL 162.A O no hydrogen 2.888 N/A GLY 166.A N THR 381.A O no hydrogen 3.006 N/A ASN 168.A N LEU 165.A O no hydrogen 2.934 N/A ASN 168.A ND2 GLY 164.A O no hydrogen 2.888 N/A MET 170.A N ASN 168.A OD1 no hydrogen 2.724 N/A ALA 171.A N ASN 168.A O no hydrogen 2.683 N/A VAL 173.A N PRO 169.A O no hydrogen 3.195 N/A SER 174.A N MET 170.A O no hydrogen 2.787 N/A LYS 175.A N ALA 171.A O no hydrogen 3.254 N/A GLN 176.A N VAL 172.A O no hydrogen 3.144 N/A GLN 176.A N VAL 173.A O no hydrogen 3.035 N/A GLN 176.A NE2 PRO 53.A O no hydrogen 2.674 N/A GLN 176.A NE2 PHE 92.A O no hydrogen 2.972 N/A VAL 177.A N VAL 173.A O no hydrogen 2.960 N/A MET 179.A N SER 174.A O no hydrogen 3.205 N/A ALA 182.A N THR 386.A O no hydrogen 3.149 N/A ILE 184.A N HIS 384.A O no hydrogen 3.217 N/A LYS 185.A N ASN 496.A OD1 no hydrogen 3.067 N/A LYS 187.A N LYS 185.A O no hydrogen 2.862 N/A TYR 191.A N GLY 499.A O no hydrogen 3.105 N/A GLU 192.A N GLN 196.A O no hydrogen 2.347 N/A GLY 195.A N GLU 192.A O no hydrogen 2.656 N/A GLN 196.A N ASN 194.A OD1 no hydrogen 2.553 N/A GLU 204.A N LYS 200.A O no hydrogen 2.773 N/A MET 205.A N GLU 201.A O no hydrogen 2.449 N/A VAL 206.A N LYS 202.A O no hydrogen 3.088 N/A GLU 207.A N ASP 203.A O no hydrogen 2.850 N/A GLN 208.A N GLU 204.A O no hydrogen 3.188 N/A GLU 209.A N MET 205.A O no hydrogen 2.779 N/A PHE 210.A N VAL 206.A O no hydrogen 2.550 N/A ASN 211.A N GLU 207.A O no hydrogen 3.041 N/A ARG 212.A N GLN 208.A O no hydrogen 3.016 N/A LEU 213.A N GLU 209.A O no hydrogen 2.816 N/A LEU 214.A N PHE 210.A O no hydrogen 2.811 N/A GLU 215.A N ASN 211.A O no hydrogen 2.777 N/A ALA 216.A N ARG 212.A O no hydrogen 3.038 N/A THR 217.A N LEU 213.A O no hydrogen 3.216 N/A THR 217.A OG1 LEU 213.A O no hydrogen 3.411 N/A SER 218.A N LEU 214.A O no hydrogen 3.337 N/A SER 218.A OG LEU 214.A O no hydrogen 3.472 N/A TYR 219.A N GLU 215.A O no hydrogen 2.954 N/A LEU 220.A N ALA 216.A O no hydrogen 2.868 N/A SER 221.A N THR 217.A O no hydrogen 3.374 N/A HIS 222.A N SER 218.A O no hydrogen 3.355 N/A ASP 225.A N SER 221.A O no hydrogen 2.813 N/A PHE 226.A N LEU 220.A O no hydrogen 3.037 N/A ASN 227.A N ASP 225.A O no hydrogen 3.104 N/A LEU 229.A N LYS 232.A O no hydrogen 2.948 N/A VAL 234.A N ASN 227.A O no hydrogen 2.878 N/A LEU 236.A N LEU 367.A O no hydrogen 3.043 N/A GLY 237.A N SER 235.A OG no hydrogen 3.154 N/A GLY 237.A N LEU 364.A O no hydrogen 3.160 N/A GLN 238.A NE2 PRO 233.A O no hydrogen 3.589 N/A ALA 239.A N SER 235.A O no hydrogen 3.244 N/A LEU 240.A N LEU 236.A O no hydrogen 2.842 N/A GLU 241.A N GLY 237.A O no hydrogen 3.085 N/A GLU 241.A N GLN 238.A O no hydrogen 2.677 N/A VAL 242.A N GLN 238.A O no hydrogen 2.883 N/A VAL 243.A N ALA 239.A O no hydrogen 2.920 N/A ILE 244.A N LEU 240.A O no hydrogen 3.376 N/A GLN 245.A N GLU 241.A O no hydrogen 3.120 N/A LEU 246.A N VAL 242.A O no hydrogen 3.207 N/A GLN 247.A N VAL 243.A O no hydrogen 3.146 N/A GLN 247.A N ILE 244.A O no hydrogen 3.082 N/A GLU 248.A N ILE 244.A O no hydrogen 2.732 N/A LYS 249.A N GLN 245.A O no hydrogen 2.728 N/A LYS 249.A NZ ASP 253.A OD1 no hydrogen 3.452 N/A HIS 250.A N LEU 246.A O no hydrogen 3.134 N/A VAL 251.A N GLN 247.A O no hydrogen 3.403 N/A LYS 252.A N GLU 248.A O no hydrogen 3.327 N/A ASP 253.A N LYS 249.A O no hydrogen 3.090 N/A GLU 254.A N HIS 250.A O no hydrogen 3.171 N/A GLN 255.A N VAL 251.A O no hydrogen 2.985 N/A ILE 256.A N ASP 253.A O no hydrogen 2.835 N/A GLU 257.A N ASP 253.A O no hydrogen 2.794 N/A HIS 258.A N GLU 254.A O no hydrogen 3.071 N/A TRP 259.A N GLN 255.A O no hydrogen 3.340 N/A LYS 260.A N ILE 256.A O no hydrogen 2.715 N/A LYS 261.A N GLU 257.A O no hydrogen 3.132 N/A ILE 262.A N HIS 258.A O no hydrogen 2.966 N/A VAL 263.A N TRP 259.A O no hydrogen 2.926 N/A LYS 264.A N LYS 260.A O no hydrogen 2.796 N/A THR 265.A N LYS 261.A O no hydrogen 2.965 N/A THR 265.A OG1 LYS 261.A O no hydrogen 3.241 N/A GLN 266.A N ILE 262.A O no hydrogen 3.201 N/A GLN 266.A NE2 ILE 262.A O no hydrogen 2.772 N/A GLU 267.A N VAL 263.A O no hydrogen 3.047 N/A GLU 268.A N LYS 264.A O no hydrogen 2.920 N/A LEU 269.A N THR 265.A O no hydrogen 3.035 N/A LYS 270.A N GLN 266.A O no hydrogen 3.197 N/A GLU 271.A N GLU 267.A O no hydrogen 3.023 N/A LEU 272.A N LEU 269.A O no hydrogen 3.333 N/A LEU 273.A N LEU 269.A O no hydrogen 2.965 N/A ASN 274.A N LYS 270.A O no hydrogen 3.009 N/A MET 276.A N LEU 272.A O no hydrogen 2.812 N/A VAL 277.A N LEU 273.A O no hydrogen 2.846 N/A ASN 278.A N ASN 274.A O no hydrogen 2.843 N/A LEU 279.A N MET 276.A O no hydrogen 2.719 N/A LYS 280.A N MET 276.A O no hydrogen 2.958 N/A LYS 282.A N LEU 279.A O no hydrogen 2.887 N/A ILE 283.A N LEU 279.A O no hydrogen 2.832 N/A LYS 284.A N LYS 280.A O no hydrogen 2.587 N/A LEU 286.A N ILE 283.A O no hydrogen 2.658 N/A HIS 287.A N ILE 283.A O no hydrogen 3.242 N/A HIS 287.A N LYS 284.A O no hydrogen 3.225 N/A GLN 289.A N GLU 285.A O no hydrogen 3.379 N/A TYR 290.A N LEU 286.A O no hydrogen 2.645 N/A GLU 292.A N GLN 289.A O no hydrogen 2.945 N/A ALA 293.A N GLN 289.A O no hydrogen 3.369 N/A GLU 297.A N ILE 294.A O no hydrogen 3.316 N/A PHE 298.A N ILE 294.A O no hydrogen 3.014 N/A VAL 300.A N ALA 296.A O no hydrogen 3.287 N/A SER 302.A OG PHE 298.A O no hydrogen 2.813 N/A LYS 303.A N LEU 299.A O no hydrogen 2.807 N/A HIS 304.A N VAL 300.A O no hydrogen 3.212 N/A ASP 306.A N SER 302.A O no hydrogen 2.635 N/A ASP 306.A N LYS 303.A O no hydrogen 3.115 N/A LEU 307.A N LYS 303.A O no hydrogen 2.647 N/A THR 308.A OG1 HIS 304.A O no hydrogen 2.878 N/A ALA 309.A N ASP 306.A O no hydrogen 2.482 N/A LEU 310.A N ASP 306.A O no hydrogen 3.090 N/A CYS 311.A N LEU 307.A O no hydrogen 3.403 N/A CYS 311.A SG LEU 307.A O no hydrogen 3.128 N/A GLU 313.A N LEU 310.A O no hydrogen 2.927 N/A TYR 314.A N LEU 310.A O no hydrogen 2.875 N/A ASP 315.A N CYS 311.A O no hydrogen 3.257 N/A GLU 316.A N GLU 313.A O no hydrogen 2.857 N/A LEU 317.A N GLU 313.A O no hydrogen 3.252 N/A ALA 318.A N TYR 314.A O no hydrogen 3.315 N/A GLU 319.A N GLU 316.A O no hydrogen 3.022 N/A THR 320.A N GLU 316.A O no hydrogen 3.191 N/A THR 320.A N LEU 317.A O no hydrogen 2.747 N/A THR 320.A OG1 GLU 316.A O no hydrogen 3.251 N/A GLN 321.A N LEU 317.A O no hydrogen 2.654 N/A LYS 323.A N GLU 319.A O no hydrogen 3.165 N/A LEU 324.A N THR 320.A O no hydrogen 2.771 N/A GLU 326.A N GLY 322.A O no hydrogen 2.952 N/A LEU 328.A N LEU 324.A O no hydrogen 2.718 N/A GLN 329.A N GLU 325.A O no hydrogen 2.699 N/A GLU 330.A N GLU 326.A O no hydrogen 3.263 N/A LEU 331.A N LYS 327.A O no hydrogen 3.407 N/A GLU 332.A N GLN 329.A O no hydrogen 2.673 N/A ALA 333.A N GLN 329.A O no hydrogen 3.083 N/A ASN 334.A N GLU 330.A O no hydrogen 2.721 N/A TYR 340.A OH GLU 209.A OE1 no hydrogen 2.221 N/A SER 342.A OG ASP 345.A OD1 no hydrogen 3.288 N/A ARG 346.A N SER 342.A O no hydrogen 2.962 N/A ILE 348.A N ARG 344.A O no hydrogen 2.769 N/A ILE 348.A N ASP 345.A O no hydrogen 3.111 N/A LEU 349.A N ASP 345.A O no hydrogen 2.656 N/A ASP 350.A N ARG 346.A O no hydrogen 2.767 N/A TRP 351.A NE1 PHE 512.A O no hydrogen 2.699 N/A PHE 353.A N ASP 350.A O no hydrogen 2.491 N/A ALA 354.A N ASP 350.A O no hydrogen 2.751 N/A ASN 355.A N TRP 351.A O no hydrogen 2.734 N/A GLU 357.A N PHE 353.A O no hydrogen 2.652 N/A PHE 358.A N ALA 354.A O no hydrogen 2.628 N/A ALA 359.A N ASN 355.A O no hydrogen 3.091 N/A ASN 360.A N LEU 356.A O no hydrogen 3.188 N/A ASN 360.A ND2 LEU 356.A O no hydrogen 3.167 N/A THR 362.A OG1 THR 366.A OG1 no hydrogen 2.675 N/A LEU 364.A N GLU 357.A OE2 no hydrogen 2.901 N/A THR 366.A N PRO 363.A O no hydrogen 3.181 N/A THR 366.A OG1 THR 362.A OG1 no hydrogen 2.675 N/A THR 366.A OG1 PRO 363.A O no hydrogen 2.599 N/A LEU 367.A N LEU 364.A O no hydrogen 3.001 N/A SER 368.A N VAL 584.A O no hydrogen 2.955 N/A SER 368.A OG ALA 586.A O no hydrogen 3.546 N/A LEU 369.A N VAL 234.A O no hydrogen 3.410 N/A LYS 370.A NZ HIS 371.A NE2 no hydrogen 3.427 N/A HIS 371.A N SER 368.A O no hydrogen 2.970 N/A HIS 371.A N SER 368.A OG no hydrogen 3.354 N/A GLN 374.A NE2 ARG 620.A O no hydrogen 3.535 N/A THR 381.A N GLY 166.A O no hydrogen 3.406 N/A LEU 385.A N VAL 162.A O no hydrogen 2.879 N/A THR 386.A OG1 MET 160.A O no hydrogen 3.555 N/A ARG 388.A N GLU 180.A O no hydrogen 3.280 N/A GLY 390.A N VAL 387.A O no hydrogen 3.426 N/A TYR 391.A N ASP 156.A OD1 no hydrogen 3.269 N/A TYR 391.A N ASP 156.A OD2 no hydrogen 3.079 N/A SER 392.A N THR 147.A OG1 no hydrogen 3.018 N/A CYS 393.A N GLY 390.A O no hydrogen 2.967 N/A CYS 393.A SG GLY 390.A O no hydrogen 3.182 N/A VAL 394.A N TYR 391.A O no hydrogen 3.062 N/A VAL 396.A N SER 392.A O no hydrogen 3.248 N/A ALA 397.A N CYS 393.A O no hydrogen 3.110 N/A ALA 397.A N VAL 394.A O no hydrogen 3.256 N/A LEU 398.A N VAL 394.A O no hydrogen 3.045 N/A ALA 399.A N PRO 395.A O no hydrogen 2.929 N/A LYS 405.A N LEU 134.A O no hydrogen 2.641 N/A ASN 407.A N ARG 138.A O no hydrogen 2.674 N/A THR 408.A N GLU 136.A O no hydrogen 2.723 N/A THR 408.A OG1 LEU 406.A O no hydrogen 2.981 N/A ALA 409.A N VAL 425.A O no hydrogen 2.919 N/A ARG 411.A N ILE 423.A O no hydrogen 2.717 N/A GLN 412.A N ILE 423.A O no hydrogen 3.127 N/A VAL 413.A N GLN 458.A O no hydrogen 2.803 N/A GLN 414.A N GLU 421.A O no hydrogen 2.866 N/A TYR 415.A N VAL 460.A O no hydrogen 3.141 N/A TYR 415.A OH PRO 461.A O no hydrogen 2.319 N/A THR 416.A N GLY 419.A O no hydrogen 2.786 N/A THR 416.A OG1 SER 418.A OG no hydrogen 2.691 N/A THR 416.A OG1 GLY 419.A O no hydrogen 3.128 N/A SER 418.A N THR 416.A OG1 no hydrogen 3.366 N/A SER 418.A OG THR 416.A OG1 no hydrogen 2.691 N/A GLY 419.A N THR 416.A O no hydrogen 3.065 N/A CYS 420.A N CYS 438.A O no hydrogen 2.740 N/A CYS 420.A SG ASP 439.A O no hydrogen 3.563 N/A GLU 421.A N GLN 414.A O no hydrogen 2.738 N/A VAL 422.A N TYR 436.A O no hydrogen 2.740 N/A ILE 423.A N GLN 412.A O no hydrogen 2.819 N/A ALA 424.A N PHE 434.A O no hydrogen 3.186 N/A VAL 425.A N ALA 409.A O no hydrogen 2.779 N/A ASN 426.A N GLN 432.A O no hydrogen 3.299 N/A THR 427.A N ASN 407.A O no hydrogen 2.862 N/A THR 427.A OG1 ALA 137.A O no hydrogen 3.517 N/A ARG 428.A N ASN 426.A OD1 no hydrogen 2.629 N/A SER 429.A N ASN 426.A O no hydrogen 3.052 N/A GLN 432.A N SER 429.A O no hydrogen 3.041 N/A PHE 434.A N ALA 424.A O no hydrogen 2.829 N/A TYR 436.A N VAL 422.A O no hydrogen 2.766 N/A LYS 437.A NZ GLU 421.A OE2 no hydrogen 3.437 N/A CYS 438.A N CYS 420.A O no hydrogen 2.827 N/A CYS 438.A SG CYS 420.A O no hydrogen 3.720 N/A CYS 438.A SG ALA 440.A O no hydrogen 3.463 N/A ASP 439.A N LYS 108.A O no hydrogen 2.862 N/A ALA 440.A N LYS 108.A O no hydrogen 3.253 N/A VAL 441.A N ARG 610.A O no hydrogen 2.810 N/A LEU 442.A N ILE 110.A O no hydrogen 2.811 N/A CYS 443.A N PHE 612.A O no hydrogen 2.709 N/A THR 444.A N ILE 112.A O no hydrogen 3.297 N/A THR 444.A OG1 ILE 112.A O no hydrogen 2.399 N/A THR 444.A OG1 GLY 113.A O no hydrogen 3.563 N/A VAL 449.A N PRO 446.A O no hydrogen 2.717 N/A LEU 450.A N PRO 446.A O no hydrogen 3.261 N/A LYS 451.A NZ VAL 471.A O no hydrogen 2.618 N/A LYS 451.A NZ GLN 472.A O no hydrogen 3.164 N/A LYS 451.A NZ MET 474.A O no hydrogen 2.782 N/A GLN 458.A N ARG 411.A O no hydrogen 3.015 N/A VAL 460.A N VAL 413.A O no hydrogen 2.866 N/A LYS 467.A N PRO 464.A O no hydrogen 3.292 N/A LYS 467.A NZ LEU 595.A O no hydrogen 3.039 N/A LYS 467.A NZ MET 596.A O no hydrogen 3.119 N/A LYS 467.A NZ GLN 598.A O no hydrogen 2.683 N/A THR 468.A N PRO 464.A O no hydrogen 3.312 N/A THR 468.A OG1 PRO 464.A O no hydrogen 2.908 N/A THR 468.A OG1 GLU 465.A O no hydrogen 3.027 N/A SER 469.A N GLU 465.A O no hydrogen 2.733 N/A SER 469.A OG GLU 465.A O no hydrogen 3.170 N/A ALA 470.A N TRP 466.A O no hydrogen 3.378 N/A VAL 471.A N LYS 467.A O no hydrogen 3.161 N/A GLN 472.A N THR 468.A O no hydrogen 2.826 N/A GLN 472.A NE2 THR 468.A O no hydrogen 3.469 N/A ARG 473.A N SER 469.A O no hydrogen 2.862 N/A ARG 473.A NE ASP 592.A OD1 no hydrogen 3.519 N/A MET 474.A N ALA 470.A O no hydrogen 2.844 N/A GLY 475.A N TYR 583.A O no hydrogen 3.293 N/A GLY 477.A N TYR 581.A O no hydrogen 2.883 N/A ASN 478.A N ALA 361.A O no hydrogen 2.713 N/A ASN 478.A ND2 GLU 536.A OE2 no hydrogen 2.661 N/A ASN 480.A N VAL 527.A O no hydrogen 3.248 N/A LYS 481.A N SER 569.A OG no hydrogen 3.109 N/A LYS 481.A NZ ASP 156.A O no hydrogen 3.251 N/A LYS 481.A NZ GLY 158.A O no hydrogen 2.938 N/A VAL 482.A N ALA 525.A O no hydrogen 2.901 N/A VAL 483.A N VAL 567.A O no hydrogen 2.657 N/A LEU 484.A N LEU 523.A O no hydrogen 2.769 N/A CYS 485.A N GLU 565.A O no hydrogen 2.889 N/A PHE 486.A N PRO 521.A O no hydrogen 2.940 N/A TRP 491.A NE1 ASN 516.A OD1 no hydrogen 2.303 N/A VAL 495.A N ASP 492.A O no hydrogen 2.813 N/A GLY 499.A N PRO 189.A O no hydrogen 3.138 N/A HIS 500.A N PHE 512.A O no hydrogen 3.107 N/A VAL 501.A N TYR 191.A O no hydrogen 3.034 N/A THR 505.A OG1 ASP 350.A OD2 no hydrogen 2.913 N/A ARG 508.A NE GLU 357.A OE1 no hydrogen 3.199 N/A GLU 510.A N SER 507.A O no hydrogen 3.405 N/A PHE 514.A N PHE 498.A O no hydrogen 3.126 N/A TRP 515.A N LEU 524.A O no hydrogen 2.592 N/A ALA 520.A N TYR 518.A O no hydrogen 2.261 N/A ILE 522.A N ALA 520.A O no hydrogen 2.776 N/A LEU 523.A N LEU 484.A O no hydrogen 2.902 N/A LEU 524.A N TRP 515.A O no hydrogen 3.020 N/A ALA 525.A N VAL 482.A O no hydrogen 3.142 N/A LEU 526.A N LEU 513.A O no hydrogen 2.845 N/A VAL 527.A N ASN 480.A O no hydrogen 3.192 N/A ALA 528.A N GLY 509.A O no hydrogen 2.668 N/A ALA 531.A N ALA 528.A O no hydrogen 3.300 N/A ALA 532.A N GLY 529.A O no hydrogen 2.763 N/A MET 535.A N ALA 531.A O no hydrogen 2.905 N/A GLU 536.A N GLY 533.A O no hydrogen 2.650 N/A ASN 537.A N ILE 534.A O no hydrogen 2.882 N/A ILE 543.A N SER 539.A O no hydrogen 3.030 N/A VAL 544.A N ASP 540.A O no hydrogen 2.776 N/A GLY 545.A N ASP 541.A O no hydrogen 2.841 N/A ARG 546.A N VAL 542.A O no hydrogen 3.267 N/A ARG 546.A NE GLU 510.A OE2 no hydrogen 2.773 N/A CYS 547.A N ILE 543.A O no hydrogen 3.334 N/A CYS 547.A N VAL 544.A O no hydrogen 2.645 N/A CYS 547.A SG ILE 543.A O no hydrogen 3.513 N/A LEU 548.A N VAL 544.A O no hydrogen 2.994 N/A ALA 549.A N GLY 545.A O no hydrogen 2.910 N/A ILE 550.A N ARG 546.A O no hydrogen 3.059 N/A LEU 551.A N CYS 547.A O no hydrogen 2.862 N/A LYS 552.A N LEU 548.A O no hydrogen 2.679 N/A LYS 552.A NZ SER 557.A O no hydrogen 3.025 N/A LYS 552.A NZ VAL 560.A O no hydrogen 3.413 N/A GLY 553.A N ALA 549.A O no hydrogen 3.128 N/A GLY 553.A N ILE 550.A O no hydrogen 3.337 N/A ILE 554.A N LEU 551.A O no hydrogen 2.607 N/A PHE 555.A N LEU 551.A O no hydrogen 3.268 N/A ALA 559.A N GLY 556.A O no hydrogen 3.241 N/A LYS 564.A N CYS 485.A O no hydrogen 2.763 N/A GLU 565.A N CYS 485.A O no hydrogen 3.483 N/A THR 566.A OG1 VAL 483.A O no hydrogen 3.462 N/A VAL 567.A N VAL 483.A O no hydrogen 3.112 N/A SER 569.A N LYS 481.A O no hydrogen 3.026 N/A ARG 570.A NH1 GLU 536.A O no hydrogen 2.967 N/A ARG 570.A NH1 ILE 538.A O no hydrogen 3.215 N/A TRP 571.A NE1 LEU 157.A O no hydrogen 2.825 N/A ARG 572.A N GLU 536.A OE2 no hydrogen 3.145 N/A ARG 572.A NH1 PHE 476.A O no hydrogen 3.273 N/A ARG 572.A NH1 ARG 578.A O no hydrogen 2.643 N/A ARG 572.A NH2 PHE 476.A O no hydrogen 2.573 N/A ALA 573.A N GLU 536.A OE1 no hydrogen 2.860 N/A ASP 574.A N ARG 570.A O no hydrogen 3.248 N/A TRP 576.A N ASP 574.A OD1 no hydrogen 2.687 N/A ALA 577.A N ASP 574.A O no hydrogen 3.029 N/A ARG 578.A N ASP 574.A O no hydrogen 2.610 N/A GLY 579.A N TRP 571.A O no hydrogen 2.419 N/A SER 580.A N GLY 477.A O no hydrogen 2.779 N/A SER 580.A OG LEU 479.A O no hydrogen 3.312 N/A TYR 581.A OH ALA 359.A O no hydrogen 3.159 N/A SER 582.A N GLU 616.A OE2 no hydrogen 2.832 N/A SER 582.A OG TYR 593.A OH no hydrogen 3.355 N/A SER 582.A OG GLU 616.A OE2 no hydrogen 2.408 N/A TYR 583.A N GLY 475.A O no hydrogen 3.249 N/A ALA 586.A N THR 366.A O no hydrogen 3.102 N/A SER 588.A N ALA 585.A O no hydrogen 2.657 N/A SER 588.A OG SER 589.A O no hydrogen 3.428 N/A SER 588.A OG ASP 592.A OD2 no hydrogen 2.802 N/A ASN 591.A ND2 SER 589.A OG no hydrogen 3.197 N/A ASP 592.A N SER 589.A O no hydrogen 2.930 N/A TYR 593.A N GLY 590.A O no hydrogen 2.799 N/A TYR 593.A OH SER 582.A OG no hydrogen 3.355 N/A ASP 594.A N GLY 590.A O no hydrogen 3.306 N/A ASP 594.A N ASN 591.A O no hydrogen 3.079 N/A LEU 595.A N ASN 591.A O no hydrogen 3.022 N/A MET 596.A N ASP 592.A O no hydrogen 3.096 N/A ALA 597.A N ASP 594.A O no hydrogen 3.143 N/A GLN 598.A N ASP 594.A O no hydrogen 3.062 N/A GLN 598.A N LEU 595.A O no hydrogen 3.229 N/A ILE 600.A N LEU 611.A O no hydrogen 2.817 N/A ARG 610.A N ILE 600.A O no hydrogen 3.130 N/A ARG 610.A NH1 ASP 439.A O no hydrogen 2.896 N/A ARG 610.A NH2 ALA 417.A O no hydrogen 3.247 N/A LEU 611.A N ILE 600.A O no hydrogen 3.415 N/A PHE 612.A N VAL 441.A O no hydrogen 2.789 N/A ALA 614.A N CYS 443.A O no hydrogen 3.053 N/A GLY 615.A N SER 632.A OG no hydrogen 2.928 N/A THR 618.A N GLY 615.A O no hydrogen 2.689 N/A THR 618.A OG1 GLY 615.A O no hydrogen 2.825 N/A ALA 624.A N GLU 616.A O no hydrogen 3.331 N/A THR 625.A OG1 TYR 622.A O no hydrogen 2.624 N/A GLY 628.A N THR 625.A OG1 no hydrogen 3.106 N/A ALA 629.A N THR 625.A O no hydrogen 3.380 N/A LEU 630.A N VAL 626.A O no hydrogen 2.980 N/A LEU 631.A N HIS 627.A O no hydrogen 2.840 N/A SER 632.A N GLY 628.A O no hydrogen 2.802 N/A SER 632.A OG GLY 628.A O no hydrogen 3.282 N/A SER 632.A OG ALA 629.A O no hydrogen 2.469 N/A GLY 633.A N ALA 629.A O no hydrogen 3.035 N/A LEU 634.A N LEU 630.A O no hydrogen 3.223 N/A ARG 635.A N LEU 631.A O no hydrogen 2.923 N/A ARG 635.A NE GLU 636.A OE2 no hydrogen 2.703 N/A ARG 635.A NH1 THR 618.A O no hydrogen 3.178 N/A ARG 635.A NH2 PHE 613.A O no hydrogen 3.367 N/A ARG 635.A NH2 THR 618.A OG1 no hydrogen 2.742 N/A ARG 635.A NH2 GLU 636.A OE2 no hydrogen 3.374 N/A GLU 636.A N SER 632.A O no hydrogen 3.027 N/A ALA 637.A N GLY 633.A O no hydrogen 2.932 N/A GLY 638.A N LEU 634.A O no hydrogen 3.274 N/A ARG 639.A N ARG 635.A O no hydrogen 3.071 N/A ARG 639.A NE GLU 636.A OE1 no hydrogen 2.904 N/A ARG 639.A NE GLU 636.A OE2 no hydrogen 3.192 N/A ARG 639.A NH2 GLU 636.A OE2 no hydrogen 3.039 N/A ILE 640.A N GLU 636.A O no hydrogen 2.651 N/A ALA 641.A N ALA 637.A O no hydrogen 3.044 N/A ASP 642.A N GLY 638.A O no hydrogen 2.793 N/A GLN 643.A N ARG 639.A O no hydrogen 3.170 N/A GLN 643.A N ILE 640.A O no hydrogen 2.810 N/A PHE 644.A N ILE 640.A O no hydrogen 3.018 N/A LEU 645.A N ALA 641.A O no hydrogen 3.053 N/A