Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1bs2_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLN 6.A N ASN 2.A O no hydrogen 3.114 N/A GLN 6.A NE2 LYS 117.A O no hydrogen 3.038 N/A LEU 7.A N MET 3.A O no hydrogen 3.049 N/A LYS 8.A N ILE 4.A O no hydrogen 3.159 N/A LYS 9.A N SER 5.A O no hydrogen 3.017 N/A LYS 9.A NZ GLN 6.A OE1 no hydrogen 3.283 N/A LEU 10.A N GLN 6.A O no hydrogen 2.883 N/A SER 11.A N LYS 8.A O no hydrogen 2.733 N/A SER 11.A OG LYS 9.A O no hydrogen 3.204 N/A ILE 12.A N LEU 7.A O no hydrogen 2.859 N/A ALA 16.A N GLN 37.A OE1 no hydrogen 2.679 N/A ALA 18.A N ASN 33.A OD1 no hydrogen 3.290 N/A SER 21.A N ALA 18.A O no hydrogen 3.227 N/A SER 21.A OG ALA 18.A O no hydrogen 3.009 N/A SER 21.A OG ASN 33.A OD1 no hydrogen 3.494 N/A HIS 22.A N ASP 29.A OD2 no hydrogen 2.798 N/A VAL 25.A N HIS 22.A O no hydrogen 3.171 N/A ASN 26.A N HIS 22.A O no hydrogen 3.034 N/A ASN 26.A ND2 ASP 532.A OD1 no hydrogen 3.079 N/A VAL 28.A N ASN 26.A OD1 no hydrogen 2.725 N/A ASP 29.A N ASN 26.A O no hydrogen 2.903 N/A ASP 29.A N ASN 26.A OD1 no hydrogen 3.240 N/A LEU 30.A N ASN 26.A O no hydrogen 3.282 N/A MET 31.A N ILE 27.A O no hydrogen 2.887 N/A ARG 32.A N VAL 28.A O no hydrogen 2.881 N/A ARG 32.A NE VAL 28.A O no hydrogen 3.152 N/A ARG 32.A NH2 ASP 532.A OD1 no hydrogen 2.473 N/A ARG 32.A NH2 ASP 532.A OD2 no hydrogen 2.684 N/A ASN 33.A N ASP 29.A O no hydrogen 2.791 N/A ASN 33.A ND2 SER 21.A OG no hydrogen 3.240 N/A TYR 34.A N LEU 30.A O no hydrogen 3.009 N/A TYR 34.A OH PRO 91.A O no hydrogen 2.564 N/A ILE 35.A N MET 31.A O no hydrogen 3.061 N/A SER 36.A N ARG 32.A O no hydrogen 2.999 N/A SER 36.A OG ARG 32.A O no hydrogen 2.864 N/A GLN 37.A N ASN 33.A O no hydrogen 3.188 N/A GLN 37.A NE2 GLU 38.A OE2 no hydrogen 2.903 N/A GLU 38.A N TYR 34.A O no hydrogen 3.104 N/A LEU 39.A N ILE 35.A O no hydrogen 2.664 N/A SER 40.A N SER 36.A O no hydrogen 2.709 N/A SER 40.A OG VAL 45.A O no hydrogen 2.623 N/A LYS 41.A NZ GLU 38.A OE2 no hydrogen 3.143 N/A ILE 42.A N GLU 38.A O no hydrogen 3.441 N/A SER 43.A N LEU 39.A O no hydrogen 3.053 N/A SER 43.A OG LEU 39.A O no hydrogen 2.540 N/A SER 48.A N ASP 46.A OD2 no hydrogen 3.243 N/A SER 48.A OG ASP 46.A OD2 no hydrogen 2.560 N/A LEU 49.A N ASP 46.A O no hydrogen 3.091 N/A PHE 51.A N SER 47.A O no hydrogen 2.955 N/A ALA 53.A N LEU 49.A O no hydrogen 3.291 N/A LEU 54.A N ILE 50.A O no hydrogen 2.929 N/A LEU 54.A N PHE 51.A O no hydrogen 3.315 N/A GLU 55.A N LEU 66.A O no hydrogen 2.641 N/A TRP 56.A NE1 ASP 532.A OD2 no hydrogen 2.928 N/A THR 57.A OG1 THR 59.A O no hydrogen 2.882 N/A THR 57.A OG1 GLY 63.A O no hydrogen 2.895 N/A ARG 62.A N THR 59.A O no hydrogen 3.124 N/A GLY 63.A N MET 60.A O no hydrogen 3.402 N/A ASP 64.A N PHE 108.A O no hydrogen 2.719 N/A LEU 65.A N PHE 108.A O no hydrogen 3.435 N/A LEU 66.A N GLU 55.A O no hydrogen 2.786 N/A ILE 67.A N ILE 106.A O no hydrogen 3.087 N/A ILE 69.A N PRO 104.A O no hydrogen 3.018 N/A ARG 71.A N PRO 68.A O no hydrogen 2.820 N/A LEU 72.A N ILE 69.A O no hydrogen 2.656 N/A ARG 73.A N PRO 70.A O no hydrogen 2.853 N/A LEU 82.A N ASN 78.A O no hydrogen 2.932 N/A ALA 83.A N PRO 79.A O no hydrogen 2.980 N/A VAL 84.A N LYS 80.A O no hydrogen 3.379 N/A GLN 85.A N ASP 81.A O no hydrogen 2.830 N/A TRP 86.A N LEU 82.A O no hydrogen 2.535 N/A ALA 87.A N ALA 83.A O no hydrogen 2.864 N/A GLU 88.A N GLN 85.A O no hydrogen 2.926 N/A LYS 89.A N GLN 85.A O no hydrogen 3.267 N/A PHE 95.A N CYS 92.A O no hydrogen 2.922 N/A LEU 96.A N CYS 92.A O no hydrogen 3.201 N/A GLU 97.A N PHE 109.A O no hydrogen 2.621 N/A LYS 98.A NZ GLU 97.A OE2 no hydrogen 3.407 N/A GLU 100.A N GLN 107.A O no hydrogen 2.865 N/A ASN 102.A N PHE 105.A O no hydrogen 2.950 N/A ASN 102.A ND2 GLN 107.A OE1 no hydrogen 3.467 N/A PHE 105.A N ASN 102.A O no hydrogen 2.951 N/A ILE 106.A N ILE 67.A O no hydrogen 3.332 N/A GLN 107.A N GLU 100.A O no hydrogen 2.705 N/A PHE 108.A N LEU 65.A O no hydrogen 2.831 N/A PHE 109.A N LYS 98.A O no hydrogen 2.973 N/A PHE 110.A N ASP 64.A OD2 no hydrogen 2.875 N/A ASN 111.A N PHE 95.A O no hydrogen 2.783 N/A ASN 111.A ND2 ASP 94.A O no hydrogen 3.562 N/A GLN 113.A N ASN 111.A OD1 no hydrogen 3.290 N/A GLN 113.A NE2 LEU 515.A O no hydrogen 3.328 N/A PHE 114.A N ASN 111.A OD1 no hydrogen 3.483 N/A LEU 115.A N ASN 111.A O no hydrogen 2.858 N/A ALA 116.A N PRO 112.A O no hydrogen 2.975 N/A LYS 117.A N GLN 113.A O no hydrogen 3.141 N/A LEU 118.A N PHE 114.A O no hydrogen 3.313 N/A LEU 118.A N LEU 115.A O no hydrogen 2.967 N/A VAL 119.A N LEU 115.A O no hydrogen 2.586 N/A ILE 120.A N ALA 116.A O no hydrogen 3.171 N/A ASP 122.A N LEU 118.A O no hydrogen 3.025 N/A ILE 123.A N VAL 119.A O no hydrogen 2.954 N/A LEU 124.A N ILE 120.A O no hydrogen 3.088 N/A THR 125.A N PRO 121.A O no hydrogen 2.935 N/A THR 125.A OG1 PRO 121.A O no hydrogen 2.574 N/A ARG 126.A N ASP 122.A O no hydrogen 2.940 N/A ARG 126.A NH1 ASP 122.A OD2 no hydrogen 2.965 N/A ARG 126.A NH2 SER 132.A O no hydrogen 3.054 N/A LYS 127.A N ILE 123.A O no hydrogen 2.757 N/A ASP 129.A N ARG 126.A O no hydrogen 2.859 N/A TYR 130.A N LYS 127.A O no hydrogen 2.969 N/A TYR 130.A OH LEU 527.A O no hydrogen 2.708 N/A SER 132.A N ASP 129.A O no hydrogen 2.706 N/A SER 132.A OG LYS 174.A O no hydrogen 3.123 N/A CYS 133.A N LYS 174.A O no hydrogen 3.025 N/A LYS 140.A N ASP 361.A OD2 no hydrogen 2.768 N/A LYS 140.A NZ TYR 358.A O no hydrogen 2.935 N/A VAL 141.A N GLU 178.A O no hydrogen 2.885 N/A ILE 142.A N LYS 362.A O no hydrogen 3.007 N/A ILE 143.A N ILE 180.A O no hydrogen 2.947 N/A GLU 144.A N ILE 364.A O no hydrogen 2.781 N/A PHE 145.A N MET 182.A O no hydrogen 3.121 N/A SER 146.A N SER 161.A OG no hydrogen 2.777 N/A SER 146.A OG THR 162.A OG1 no hydrogen 2.586 N/A SER 146.A OG TYR 277.A OH no hydrogen 2.585 N/A SER 147.A N PHE 145.A O no hydrogen 2.851 N/A SER 147.A OG GLU 144.A OE2 no hydrogen 3.264 N/A ILE 150.A N GLY 186.A O no hydrogen 2.966 N/A LYS 152.A N ASN 149.A O no hydrogen 3.414 N/A PHE 154.A N PHE 413.A O no hydrogen 2.626 N/A HIS 155.A N HIS 158.A ND1 no hydrogen 2.969 N/A LEU 159.A N HIS 155.A O no hydrogen 3.169 N/A ARG 160.A N ALA 156.A O no hydrogen 2.888 N/A ARG 160.A NE GLY 399.A O no hydrogen 2.983 N/A ARG 160.A NH1 ASP 458.A O no hydrogen 3.151 N/A ARG 160.A NH1 ASP 458.A OD2 no hydrogen 2.776 N/A SER 161.A N GLY 157.A O no hydrogen 2.960 N/A SER 161.A OG VAL 366.A O no hydrogen 2.572 N/A THR 162.A N HIS 158.A O no hydrogen 2.731 N/A THR 162.A OG1 SER 146.A OG no hydrogen 2.586 N/A THR 162.A OG1 HIS 158.A O no hydrogen 2.668 N/A ILE 163.A N LEU 159.A O no hydrogen 2.895 N/A ILE 164.A N ARG 160.A O no hydrogen 3.046 N/A GLY 165.A N SER 161.A O no hydrogen 3.015 N/A GLY 166.A N THR 162.A O no hydrogen 3.153 N/A PHE 167.A N ILE 163.A O no hydrogen 3.274 N/A LEU 168.A N ILE 164.A O no hydrogen 2.826 N/A ALA 169.A N GLY 165.A O no hydrogen 2.928 N/A ASN 170.A N GLY 166.A O no hydrogen 3.207 N/A ASN 170.A ND2 LEU 594.A O no hydrogen 3.094 N/A LEU 171.A N PHE 167.A O no hydrogen 2.785 N/A TYR 172.A N LEU 168.A O no hydrogen 2.818 N/A TYR 172.A OH HIS 541.A NE2 no hydrogen 2.753 N/A GLU 173.A N ALA 169.A O no hydrogen 3.111 N/A GLU 173.A N ASN 170.A O no hydrogen 3.177 N/A LYS 174.A N ASN 170.A O no hydrogen 3.116 N/A GLY 176.A N GLU 173.A O no hydrogen 2.744 N/A TRP 177.A N TYR 172.A O no hydrogen 3.037 N/A GLU 178.A N LYS 139.A O no hydrogen 2.929 N/A ILE 180.A N VAL 141.A O no hydrogen 2.952 N/A ARG 181.A N ASP 285.A OD2 no hydrogen 2.511 N/A ARG 181.A NH1 ASN 170.A OD1 no hydrogen 3.485 N/A ARG 181.A NH2 ASN 170.A OD1 no hydrogen 3.467 N/A MET 182.A N ILE 143.A O no hydrogen 2.931 N/A ASN 183.A N VAL 286.A O no hydrogen 2.993 N/A ASN 183.A ND2 TYR 277.A OH no hydrogen 3.035 N/A TYR 184.A OH ARG 346.A O no hydrogen 3.410 N/A LEU 185.A N ASN 183.A O no hydrogen 2.979 N/A LEU 185.A N SER 288.A O no hydrogen 3.300 N/A GLY 186.A N PRO 148.A O no hydrogen 2.742 N/A PHE 192.A N GLY 189.A O no hydrogen 2.885 N/A GLY 193.A N LYS 190.A O no hydrogen 3.015 N/A LEU 194.A N LYS 190.A O no hydrogen 3.258 N/A LEU 195.A N GLN 191.A O no hydrogen 2.977 N/A ALA 196.A N PHE 192.A O no hydrogen 2.660 N/A VAL 197.A N GLY 193.A O no hydrogen 2.803 N/A GLY 198.A N LEU 194.A O no hydrogen 2.740 N/A PHE 199.A N LEU 195.A O no hydrogen 2.731 N/A GLU 200.A N ALA 196.A O no hydrogen 3.148 N/A ARG 201.A N VAL 197.A O no hydrogen 3.210 N/A ARG 201.A NH1 ASP 226.A OD2 no hydrogen 3.370 N/A ARG 201.A NH1 THR 240.A OG1 no hydrogen 2.867 N/A TYR 202.A N GLY 198.A O no hydrogen 2.785 N/A TYR 202.A OH ASP 226.A OD2 no hydrogen 2.524 N/A ASN 204.A N HIS 215.A NE2 no hydrogen 3.099 N/A LEU 208.A N ASN 204.A O no hydrogen 3.074 N/A LYS 210.A N GLU 206.A O no hydrogen 3.038 N/A ASP 211.A N ALA 207.A O no hydrogen 2.986 N/A HIS 214.A N ASP 211.A OD1 no hydrogen 3.202 N/A HIS 214.A NE2 ASN 416.A OD1 no hydrogen 2.844 N/A HIS 215.A N ASP 211.A O no hydrogen 2.907 N/A LEU 216.A N PRO 212.A O no hydrogen 3.104 N/A PHE 217.A N ILE 213.A O no hydrogen 3.359 N/A ASP 218.A N HIS 214.A O no hydrogen 2.882 N/A VAL 219.A N HIS 215.A O no hydrogen 2.804 N/A TYR 220.A N LEU 216.A O no hydrogen 2.872 N/A VAL 221.A N PHE 217.A O no hydrogen 3.031 N/A ARG 222.A N ASP 218.A O no hydrogen 3.164 N/A ILE 223.A N VAL 219.A O no hydrogen 2.968 N/A ASN 224.A N TYR 220.A O no hydrogen 3.244 N/A ASN 224.A ND2 TYR 220.A O no hydrogen 2.657 N/A LYS 225.A N VAL 221.A O no hydrogen 3.412 N/A LYS 225.A NZ TYR 202.A OH no hydrogen 3.399 N/A LYS 225.A NZ ARG 222.A O no hydrogen 3.314 N/A ILE 227.A N ILE 223.A O no hydrogen 3.459 N/A GLU 228.A N ASN 224.A O no hydrogen 3.170 N/A GLU 229.A N LYS 225.A O no hydrogen 3.171 N/A GLU 230.A N ASP 226.A O no hydrogen 3.068 N/A ILE 234.A N ASP 232.A O no hydrogen 2.751 N/A GLU 237.A N PRO 235.A O no hydrogen 2.492 N/A GLN 238.A N PRO 235.A O no hydrogen 2.969 N/A THR 240.A N GLU 230.A OE1 no hydrogen 2.881 N/A THR 240.A OG1 GLU 230.A OE1 no hydrogen 3.308 N/A THR 240.A OG1 GLU 230.A OE2 no hydrogen 2.867 N/A GLY 242.A N SER 239.A OG no hydrogen 3.086 N/A LYS 243.A N SER 239.A O no hydrogen 3.197 N/A ALA 244.A N THR 240.A O no hydrogen 3.008 N/A ARG 245.A N ASN 241.A O no hydrogen 3.029 N/A GLU 246.A N GLY 242.A O no hydrogen 2.876 N/A TYR 247.A N LYS 243.A O no hydrogen 2.624 N/A PHE 248.A N ALA 244.A O no hydrogen 2.808 N/A LYS 249.A N GLU 246.A O no hydrogen 2.804 N/A ASP 253.A N GLU 252.A OE1 no hydrogen 3.366 N/A GLU 257.A N ASP 255.A OD1 no hydrogen 2.545 N/A LEU 259.A N ASP 255.A O no hydrogen 3.087 N/A ILE 261.A N GLU 257.A O no hydrogen 3.160 N/A LYS 263.A N LEU 259.A O no hydrogen 2.595 N/A ARG 264.A N ILE 261.A O no hydrogen 3.268 N/A PHE 265.A N ILE 261.A O no hydrogen 3.190 N/A ARG 266.A N TRP 262.A O no hydrogen 2.979 N/A ARG 266.A NH1 ASP 187.A OD2 no hydrogen 2.771 N/A ARG 266.A NH1 SER 288.A O no hydrogen 3.459 N/A ARG 266.A NH2 TYR 287.A O no hydrogen 2.604 N/A GLU 267.A N LYS 263.A O no hydrogen 3.065 N/A PHE 268.A N ARG 264.A O no hydrogen 2.861 N/A SER 269.A N PHE 265.A O no hydrogen 3.004 N/A SER 269.A OG PHE 265.A O no hydrogen 2.632 N/A ILE 270.A N ARG 266.A O no hydrogen 2.832 N/A GLU 271.A N GLU 267.A O no hydrogen 3.005 N/A LYS 272.A N PHE 268.A O no hydrogen 3.306 N/A LYS 272.A N SER 269.A O no hydrogen 2.927 N/A TYR 273.A N SER 269.A O no hydrogen 2.960 N/A ILE 274.A N ILE 270.A O no hydrogen 3.058 N/A ASP 275.A N LYS 272.A O no hydrogen 3.014 N/A THR 276.A N LYS 272.A O no hydrogen 3.304 N/A TYR 277.A N TYR 273.A O no hydrogen 2.717 N/A TYR 277.A OH SER 146.A OG no hydrogen 2.585 N/A ALA 278.A N ILE 274.A O no hydrogen 3.209 N/A ARG 279.A N THR 276.A O no hydrogen 2.901 N/A ARG 279.A NE ASP 447.A OD2 no hydrogen 3.214 N/A ARG 279.A NH2 GLU 420.A OE1 no hydrogen 3.381 N/A ARG 279.A NH2 ASP 447.A OD1 no hydrogen 2.529 N/A LEU 280.A N TYR 277.A O no hydrogen 2.774 N/A ASN 281.A N ALA 278.A O no hydrogen 3.041 N/A ASN 281.A ND2 GLY 596.A O no hydrogen 2.892 N/A ASN 281.A ND2 THR 598.A OG1 no hydrogen 2.837 N/A ILE 282.A N TYR 277.A O no hydrogen 3.050 N/A TYR 284.A OH PHE 145.A O no hydrogen 2.676 N/A ASP 285.A N ARG 181.A O no hydrogen 2.869 N/A VAL 286.A N ARG 181.A O no hydrogen 3.350 N/A GLY 289.A N SER 288.A OG no hydrogen 2.580 N/A GLU 290.A N LEU 185.A O no hydrogen 3.178 N/A SER 291.A N ASP 187.A OD1 no hydrogen 3.280 N/A SER 291.A OG ASP 187.A OD1 no hydrogen 2.950 N/A SER 291.A OG ASP 187.A OD2 no hydrogen 3.004 N/A SER 294.A N ASP 353.A OD2 no hydrogen 2.740 N/A SER 294.A OG SER 297.A OG no hydrogen 3.086 N/A SER 294.A OG ASP 353.A OD1 no hydrogen 3.117 N/A SER 297.A N SER 294.A OG no hydrogen 2.897 N/A SER 297.A OG SER 294.A OG no hydrogen 3.086 N/A SER 297.A OG ASP 353.A OD1 no hydrogen 2.804 N/A MET 298.A N SER 294.A O no hydrogen 3.006 N/A LEU 299.A N LYS 295.A O no hydrogen 3.059 N/A LYS 300.A N GLU 296.A O no hydrogen 2.723 N/A ALA 301.A N SER 297.A O no hydrogen 2.715 N/A ILE 302.A N MET 298.A O no hydrogen 3.208 N/A ASP 303.A N LEU 299.A O no hydrogen 2.809 N/A LEU 304.A N LYS 300.A O no hydrogen 2.850 N/A PHE 305.A N ALA 301.A O no hydrogen 2.935 N/A LYS 306.A N ASP 303.A O no hydrogen 3.082 N/A GLU 307.A N ASP 303.A O no hydrogen 3.200 N/A LYS 308.A N LEU 304.A O no hydrogen 3.117 N/A GLY 309.A N LYS 306.A O no hydrogen 2.812 N/A LEU 310.A N PHE 305.A O no hydrogen 3.320 N/A HIS 312.A ND1 LEU 319.A O no hydrogen 3.076 N/A ASP 314.A N ALA 317.A O no hydrogen 2.899 N/A ALA 317.A N ASP 314.A O no hydrogen 3.064 N/A VAL 318.A N GLN 335.A O no hydrogen 2.506 N/A ILE 320.A N ALA 332.A O no hydrogen 2.794 N/A LEU 322.A N GLY 330.A O no hydrogen 3.200 N/A PHE 325.A N LEU 322.A O no hydrogen 2.790 N/A ASN 326.A N LEU 322.A O no hydrogen 3.112 N/A LEU 329.A N ASN 326.A O no hydrogen 2.791 N/A ALA 332.A N ILE 320.A O no hydrogen 2.901 N/A VAL 334.A N VAL 318.A O no hydrogen 2.996 N/A GLN 335.A N VAL 318.A O no hydrogen 3.380 N/A LYS 336.A N THR 340.A O no hydrogen 3.423 N/A SER 337.A OG LYS 315.A O no hydrogen 2.992 N/A GLY 339.A N LYS 336.A O no hydrogen 2.782 N/A TYR 343.A OH GLN 371.A OE1 no hydrogen 2.819 N/A THR 345.A OG1 VAL 334.A O no hydrogen 2.592 N/A ARG 346.A N LEU 342.A O no hydrogen 2.970 N/A ARG 346.A NE GLU 290.A OE1 no hydrogen 2.946 N/A ARG 346.A NH1 THR 341.A O no hydrogen 3.429 N/A ASP 347.A N TYR 343.A O no hydrogen 3.304 N/A ASP 347.A N LEU 344.A O no hydrogen 3.197 N/A VAL 348.A N LEU 344.A O no hydrogen 3.118 N/A GLY 349.A N THR 345.A O no hydrogen 2.908 N/A ALA 350.A N ARG 346.A O no hydrogen 2.808 N/A ALA 351.A N ASP 347.A O no hydrogen 2.986 N/A MET 352.A N VAL 348.A O no hydrogen 3.304 N/A ASP 353.A N GLY 349.A O no hydrogen 2.942 N/A ARG 354.A N ALA 350.A O no hydrogen 2.879 N/A ARG 354.A NH1 GLU 144.A OE1 no hydrogen 3.052 N/A ARG 354.A NH2 GLU 144.A OE1 no hydrogen 2.869 N/A TYR 355.A N ALA 351.A O no hydrogen 2.875 N/A GLU 356.A N MET 352.A O no hydrogen 3.354 N/A LYS 357.A N ASP 353.A O no hydrogen 2.983 N/A TYR 358.A N ARG 354.A O no hydrogen 2.857 N/A HIS 359.A N TYR 355.A O no hydrogen 2.436 N/A ASP 361.A N LYS 140.A O no hydrogen 2.806 N/A LYS 362.A N LYS 140.A O no hydrogen 3.230 N/A LYS 362.A NZ GLN 394.A OE1 no hydrogen 3.004 N/A MET 363.A N ASP 392.A O no hydrogen 2.968 N/A ILE 364.A N ILE 142.A O no hydrogen 2.559 N/A TYR 365.A N GLN 394.A O no hydrogen 2.911 N/A VAL 366.A N GLU 144.A O no hydrogen 2.923 N/A SER 369.A N PHE 398.A O no hydrogen 2.989 N/A SER 369.A OG PHE 398.A O no hydrogen 2.897 N/A GLN 371.A N ALA 368.A O no hydrogen 3.035 N/A ASP 372.A N SER 369.A O no hydrogen 3.265 N/A HIS 374.A NE2 ASP 347.A OD2 no hydrogen 2.579 N/A ALA 375.A N GLN 371.A O no hydrogen 3.045 N/A ALA 376.A N ASP 372.A O no hydrogen 2.869 N/A GLN 377.A N LEU 373.A O no hydrogen 2.809 N/A PHE 378.A N HIS 374.A O no hydrogen 3.210 N/A GLU 380.A N ALA 376.A O no hydrogen 3.152 N/A ILE 381.A N GLN 377.A O no hydrogen 2.777 N/A LEU 382.A N PHE 378.A O no hydrogen 3.372 N/A LYS 383.A N PHE 379.A O no hydrogen 3.268 N/A LYS 383.A NZ GLU 380.A OE2 no hydrogen 3.398 N/A GLN 384.A N GLU 380.A O no hydrogen 3.153 N/A GLN 384.A NE2 GLU 380.A OE2 no hydrogen 2.897 N/A MET 385.A N ILE 381.A O no hydrogen 2.882 N/A GLY 386.A N LYS 383.A O no hydrogen 2.809 N/A LYS 391.A N GLU 388.A O no hydrogen 3.069 N/A LYS 391.A NZ GLU 388.A OE2 no hydrogen 3.387 N/A ASP 392.A N TRP 389.A O no hydrogen 2.672 N/A LEU 393.A N ALA 390.A O no hydrogen 3.170 N/A GLN 394.A N MET 363.A O no hydrogen 2.918 N/A GLN 394.A NE2 HIS 541.A ND1 no hydrogen 3.480 N/A HIS 395.A NE2 ILE 367.A O no hydrogen 3.033 N/A VAL 396.A N TYR 365.A O no hydrogen 2.908 N/A GLY 399.A N ARG 463.A O no hydrogen 2.689 N/A MET 400.A N ASN 466.A OD1 no hydrogen 2.983 N/A GLN 402.A N TYR 467.A O no hydrogen 2.876 N/A LYS 408.A NZ THR 406.A O no hydrogen 3.436 N/A THR 410.A N ARG 407.A O no hydrogen 3.155 N/A THR 410.A OG1 VAL 411.A O no hydrogen 3.369 N/A LEU 418.A N LEU 414.A O no hydrogen 3.302 N/A LEU 418.A N ASP 415.A O no hydrogen 2.772 N/A GLU 419.A N ASP 415.A O no hydrogen 3.270 N/A GLU 420.A N ASN 416.A O no hydrogen 2.972 N/A THR 421.A N ILE 417.A O no hydrogen 2.864 N/A LYS 422.A N LEU 418.A O no hydrogen 2.923 N/A GLU 423.A N GLU 419.A O no hydrogen 2.856 N/A LYS 424.A N GLU 420.A O no hydrogen 2.896 N/A MET 425.A N THR 421.A O no hydrogen 2.768 N/A HIS 426.A N LYS 422.A O no hydrogen 2.731 N/A GLU 427.A N GLU 423.A O no hydrogen 2.722 N/A GLU 427.A N LYS 424.A O no hydrogen 2.975 N/A VAL 428.A N LYS 424.A O no hydrogen 3.101 N/A MET 429.A N MET 425.A O no hydrogen 3.127 N/A LYS 430.A N HIS 426.A O no hydrogen 2.801 N/A LYS 431.A N GLU 427.A O no hydrogen 2.932 N/A LYS 431.A NZ GLU 427.A OE1 no hydrogen 3.387 N/A ASN 432.A N VAL 428.A O no hydrogen 3.133 N/A ASN 432.A N MET 429.A O no hydrogen 3.211 N/A ASN 432.A ND2 VAL 428.A O no hydrogen 2.813 N/A GLU 433.A N LYS 430.A O no hydrogen 3.140 N/A TYR 436.A N GLU 433.A O no hydrogen 3.133 N/A HIS 441.A N MET 603.A O no hydrogen 3.377 N/A GLU 444.A N GLU 444.A OE1 no hydrogen 2.440 N/A VAL 445.A N HIS 441.A O no hydrogen 3.057 N/A ALA 446.A N PRO 442.A O no hydrogen 2.747 N/A ASP 447.A N GLU 443.A O no hydrogen 3.063 N/A LEU 448.A N GLU 444.A O no hydrogen 3.236 N/A VAL 449.A N VAL 445.A O no hydrogen 2.785 N/A GLY 450.A N ALA 446.A O no hydrogen 2.683 N/A ILE 451.A N ASP 447.A O no hydrogen 2.947 N/A SER 452.A N LEU 448.A O no hydrogen 2.982 N/A SER 452.A OG LEU 448.A O no hydrogen 2.726 N/A ALA 453.A N VAL 449.A O no hydrogen 2.935 N/A VAL 454.A N GLY 450.A O no hydrogen 3.208 N/A MET 455.A N ILE 451.A O no hydrogen 2.995 N/A ILE 456.A N SER 452.A O no hydrogen 2.957 N/A GLN 457.A N ALA 453.A O no hydrogen 3.104 N/A ASP 458.A N VAL 454.A O no hydrogen 3.051 N/A MET 459.A N MET 455.A O no hydrogen 2.985 N/A MET 459.A N ILE 456.A O no hydrogen 2.979 N/A ARG 463.A N GLU 542.A OE1 no hydrogen 3.006 N/A ARG 463.A NE HIS 541.A O no hydrogen 2.564 N/A ARG 463.A NH1 ASN 397.A O no hydrogen 2.495 N/A ARG 463.A NH2 THR 540.A O no hydrogen 3.442 N/A ASN 465.A N LYS 462.A O no hydrogen 3.255 N/A TYR 467.A N MET 400.A O no hydrogen 3.353 N/A TYR 467.A OH ASP 458.A OD2 no hydrogen 2.443 N/A PHE 469.A N GLN 402.A O no hydrogen 2.919 N/A LYS 470.A N GLN 457.A OE1 no hydrogen 3.365 N/A LYS 470.A NZ GLU 472.A OE2 no hydrogen 2.983 N/A MET 474.A N LYS 470.A O no hydrogen 2.901 N/A LEU 475.A N TRP 471.A O no hydrogen 3.185 N/A GLU 478.A N SER 476.A OG no hydrogen 2.746 N/A THR 481.A N GLY 479.A O no hydrogen 2.901 N/A THR 481.A OG1 SER 476.A O no hydrogen 2.488 N/A TYR 484.A N THR 481.A OG1 no hydrogen 3.236 N/A LEU 485.A N THR 481.A O no hydrogen 3.286 N/A GLN 486.A N GLY 482.A O no hydrogen 3.139 N/A GLN 486.A NE2 SER 452.A OG no hydrogen 2.779 N/A GLN 486.A NE2 THR 598.A O no hydrogen 2.877 N/A TYR 487.A N PRO 483.A O no hydrogen 3.007 N/A ALA 488.A N TYR 484.A O no hydrogen 3.101 N/A HIS 489.A N LEU 485.A O no hydrogen 2.821 N/A SER 490.A N GLN 486.A O no hydrogen 2.917 N/A SER 490.A OG GLN 486.A O no hydrogen 3.162 N/A ARG 491.A N TYR 487.A O no hydrogen 2.915 N/A LEU 492.A N ALA 488.A O no hydrogen 2.891 N/A ARG 493.A N HIS 489.A O no hydrogen 2.663 N/A SER 494.A N SER 490.A O no hydrogen 2.877 N/A SER 494.A OG ARG 491.A O no hydrogen 2.930 N/A VAL 495.A N ARG 491.A O no hydrogen 2.943 N/A GLU 496.A N LEU 492.A O no hydrogen 3.230 N/A GLU 496.A N ARG 493.A O no hydrogen 3.089 N/A ARG 497.A N SER 494.A O no hydrogen 2.852 N/A ARG 497.A NE VAL 495.A O no hydrogen 2.980 N/A THR 503.A N SER 500.A O no hydrogen 2.977 N/A GLN 504.A N SER 500.A O no hydrogen 3.015 N/A GLN 504.A NE2 LEU 124.A O no hydrogen 3.257 N/A LYS 506.A N ILE 502.A O no hydrogen 3.296 N/A LYS 506.A N THR 503.A O no hydrogen 2.865 N/A TRP 507.A N THR 503.A O no hydrogen 3.088 N/A ILE 508.A N GLN 504.A O no hydrogen 3.359 N/A ASN 509.A N LYS 506.A O no hydrogen 3.199 N/A ASN 509.A ND2 GLU 505.A O no hydrogen 3.147 N/A ALA 510.A N TRP 507.A O no hydrogen 3.045 N/A PHE 512.A N ALA 510.A O no hydrogen 3.054 N/A SER 513.A N ASP 511.A OD1 no hydrogen 3.203 N/A SER 513.A OG ASP 511.A OD1 no hydrogen 2.433 N/A SER 513.A OG ASP 511.A OD2 no hydrogen 3.123 N/A LEU 514.A N ASP 511.A O no hydrogen 2.915 N/A LEU 515.A N PHE 512.A O no hydrogen 2.865 N/A GLU 517.A N GLU 517.A OE1 no hydrogen 2.570 N/A ALA 520.A N GLU 517.A O no hydrogen 2.803 N/A LYS 521.A N GLU 517.A O no hydrogen 2.958 N/A LYS 521.A NZ LYS 516.A O no hydrogen 2.900 N/A LEU 522.A N PRO 518.A O no hydrogen 2.921 N/A LEU 523.A N ALA 519.A O no hydrogen 3.436 N/A ILE 524.A N ALA 520.A O no hydrogen 2.990 N/A ARG 525.A N LYS 521.A O no hydrogen 2.940 N/A ARG 525.A NH1 MET 60.A O no hydrogen 3.555 N/A ARG 525.A NH1 GLY 63.A O no hydrogen 3.550 N/A ARG 525.A NH1 ASP 64.A OD1 no hydrogen 3.024 N/A ARG 525.A NH1 ASP 64.A OD2 no hydrogen 3.048 N/A ARG 525.A NH2 MET 60.A O no hydrogen 2.968 N/A LEU 526.A N LEU 522.A O no hydrogen 2.960 N/A LEU 527.A N LEU 523.A O no hydrogen 2.643 N/A GLY 528.A N ILE 524.A O no hydrogen 3.077 N/A GLN 529.A N LEU 526.A O no hydrogen 2.986 N/A TYR 530.A N LEU 527.A O no hydrogen 3.451 N/A VAL 533.A N GLN 529.A O no hydrogen 2.920 N/A LEU 534.A N TYR 530.A O no hydrogen 3.135 N/A ARG 535.A N PRO 531.A O no hydrogen 3.074 N/A ARG 535.A NE ASP 532.A OD1 no hydrogen 3.109 N/A ASN 536.A N ASP 532.A O no hydrogen 2.916 N/A ALA 537.A N VAL 533.A O no hydrogen 2.960 N/A ILE 538.A N LEU 534.A O no hydrogen 3.194 N/A LYS 539.A N ASN 536.A O no hydrogen 3.074 N/A THR 540.A N ALA 537.A O no hydrogen 3.142 N/A THR 540.A OG1 ALA 537.A O no hydrogen 3.363 N/A HIS 541.A N ALA 537.A O no hydrogen 2.434 N/A HIS 541.A NE2 TYR 172.A OH no hydrogen 2.753 N/A GLU 542.A N THR 540.A OG1 no hydrogen 3.258 N/A THR 544.A OG1 MET 459.A O no hydrogen 3.441 N/A THR 544.A OG1 GLN 460.A O no hydrogen 3.100 N/A VAL 546.A N PRO 543.A O no hydrogen 2.796 N/A VAL 547.A N PRO 543.A O no hydrogen 2.954 N/A THR 548.A N THR 544.A O no hydrogen 2.590 N/A THR 548.A OG1 THR 544.A O no hydrogen 3.390 N/A TYR 549.A N THR 545.A O no hydrogen 3.008 N/A TYR 549.A OH LEU 526.A O no hydrogen 2.641 N/A LEU 550.A N VAL 546.A O no hydrogen 2.873 N/A PHE 551.A N VAL 547.A O no hydrogen 3.217 N/A LYS 552.A N THR 548.A O no hydrogen 3.162 N/A LEU 553.A N TYR 549.A O no hydrogen 3.002 N/A THR 554.A N LEU 550.A O no hydrogen 3.040 N/A THR 554.A OG1 LEU 550.A O no hydrogen 3.481 N/A THR 554.A OG1 PHE 551.A O no hydrogen 2.966 N/A HIS 555.A N PHE 551.A O no hydrogen 3.010 N/A HIS 555.A NE2 ASP 480.A OD1 no hydrogen 2.864 N/A GLN 556.A N LYS 552.A O no hydrogen 3.001 N/A GLN 556.A NE2 ALA 519.A O no hydrogen 3.527 N/A VAL 557.A N LEU 553.A O no hydrogen 2.931 N/A SER 558.A N THR 554.A O no hydrogen 2.903 N/A SER 559.A N HIS 555.A O no hydrogen 3.011 N/A SER 559.A OG HIS 555.A O no hydrogen 3.239 N/A CYS 560.A N GLN 556.A O no hydrogen 2.883 N/A CYS 560.A SG ALA 519.A O no hydrogen 3.296 N/A CYS 560.A SG GLN 556.A O no hydrogen 3.434 N/A TYR 561.A N VAL 557.A O no hydrogen 2.988 N/A TYR 561.A N SER 558.A O no hydrogen 3.156 N/A VAL 563.A N CYS 560.A O no hydrogen 3.034 N/A LEU 564.A N CYS 560.A O no hydrogen 2.625 N/A TRP 565.A NE1 ASP 562.A O no hydrogen 2.718 N/A GLN 569.A NE2 ALA 567.A O no hydrogen 3.034 N/A THR 570.A OG1 GLU 572.A OE1 no hydrogen 3.273 N/A LEU 573.A N THR 570.A OG1 no hydrogen 3.268 N/A ALA 574.A N THR 570.A O no hydrogen 3.169 N/A THR 575.A N GLU 571.A O no hydrogen 2.891 N/A THR 575.A OG1 GLU 571.A O no hydrogen 2.879 N/A ALA 576.A N GLU 572.A O no hydrogen 3.242 N/A ARG 577.A N LEU 573.A O no hydrogen 3.074 N/A ARG 577.A NH1 TRP 565.A O no hydrogen 2.563 N/A ARG 577.A NH2 GLU 517.A OE2 no hydrogen 2.693 N/A LEU 578.A N ALA 574.A O no hydrogen 2.859 N/A ALA 579.A N THR 575.A O no hydrogen 2.998 N/A LEU 580.A N ALA 576.A O no hydrogen 3.379 N/A TYR 581.A N ARG 577.A O no hydrogen 2.881 N/A TYR 581.A OH LEU 564.A O no hydrogen 2.842 N/A GLY 582.A N LEU 578.A O no hydrogen 2.764 N/A ALA 583.A N ALA 579.A O no hydrogen 2.912 N/A ALA 584.A N LEU 580.A O no hydrogen 2.801 N/A ARG 585.A N TYR 581.A O no hydrogen 2.727 N/A ARG 585.A NE GLU 496.A OE2 no hydrogen 3.038 N/A ARG 585.A NH1 HIS 489.A NE2 no hydrogen 3.227 N/A GLN 586.A N GLY 582.A O no hydrogen 2.911 N/A GLN 586.A NE2 GLN 586.A O no hydrogen 3.330 N/A GLN 586.A NE2 ASN 590.A OD1 no hydrogen 2.769 N/A VAL 587.A N ALA 583.A O no hydrogen 3.033 N/A LEU 588.A N ALA 584.A O no hydrogen 3.035 N/A TYR 589.A N ARG 585.A O no hydrogen 2.806 N/A ASN 590.A N GLN 586.A O no hydrogen 2.901 N/A ASN 590.A ND2 LYS 127.A O no hydrogen 3.015 N/A GLY 591.A N VAL 587.A O no hydrogen 2.847 N/A MET 592.A N LEU 588.A O no hydrogen 2.994 N/A ARG 593.A N TYR 589.A O no hydrogen 3.034 N/A LEU 594.A N ASN 590.A O no hydrogen 2.929 N/A LEU 595.A N GLY 591.A O no hydrogen 3.136 N/A GLY 596.A N ARG 593.A O no hydrogen 2.748 N/A LEU 597.A N MET 592.A O no hydrogen 2.897 N/A VAL 600.A N GLN 486.A OE1 no hydrogen 2.947 N/A