Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 2io7_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ALA 1.A N HIS 129.A O no hydrogen 3.379 N/A GLY 4.A N SER 18.A O no hydrogen 3.032 N/A LEU 7.A N ILE 16.A O no hydrogen 3.073 N/A ALA 10.A N VAL 14.A O no hydrogen 2.593 N/A GLY 13.A N ALA 10.A O no hydrogen 3.032 N/A VAL 14.A N ALA 10.A O no hydrogen 3.362 N/A ILE 16.A N GLY 8.A O no hydrogen 2.550 N/A TYR 17.A N GLN 125.A OE1 no hydrogen 2.918 N/A SER 18.A N THR 5.A O no hydrogen 2.954 N/A SER 18.A OG ALA 1.A O no hydrogen 3.262 N/A SER 18.A OG PRO 2.A O no hydrogen 3.338 N/A TYR 21.A OH LYS 33.A O no hydrogen 2.785 N/A TYR 21.A OH GLN 35.A OE1 no hydrogen 2.330 N/A SER 23.A OG GLU 38.A OE1 no hydrogen 3.214 N/A ILE 25.A N GLU 28.A O no hydrogen 3.004 N/A GLU 28.A N ILE 25.A O no hydrogen 3.324 N/A MET 30.A N SER 23.A O no hydrogen 2.871 N/A GLY 31.A N SER 23.A O no hydrogen 3.349 N/A TRP 34.A N SER 19.A OG no hydrogen 2.967 N/A GLN 35.A N HIS 32.A O no hydrogen 2.804 N/A GLN 35.A NE2 ASN 126.A OD1 no hydrogen 3.231 N/A PHE 39.A N GLN 35.A O no hydrogen 3.334 N/A ALA 40.A N CYS 36.A O no hydrogen 3.136 N/A ARG 41.A N VAL 37.A O no hydrogen 2.881 N/A ARG 41.A NE PHE 52.A O no hydrogen 2.897 N/A ARG 41.A NH1 MET 30.A O no hydrogen 2.481 N/A ARG 41.A NH2 PHE 52.A O no hydrogen 2.860 N/A ARG 41.A NH2 THR 53.A O no hydrogen 2.817 N/A ARG 42.A N GLU 38.A O no hydrogen 3.196 N/A ARG 42.A NE GLU 38.A OE1 no hydrogen 2.777 N/A ARG 42.A NH1 ALA 15.A O no hydrogen 3.021 N/A ARG 42.A NH2 ALA 15.A O no hydrogen 3.185 N/A ARG 42.A NH2 GLU 38.A OE1 no hydrogen 3.548 N/A ARG 42.A NH2 GLU 38.A OE2 no hydrogen 3.144 N/A PHE 43.A N PHE 39.A O no hydrogen 2.813 N/A LEU 44.A N ALA 40.A O no hydrogen 3.425 N/A PHE 45.A N ARG 41.A O no hydrogen 3.082 N/A LEU 46.A N ARG 42.A O no hydrogen 2.977 N/A ASN 47.A N PHE 43.A O no hydrogen 2.889 N/A TYR 48.A N LEU 44.A O no hydrogen 2.567 N/A GLY 49.A N PHE 45.A O no hydrogen 2.933 N/A VAL 51.A N ARG 68.A O no hydrogen 3.062 N/A MET 57.A N GLU 60.A OE1 no hydrogen 2.382 N/A TRP 59.A N THR 106.A O no hydrogen 3.421 N/A GLU 60.A N MET 57.A O no hydrogen 2.939 N/A ILE 61.A N ALA 58.A O no hydrogen 3.174 N/A SER 63.A N GLU 60.A O no hydrogen 2.826 N/A LEU 64.A N ILE 61.A O no hydrogen 2.967 N/A ARG 65.A NH1 PHE 62.A O no hydrogen 3.088 N/A ARG 65.A NH1 LEU 64.A O no hydrogen 3.013 N/A ARG 65.A NH2 PRO 177.A O no hydrogen 3.373 N/A LEU 67.A N LEU 76.A O no hydrogen 2.661 N/A ARG 68.A N VAL 51.A O no hydrogen 2.876 N/A ARG 68.A NE ASP 73.A OD1 no hydrogen 2.921 N/A ARG 68.A NH1 GLU 28.A OE2 no hydrogen 2.992 N/A ARG 68.A NH2 GLU 28.A OE1 no hydrogen 2.394 N/A ARG 68.A NH2 ASP 73.A OD1 no hydrogen 3.100 N/A GLU 69.A N ASN 74.A O no hydrogen 2.814 N/A VAL 70.A N GLY 49.A O no hydrogen 3.005 N/A ASN 72.A N GLU 69.A O no hydrogen 3.387 N/A ASP 73.A N VAL 70.A O no hydrogen 3.470 N/A ASN 74.A N GLU 69.A O no hydrogen 3.299 N/A ASN 74.A ND2 GLU 69.A OE2 no hydrogen 3.259 N/A LEU 76.A N LEU 67.A O no hydrogen 2.797 N/A GLN 79.A N ILE 167.A O no hydrogen 3.135 N/A GLN 79.A NE2 THR 169.A O no hydrogen 3.224 N/A PHE 81.A N TRP 165.A O no hydrogen 2.963 N/A ASN 83.A N LEU 163.A O no hydrogen 3.082 N/A ASN 83.A ND2 LEU 153.A O no hydrogen 3.208 N/A SER 85.A N PRO 82.A O no hydrogen 3.235 N/A SER 85.A OG TYR 174.A O no hydrogen 3.510 N/A ARG 87.A N SER 85.A OG no hydrogen 3.312 N/A VAL 90.A N ALA 88.A O no hydrogen 2.866 N/A GLY 92.A N ILE 112.A O no hydrogen 2.618 N/A ALA 93.A N VAL 90.A O no hydrogen 3.382 N/A LEU 94.A N MET 166.A O no hydrogen 3.235 N/A LEU 95.A N ALA 110.A O no hydrogen 2.764 N/A ILE 96.A N GLY 164.A O no hydrogen 2.892 N/A TRP 97.A N HIS 108.A O no hydrogen 2.537 N/A ASP 98.A N THR 161.A O no hydrogen 2.950 N/A GLY 100.A N PHE 103.A O no hydrogen 2.898 N/A GLU 102.A N ASP 159.A OD2 no hydrogen 2.910 N/A PHE 103.A N GLY 100.A O no hydrogen 3.138 N/A THR 106.A OG1 GLY 107.A O no hydrogen 2.723 N/A GLY 107.A N PHE 103.A O no hydrogen 3.390 N/A ALA 110.A N LEU 95.A O no hydrogen 2.872 N/A ILE 111.A N ALA 123.A O no hydrogen 3.016 N/A ILE 112.A N ALA 93.A O no hydrogen 3.289 N/A THR 113.A N ARG 121.A O no hydrogen 2.615 N/A GLN 114.A N ARG 121.A O no hydrogen 3.342 N/A HIS 116.A N LYS 119.A O no hydrogen 2.852 N/A ASN 118.A N HIS 116.A O no hydrogen 2.595 N/A LYS 119.A NZ GLU 141.A OE2 no hydrogen 2.739 N/A VAL 120.A N LEU 142.A O no hydrogen 2.892 N/A ARG 121.A N GLN 114.A O no hydrogen 2.840 N/A ARG 121.A NE GLU 141.A OE2 no hydrogen 2.724 N/A ARG 121.A NH1 GLN 114.A OE1 no hydrogen 2.572 N/A ARG 121.A NH2 GLU 141.A OE2 no hydrogen 2.840 N/A ILE 122.A N ARG 140.A O no hydrogen 3.028 N/A ALA 123.A N ILE 111.A O no hydrogen 2.887 N/A GLN 125.A NE2 GLN 35.A O no hydrogen 3.136 N/A GLN 125.A NE2 GLU 38.A OE2 no hydrogen 2.685 N/A LEU 132.A N LEU 7.A O no hydrogen 3.209 N/A GLN 136.A N PRO 133.A O no hydrogen 2.654 N/A THR 139.A N ILE 122.A O no hydrogen 2.786 N/A THR 139.A OG1 ILE 122.A O no hydrogen 3.287 N/A THR 139.A OG1 GLU 124.A OE1 no hydrogen 2.903 N/A ARG 140.A N ILE 122.A O no hydrogen 3.300 N/A ARG 140.A NE GLU 124.A OE1 no hydrogen 2.828 N/A ARG 140.A NH1 ASP 155.A OD1 no hydrogen 2.767 N/A ARG 140.A NH1 THR 156.A OG1 no hydrogen 2.465 N/A ARG 140.A NH2 ASP 155.A OD1 no hydrogen 3.346 N/A LEU 142.A N VAL 120.A O no hydrogen 2.768 N/A MET 144.A N ASN 118.A O no hydrogen 3.088 N/A VAL 145.A N THR 152.A O no hydrogen 2.771 N/A GLU 147.A N CYS 150.A O no hydrogen 3.236 N/A CYS 150.A N GLU 147.A O no hydrogen 3.264 N/A CYS 150.A SG GLY 84.A O no hydrogen 3.418 N/A TYR 151.A N SER 85.A O no hydrogen 2.982 N/A THR 152.A N VAL 145.A O no hydrogen 3.055 N/A LEU 153.A N ASN 83.A OD1 no hydrogen 2.950 N/A LYS 154.A N GLU 143.A O no hydrogen 2.995 N/A THR 160.A OG1 ASP 155.A OD2 no hydrogen 2.555 N/A GLY 164.A N ILE 96.A O no hydrogen 3.379 N/A TRP 165.A N PHE 81.A O no hydrogen 3.246 N/A TRP 165.A NE1 ARG 87.A O no hydrogen 3.190 N/A MET 166.A N LEU 94.A O no hydrogen 2.828 N/A ILE 167.A N GLN 79.A O no hydrogen 3.085 N/A GLN 168.A NE2 PRO 77.A O no hydrogen 3.206 N/A ASP 171.A N THR 169.A OG1 no hydrogen 3.191 N/A GLU 173.A N ASP 171.A OD2 no hydrogen 3.005 N/A SER 175.A N THR 172.A O no hydrogen 3.137 N/A SER 175.A OG THR 172.A O no hydrogen 2.518 N/A LEU 176.A N ALA 80.A O no hydrogen 2.755 N/A LEU 185.A N ALA 182.A O no hydrogen 2.653 N/A LEU 186.A N GLY 183.A O no hydrogen 3.085 N/A LYS 187.A NZ GLU 184.A OE1 no hydrogen 3.096 N/A SER 189.A N THR 231.A O no hydrogen 2.962 N/A ALA 191.A N TYR 229.A O no hydrogen 2.781 N/A ARG 192.A NH1 ASP 225.A OD2 no hydrogen 3.058 N/A ARG 192.A NH2 ASP 225.A OD2 no hydrogen 2.573 N/A LEU 193.A N TYR 227.A O no hydrogen 2.720 N/A LYS 196.A N GLN 198.A OE1 no hydrogen 2.820 N/A GLY 197.A N ASN 195.A OD1 no hydrogen 3.200 N/A GLN 198.A N GLN 198.A OE1 no hydrogen 2.524 N/A GLN 198.A NE2 GLU 194.A O no hydrogen 2.867 N/A PHE 199.A N TYR 227.A OH no hydrogen 2.724 N/A LYS 202.A NZ GLU 206.A OE2 no hydrogen 2.459 N/A LEU 204.A N GLN 220.A OE1 no hydrogen 2.636 N/A LYS 207.A N ASP 205.A OD2 no hydrogen 2.710 N/A ASP 208.A N ASP 205.A O no hydrogen 3.296 N/A LEU 210.A N ASP 208.A OD2 no hydrogen 3.162 N/A GLN 211.A NE2 ASP 208.A OD1 no hydrogen 3.203 N/A ASN 212.A N ASP 208.A O no hydrogen 2.938 N/A ALA 213.A N PRO 209.A O no hydrogen 2.808 N/A TYR 214.A N LEU 210.A O no hydrogen 2.967 N/A TYR 214.A OH VAL 221.A O no hydrogen 2.870 N/A VAL 215.A N GLN 211.A O no hydrogen 2.883 N/A GLN 216.A N ASN 212.A O no hydrogen 2.816 N/A ALA 217.A N TYR 214.A O no hydrogen 3.143 N/A ASN 218.A N TYR 214.A O no hydrogen 2.764 N/A GLY 219.A N VAL 215.A O no hydrogen 2.633 N/A GLN 220.A NE2 LEU 204.A O no hydrogen 3.312 N/A VAL 221.A N GLY 219.A O no hydrogen 2.719 N/A TYR 227.A OH ASP 200.A OD1 no hydrogen 3.229 N/A HIS 228.A N ASP 225.A O no hydrogen 2.838 N/A HIS 228.A NE2 ASP 549.A OD2 no hydrogen 2.690 N/A TYR 229.A N ALA 191.A O no hydrogen 3.016 N/A TYR 230.A N PRO 585.A O no hydrogen 2.933 N/A TYR 230.A OH VAL 548.A O no hydrogen 2.643 N/A THR 231.A N SER 189.A O no hydrogen 2.869 N/A ILE 232.A N ILE 587.A O no hydrogen 3.228 N/A THR 233.A OG1 LEU 185.A O no hydrogen 3.309 N/A THR 233.A OG1 SER 235.A OG no hydrogen 2.560 N/A SER 235.A N THR 233.A OG1 no hydrogen 3.147 N/A SER 235.A OG THR 233.A OG1 no hydrogen 2.560 N/A ALA 236.A N THR 233.A OG1 no hydrogen 3.056 N/A GLU 237.A N THR 233.A O no hydrogen 3.009 N/A GLN 238.A N GLU 234.A O no hydrogen 3.054 N/A GLU 239.A N SER 235.A O no hydrogen 2.934 N/A LEU 240.A N ALA 236.A O no hydrogen 2.708 N/A ILE 241.A N GLU 237.A O no hydrogen 2.680 N/A LYS 242.A N GLN 238.A O no hydrogen 2.759 N/A LYS 242.A NZ SER 63.A O no hydrogen 2.940 N/A ALA 243.A N GLU 239.A O no hydrogen 2.799 N/A THR 244.A N LEU 240.A O no hydrogen 2.971 N/A THR 244.A OG1 LEU 240.A O no hydrogen 2.963 N/A THR 244.A OG1 THR 557.A OG1 no hydrogen 2.726 N/A ASN 245.A N ILE 241.A O no hydrogen 3.052 N/A GLU 246.A N LYS 242.A O no hydrogen 3.089 N/A LEU 247.A N ALA 243.A O no hydrogen 2.742 N/A HIS 248.A N THR 244.A O no hydrogen 2.942 N/A HIS 248.A ND1 TYR 308.A OH no hydrogen 2.698 N/A LEU 249.A N ASN 245.A O no hydrogen 3.087 N/A MET 250.A N GLU 246.A O no hydrogen 2.878 N/A TYR 251.A N LEU 247.A O no hydrogen 2.738 N/A LEU 252.A N HIS 248.A O no hydrogen 3.031 N/A HIS 253.A N LEU 249.A O no hydrogen 2.969 N/A ALA 254.A N MET 250.A O no hydrogen 2.779 N/A THR 255.A N TYR 251.A O no hydrogen 2.686 N/A THR 255.A OG1 TYR 251.A O no hydrogen 3.514 N/A ASP 256.A N LEU 252.A O no hydrogen 3.157 N/A LYS 257.A N HIS 253.A O no hydrogen 3.020 N/A VAL 258.A N ALA 254.A O no hydrogen 3.065 N/A LEU 259.A N THR 255.A O no hydrogen 2.960 N/A LYS 260.A N LYS 257.A O no hydrogen 3.440 N/A LYS 260.A NZ ASP 256.A OD1 no hydrogen 2.595 N/A LYS 260.A NZ ASP 256.A OD2 no hydrogen 2.798 N/A ASP 261.A N VAL 258.A O no hydrogen 3.267 N/A ASN 263.A N ASP 261.A OD2 no hydrogen 2.919 N/A LEU 264.A N ASP 261.A O no hydrogen 2.772 N/A LEU 265.A N ASP 261.A O no hydrogen 3.188 N/A ALA 266.A N ASP 262.A O no hydrogen 3.158 N/A LEU 267.A N LEU 264.A O no hydrogen 2.585 N/A PHE 268.A N LEU 265.A O no hydrogen 3.132 N/A LEU 274.A N PRO 271.A O no hydrogen 2.845 N/A TRP 275.A N LYS 272.A O no hydrogen 2.568 N/A TRP 275.A NE1 ILE 270.A O no hydrogen 2.923 N/A ARG 277.A NH1 LEU 452.A O no hydrogen 2.738 N/A ARG 277.A NH2 LEU 452.A O no hydrogen 3.530 N/A LEU 278.A N LEU 274.A O no hydrogen 2.875 N/A ARG 279.A N TRP 275.A O no hydrogen 3.101 N/A ARG 279.A NE LEU 259.A O no hydrogen 3.152 N/A ARG 279.A NH1 ASP 262.A OD2 no hydrogen 3.390 N/A ARG 279.A NH2 ASP 262.A OD2 no hydrogen 2.716 N/A LEU 280.A N PRO 276.A O no hydrogen 2.959 N/A SER 281.A N ARG 277.A O no hydrogen 2.768 N/A TRP 282.A N LEU 278.A O no hydrogen 3.049 N/A TRP 282.A NE1 ASP 256.A OD1 no hydrogen 2.941 N/A GLN 283.A N ARG 279.A O no hydrogen 3.249 N/A ARG 284.A N LEU 280.A O no hydrogen 3.177 N/A ARG 285.A N SER 281.A O no hydrogen 2.977 N/A ARG 285.A NH1 VAL 458.A O no hydrogen 3.253 N/A ARG 285.A NH2 VAL 458.A O no hydrogen 2.620 N/A ARG 286.A NE ASP 73.A OD2 no hydrogen 2.553 N/A ARG 286.A NH1 ARG 286.A O no hydrogen 3.476 N/A ARG 286.A NH2 ASP 73.A OD1 no hydrogen 2.726 N/A ARG 286.A NH2 ASP 73.A OD2 no hydrogen 2.895 N/A HIS 288.A N ARG 285.A O no hydrogen 3.253 N/A ILE 290.A N GLU 460.A OE1 no hydrogen 3.027 N/A ILE 290.A N GLU 460.A OE2 no hydrogen 2.574 N/A THR 291.A N GLU 460.A OE1 no hydrogen 2.884 N/A THR 291.A OG1 THR 559.A O no hydrogen 2.703 N/A GLY 292.A N THR 559.A O no hydrogen 2.812 N/A ARG 293.A N ASN 309.A O no hydrogen 3.033 N/A ARG 293.A NE SER 314.A O no hydrogen 3.333 N/A ARG 293.A NH1 ASP 295.A OD1 no hydrogen 2.925 N/A MET 294.A N THR 557.A O no hydrogen 2.910 N/A ASP 295.A N GLU 307.A O no hydrogen 3.051 N/A PHE 296.A N VAL 555.A O no hydrogen 3.038 N/A CYS 297.A N LYS 304.A O no hydrogen 2.788 N/A CYS 297.A SG CYS 544.A O no hydrogen 3.476 N/A ASP 299.A N GLY 302.A O no hydrogen 3.339 N/A ARG 301.A N ASP 299.A OD2 no hydrogen 2.737 N/A ARG 301.A NE ASP 299.A OD1 no hydrogen 2.827 N/A ARG 301.A NH2 ASP 299.A OD1 no hydrogen 2.942 N/A ARG 301.A NH2 CYS 544.A O no hydrogen 2.549 N/A GLY 302.A N ASP 299.A O no hydrogen 2.711 N/A LYS 304.A N CYS 297.A O no hydrogen 2.960 N/A LYS 304.A NZ ARG 484.A O no hydrogen 3.072 N/A LYS 304.A NZ LEU 486.A O no hydrogen 2.778 N/A VAL 305.A N TYR 485.A O no hydrogen 3.235 N/A TYR 306.A N ASP 295.A O no hydrogen 2.757 N/A TYR 306.A OH TRP 543.A O no hydrogen 2.708 N/A TYR 308.A OH HIS 248.A ND1 no hydrogen 2.698 N/A ASN 309.A N ARG 293.A O no hydrogen 2.708 N/A ASN 309.A ND2 GLU 307.A OE2 no hydrogen 2.949 N/A THR 317.A OG1 TYR 371.A O no hydrogen 3.278 N/A GLU 318.A N GLU 318.A OE2 no hydrogen 2.749 N/A ALA 319.A N CYS 315.A O no hydrogen 3.091 N/A GLY 320.A N HIS 316.A O no hydrogen 2.925 N/A ILE 322.A N THR 317.A O no hydrogen 3.050 N/A LEU 323.A N GLU 318.A O no hydrogen 2.899 N/A ARG 325.A N LEU 321.A O no hydrogen 2.770 N/A ARG 325.A NE TRP 203.A O no hydrogen 2.687 N/A TRP 326.A N ILE 322.A O no hydrogen 2.798 N/A TRP 326.A NE1 PRO 226.A O no hydrogen 2.777 N/A ALA 327.A N LEU 323.A O no hydrogen 2.916 N/A GLU 328.A N GLU 324.A O no hydrogen 2.914 N/A GLN 329.A N TRP 326.A O no hydrogen 3.124 N/A GLY 330.A N TRP 326.A O no hydrogen 2.681 N/A TYR 331.A N ALA 327.A O no hydrogen 2.827 N/A GLY 335.A N TYR 331.A OH no hydrogen 2.991 N/A ASN 337.A ND2 ALA 319.A O no hydrogen 3.231 N/A ASN 337.A ND2 GLU 324.A OE1 no hydrogen 2.693 N/A ALA 339.A N ASN 337.A OD1 no hydrogen 3.207 N/A GLU 340.A N ASN 337.A O no hydrogen 3.155 N/A LEU 342.A N ALA 339.A O no hydrogen 3.083 N/A GLU 345.A N GLY 341.A O no hydrogen 2.820 N/A LEU 346.A N LEU 342.A O no hydrogen 2.690 N/A ALA 347.A N ILE 343.A O no hydrogen 3.051 N/A GLY 348.A N ASN 344.A O no hydrogen 3.097 N/A ALA 349.A N GLU 345.A O no hydrogen 3.043 N/A TRP 350.A N LEU 346.A O no hydrogen 3.153 N/A LYS 351.A N ALA 347.A O no hydrogen 2.755 N/A LYS 351.A NZ ALA 383.A O no hydrogen 2.709 N/A HIS 352.A N GLY 348.A O no hydrogen 3.107 N/A SER 353.A N TRP 350.A O no hydrogen 2.774 N/A SER 353.A OG TRP 350.A O no hydrogen 2.620 N/A VAL 359.A N GLU 386.A O no hydrogen 2.701 N/A HIS 360.A N CYS 414.A O no hydrogen 3.138 N/A HIS 360.A NE2 ASP 406.A OD1 no hydrogen 2.754 N/A ILE 361.A N ARG 388.A O no hydrogen 3.030 N/A MET 362.A N TRP 416.A O no hydrogen 2.827 N/A GLN 363.A N LEU 390.A O no hydrogen 2.821 N/A GLN 363.A NE2 ASP 364.A O no hydrogen 3.176 N/A GLN 363.A NE2 ASN 370.A OD1 no hydrogen 2.539 N/A ASP 364.A N GLU 369.A OE1 no hydrogen 2.855 N/A ASP 366.A N ASP 364.A O no hydrogen 2.784 N/A GLU 369.A N ASP 366.A O no hydrogen 2.789 N/A TYR 371.A OH GLU 318.A OE1 no hydrogen 3.003 N/A HIS 372.A N GLU 369.A O no hydrogen 2.940 N/A ALA 373.A N GLU 369.A O no hydrogen 2.938 N/A GLN 374.A N ASN 370.A O no hydrogen 2.940 N/A PHE 375.A N TYR 371.A O no hydrogen 2.904 N/A MET 376.A N HIS 372.A O no hydrogen 3.449 N/A GLU 377.A N ALA 373.A O no hydrogen 2.720 N/A GLN 378.A N GLN 374.A O no hydrogen 3.003 N/A GLN 378.A N PHE 375.A O no hydrogen 3.142 N/A LEU 380.A N MET 376.A O no hydrogen 3.161 N/A HIS 381.A N GLU 377.A O no hydrogen 2.812 N/A GLN 382.A N GLN 378.A O no hydrogen 2.783 N/A ALA 383.A N ALA 379.A O no hydrogen 2.839 N/A GLY 384.A N HIS 381.A O no hydrogen 3.061 N/A PHE 385.A N LEU 380.A O no hydrogen 2.947 N/A GLU 386.A N PRO 357.A O no hydrogen 3.080 N/A THR 387.A OG1 GLU 377.A OE1 no hydrogen 2.946 N/A THR 387.A OG1 HIS 381.A NE2 no hydrogen 2.449 N/A LEU 390.A N ILE 361.A O no hydrogen 2.612 N/A ARG 391.A NH1 ASN 370.A OD1 no hydrogen 2.570 N/A GLY 392.A N GLN 363.A O no hydrogen 2.970 N/A LEU 396.A N LEU 393.A O no hydrogen 3.070 N/A GLY 397.A N ILE 405.A O no hydrogen 3.141 N/A ASP 399.A N GLN 403.A O no hydrogen 2.988 N/A ILE 405.A N GLY 397.A O no hydrogen 2.929 N/A ASP 406.A N ARG 410.A O no hydrogen 2.731 N/A GLY 407.A N GLU 395.A OE1 no hydrogen 2.824 N/A GLY 409.A N ASP 406.A O no hydrogen 2.868 N/A VAL 412.A N LEU 404.A O no hydrogen 3.055 N/A CYS 414.A SG LEU 457.A O no hydrogen 3.563 N/A VAL 415.A N LEU 457.A O no hydrogen 2.846 N/A TRP 416.A N HIS 360.A O no hydrogen 2.962 N/A LYS 417.A N PHE 459.A O no hydrogen 3.071 N/A LYS 417.A NZ ASP 311.A OD1 no hydrogen 2.433 N/A LYS 417.A NZ TRP 419.A O no hydrogen 3.112 N/A THR 418.A N MET 362.A O no hydrogen 2.920 N/A TRP 421.A N ASP 311.A OD2 no hydrogen 2.809 N/A TRP 421.A NE1 GLU 460.A O no hydrogen 3.201 N/A THR 423.A N ALA 420.A O no hydrogen 2.891 N/A PHE 425.A N TRP 421.A O no hydrogen 2.853 N/A ASP 426.A N GLU 422.A O no hydrogen 2.779 N/A GLN 427.A N ALA 424.A O no hydrogen 3.077 N/A ILE 428.A N PHE 425.A O no hydrogen 2.957 N/A ARG 429.A N PHE 425.A O no hydrogen 3.314 N/A ARG 429.A N ASP 426.A O no hydrogen 3.050 N/A ARG 429.A NE ASP 426.A OD1 no hydrogen 3.378 N/A ARG 429.A NH1 ASP 269.A O no hydrogen 2.784 N/A ARG 429.A NH2 ASP 269.A O no hydrogen 3.503 N/A ARG 429.A NH2 GLU 422.A OE2 no hydrogen 2.717 N/A ILE 436.A N VAL 434.A O no hydrogen 3.079 N/A ARG 437.A N ASP 449.A OD2 no hydrogen 2.439 N/A ARG 437.A NH2 GLU 444.A O no hydrogen 3.182 N/A ARG 437.A NH2 GLU 444.A OE2 no hydrogen 3.126 N/A ASN 443.A N HIS 440.A O no hydrogen 2.662 N/A GLU 444.A N HIS 440.A ND1 no hydrogen 3.349 N/A ARG 446.A N ASP 449.A OD1 no hydrogen 2.985 N/A ARG 446.A NE ASP 449.A OD1 no hydrogen 2.694 N/A ARG 446.A NH2 PRO 435.A O no hydrogen 3.294 N/A ARG 446.A NH2 ASP 449.A OD1 no hydrogen 3.252 N/A ARG 446.A NH2 ASP 449.A OD2 no hydrogen 2.497 N/A ILE 448.A N GLN 427.A OE1 no hydrogen 2.718 N/A ASP 449.A N ARG 446.A O no hydrogen 3.107 N/A VAL 450.A N LEU 447.A O no hydrogen 2.863 N/A LEU 451.A N LEU 447.A O no hydrogen 3.256 N/A LEU 452.A N ILE 448.A O no hydrogen 3.238 N/A ARG 453.A N VAL 450.A O no hydrogen 3.183 N/A ARG 453.A NH2 GLY 402.A O no hydrogen 2.505 N/A VAL 456.A N ARG 453.A O no hydrogen 3.145 N/A LEU 457.A N ASN 413.A O no hydrogen 2.680 N/A PHE 459.A N VAL 415.A O no hydrogen 2.818 N/A TRP 463.A N SER 281.A OG no hydrogen 2.951 N/A TRP 463.A NE1 ARG 285.A O no hydrogen 2.660 N/A THR 464.A N PRO 461.A O no hydrogen 3.079 N/A THR 464.A OG1 ALA 310.A O no hydrogen 3.536 N/A THR 464.A OG1 PRO 461.A O no hydrogen 3.139 N/A VAL 465.A N LEU 462.A O no hydrogen 2.930 N/A ILE 466.A N TRP 463.A O no hydrogen 2.832 N/A GLY 468.A N THR 464.A O no hydrogen 3.165 N/A ASN 469.A N ILE 466.A O no hydrogen 2.940 N/A LYS 470.A N ILE 507.A O no hydrogen 2.790 N/A LYS 470.A NZ GLU 307.A OE1 no hydrogen 2.994 N/A ILE 472.A N ASN 469.A O no hydrogen 3.296 N/A LEU 473.A N LYS 470.A O no hydrogen 3.098 N/A LEU 476.A N ILE 472.A O no hydrogen 2.796 N/A TRP 477.A N LEU 473.A O no hydrogen 2.875 N/A SER 478.A N PRO 474.A O no hydrogen 2.766 N/A LEU 479.A N ILE 475.A O no hydrogen 2.912 N/A PHE 480.A N LEU 476.A O no hydrogen 2.984 N/A HIS 483.A N PHE 480.A O no hydrogen 3.074 N/A HIS 483.A NE2 GLU 246.A OE2 no hydrogen 2.968 N/A ARG 484.A NH1 GLU 246.A OE2 no hydrogen 3.149 N/A ARG 484.A NH2 GLU 246.A OE1 no hydrogen 2.693 N/A ARG 484.A NH2 GLU 246.A OE2 no hydrogen 2.864 N/A TYR 485.A N HIS 483.A ND1 no hydrogen 2.744 N/A TYR 485.A OH GLU 239.A OE2 no hydrogen 2.625 N/A LEU 486.A N HIS 483.A O no hydrogen 3.153 N/A ASP 488.A N GLN 541.A OE1 no hydrogen 3.372 N/A THR 489.A OG1 LEU 487.A O no hydrogen 2.737 N/A ASP 490.A N TYR 539.A O no hydrogen 2.969 N/A PHE 491.A N ASP 490.A OD1 no hydrogen 2.662 N/A ASN 494.A ND2 ASP 490.A OD2 no hydrogen 2.564 N/A LEU 497.A N ASN 494.A OD1 no hydrogen 2.820 N/A VAL 498.A N ASN 494.A O no hydrogen 3.040 N/A VAL 498.A N ASP 495.A O no hydrogen 2.825 N/A LYS 499.A N ASP 495.A O no hydrogen 3.216 N/A THR 500.A N GLU 496.A O no hydrogen 3.242 N/A THR 500.A OG1 LEU 497.A O no hydrogen 3.556 N/A THR 500.A OG1 GLY 501.A O no hydrogen 2.881 N/A GLY 501.A N LEU 497.A O no hydrogen 3.012 N/A TYR 502.A N VAL 518.A O no hydrogen 2.828 N/A ALA 503.A N GLN 540.A O no hydrogen 2.584 N/A VAL 504.A N ASP 516.A O no hydrogen 2.737 N/A LYS 505.A N ILE 538.A O no hydrogen 3.098 N/A LYS 505.A NZ GLN 540.A OE1 no hydrogen 3.268 N/A ILE 507.A N LYS 536.A O no hydrogen 2.822 N/A ARG 510.A NH2 SER 312.A O no hydrogen 3.141 N/A ARG 510.A NH2 SER 312.A OG no hydrogen 2.364 N/A SER 513.A N ARG 510.A O no hydrogen 3.226 N/A SER 513.A OG ARG 510.A O no hydrogen 3.536 N/A ASN 514.A N SER 529.A O no hydrogen 2.746 N/A ILE 515.A N THR 528.A OG1 no hydrogen 2.792 N/A ASP 516.A N VAL 504.A O no hydrogen 3.110 N/A LEU 517.A N ASP 526.A O no hydrogen 2.917 N/A VAL 518.A N TYR 502.A O no hydrogen 2.977 N/A SER 519.A N GLU 523.A O no hydrogen 2.770 N/A SER 519.A OG GLU 523.A O no hydrogen 3.307 N/A HIS 520.A N HIS 520.A ND1 no hydrogen 2.710 N/A GLU 522.A N SER 519.A O no hydrogen 2.826 N/A GLU 523.A N SER 519.A OG no hydrogen 2.656 N/A LEU 525.A N GLU 523.A O no hydrogen 3.123 N/A LYS 527.A N ASP 526.A OD1 no hydrogen 3.002 N/A THR 528.A N ILE 515.A O no hydrogen 3.065 N/A THR 528.A OG1 GLY 512.A O no hydrogen 2.786 N/A THR 528.A OG1 ILE 515.A O no hydrogen 3.449 N/A PHE 532.A N ASN 514.A OD1 no hydrogen 3.205 N/A GLN 535.A N PHE 532.A O no hydrogen 3.197 N/A LYS 536.A NZ LEU 267.A O no hydrogen 3.157 N/A ILE 538.A N LYS 505.A O no hydrogen 2.827 N/A TYR 539.A N ASP 490.A O no hydrogen 2.726 N/A GLN 540.A N ALA 503.A O no hydrogen 2.863 N/A GLN 540.A NE2 TYR 306.A O no hydrogen 3.482 N/A GLN 541.A N ASP 488.A O no hydrogen 2.751 N/A LEU 542.A N GLY 501.A O no hydrogen 2.660 N/A LYS 547.A NZ GLY 550.A O no hydrogen 3.247 N/A VAL 548.A N LYS 551.A O no hydrogen 2.592 N/A LYS 551.A N VAL 548.A O no hydrogen 3.455 N/A LYS 551.A NZ GLU 584.A OE1 no hydrogen 3.105 N/A TYR 552.A N ASP 572.A O no hydrogen 3.065 N/A ILE 553.A N PRO 546.A O no hydrogen 3.143 N/A GLN 554.A N ARG 570.A O no hydrogen 2.920 N/A VAL 555.A N PHE 296.A O no hydrogen 3.185 N/A CYS 556.A N CYS 568.A O no hydrogen 2.629 N/A CYS 556.A SG ASP 295.A OD1 no hydrogen 3.057 N/A CYS 556.A SG GLN 554.A OE1 no hydrogen 3.946 N/A THR 557.A N MET 294.A O no hydrogen 3.244 N/A THR 557.A OG1 THR 244.A OG1 no hydrogen 2.726 N/A PHE 558.A N GLY 566.A O no hydrogen 2.823 N/A THR 559.A N GLY 292.A O no hydrogen 2.697 N/A THR 559.A OG1 TYR 308.A OH no hydrogen 3.421 N/A VAL 560.A N ASN 563.A O no hydrogen 2.854 N/A GLY 561.A N ILE 290.A O no hydrogen 2.681 N/A ASN 563.A N VAL 560.A O no hydrogen 3.201 N/A TYR 564.A OH GLU 237.A OE1 no hydrogen 2.842 N/A TYR 564.A OH THR 567.A OG1 no hydrogen 2.979 N/A GLY 565.A N PHE 558.A O no hydrogen 2.705 N/A THR 567.A OG1 TYR 564.A OH no hydrogen 2.979 N/A CYS 568.A N CYS 556.A O no hydrogen 2.784 N/A ARG 570.A N GLN 554.A O no hydrogen 3.159 N/A GLY 571.A N ASP 582.A O no hydrogen 3.368 N/A ASP 572.A N TYR 552.A O no hydrogen 3.033 N/A SER 574.A N ASP 572.A OD1 no hydrogen 2.934 N/A SER 574.A OG ASP 572.A OD1 no hydrogen 3.036 N/A SER 574.A OG VAL 576.A O no hydrogen 3.039 N/A VAL 576.A N SER 574.A OG no hydrogen 3.248 N/A LYS 578.A N SER 581.A OG no hydrogen 2.876 N/A LYS 578.A NZ SER 574.A OG no hydrogen 2.649 N/A LYS 578.A NZ VAL 576.A O no hydrogen 2.893 N/A LYS 579.A N CYS 511.A O no hydrogen 3.367 N/A LYS 579.A NZ GLU 368.A OE2 no hydrogen 3.297 N/A SER 581.A N LYS 578.A O no hydrogen 2.904 N/A SER 581.A OG ASP 572.A OD2 no hydrogen 2.596 N/A SER 581.A OG LYS 578.A O no hydrogen 3.253 N/A ILE 587.A N TYR 230.A O no hydrogen 3.116 N/A