Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 2zxr_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ARG 4.A NH1 LEU 314.A O no hydrogen 2.963 N/A ARG 4.A NH1 PRO 382.A O no hydrogen 2.803 N/A ARG 4.A NH2 THR 313.A O no hydrogen 3.158 N/A ARG 6.A N ARG 384.A O no hydrogen 2.709 N/A TRP 7.A NE1 ASP 484.A OD2 no hydrogen 3.192 N/A ARG 8.A N VAL 386.A O no hydrogen 2.998 N/A ARG 8.A NE GLU 385.A OE1 no hydrogen 3.342 N/A VAL 9.A N GLU 492.A O no hydrogen 2.858 N/A LEU 10.A N LEU 388.A O no hydrogen 2.832 N/A LEU 12.A N GLU 606.A OE2 no hydrogen 2.874 N/A TRP 18.A N PRO 14.A O no hydrogen 2.867 N/A TRP 18.A NE1 PRO 29.A O no hydrogen 2.983 N/A ARG 19.A N LEU 15.A O no hydrogen 2.845 N/A ARG 19.A NE GLU 581.A OE1 no hydrogen 2.828 N/A ARG 19.A NH2 GLU 581.A OE1 no hydrogen 3.337 N/A ARG 19.A NH2 GLU 581.A OE2 no hydrogen 2.889 N/A GLU 20.A N ALA 16.A O no hydrogen 3.075 N/A VAL 21.A N GLN 17.A O no hydrogen 2.989 N/A MET 22.A N TRP 18.A O no hydrogen 3.024 N/A ALA 23.A N ARG 19.A O no hydrogen 2.970 N/A ALA 24.A N GLU 20.A O no hydrogen 2.851 N/A LEU 25.A N VAL 21.A O no hydrogen 2.950 N/A VAL 27.A N MET 22.A O no hydrogen 3.085 N/A GLY 28.A N GLU 404.A OE1 no hydrogen 2.820 N/A ALA 32.A N GLY 28.A O no hydrogen 3.173 N/A LEU 33.A N PRO 29.A O no hydrogen 2.998 N/A ALA 34.A N GLU 30.A O no hydrogen 3.270 N/A TYR 35.A N ALA 31.A O no hydrogen 2.876 N/A TYR 35.A OH GLU 404.A O no hydrogen 2.593 N/A TRP 36.A N ALA 32.A O no hydrogen 2.820 N/A HIS 37.A N LEU 33.A O no hydrogen 3.050 N/A HIS 37.A NE2 SER 11.A O no hydrogen 3.056 N/A ARG 38.A N ALA 34.A O no hydrogen 2.927 N/A ARG 38.A NH1 PRO 416.A O no hydrogen 2.917 N/A ARG 38.A NH2 PRO 416.A O no hydrogen 2.890 N/A GLY 39.A N TRP 36.A O no hydrogen 3.230 N/A PHE 40.A N TYR 35.A O no hydrogen 2.757 N/A ARG 41.A N ASP 45.A OD2 no hydrogen 2.976 N/A ARG 41.A NH1 TRP 36.A O no hydrogen 3.392 N/A ARG 42.A N ASP 45.A OD2 no hydrogen 3.166 N/A LYS 43.A NZ GLU 26.A OE2 no hydrogen 2.517 N/A ASP 45.A N ARG 42.A O no hydrogen 2.981 N/A LEU 46.A N LYS 43.A O no hydrogen 3.164 N/A LEU 55.A N LEU 53.A O no hydrogen 3.016 N/A LYS 56.A N THR 136.A OG1 no hydrogen 3.035 N/A LEU 58.A N LEU 55.A O no hydrogen 3.200 N/A ALA 61.A N GLY 57.A O no hydrogen 2.855 N/A ALA 62.A N LEU 58.A O no hydrogen 2.994 N/A ALA 63.A N ARG 59.A O no hydrogen 2.907 N/A LEU 64.A N GLU 60.A O no hydrogen 2.971 N/A LEU 65.A N ALA 61.A O no hydrogen 3.085 N/A GLU 66.A N ALA 62.A O no hydrogen 2.887 N/A GLU 67.A N ALA 63.A O no hydrogen 3.008 N/A ALA 68.A N LEU 64.A O no hydrogen 2.948 N/A LEU 69.A N LEU 65.A O no hydrogen 2.846 N/A ARG 70.A N GLU 66.A O no hydrogen 2.957 N/A ARG 70.A NH1 GLU 67.A OE1 no hydrogen 3.109 N/A GLN 71.A N GLU 67.A O no hydrogen 2.907 N/A GLY 72.A N LEU 69.A O no hydrogen 3.240 N/A LYS 73.A N ALA 68.A O no hydrogen 2.845 N/A ARG 74.A N ASP 110.A OD2 no hydrogen 2.755 N/A ILE 75.A N ASP 102.A O no hydrogen 2.728 N/A ARG 76.A N LEU 111.A O no hydrogen 2.961 N/A VAL 77.A N HIS 104.A O no hydrogen 2.855 N/A HIS 78.A N LEU 113.A O no hydrogen 2.593 N/A HIS 78.A ND1 PHE 106.A O no hydrogen 2.732 N/A ALA 83.A N ASN 231.A OD1 no hydrogen 2.723 N/A GLY 85.A N ASP 82.A OD2 no hydrogen 3.101 N/A LEU 86.A N ASP 82.A O no hydrogen 2.892 N/A THR 87.A N ALA 83.A O no hydrogen 2.846 N/A THR 87.A OG1 ALA 83.A O no hydrogen 2.769 N/A THR 87.A OG1 ASP 84.A O no hydrogen 3.363 N/A THR 87.A OG1 LEU 171.A O no hydrogen 3.435 N/A GLY 88.A N ASP 84.A O no hydrogen 3.097 N/A THR 89.A N GLY 85.A O no hydrogen 2.886 N/A ALA 90.A N LEU 86.A O no hydrogen 2.973 N/A ILE 91.A N THR 87.A O no hydrogen 2.962 N/A LEU 92.A N GLY 88.A O no hydrogen 3.148 N/A VAL 93.A N THR 89.A O no hydrogen 2.725 N/A ARG 94.A N ALA 90.A O no hydrogen 2.917 N/A ARG 94.A NE LEU 246.A O no hydrogen 2.796 N/A ARG 94.A NH1 ASP 249.A OD2 no hydrogen 2.841 N/A ARG 94.A NH2 LEU 246.A O no hydrogen 2.981 N/A ARG 94.A NH2 THR 248.A O no hydrogen 3.013 N/A ARG 94.A NH2 ASP 249.A OD2 no hydrogen 3.287 N/A GLY 95.A N ILE 91.A O no hydrogen 2.794 N/A LEU 96.A N LEU 92.A O no hydrogen 2.898 N/A ALA 97.A N VAL 93.A O no hydrogen 2.960 N/A ALA 98.A N ARG 94.A O no hydrogen 2.833 N/A LEU 99.A N LEU 96.A O no hydrogen 2.982 N/A GLY 100.A N ALA 97.A O no hydrogen 3.135 N/A ALA 101.A N LEU 96.A O no hydrogen 3.051 N/A HIS 104.A N ILE 75.A O no hydrogen 2.950 N/A PHE 106.A N VAL 77.A O no hydrogen 2.651 N/A ASP 110.A N ARG 74.A O no hydrogen 2.741 N/A LEU 111.A N ARG 74.A O no hydrogen 3.198 N/A PHE 112.A N GLU 120.A O no hydrogen 2.884 N/A LEU 113.A N ARG 76.A O no hydrogen 2.753 N/A THR 114.A N ILE 122.A O no hydrogen 3.133 N/A THR 114.A OG1 CYS 117.A O no hydrogen 3.511 N/A VAL 115.A N HIS 78.A O no hydrogen 2.539 N/A CYS 117.A SG HIS 127.A O no hydrogen 3.106 N/A GLU 120.A N ASP 110.A O no hydrogen 2.960 N/A ILE 122.A N PHE 112.A O no hydrogen 2.982 N/A VAL 123.A N LEU 129.A O no hydrogen 2.722 N/A HIS 126.A NE2 ASP 179.A OD2 no hydrogen 2.880 N/A HIS 127.A ND1 ASP 116.A OD1 no hydrogen 3.106 N/A HIS 127.A ND1 ASP 116.A OD2 no hydrogen 2.790 N/A THR 128.A OG1 HIS 127.A O no hydrogen 2.602 N/A VAL 131.A N VAL 123.A O no hydrogen 2.889 N/A ALA 134.A N HIS 132.A ND1 no hydrogen 2.901 N/A LEU 135.A N HIS 132.A O no hydrogen 2.865 N/A THR 136.A N PRO 133.A O no hydrogen 2.598 N/A LEU 139.A N THR 136.A O no hydrogen 3.298 N/A LYS 140.A NZ ASP 138.A O no hydrogen 3.315 N/A THR 144.A OG1 ASP 84.A OD1 no hydrogen 2.840 N/A GLY 145.A N ASP 84.A OD2 no hydrogen 2.900 N/A ALA 146.A N ASP 84.A OD1 no hydrogen 2.902 N/A GLY 147.A N THR 144.A OG1 no hydrogen 3.408 N/A VAL 148.A N THR 144.A O no hydrogen 2.810 N/A ALA 149.A N GLY 145.A O no hydrogen 3.041 N/A PHE 150.A N ALA 146.A O no hydrogen 2.968 N/A LEU 151.A N GLY 147.A O no hydrogen 2.893 N/A LEU 152.A N VAL 148.A O no hydrogen 2.830 N/A LEU 153.A N ALA 149.A O no hydrogen 2.951 N/A TRP 154.A N PHE 150.A O no hydrogen 2.959 N/A ALA 155.A N LEU 151.A O no hydrogen 2.748 N/A LEU 156.A N LEU 152.A O no hydrogen 3.029 N/A HIS 157.A N LEU 153.A O no hydrogen 2.972 N/A HIS 157.A ND1 PRO 163.A O no hydrogen 2.975 N/A GLU 158.A N TRP 154.A O no hydrogen 2.903 N/A ARG 159.A N ALA 155.A O no hydrogen 3.078 N/A ARG 159.A NE GLU 66.A OE2 no hydrogen 2.454 N/A LEU 160.A N LEU 156.A O no hydrogen 2.925 N/A GLY 161.A N GLU 158.A O no hydrogen 3.049 N/A LEU 162.A N HIS 157.A O no hydrogen 2.690 N/A LEU 166.A N PRO 164.A O no hydrogen 2.797 N/A TYR 168.A N PRO 165.A O no hydrogen 3.103 N/A ALA 169.A N LEU 166.A O no hydrogen 2.979 N/A LEU 171.A N ASP 170.A OD2 no hydrogen 2.683 N/A ALA 172.A N TYR 168.A O no hydrogen 3.119 N/A ALA 173.A N ALA 169.A O no hydrogen 2.822 N/A VAL 174.A N ASP 170.A O no hydrogen 3.011 N/A GLY 175.A N LEU 171.A O no hydrogen 3.143 N/A THR 176.A N ALA 172.A O no hydrogen 2.987 N/A THR 176.A OG1 ALA 172.A O no hydrogen 2.676 N/A ILE 177.A N ALA 173.A O no hydrogen 2.914 N/A ALA 178.A N VAL 174.A O no hydrogen 2.954 N/A ASP 179.A N GLY 175.A O no hydrogen 2.883 N/A VAL 180.A N ILE 177.A O no hydrogen 2.942 N/A TRP 186.A N GLU 141.A OE2 no hydrogen 3.185 N/A TRP 186.A NE1 ALA 51.A O no hydrogen 2.637 N/A ASN 187.A ND2 LYS 142.A O no hydrogen 2.721 N/A ASN 187.A ND2 PRO 182.A O no hydrogen 3.047 N/A ARG 188.A N TRP 184.A O no hydrogen 3.398 N/A ARG 188.A NH1 LEU 46.A O no hydrogen 3.027 N/A ARG 188.A NH1 LEU 407.A O no hydrogen 3.283 N/A ARG 188.A NH2 LEU 408.A O no hydrogen 2.257 N/A ARG 188.A NH2 ASN 415.A OD1 no hydrogen 3.264 N/A ALA 189.A N GLY 185.A O no hydrogen 3.020 N/A LEU 190.A N TRP 186.A O no hydrogen 2.832 N/A VAL 191.A N ASN 187.A O no hydrogen 3.013 N/A LYS 192.A N ARG 188.A O no hydrogen 3.002 N/A LYS 192.A NZ LEU 46.A O no hydrogen 3.188 N/A LYS 192.A NZ GLU 409.A O no hydrogen 3.174 N/A GLU 193.A N ALA 189.A O no hydrogen 3.114 N/A GLY 194.A N LEU 190.A O no hydrogen 2.849 N/A LEU 195.A N VAL 191.A O no hydrogen 2.805 N/A ALA 196.A N LYS 192.A O no hydrogen 3.263 N/A ARG 197.A N GLU 193.A O no hydrogen 3.198 N/A ARG 197.A N GLY 194.A O no hydrogen 2.963 N/A ARG 197.A NH1 GLU 193.A OE2 no hydrogen 3.096 N/A ILE 198.A N GLY 194.A O no hydrogen 3.155 N/A ALA 200.A N ARG 197.A O no hydrogen 3.201 N/A SER 201.A N ILE 198.A O no hydrogen 3.034 N/A SER 201.A OG ASP 170.A OD1 no hydrogen 2.622 N/A SER 201.A OG TRP 203.A O no hydrogen 3.404 N/A SER 202.A OG GLU 167.A OE1 no hydrogen 2.839 N/A TRP 203.A N SER 201.A OG no hydrogen 2.842 N/A TRP 203.A NE1 ASP 170.A OD2 no hydrogen 2.896 N/A LEU 206.A N TRP 203.A O no hydrogen 2.961 N/A ARG 207.A N TRP 203.A O no hydrogen 3.207 N/A ARG 207.A NE GLU 211.A OE2 no hydrogen 2.952 N/A LEU 208.A N VAL 204.A O no hydrogen 2.964 N/A LEU 209.A N GLY 205.A O no hydrogen 2.905 N/A ALA 210.A N LEU 206.A O no hydrogen 2.889 N/A GLU 211.A N ARG 207.A O no hydrogen 2.901 N/A ALA 212.A N LEU 208.A O no hydrogen 2.962 N/A VAL 213.A N LEU 209.A O no hydrogen 3.257 N/A VAL 213.A N ALA 210.A O no hydrogen 3.222 N/A GLY 214.A N GLU 211.A O no hydrogen 2.859 N/A TYR 215.A N ALA 210.A O no hydrogen 3.050 N/A TYR 215.A OH LEU 195.A O no hydrogen 2.668 N/A THR 216.A N GLU 221.A OE1 no hydrogen 2.666 N/A THR 216.A OG1 GLU 221.A OE1 no hydrogen 3.192 N/A THR 216.A OG1 GLU 221.A OE2 no hydrogen 2.701 N/A LYS 218.A N GLU 221.A OE1 no hydrogen 3.045 N/A GLU 221.A N LYS 218.A O no hydrogen 3.218 N/A ALA 223.A N ALA 219.A O no hydrogen 2.982 N/A PHE 224.A N VAL 220.A O no hydrogen 3.032 N/A ARG 225.A N GLU 221.A O no hydrogen 2.749 N/A ILE 226.A N GLU 221.A O no hydrogen 3.178 N/A ALA 227.A N VAL 222.A O no hydrogen 2.833 N/A ARG 229.A N ILE 226.A O no hydrogen 3.119 N/A ARG 229.A NH1 ARG 225.A O no hydrogen 3.219 N/A ILE 230.A N ILE 226.A O no hydrogen 3.359 N/A ASN 231.A N ALA 227.A O no hydrogen 2.755 N/A ALA 232.A N PRO 228.A O no hydrogen 2.914 N/A ALA 233.A N ILE 230.A O no hydrogen 3.269 N/A SER 234.A OG ASP 80.A O no hydrogen 2.990 N/A SER 234.A OG TYR 81.A O no hydrogen 2.643 N/A ARG 235.A N ASN 231.A O no hydrogen 2.785 N/A LEU 236.A N ALA 232.A O no hydrogen 2.903 N/A GLY 237.A N SER 234.A O no hydrogen 2.989 N/A GLU 238.A N ALA 233.A O no hydrogen 2.594 N/A LYS 241.A N GLU 238.A O no hydrogen 2.973 N/A LYS 241.A NZ GLU 238.A OE2 no hydrogen 2.642 N/A LYS 241.A NZ GLU 260.A OE2 no hydrogen 2.827 N/A LEU 243.A N ALA 239.A O no hydrogen 2.890 N/A ARG 244.A N GLU 240.A O no hydrogen 2.749 N/A ARG 244.A NE GLU 253.A OE2 no hydrogen 2.641 N/A ARG 244.A NH2 GLU 253.A OE1 no hydrogen 2.670 N/A ARG 244.A NH2 GLU 253.A OE2 no hydrogen 3.152 N/A LEU 245.A N LYS 241.A O no hydrogen 3.063 N/A LEU 246.A N ALA 242.A O no hydrogen 3.218 N/A LEU 246.A N LEU 243.A O no hydrogen 2.928 N/A LEU 247.A N LEU 243.A O no hydrogen 3.127 N/A LEU 247.A N ARG 244.A O no hydrogen 3.092 N/A THR 248.A N ARG 244.A O no hydrogen 3.028 N/A THR 248.A OG1 GLU 253.A OE1 no hydrogen 2.591 N/A ASP 250.A N THR 248.A OG1 no hydrogen 3.033 N/A GLU 253.A N ASP 250.A OD1 no hydrogen 3.146 N/A ALA 254.A N ASP 250.A O no hydrogen 2.912 N/A GLN 255.A N ALA 251.A O no hydrogen 2.734 N/A ALA 256.A N ALA 252.A O no hydrogen 3.082 N/A LEU 257.A N GLU 253.A O no hydrogen 2.955 N/A VAL 258.A N ALA 254.A O no hydrogen 2.807 N/A GLY 259.A N GLN 255.A O no hydrogen 3.082 N/A GLU 260.A N ALA 256.A O no hydrogen 2.962 N/A LEU 261.A N LEU 257.A O no hydrogen 2.783 N/A HIS 262.A N VAL 258.A O no hydrogen 2.911 N/A ARG 263.A N GLY 259.A O no hydrogen 3.082 N/A LEU 264.A N GLU 260.A O no hydrogen 2.926 N/A ASN 265.A N LEU 261.A O no hydrogen 2.919 N/A ASN 265.A ND2 GLN 269.A OE1 no hydrogen 3.273 N/A ALA 266.A N HIS 262.A O no hydrogen 3.049 N/A ARG 267.A N ARG 263.A O no hydrogen 3.008 N/A ARG 268.A N LEU 264.A O no hydrogen 2.851 N/A ARG 268.A NH1 GLU 272.A OE1 no hydrogen 2.839 N/A ARG 268.A NH2 ASN 265.A OD1 no hydrogen 2.633 N/A GLN 269.A N ASN 265.A O no hydrogen 2.877 N/A THR 270.A N ALA 266.A O no hydrogen 2.969 N/A THR 270.A OG1 ALA 266.A O no hydrogen 2.695 N/A LEU 271.A N ARG 267.A O no hydrogen 2.953 N/A GLU 272.A N ARG 268.A O no hydrogen 2.880 N/A GLU 273.A N GLN 269.A O no hydrogen 2.912 N/A ALA 274.A N THR 270.A O no hydrogen 2.990 N/A MET 275.A N LEU 271.A O no hydrogen 2.823 N/A LEU 276.A N GLU 272.A O no hydrogen 2.921 N/A ARG 277.A N GLU 273.A O no hydrogen 2.867 N/A LYS 278.A N ALA 274.A O no hydrogen 3.074 N/A LYS 278.A NZ ASP 294.A OD1 no hydrogen 3.310 N/A LEU 279.A N MET 275.A O no hydrogen 2.746 N/A LEU 280.A N LEU 276.A O no hydrogen 2.798 N/A GLN 282.A N LEU 279.A O no hydrogen 2.768 N/A GLN 282.A NE2 LYS 278.A O no hydrogen 3.222 N/A LYS 288.A NZ ASP 381.A OD2 no hydrogen 3.237 N/A ILE 290.A N PRO 316.A O no hydrogen 3.043 N/A LEU 292.A N PHE 318.A O no hydrogen 2.951 N/A ASP 294.A N VAL 320.A O no hydrogen 2.880 N/A GLY 297.A N ASP 294.A O no hydrogen 2.811 N/A VAL 301.A N HIS 298.A O no hydrogen 3.070 N/A VAL 305.A N VAL 301.A O no hydrogen 3.289 N/A ALA 306.A N MET 302.A O no hydrogen 2.796 N/A SER 307.A N GLY 303.A O no hydrogen 3.114 N/A SER 307.A OG GLY 303.A O no hydrogen 3.486 N/A ARG 308.A N ILE 304.A O no hydrogen 2.867 N/A ARG 308.A NH1 GLU 272.A OE2 no hydrogen 2.701 N/A ARG 308.A NH1 GLU 273.A OE2 no hydrogen 2.977 N/A ILE 309.A N VAL 305.A O no hydrogen 2.918 N/A LEU 310.A N ALA 306.A O no hydrogen 2.859 N/A GLU 311.A N SER 307.A O no hydrogen 2.934 N/A ALA 312.A N ARG 308.A O no hydrogen 3.238 N/A ALA 312.A N ILE 309.A O no hydrogen 3.165 N/A THR 313.A N ILE 309.A O no hydrogen 2.987 N/A LEU 314.A N LEU 310.A O no hydrogen 2.503 N/A ARG 315.A NH1 ASP 381.A OD2 no hydrogen 3.061 N/A ARG 315.A NH2 GLU 286.A OE2 no hydrogen 3.404 N/A VAL 317.A N ARG 328.A O no hydrogen 2.720 N/A PHE 318.A N ILE 290.A O no hydrogen 2.837 N/A LEU 319.A N THR 326.A O no hydrogen 2.948 N/A VAL 320.A N LEU 292.A O no hydrogen 3.004 N/A ALA 321.A N LYS 324.A O no hydrogen 2.888 N/A GLN 322.A N PRO 295.A O no hydrogen 3.053 N/A GLY 323.A N GLU 362.A OE2 no hydrogen 2.838 N/A LYS 324.A N ALA 321.A O no hydrogen 2.921 N/A GLY 325.A N PHE 358.A O no hydrogen 2.700 N/A THR 326.A N LEU 319.A O no hydrogen 2.821 N/A VAL 327.A N ALA 356.A O no hydrogen 2.880 N/A ARG 328.A N VAL 317.A O no hydrogen 2.905 N/A ARG 328.A NH1 VAL 327.A O no hydrogen 2.777 N/A SER 329.A N GLU 354.A O no hydrogen 2.974 N/A SER 329.A OG LEU 330.A O no hydrogen 3.546 N/A SER 329.A OG ILE 333.A O no hydrogen 2.463 N/A ILE 333.A N LEU 330.A O no hydrogen 2.995 N/A ALA 335.A N LYS 353.A O no hydrogen 3.026 N/A VAL 336.A N HIS 352.A O no hydrogen 3.110 N/A GLU 337.A N SER 334.A OG no hydrogen 3.362 N/A ALA 338.A N SER 334.A O no hydrogen 2.977 N/A LEU 339.A N ALA 335.A O no hydrogen 3.192 N/A ARG 340.A N VAL 336.A O no hydrogen 2.930 N/A ARG 340.A NE TYR 349.A OH no hydrogen 3.026 N/A SER 341.A N GLU 337.A O no hydrogen 2.983 N/A SER 341.A OG ALA 338.A O no hydrogen 2.692 N/A ALA 342.A N LEU 339.A O no hydrogen 2.911 N/A GLU 343.A N ARG 340.A O no hydrogen 3.033 N/A LEU 345.A N ALA 342.A O no hydrogen 3.115 N/A LEU 346.A N GLU 343.A O no hydrogen 3.064 N/A LEU 347.A N ALA 359.A O no hydrogen 3.057 N/A TYR 349.A OH GLU 343.A OE1 no hydrogen 3.267 N/A GLY 350.A N GLY 357.A O no hydrogen 2.941 N/A HIS 352.A N ALA 355.A O no hydrogen 2.877 N/A ALA 356.A N VAL 327.A O no hydrogen 3.039 N/A GLY 357.A N GLY 350.A O no hydrogen 2.807 N/A PHE 358.A N GLY 325.A O no hydrogen 2.910 N/A ALA 359.A N ARG 348.A O no hydrogen 2.980 N/A MET 360.A N GLY 323.A O no hydrogen 2.921 N/A ALA 363.A N ASP 361.A OD1 no hydrogen 2.831 N/A LEU 364.A N ASP 361.A O no hydrogen 2.951 N/A PHE 365.A N GLU 362.A O no hydrogen 3.045 N/A PHE 368.A N LEU 364.A O no hydrogen 2.910 N/A LYS 369.A N PHE 365.A O no hydrogen 2.785 N/A LYS 369.A NZ GLU 373.A OE2 no hydrogen 2.628 N/A ALA 370.A N PRO 366.A O no hydrogen 3.147 N/A ARG 371.A N ALA 367.A O no hydrogen 3.202 N/A ARG 371.A NH1 SER 341.A O no hydrogen 2.930 N/A ARG 371.A NH1 ASP 344.A OD1 no hydrogen 2.987 N/A ARG 371.A NH2 ASP 344.A OD1 no hydrogen 3.370 N/A ARG 371.A NH2 ASP 344.A OD2 no hydrogen 3.548 N/A VAL 372.A N PHE 368.A O no hydrogen 2.967 N/A GLU 373.A N LYS 369.A O no hydrogen 2.895 N/A ALA 374.A N ALA 370.A O no hydrogen 2.947 N/A TYR 375.A N ARG 371.A O no hydrogen 2.906 N/A ALA 376.A N VAL 372.A O no hydrogen 2.947 N/A ALA 377.A N GLU 373.A O no hydrogen 3.028 N/A ARG 378.A N TYR 375.A O no hydrogen 3.110 N/A PHE 379.A N ALA 376.A O no hydrogen 3.074 N/A ARG 384.A N ARG 4.A O no hydrogen 2.751 N/A VAL 386.A N ARG 6.A O no hydrogen 2.866 N/A LEU 388.A N ARG 8.A O no hydrogen 2.752 N/A LEU 389.A N LEU 419.A O no hydrogen 2.819 N/A LEU 392.A N LEU 421.A O no hydrogen 2.859 N/A LEU 397.A N GLU 394.A O no hydrogen 3.015 N/A LEU 398.A N PRO 395.A O no hydrogen 3.200 N/A VAL 401.A N LEU 397.A O no hydrogen 2.955 N/A PHE 402.A N LEU 398.A O no hydrogen 2.728 N/A ARG 403.A N PRO 399.A O no hydrogen 2.797 N/A GLU 404.A N GLN 400.A O no hydrogen 2.928 N/A LEU 405.A N VAL 401.A O no hydrogen 3.001 N/A ALA 406.A N PHE 402.A O no hydrogen 3.289 N/A ALA 406.A N ARG 403.A O no hydrogen 3.374 N/A LEU 408.A N LEU 405.A O no hydrogen 2.997 N/A GLU 409.A N ALA 406.A O no hydrogen 3.145 N/A GLY 412.A N ASN 415.A O no hydrogen 2.962 N/A ASN 415.A ND2 PRO 410.A O no hydrogen 3.431 N/A PHE 420.A N GLY 465.A O no hydrogen 2.807 N/A LEU 421.A N ASP 390.A O no hydrogen 2.850 N/A LEU 422.A N VAL 463.A O no hydrogen 2.887 N/A GLY 424.A N VAL 461.A O no hydrogen 3.102 N/A GLU 427.A N ARG 441.A O no hydrogen 3.048 N/A ARG 430.A N ALA 439.A O no hydrogen 2.856 N/A LEU 432.A N HIS 437.A O no hydrogen 3.004 N/A LEU 438.A N ALA 449.A O no hydrogen 2.898 N/A ALA 439.A N ARG 430.A O no hydrogen 3.145 N/A PHE 440.A N VAL 447.A O no hydrogen 3.093 N/A ARG 441.A N GLU 427.A O no hydrogen 2.774 N/A LEU 442.A N VAL 445.A O no hydrogen 3.027 N/A VAL 445.A N LEU 442.A O no hydrogen 2.957 N/A ARG 446.A NE GLU 479.A OE1 no hydrogen 2.611 N/A ARG 446.A NH2 GLU 479.A OE1 no hydrogen 3.342 N/A VAL 447.A N PHE 440.A O no hydrogen 2.871 N/A LEU 448.A N VAL 480.A O no hydrogen 2.857 N/A ALA 449.A N LEU 438.A O no hydrogen 3.043 N/A LYS 451.A N ARG 436.A O no hydrogen 3.039 N/A LYS 451.A NZ GLN 452.A O no hydrogen 3.018 N/A VAL 461.A N GLY 424.A O no hydrogen 2.768 N/A GLU 462.A N ARG 486.A O no hydrogen 2.742 N/A VAL 463.A N LEU 422.A O no hydrogen 2.919 N/A ALA 464.A N ASP 484.A O no hydrogen 2.971 N/A GLY 465.A N PHE 420.A O no hydrogen 2.790 N/A LEU 466.A N GLN 481.A O no hydrogen 2.971 N/A SER 468.A N GLU 479.A O no hydrogen 2.622 N/A SER 468.A OG LEU 466.A O no hydrogen 3.039 N/A ASN 470.A N ALA 477.A O no hydrogen 2.833 N/A ASN 470.A ND2 GLU 479.A OE2 no hydrogen 2.543 N/A TRP 472.A N HIS 475.A O no hydrogen 2.674 N/A HIS 475.A N TRP 472.A O no hydrogen 2.735 N/A ALA 477.A N ASN 470.A O no hydrogen 2.834 N/A TYR 478.A OH GLU 469.A OE2 no hydrogen 2.366 N/A GLU 479.A N SER 468.A O no hydrogen 2.902 N/A VAL 480.A N ARG 446.A O no hydrogen 2.879 N/A GLN 481.A N LEU 466.A O no hydrogen 3.016 N/A ALA 482.A N LEU 448.A O no hydrogen 2.756 N/A VAL 483.A N ALA 464.A O no hydrogen 2.920 N/A ASP 484.A N ALA 464.A O no hydrogen 3.287 N/A LEU 485.A N ASP 484.A OD1 no hydrogen 2.812 N/A ARG 486.A N GLU 462.A O no hydrogen 2.974 N/A ARG 486.A NE GLU 462.A OE2 no hydrogen 2.957 N/A ARG 486.A NH2 GLU 462.A OE2 no hydrogen 3.156 N/A ARG 486.A NH2 ALA 490.A O no hydrogen 2.729 N/A GLU 489.A N GLU 462.A OE2 no hydrogen 3.350 N/A GLU 492.A N TRP 7.A O no hydrogen 2.877 N/A ILE 495.A N GLY 602.A O no hydrogen 3.250 N/A PHE 498.A N SER 605.A OG no hydrogen 2.953 N/A ALA 499.A N SER 605.A OG no hydrogen 2.981 N/A TYR 500.A N VAL 559.A O no hydrogen 2.793 N/A LEU 502.A N VAL 561.A O no hydrogen 2.762 N/A ALA 507.A N PRO 503.A O no hydrogen 3.019 N/A LEU 508.A N LEU 504.A O no hydrogen 2.894 N/A ALA 509.A N LEU 505.A O no hydrogen 3.129 N/A ARG 510.A N GLU 506.A O no hydrogen 3.250 N/A ARG 510.A NE GLU 515.A OE1 no hydrogen 2.671 N/A ARG 510.A NH1 GLU 515.A OE1 no hydrogen 3.308 N/A ARG 510.A NH1 GLU 515.A OE2 no hydrogen 2.694 N/A ARG 510.A NH1 GLU 560.A OE1 no hydrogen 2.644 N/A ARG 510.A NH2 GLU 560.A OE1 no hydrogen 3.391 N/A ARG 510.A NH2 GLU 560.A OE2 no hydrogen 3.048 N/A ALA 511.A N ALA 507.A O no hydrogen 2.989 N/A ARG 512.A N LEU 508.A O no hydrogen 2.965 N/A ARG 512.A NH1 TYR 529.A OH no hydrogen 3.270 N/A LEU 513.A N ALA 509.A O no hydrogen 3.163 N/A LEU 513.A N ARG 510.A O no hydrogen 3.216 N/A GLY 514.A N ALA 511.A O no hydrogen 3.167 N/A GLU 515.A N ARG 510.A O no hydrogen 3.084 N/A VAL 517.A N ARG 536.A O no hydrogen 2.850 N/A TYR 518.A N LEU 545.A O no hydrogen 2.987 N/A GLY 526.A N ASN 523.A O no hydrogen 2.693 N/A LEU 527.A N ASN 523.A O no hydrogen 3.128 N/A ASP 528.A N PRO 524.A O no hydrogen 2.497 N/A TYR 529.A N GLU 525.A O no hydrogen 2.768 N/A ALA 530.A N GLY 526.A O no hydrogen 2.756 N/A TRP 531.A N LEU 527.A O no hydrogen 2.797 N/A LYS 532.A N ASP 528.A O no hydrogen 2.561 N/A GLY 534.A N TRP 531.A O no hydrogen 3.134 N/A PHE 535.A N ALA 530.A O no hydrogen 3.176 N/A LEU 538.A N VAL 517.A O no hydrogen 2.713 N/A GLU 541.A N GLU 541.A OE1 no hydrogen 2.584 N/A GLU 542.A N PRO 539.A O no hydrogen 2.790 N/A ALA 543.A N PRO 539.A O no hydrogen 3.042 N/A TRP 546.A N GLU 560.A O no hydrogen 2.783 N/A TRP 546.A NE1 PRO 540.A O no hydrogen 3.161 N/A LEU 547.A N TYR 518.A O no hydrogen 2.887 N/A ARG 557.A NH1 PRO 540.A O no hydrogen 2.616 N/A VAL 559.A N PHE 498.A O no hydrogen 2.763 N/A GLU 560.A N GLY 544.A O no hydrogen 3.023 N/A VAL 561.A N TYR 500.A O no hydrogen 2.784 N/A ALA 562.A N TRP 546.A O no hydrogen 2.854 N/A LEU 563.A N TYR 596.A OH no hydrogen 2.976 N/A ARG 565.A NE ARG 565.A O no hydrogen 2.949 N/A ARG 568.A N ASN 523.A OD1 no hydrogen 3.359 N/A ARG 570.A NH1 GLY 564.A O no hydrogen 2.728 N/A LEU 571.A N ARG 568.A O no hydrogen 2.776 N/A SER 572.A N ARG 570.A O no hydrogen 2.524 N/A ARG 583.A N PRO 580.A O no hydrogen 3.068 N/A ARG 583.A NH2 GLU 404.A OE1 no hydrogen 3.289 N/A ARG 583.A NH2 GLU 404.A OE2 no hydrogen 2.737 N/A LEU 584.A N GLU 581.A O no hydrogen 3.081 N/A LYS 585.A N GLU 581.A O no hydrogen 3.325 N/A ALA 586.A N ALA 582.A O no hydrogen 2.967 N/A LEU 587.A N ARG 583.A O no hydrogen 2.930 N/A VAL 588.A N LEU 584.A O no hydrogen 3.113 N/A HIS 589.A N LYS 585.A O no hydrogen 2.880 N/A ARG 590.A N ALA 586.A O no hydrogen 3.013 N/A ARG 591.A N LEU 587.A O no hydrogen 2.955 N/A LEU 592.A N VAL 588.A O no hydrogen 2.829 N/A LEU 593.A N HIS 589.A O no hydrogen 2.940 N/A PHE 594.A N ARG 590.A O no hydrogen 2.874 N/A ALA 595.A N ARG 591.A O no hydrogen 2.799 N/A TYR 596.A N LEU 592.A O no hydrogen 2.805 N/A TYR 596.A OH LEU 502.A O no hydrogen 2.793 N/A GLU 597.A N LEU 593.A O no hydrogen 2.971 N/A ARG 598.A N PHE 594.A O no hydrogen 2.995 N/A ARG 599.A N TYR 596.A O no hydrogen 2.911 N/A HIS 600.A N ALA 595.A O no hydrogen 2.901 N/A HIS 600.A NE2 LEU 491.A O no hydrogen 2.723 N/A LEU 603.A N HIS 600.A ND1 no hydrogen 3.041 N/A PHE 604.A N HIS 600.A O no hydrogen 2.940 N/A SER 605.A N PRO 601.A O no hydrogen 2.903 N/A SER 605.A OG ALA 499.A O no hydrogen 3.300 N/A SER 605.A OG PRO 601.A O no hydrogen 2.708 N/A GLU 606.A N GLY 602.A O no hydrogen 2.859 N/A ALA 607.A N LEU 603.A O no hydrogen 2.819 N/A LEU 608.A N PHE 604.A O no hydrogen 2.792 N/A LEU 609.A N SER 605.A O no hydrogen 3.145 N/A ALA 610.A N GLU 606.A O no hydrogen 3.187 N/A TYR 611.A N ALA 607.A O no hydrogen 2.846 N/A TRP 612.A N LEU 608.A O no hydrogen 2.910 N/A GLU 613.A N LEU 609.A O no hydrogen 3.194 N/A VAL 614.A N ALA 610.A O no hydrogen 2.783 N/A ASN 615.A N TRP 612.A O no hydrogen 3.198 N/A ASN 615.A ND2 TYR 611.A O no hydrogen 2.849 N/A ARG 616.A N GLU 613.A O no hydrogen 2.945 N/A