Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4ope_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): VAL 5.A N LYS 240.A O no hydrogen 2.782 N/A ILE 6.A N ALA 254.A O no hydrogen 2.986 N/A VAL 7.A N LEU 238.A O no hydrogen 2.842 N/A VAL 9.A N ASP 101.A OD2 no hydrogen 2.831 N/A ALA 10.A N ALA 236.A O no hydrogen 2.965 N/A ARG 12.A N SER 234.A O no hydrogen 2.880 N/A ARG 12.A NE ASP 17.A OD1 no hydrogen 3.532 N/A ARG 12.A NH2 ASP 17.A OD1 no hydrogen 3.543 N/A ARG 12.A NH2 ASP 67.A O no hydrogen 3.129 N/A TYR 13.A N ALA 16.A O no hydrogen 2.896 N/A LYS 15.A NZ GLU 34.A OE1 no hydrogen 3.416 N/A ALA 16.A N TYR 13.A O no hydrogen 2.827 N/A GLN 21.A N ASP 18.A OD1 no hydrogen 3.095 N/A GLN 21.A NE2 ASN 25.A OD1 no hydrogen 2.938 N/A PHE 22.A N ASP 18.A O no hydrogen 2.973 N/A TRP 23.A N LEU 19.A O no hydrogen 2.889 N/A ARG 24.A N ALA 20.A O no hydrogen 3.116 N/A ARG 24.A NE GLN 21.A OE1 no hydrogen 3.156 N/A ARG 24.A NH1 GLU 465.A OE1 no hydrogen 2.664 N/A ARG 24.A NH2 GLN 21.A OE1 no hydrogen 2.822 N/A ASN 25.A N GLN 21.A O no hydrogen 3.049 N/A ASN 25.A ND2 LYS 15.A O no hydrogen 3.077 N/A LEU 26.A N PHE 22.A O no hydrogen 2.926 N/A ARG 27.A N TRP 23.A O no hydrogen 2.822 N/A ARG 27.A NH2 GLU 362.A OE1 no hydrogen 2.984 N/A GLU 28.A N ARG 24.A O no hydrogen 2.899 N/A GLY 29.A N LEU 26.A O no hydrogen 3.203 N/A ARG 30.A N ASN 25.A O no hydrogen 2.913 N/A ARG 30.A NH1 ASN 25.A OD1 no hydrogen 3.042 N/A CYS 32.A N GLY 339.A O no hydrogen 2.896 N/A CYS 32.A SG PRO 14.A O no hydrogen 3.761 N/A CYS 32.A SG ARG 30.A O no hydrogen 3.591 N/A VAL 33.A N ASP 31.A OD1 no hydrogen 3.065 N/A GLU 34.A N GLY 62.A O no hydrogen 2.928 N/A VAL 36.A N LYS 60.A O no hydrogen 2.784 N/A ARG 40.A N PRO 37.A O no hydrogen 3.163 N/A ARG 40.A NH1 LEU 65.A O no hydrogen 3.279 N/A ARG 40.A NH1 GLU 232.A OE1 no hydrogen 3.339 N/A ARG 40.A NH1 GLU 232.A OE2 no hydrogen 2.583 N/A ARG 40.A NH2 GLU 232.A OE1 no hydrogen 2.606 N/A TRP 41.A NE1 HIS 43.A ND1 no hydrogen 2.978 N/A ASP 42.A N VAL 572.A O no hydrogen 2.847 N/A HIS 43.A NE2 ALA 59.A O no hydrogen 2.904 N/A GLY 44.A N ASP 42.A OD1 no hydrogen 3.131 N/A ARG 45.A NH1 ALA 571.A O no hydrogen 3.499 N/A ARG 45.A NH2 ALA 571.A O no hydrogen 2.848 N/A PHE 46.A N HIS 43.A O no hydrogen 3.036 N/A TYR 47.A N GLY 44.A O no hydrogen 3.463 N/A ASP 48.A N ALA 57.A O no hydrogen 2.971 N/A ASP 50.A N ASP 48.A OD1 no hydrogen 2.808 N/A ALA 52.A N ASP 50.A OD1 no hydrogen 2.977 N/A ALA 53.A N ASP 50.A O no hydrogen 3.176 N/A LYS 56.A NZ ARG 45.A O no hydrogen 3.226 N/A ALA 57.A N PHE 46.A O no hydrogen 2.851 N/A TYR 58.A OH LEU 212.A O no hydrogen 2.788 N/A LYS 60.A NZ GLU 35.A OE2 no hydrogen 3.055 N/A GLY 62.A N GLU 34.A O no hydrogen 2.714 N/A GLY 63.A N PRO 230.A O no hydrogen 2.771 N/A TRP 64.A NE1 GLU 34.A O no hydrogen 3.129 N/A LEU 65.A N GLU 232.A OE2 no hydrogen 2.762 N/A SER 66.A OG ASP 17.A OD1 no hydrogen 3.142 N/A SER 66.A OG ASP 17.A OD2 no hydrogen 2.784 N/A SER 70.A OG ASP 67.A OD2 no hydrogen 2.345 N/A PHE 71.A N GLU 562.A O no hydrogen 2.896 N/A PHE 75.A N ASP 72.A O no hydrogen 3.287 N/A GLN 78.A NE2 GLU 82.A OE1 no hydrogen 3.295 N/A GLN 78.A NE2 ARG 563.A O no hydrogen 3.167 N/A GLU 80.A N SER 77.A OG no hydrogen 2.969 N/A ALA 81.A N SER 77.A O no hydrogen 3.084 N/A GLU 82.A N GLN 78.A O no hydrogen 3.146 N/A HIS 83.A N GLU 80.A O no hydrogen 2.937 N/A HIS 83.A ND1 VAL 79.A O no hydrogen 2.920 N/A ILE 84.A N ALA 81.A O no hydrogen 3.231 N/A ASP 85.A N SER 141.A O no hydrogen 2.945 N/A GLN 87.A N ASP 85.A OD1 no hydrogen 2.927 N/A GLN 87.A NE2 TYR 121.A O no hydrogen 3.008 N/A GLU 88.A N ASP 85.A O no hydrogen 3.049 N/A ARG 89.A NE ILE 84.A O no hydrogen 2.999 N/A ARG 89.A NH2 ILE 84.A O no hydrogen 2.869 N/A ILE 90.A N PRO 86.A O no hydrogen 2.892 N/A PHE 91.A N GLN 87.A O no hydrogen 3.085 N/A LEU 92.A N GLU 88.A O no hydrogen 3.375 N/A GLN 93.A N ARG 89.A O no hydrogen 3.365 N/A THR 94.A N ILE 90.A O no hydrogen 2.877 N/A THR 94.A OG1 ILE 90.A O no hydrogen 3.029 N/A THR 94.A OG1 SER 234.A OG no hydrogen 2.844 N/A VAL 95.A N PHE 91.A O no hydrogen 2.877 N/A TRP 96.A N LEU 92.A O no hydrogen 3.058 N/A TRP 96.A NE1 GLU 100.A OE2 no hydrogen 2.993 N/A HIS 97.A N GLN 93.A O no hydrogen 2.895 N/A HIS 97.A NE2 TYR 557.A O no hydrogen 2.859 N/A LEU 98.A N THR 94.A O no hydrogen 2.770 N/A LEU 99.A N VAL 95.A O no hydrogen 3.059 N/A GLU 100.A N TRP 96.A O no hydrogen 3.237 N/A ASP 101.A N HIS 97.A O no hydrogen 2.886 N/A ALA 102.A N LEU 98.A O no hydrogen 2.847 N/A GLY 103.A N GLU 100.A O no hydrogen 2.991 N/A THR 104.A N LEU 99.A O no hydrogen 3.015 N/A ARG 106.A NE GLU 482.A OE1 no hydrogen 3.083 N/A ARG 106.A NH1 PHE 154.A O no hydrogen 3.151 N/A ARG 106.A NH2 GLU 482.A OE1 no hydrogen 3.472 N/A ARG 106.A NH2 GLU 482.A OE2 no hydrogen 2.828 N/A ALA 108.A N SER 105.A OG no hydrogen 3.043 N/A LEU 109.A N SER 105.A O no hydrogen 2.986 N/A SER 110.A N ALA 107.A O no hydrogen 3.263 N/A SER 110.A OG ALA 107.A O no hydrogen 3.014 N/A LYS 111.A NZ ALA 108.A O no hydrogen 3.471 N/A VAL 112.A N LEU 109.A O no hydrogen 3.178 N/A ARG 113.A N GLU 187.A OE2 no hydrogen 2.989 N/A GLY 115.A N VAL 188.A O no hydrogen 2.940 N/A VAL 116.A N PRO 160.A O no hydrogen 2.758 N/A PHE 117.A N VAL 190.A O no hydrogen 2.961 N/A VAL 118.A N ILE 162.A O no hydrogen 3.225 N/A GLY 119.A N GLY 192.A O no hydrogen 2.836 N/A LEU 120.A N LEU 164.A O no hydrogen 2.935 N/A TYR 124.A OH GLU 82.A O no hydrogen 2.671 N/A GLN 125.A N SER 142.A OG no hydrogen 3.105 N/A GLN 125.A NE2 GLY 122.A O no hydrogen 2.767 N/A LEU 126.A N HIS 123.A O no hydrogen 2.954 N/A TYR 127.A N TYR 124.A O no hydrogen 3.074 N/A TYR 127.A OH SER 198.A O no hydrogen 2.620 N/A GLU 131.A N GLU 131.A OE1 no hydrogen 2.719 N/A ALA 132.A N GLY 128.A O no hydrogen 3.171 N/A LEU 133.A N VAL 129.A O no hydrogen 3.131 N/A ARG 134.A N GLU 130.A O no hydrogen 2.842 N/A GLY 135.A N ALA 132.A O no hydrogen 3.366 N/A THR 136.A OG1 ARG 134.A O no hydrogen 3.540 N/A GLY 137.A N GLU 131.A O no hydrogen 3.189 N/A THR 140.A OG1 TYR 124.A O no hydrogen 3.300 N/A THR 140.A OG1 TYR 127.A O no hydrogen 2.829 N/A SER 141.A N HIS 83.A O no hydrogen 2.685 N/A SER 142.A OG ASP 85.A OD2 no hydrogen 2.450 N/A SER 143.A N SER 141.A OG no hydrogen 3.269 N/A SER 146.A N SER 143.A OG no hydrogen 3.150 N/A SER 146.A OG GLU 88.A OE2 no hydrogen 2.744 N/A VAL 147.A N TYR 144.A O no hydrogen 2.958 N/A ASN 149.A N ALA 145.A O no hydrogen 2.774 N/A ASN 149.A ND2 SER 161.A OG no hydrogen 2.924 N/A ARG 150.A N SER 146.A O no hydrogen 2.895 N/A ARG 150.A NH1 GLU 88.A OE2 no hydrogen 2.942 N/A ARG 150.A NH2 GLU 80.A OE2 no hydrogen 3.301 N/A SER 152.A N ALA 148.A O no hydrogen 2.862 N/A SER 152.A OG ALA 148.A O no hydrogen 3.455 N/A SER 152.A OG SER 161.A OG no hydrogen 2.893 N/A TYR 153.A N ASN 149.A O no hydrogen 2.804 N/A PHE 154.A N ARG 150.A O no hydrogen 3.059 N/A PHE 155.A N VAL 151.A O no hydrogen 2.982 N/A ASP 156.A N TYR 153.A O no hydrogen 3.278 N/A PHE 157.A N SER 152.A O no hydrogen 2.771 N/A GLY 159.A N THR 114.A O no hydrogen 2.815 N/A SER 161.A OG SER 152.A OG no hydrogen 2.893 N/A ILE 162.A N VAL 116.A O no hydrogen 2.925 N/A LEU 164.A N VAL 118.A O no hydrogen 2.985 N/A THR 166.A N SER 169.A OG no hydrogen 2.839 N/A THR 166.A OG1 SER 168.A OG no hydrogen 2.722 N/A THR 166.A OG1 THR 172.A OG1 no hydrogen 2.887 N/A CYS 167.A SG HIS 342.A NE2 no hydrogen 3.579 N/A SER 168.A OG THR 166.A O no hydrogen 3.059 N/A SER 168.A OG THR 166.A OG1 no hydrogen 2.722 N/A SER 168.A OG SER 417.A O no hydrogen 2.802 N/A SER 170.A OG SER 345.A O no hydrogen 2.609 N/A THR 172.A N SER 168.A O no hydrogen 2.812 N/A THR 172.A OG1 THR 166.A OG1 no hydrogen 2.887 N/A THR 172.A OG1 SER 168.A O no hydrogen 3.162 N/A ALA 173.A N SER 169.A O no hydrogen 2.860 N/A LEU 174.A N SER 170.A O no hydrogen 2.988 N/A HIS 175.A N LEU 171.A O no hydrogen 2.957 N/A HIS 175.A ND1 THR 259.A OG1 no hydrogen 2.840 N/A LEU 176.A N THR 172.A O no hydrogen 2.957 N/A ALA 177.A N ALA 173.A O no hydrogen 2.777 N/A CYS 178.A N LEU 174.A O no hydrogen 3.055 N/A CYS 178.A SG LEU 174.A O no hydrogen 3.247 N/A ARG 179.A N HIS 175.A O no hydrogen 3.171 N/A ALA 180.A N LEU 176.A O no hydrogen 2.929 N/A ILE 181.A N ALA 177.A O no hydrogen 3.127 N/A ARG 182.A N CYS 178.A O no hydrogen 3.119 N/A ASP 183.A N ARG 179.A O no hydrogen 2.853 N/A GLY 184.A N ILE 181.A O no hydrogen 3.168 N/A ASP 185.A N ALA 180.A O no hydrogen 2.874 N/A CYS 186.A SG VAL 188.A O no hydrogen 3.442 N/A GLU 187.A N ARG 113.A O no hydrogen 2.900 N/A VAL 188.A N ARG 113.A O no hydrogen 3.281 N/A ALA 189.A N LEU 239.A O no hydrogen 3.048 N/A VAL 190.A N GLY 115.A O no hydrogen 2.739 N/A ALA 191.A N VAL 237.A O no hydrogen 3.079 N/A GLY 192.A N PHE 117.A O no hydrogen 2.863 N/A GLY 193.A N GLY 235.A O no hydrogen 2.944 N/A VAL 194.A N GLY 119.A O no hydrogen 3.179 N/A ASN 195.A N GLY 233.A O no hydrogen 2.718 N/A ASN 195.A ND2 ALA 231.A O no hydrogen 3.129 N/A ASN 195.A ND2 GLU 344.A OE2 no hydrogen 2.912 N/A VAL 196.A N GLN 87.A OE1 no hydrogen 2.894 N/A SER 197.A N GLU 232.A OE1 no hydrogen 2.741 N/A LEU 201.A N HIS 199.A ND1 no hydrogen 3.042 N/A LYS 202.A NZ SER 197.A OG no hydrogen 2.793 N/A LYS 202.A NZ GLU 344.A OE2 no hydrogen 2.816 N/A TYR 203.A N PRO 200.A O no hydrogen 2.977 N/A TYR 203.A OH TRP 61.A O no hydrogen 2.386 N/A LEU 204.A N PRO 200.A O no hydrogen 3.387 N/A GLN 205.A N LEU 201.A O no hydrogen 2.946 N/A LEU 206.A N LYS 202.A O no hydrogen 2.911 N/A ALA 207.A N TYR 203.A O no hydrogen 2.967 N/A LYS 208.A N LEU 204.A O no hydrogen 2.873 N/A GLY 209.A N GLN 205.A O no hydrogen 3.341 N/A GLY 210.A N ALA 207.A O no hydrogen 2.892 N/A PHE 211.A N LEU 206.A O no hydrogen 3.018 N/A SER 213.A N TYR 228.A O no hydrogen 2.864 N/A SER 213.A OG ASP 215.A OD1 no hydrogen 3.491 N/A SER 213.A OG ARG 217.A O no hydrogen 2.703 N/A SER 213.A OG TYR 228.A O no hydrogen 3.298 N/A THR 214.A N ASP 226.A OD1 no hydrogen 2.856 N/A THR 214.A OG1 ASP 226.A OD1 no hydrogen 3.397 N/A THR 214.A OG1 ASP 226.A OD2 no hydrogen 2.362 N/A ARG 217.A N ASP 215.A OD1 no hydrogen 3.158 N/A ARG 217.A NE GLY 216.A O no hydrogen 2.885 N/A CYS 218.A SG THR 304.A O no hydrogen 3.501 N/A ARG 219.A NE ASP 215.A OD2 no hydrogen 2.689 N/A ARG 219.A NH1 GLU 223.A O no hydrogen 2.904 N/A ARG 219.A NH2 ASP 215.A OD2 no hydrogen 2.678 N/A SER 220.A OG GLY 303.A O no hydrogen 2.567 N/A PHE 221.A N ASP 310.A OD2 no hydrogen 2.850 N/A GLY 222.A N ARG 219.A O no hydrogen 2.881 N/A GLU 223.A N ARG 371.A O no hydrogen 2.884 N/A TYR 228.A N PHE 211.A O no hydrogen 3.075 N/A ALA 231.A N HIS 342.A O no hydrogen 2.900 N/A GLU 232.A N GLY 63.A O no hydrogen 2.697 N/A GLY 233.A N ASN 195.A O no hydrogen 2.878 N/A SER 234.A N ARG 12.A O no hydrogen 3.094 N/A SER 234.A OG THR 94.A OG1 no hydrogen 2.844 N/A GLY 235.A N GLY 193.A O no hydrogen 2.959 N/A ALA 236.A N ALA 10.A O no hydrogen 2.953 N/A VAL 237.A N ALA 191.A O no hydrogen 2.898 N/A LEU 238.A N GLY 8.A O no hydrogen 3.029 N/A LEU 239.A N ALA 189.A O no hydrogen 2.863 N/A LYS 240.A N VAL 5.A O no hydrogen 3.076 N/A ARG 241.A NH2 ARG 182.A O no hydrogen 3.473 N/A ARG 242.A N GLU 3.A O no hydrogen 2.753 N/A SER 243.A N ASP 2.A OD1 no hydrogen 3.278 N/A SER 243.A OG ASP 2.A OD2 no hydrogen 2.239 N/A ALA 245.A N ARG 241.A O no hydrogen 3.035 N/A GLU 246.A N ARG 242.A O no hydrogen 2.816 N/A ALA 247.A N SER 243.A O no hydrogen 3.005 N/A ASP 248.A N ALA 244.A O no hydrogen 2.898 N/A GLY 249.A N GLU 246.A O no hydrogen 3.058 N/A ASP 250.A N ALA 245.A O no hydrogen 2.913 N/A ARG 251.A NH2 SER 553.A OG no hydrogen 2.727 N/A LEU 253.A N ILE 6.A O no hydrogen 2.781 N/A VAL 255.A N GLU 424.A O no hydrogen 2.665 N/A VAL 256.A N ILE 4.A O no hydrogen 3.022 N/A ARG 257.A N ILE 422.A O no hydrogen 2.920 N/A ARG 257.A NE ALA 289.A O no hydrogen 2.900 N/A ARG 257.A NH2 ALA 289.A O no hydrogen 2.846 N/A SER 258.A N ILE 422.A O no hydrogen 3.425 N/A SER 258.A OG ALA 285.A O no hydrogen 2.626 N/A THR 259.A OG1 HIS 175.A ND1 no hydrogen 2.840 N/A ALA 260.A N HIS 420.A O no hydrogen 2.867 N/A ASN 262.A N ASN 418.A O no hydrogen 3.092 N/A ASN 262.A ND2 ALA 277.A O no hydrogen 3.144 N/A HIS 263.A NE2 GLY 415.A O no hydrogen 3.003 N/A GLY 264.A N GLY 416.A O no hydrogen 3.095 N/A GLY 265.A N HIS 263.A ND1 no hydrogen 3.108 N/A GLY 269.A N GLY 267.A O no hydrogen 2.602 N/A VAL 272.A N GLY 269.A O no hydrogen 3.157 N/A ASN 274.A ND2 GLY 264.A O no hydrogen 2.783 N/A ARG 276.A N ASN 274.A OD1 no hydrogen 2.802 N/A GLN 278.A N ASN 274.A O no hydrogen 3.132 N/A GLY 279.A N PRO 275.A O no hydrogen 3.025 N/A VAL 280.A N ARG 276.A O no hydrogen 2.995 N/A LEU 281.A N ALA 277.A O no hydrogen 2.956 N/A ILE 282.A N GLN 278.A O no hydrogen 3.033 N/A GLY 283.A N GLY 279.A O no hydrogen 2.964 N/A GLU 284.A N VAL 280.A O no hydrogen 2.894 N/A ALA 285.A N LEU 281.A O no hydrogen 2.900 N/A LEU 286.A N ILE 282.A O no hydrogen 2.938 N/A GLU 287.A N GLY 283.A O no hydrogen 3.048 N/A ARG 288.A N GLU 284.A O no hydrogen 2.839 N/A ARG 288.A NH1 THR 259.A O no hydrogen 2.771 N/A ALA 289.A N ALA 285.A O no hydrogen 2.998 N/A GLY 290.A N GLU 287.A O no hydrogen 2.951 N/A LEU 291.A N LEU 286.A O no hydrogen 2.987 N/A ASP 295.A N ALA 292.A O no hydrogen 2.828 N/A LEU 296.A N PRO 293.A O no hydrogen 3.106 N/A GLY 297.A N THR 406.A O no hydrogen 3.104 N/A GLY 297.A N THR 406.A OG1 no hydrogen 3.071 N/A TYR 298.A OH GLU 300.A OE1 no hydrogen 3.151 N/A LEU 299.A N PRO 332.A O no hydrogen 3.010 N/A GLU 300.A N ALA 408.A O no hydrogen 2.823 N/A ALA 301.A N GLY 334.A O no hydrogen 2.845 N/A HIS 302.A N GLU 313.A OE2 no hydrogen 2.627 N/A GLY 303.A N GLU 313.A OE1 no hydrogen 2.830 N/A GLY 305.A N ASP 310.A OD1 no hydrogen 3.005 N/A GLY 309.A N THR 306.A OG1 no hydrogen 2.741 N/A ASP 310.A N THR 306.A O no hydrogen 3.246 N/A VAL 312.A N LEU 308.A O no hydrogen 3.429 N/A GLU 313.A N GLY 309.A O no hydrogen 2.914 N/A ILE 314.A N ASP 310.A O no hydrogen 3.238 N/A THR 315.A N PRO 311.A O no hydrogen 3.042 N/A THR 315.A OG1 PRO 311.A O no hydrogen 2.743 N/A GLY 316.A N VAL 312.A O no hydrogen 2.932 N/A LEU 317.A N GLU 313.A O no hydrogen 3.094 N/A VAL 318.A N ILE 314.A O no hydrogen 2.953 N/A ARG 319.A N THR 315.A O no hydrogen 2.884 N/A ALA 320.A N GLY 316.A O no hydrogen 2.897 N/A PHE 321.A N LEU 317.A O no hydrogen 2.980 N/A THR 327.A N ASP 325.A OD1 no hydrogen 3.311 N/A THR 327.A OG1 ASP 325.A OD1 no hydrogen 2.492 N/A ILE 331.A N PRO 382.A O no hydrogen 2.892 N/A ILE 333.A N ARG 384.A O no hydrogen 2.927 N/A GLY 334.A N LEU 299.A O no hydrogen 3.256 N/A SER 335.A N SER 366.A OG no hydrogen 2.911 N/A SER 335.A OG ALA 301.A O no hydrogen 3.362 N/A SER 335.A OG HIS 302.A O no hydrogen 3.391 N/A SER 335.A OG GLY 303.A O no hydrogen 3.473 N/A VAL 336.A N GLU 300.A OE2 no hydrogen 2.782 N/A LYS 337.A N SER 335.A OG no hydrogen 3.213 N/A LYS 337.A NZ HIS 302.A ND1 no hydrogen 3.221 N/A LYS 337.A NZ HIS 302.A O no hydrogen 2.942 N/A SER 338.A N SER 335.A O no hydrogen 3.007 N/A SER 338.A OG SER 335.A O no hydrogen 2.795 N/A SER 338.A OG SER 366.A OG no hydrogen 3.366 N/A GLY 339.A N VAL 336.A O no hydrogen 3.141 N/A ILE 340.A N VAL 336.A O no hydrogen 3.278 N/A GLY 341.A N LYS 337.A O no hydrogen 2.809 N/A HIS 342.A N VAL 229.A O no hydrogen 2.832 N/A GLU 344.A N HIS 342.A ND1 no hydrogen 3.091 N/A SER 345.A OG VAL 194.A O no hydrogen 2.760 N/A SER 345.A OG ASN 195.A OD1 no hydrogen 3.334 N/A ALA 346.A N ALA 343.A O no hydrogen 2.864 N/A ALA 347.A N GLU 344.A O no hydrogen 3.076 N/A ALA 350.A N ALA 347.A O no hydrogen 2.933 N/A LEU 351.A N GLY 348.A O no hydrogen 2.817 N/A LYS 353.A N ALA 349.A O no hydrogen 2.925 N/A LYS 353.A NZ TYR 298.A OH no hydrogen 2.706 N/A LYS 353.A NZ GLU 300.A OE1 no hydrogen 2.641 N/A VAL 354.A N ALA 350.A O no hydrogen 3.127 N/A LEU 355.A N LEU 351.A O no hydrogen 3.010 N/A LEU 356.A N THR 352.A O no hydrogen 2.982 N/A GLN 357.A N LYS 353.A O no hydrogen 3.069 N/A PHE 358.A N VAL 354.A O no hydrogen 2.833 N/A ARG 359.A N LEU 355.A O no hydrogen 3.013 N/A HIS 360.A N LEU 356.A O no hydrogen 2.987 N/A GLN 361.A N GLN 357.A O no hydrogen 2.556 N/A GLN 361.A N PHE 358.A O no hydrogen 3.332 N/A GLN 361.A NE2 GLU 425.A OE2 no hydrogen 3.520 N/A LEU 363.A N ALA 390.A O no hydrogen 2.716 N/A VAL 364.A N GLN 357.A OE1 no hydrogen 3.127 N/A SER 366.A N GLN 386.A O no hydrogen 2.790 N/A SER 366.A OG SER 335.A O no hydrogen 3.469 N/A SER 366.A OG SER 338.A OG no hydrogen 3.366 N/A LEU 367.A N SER 338.A OG no hydrogen 2.836 N/A GLU 370.A N GLU 370.A OE1 no hydrogen 2.672 N/A ARG 371.A NE GLU 223.A OE1 no hydrogen 3.216 N/A ARG 371.A NE GLU 223.A OE2 no hydrogen 3.023 N/A ARG 371.A NH2 GLU 223.A OE2 no hydrogen 3.283 N/A ASN 373.A N PHE 221.A O no hydrogen 2.981 N/A HIS 375.A N ASN 373.A OD1 no hydrogen 2.697 N/A ALA 380.A N ASP 377.A O no hydrogen 3.209 N/A THR 381.A N LEU 378.A O no hydrogen 2.614 N/A THR 381.A OG1 LEU 378.A O no hydrogen 2.491 N/A PHE 383.A N THR 381.A OG1 no hydrogen 3.108 N/A ARG 384.A N ILE 331.A O no hydrogen 3.033 N/A ARG 384.A NH1 THR 381.A O no hydrogen 2.626 N/A ARG 384.A NH1 PHE 383.A O no hydrogen 2.844 N/A ARG 384.A NH2 THR 381.A O no hydrogen 3.554 N/A GLN 386.A N ILE 333.A O no hydrogen 2.891 N/A GLN 386.A NE2 ASP 388.A O no hydrogen 2.664 N/A ARG 387.A NH1 ALA 369.A O no hydrogen 2.601 N/A ALA 390.A N LEU 363.A O no hydrogen 2.911 N/A TRP 392.A N GLN 361.A O no hydrogen 2.753 N/A ARG 395.A NE ALA 294.A O no hydrogen 3.225 N/A ARG 395.A NH2 ARG 330.A O no hydrogen 2.666 N/A ASP 397.A N ARG 401.A O no hydrogen 2.941 N/A ARG 401.A N ASP 397.A OD1 no hydrogen 3.044 N/A LEU 403.A N ARG 395.A O no hydrogen 2.786 N/A ARG 405.A N GLU 425.A OE1 no hydrogen 2.873 N/A ARG 405.A NE TRP 392.A O no hydrogen 2.799 N/A ARG 405.A NH1 GLU 425.A OE1 no hydrogen 2.913 N/A ARG 405.A NH2 TRP 392.A O no hydrogen 2.936 N/A THR 406.A OG1 ASP 295.A O no hydrogen 2.778 N/A ALA 407.A N LEU 423.A O no hydrogen 2.976 N/A ALA 408.A N TYR 298.A O no hydrogen 2.980 N/A ILE 409.A N VAL 421.A O no hydrogen 2.809 N/A SER 410.A N GLU 300.A O no hydrogen 3.045 N/A SER 410.A OG HIS 420.A ND1 no hydrogen 2.932 N/A ALA 411.A N ALA 419.A O no hydrogen 2.952 N/A GLY 413.A N SER 417.A O no hydrogen 2.779 N/A GLY 416.A N GLY 413.A O no hydrogen 2.766 N/A ASN 418.A N ASN 262.A O no hydrogen 2.927 N/A ASN 418.A ND2 ASN 262.A OD1 no hydrogen 2.963 N/A ALA 419.A N ALA 411.A O no hydrogen 2.784 N/A HIS 420.A N ALA 260.A O no hydrogen 2.779 N/A HIS 420.A ND1 SER 410.A OG no hydrogen 2.932 N/A VAL 421.A N ILE 409.A O no hydrogen 2.891 N/A ILE 422.A N SER 258.A O no hydrogen 3.019 N/A LEU 423.A N ALA 407.A O no hydrogen 2.725 N/A GLU 424.A N VAL 255.A O no hydrogen 2.787 N/A GLU 425.A N ARG 405.A O no hydrogen 2.848 N/A SER 426.A OG.A VAL 252.A O no hydrogen 2.639 N/A GLN 431.A N GLN 431.A OE1 no hydrogen 2.302 N/A TYR 439.A N PHE 491.A O no hydrogen 2.685 N/A TYR 439.A OH GLN 435.A O no hydrogen 2.609 N/A CYS 441.A N VAL 489.A O no hydrogen 2.727 N/A LEU 443.A N LEU 487.A O no hydrogen 2.968 N/A ALA 445.A N HIS 485.A O no hydrogen 3.130 N/A ARG 446.A N TYR 557.A OH no hydrogen 3.086 N/A ARG 450.A N ASP 447.A OD1 no hydrogen 2.961 N/A ARG 450.A NH1 GLU 453.A OE1 no hydrogen 2.593 N/A ARG 450.A NH1 PRO 558.A O no hydrogen 3.037 N/A ARG 450.A NH2 GLU 449.A OE1 no hydrogen 2.946 N/A LEU 451.A N ASP 447.A O no hydrogen 2.992 N/A HIS 452.A N ALA 448.A O no hydrogen 2.960 N/A GLU 453.A N GLU 449.A O no hydrogen 3.139 N/A HIS 454.A N ARG 450.A O no hydrogen 3.018 N/A THR 455.A N LEU 451.A O no hydrogen 2.899 N/A THR 455.A OG1 LEU 451.A O no hydrogen 2.896 N/A ALA 456.A N HIS 452.A O no hydrogen 3.063 N/A ARG 457.A N GLU 453.A O no hydrogen 2.806 N/A ARG 457.A NH1 GLY 556.A O no hydrogen 2.706 N/A THR 458.A N HIS 454.A O no hydrogen 2.914 N/A THR 458.A OG1 HIS 454.A O no hydrogen 2.892 N/A ALA 459.A N THR 455.A O no hydrogen 2.993 N/A GLU 460.A N ALA 456.A O no hydrogen 2.993 N/A PHE 461.A N ARG 457.A O no hydrogen 2.973 N/A LEU 462.A N THR 458.A O no hydrogen 2.950 N/A ARG 463.A N ALA 459.A O no hydrogen 3.073 N/A ARG 463.A NE GLU 502.A OE2 no hydrogen 2.760 N/A ARG 463.A NH1 ASP 499.A OD1 no hydrogen 3.527 N/A ARG 463.A NH2 ASP 499.A OD1 no hydrogen 2.772 N/A ARG 463.A NH2 GLU 502.A OE1 no hydrogen 3.172 N/A GLY 464.A N GLU 460.A O no hydrogen 3.100 N/A GLY 464.A N PHE 461.A O no hydrogen 3.143 N/A GLY 466.A N PHE 461.A O no hydrogen 2.633 N/A ARG 467.A N GLY 464.A O no hydrogen 3.230 N/A ARG 467.A NH1 ASP 495.A OD2 no hydrogen 3.205 N/A ALA 469.A N GLY 466.A O no hydrogen 2.964 N/A ALA 472.A N HIS 470.A ND1 no hydrogen 3.068 N/A ALA 473.A N HIS 470.A O no hydrogen 2.981 N/A VAL 474.A N HIS 470.A O no hydrogen 3.143 N/A ALA 475.A N PRO 471.A O no hydrogen 3.062 N/A ALA 476.A N ALA 472.A O no hydrogen 2.881 N/A THR 477.A N ALA 473.A O no hydrogen 2.962 N/A THR 477.A OG1 ALA 473.A O no hydrogen 2.853 N/A THR 477.A OG1 VAL 552.A O no hydrogen 3.209 N/A LEU 478.A N VAL 474.A O no hydrogen 3.311 N/A LEU 479.A N ALA 475.A O no hydrogen 3.264 N/A THR 480.A N THR 477.A O no hydrogen 3.025 N/A THR 480.A OG1 THR 477.A O no hydrogen 2.711 N/A ARG 481.A N LEU 478.A O no hydrogen 3.113 N/A ARG 481.A NH1 PRO 555.A O no hydrogen 2.902 N/A ARG 481.A NH2 LEU 554.A O no hydrogen 3.025 N/A ARG 481.A NH2 PRO 555.A O no hydrogen 3.078 N/A HIS 485.A N ALA 445.A O no hydrogen 3.016 N/A ARG 486.A N GLY 516.A O no hydrogen 2.786 N/A ARG 486.A NH1 TRP 537.A O no hydrogen 3.084 N/A ARG 486.A NH1 ALA 541.A O no hydrogen 3.539 N/A LEU 487.A N LEU 443.A O no hydrogen 2.984 N/A ALA 488.A N LEU 514.A O no hydrogen 2.911 N/A VAL 489.A N CYS 441.A O no hydrogen 3.050 N/A PHE 491.A N TYR 439.A O no hydrogen 2.774 N/A ASP 492.A N ASP 496.A OD1 no hydrogen 3.322 N/A THR 493.A N ASP 496.A OD2 no hydrogen 2.909 N/A THR 493.A OG1 ASP 496.A OD2 no hydrogen 2.683 N/A ASP 496.A N THR 493.A OG1 no hydrogen 3.180 N/A LEU 497.A N THR 493.A O no hydrogen 2.971 N/A ALA 498.A N VAL 494.A O no hydrogen 2.919 N/A ASP 499.A N ASP 495.A O no hydrogen 2.878 N/A ALA 500.A N ASP 496.A O no hydrogen 3.200 N/A LEU 501.A N LEU 497.A O no hydrogen 2.943 N/A GLU 502.A N ALA 498.A O no hydrogen 2.759 N/A ASP 503.A N ASP 499.A O no hydrogen 2.946 N/A HIS 504.A N ALA 500.A O no hydrogen 2.969 N/A LEU 505.A N LEU 501.A O no hydrogen 3.054 N/A ALA 506.A N GLU 502.A O no hydrogen 3.010 N/A ALA 506.A N ASP 503.A O no hydrogen 3.131 N/A GLY 507.A N HIS 504.A O no hydrogen 3.249 N/A GLY 509.A N ASP 503.A O no hydrogen 2.997 N/A ARG 512.A N SER 510.A OG no hydrogen 2.587 N/A ARG 512.A NE VAL 490.A O no hydrogen 3.442 N/A ARG 512.A NH1 ASP 496.A O no hydrogen 3.099 N/A ARG 512.A NH2 VAL 490.A O no hydrogen 3.184 N/A ARG 512.A NH2 ASP 496.A O no hydrogen 3.208 N/A VAL 513.A N SER 510.A O no hydrogen 3.164 N/A LEU 514.A N ALA 488.A O no hydrogen 2.826 N/A GLY 516.A N ARG 486.A O no hydrogen 3.110 N/A ALA 518.A N ALA 484.A O no hydrogen 2.826 N/A SER 519.A N ARG 539.A O no hydrogen 3.108 N/A SER 519.A OG ARG 539.A O no hydrogen 3.398 N/A THR 526.A OG1 GLU 532.A OE2 no hydrogen 2.510 N/A ARG 528.A NH2 ALA 544.A O no hydrogen 2.938 N/A THR 529.A OG1 GLU 532.A OE1 no hydrogen 2.823 N/A LEU 533.A N THR 529.A O no hydrogen 2.970 N/A ALA 534.A N ALA 530.A O no hydrogen 2.609 N/A GLU 535.A N PRO 531.A O no hydrogen 2.895 N/A ALA 536.A N GLU 532.A O no hydrogen 3.218 N/A TRP 537.A N LEU 533.A O no hydrogen 3.030 N/A TRP 537.A NE1 LEU 443.A O no hydrogen 3.035 N/A VAL 538.A N ALA 534.A O no hydrogen 3.236 N/A ARG 539.A N GLU 535.A O no hydrogen 3.165 N/A ARG 539.A NE ALA 523.A O no hydrogen 2.661 N/A ARG 539.A NH2 ALA 523.A O no hydrogen 2.874 N/A ARG 539.A NH2 PRO 524.A O no hydrogen 2.927 N/A GLY 540.A N ALA 536.A O no hydrogen 3.196 N/A GLY 540.A N TRP 537.A O no hydrogen 3.079 N/A ALA 541.A N ALA 536.A O no hydrogen 2.953 N/A ALA 549.A N PRO 546.A O no hydrogen 3.431 N/A ARG 551.A NH2 ASP 250.A OD1 no hydrogen 3.512 N/A VAL 552.A N THR 477.A OG1 no hydrogen 3.185 N/A SER 553.A OG ASP 101.A OD1 no hydrogen 3.364 N/A TYR 557.A N GLU 100.A OE1 no hydrogen 2.788 N/A ALA 560.A N ASP 72.A OD2 no hydrogen 2.928 N/A GLU 562.A N PHE 71.A O no hydrogen 2.875 N/A CYS 564.A N ALA 69.A O no hydrogen 3.009 N/A CYS 564.A SG GLN 78.A OE1 no hydrogen 3.577 N/A CYS 564.A SG GLU 562.A O no hydrogen 3.492 N/A LEU 566.A N TYR 124.A OH no hydrogen 2.870 N/A ALA 569.A N LEU 566.A O no hydrogen 3.390 N/A ASP 570.A N PRO 567.A O no hydrogen 3.163 N/A ALA 571.A N ALA 568.A O no hydrogen 3.321 N/A ARG 573.A N ASP 570.A O no hydrogen 3.221 N/A ARG 574.A NH1 GLU 38.A O no hydrogen 3.535 N/A