Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 7mn8_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): CYS 2.A N VAL 31.A O no hydrogen 2.969 N/A CYS 2.A SG PRO 3.A O no hydrogen 3.568 N/A CYS 2.A SG LEU 25.A O no hydrogen 3.891 N/A CYS 2.A SG VAL 31.A O no hydrogen 4.024 N/A GLY 4.A N MET 33.A O no hydrogen 2.992 N/A THR 5.A N ASN 35.A O no hydrogen 3.112 N/A THR 5.A OG1 ASN 35.A O no hydrogen 3.519 N/A THR 5.A OG1 GLU 37.A OE1 no hydrogen 2.743 N/A ASN 7.A N GLU 37.A OE1 no hydrogen 2.742 N/A GLY 8.A N GLU 37.A OE2 no hydrogen 2.886 N/A SER 10.A N ASN 7.A O no hydrogen 3.137 N/A THR 12.A N GLN 18.A OE1 no hydrogen 2.869 N/A ASN 17.A N ASP 14.A OD1 no hydrogen 2.880 N/A ASN 17.A ND2 THR 12.A O no hydrogen 2.987 N/A GLN 18.A N ASP 14.A O no hydrogen 2.953 N/A TYR 19.A N ALA 15.A O no hydrogen 2.969 N/A TYR 19.A OH ASP 46.A O no hydrogen 2.681 N/A GLN 20.A N GLU 16.A O no hydrogen 2.834 N/A GLN 20.A NE2 GLU 16.A OE2 no hydrogen 2.996 N/A THR 21.A N ASN 17.A O no hydrogen 2.964 N/A THR 21.A OG1 ASN 17.A O no hydrogen 2.789 N/A LEU 22.A N GLN 18.A O no hydrogen 2.968 N/A TYR 23.A N TYR 19.A O no hydrogen 2.766 N/A TYR 23.A OH GLU 27.A OE2 no hydrogen 2.731 N/A LYS 24.A N GLN 20.A O no hydrogen 2.907 N/A LEU 25.A N THR 21.A O no hydrogen 3.204 N/A TYR 26.A N LEU 22.A O no hydrogen 3.152 N/A ARG 28.A NH1 GLU 27.A O no hydrogen 2.900 N/A CYS 29.A N TYR 26.A O no hydrogen 3.181 N/A CYS 29.A SG VAL 31.A O no hydrogen 3.321 N/A VAL 32.A N GLU 55.A O no hydrogen 2.927 N/A MET 33.A N CYS 2.A O no hydrogen 2.768 N/A ASN 35.A N THR 5.A O no hydrogen 3.385 N/A ASN 35.A ND2 THR 5.A O no hydrogen 3.132 N/A ASN 35.A ND2 GLN 82.A OE1 no hydrogen 2.848 N/A LEU 36.A N TYR 59.A O no hydrogen 3.014 N/A ILE 38.A N LEU 61.A O no hydrogen 2.881 N/A LEU 40.A N ALA 63.A O no hydrogen 3.353 N/A ALA 45.A N GLY 42.A O no hydrogen 3.279 N/A SER 48.A N ASP 46.A OD1 no hydrogen 2.882 N/A SER 48.A OG ASP 46.A OD1 no hydrogen 2.747 N/A LEU 50.A N LEU 47.A O no hydrogen 3.056 N/A GLN 51.A N SER 48.A O no hydrogen 3.121 N/A GLN 51.A NE2 SER 48.A O no hydrogen 2.688 N/A ILE 53.A N LEU 50.A O no hydrogen 3.098 N/A ARG 54.A N GLU 30.A O no hydrogen 2.747 N/A ARG 54.A NE GLU 30.A OE1 no hydrogen 3.063 N/A ARG 54.A NH2 GLU 30.A OE1 no hydrogen 3.031 N/A GLU 55.A N GLU 30.A O no hydrogen 3.255 N/A VAL 56.A N VAL 77.A O no hydrogen 3.048 N/A THR 57.A N VAL 32.A O no hydrogen 2.940 N/A THR 57.A OG1 VAL 32.A O no hydrogen 2.725 N/A GLY 58.A N GLY 34.A O no hydrogen 3.008 N/A TYR 59.A N ASN 35.A OD1 no hydrogen 2.846 N/A TYR 59.A OH GLU 37.A OE2 no hydrogen 2.641 N/A VAL 60.A N ALA 89.A O no hydrogen 2.803 N/A LEU 61.A N LEU 36.A O no hydrogen 2.840 N/A VAL 62.A N PHE 91.A O no hydrogen 2.941 N/A ALA 63.A N ILE 38.A O no hydrogen 3.117 N/A MET 64.A N MET 93.A O no hydrogen 2.874 N/A ASN 65.A ND2 ILE 38.A O no hydrogen 3.164 N/A GLU 66.A N THR 41.A O no hydrogen 3.103 N/A LEU 70.A N GLN 106.A O no hydrogen 3.161 N/A LEU 72.A N LEU 70.A O no hydrogen 2.847 N/A ASN 74.A ND2 GLN 51.A O no hydrogen 2.786 N/A LEU 75.A N LEU 72.A O no hydrogen 3.225 N/A ARG 76.A N ARG 54.A O no hydrogen 2.967 N/A ARG 76.A NE GLN 111.A OE1 no hydrogen 2.898 N/A ARG 76.A NH2 GLN 111.A OE1 no hydrogen 3.022 N/A VAL 77.A N ARG 54.A O no hydrogen 3.474 N/A VAL 78.A N GLU 114.A O no hydrogen 3.140 N/A ARG 79.A N VAL 56.A O no hydrogen 2.857 N/A ARG 79.A NE GLU 55.A OE2 no hydrogen 2.726 N/A ARG 79.A NH1 CYS 219.A O no hydrogen 2.960 N/A ARG 79.A NH2 GLU 55.A OE1 no hydrogen 3.233 N/A ARG 79.A NH2 GLU 55.A OE2 no hydrogen 3.432 N/A ARG 79.A NH2 CYS 219.A O no hydrogen 2.890 N/A GLY 80.A N GLY 58.A O no hydrogen 3.298 N/A THR 81.A N THR 57.A O no hydrogen 3.003 N/A THR 81.A OG1 THR 57.A O no hydrogen 3.077 N/A TYR 84.A N PHE 88.A O no hydrogen 3.301 N/A GLY 86.A N VAL 83.A O no hydrogen 3.004 N/A LYS 87.A N TYR 84.A O no hydrogen 3.133 N/A PHE 88.A N TYR 84.A O no hydrogen 3.322 N/A ALA 89.A N GLY 119.A O no hydrogen 2.677 N/A ILE 90.A N GLY 119.A O no hydrogen 3.366 N/A PHE 91.A N VAL 60.A O no hydrogen 2.852 N/A VAL 92.A N TYR 121.A O no hydrogen 2.914 N/A MET 93.A N VAL 62.A O no hydrogen 3.048 N/A ASN 95.A N ASN 125.A OD1 no hydrogen 2.980 N/A ASN 95.A ND2 VAL 62.A O no hydrogen 3.589 N/A ASN 95.A ND2 ASN 125.A OD1 no hydrogen 2.935 N/A TYR 96.A N LEU 94.A O no hydrogen 2.813 N/A ASN 97.A N HIS 102.A O no hydrogen 3.058 N/A ASN 97.A ND2 GLU 66.A OE1 no hydrogen 3.168 N/A ASN 99.A N ASN 97.A OD1 no hydrogen 2.959 N/A SER 100.A N ASN 97.A O no hydrogen 2.958 N/A SER 101.A N ASN 99.A OD1 no hydrogen 2.826 N/A SER 101.A OG ASN 99.A OD1 no hydrogen 2.633 N/A SER 101.A OG HIS 102.A ND1 no hydrogen 2.777 N/A HIS 102.A ND1 SER 101.A OG no hydrogen 2.777 N/A LEU 104.A N ASN 95.A O no hydrogen 2.909 N/A ARG 105.A N SER 68.A O no hydrogen 2.857 N/A ARG 105.A NE LYS 127.A O no hydrogen 2.848 N/A GLN 106.A N SER 68.A O no hydrogen 3.247 N/A ARG 108.A NE GLN 106.A OE1 no hydrogen 2.948 N/A GLN 111.A NE2 ASN 74.A OD1 no hydrogen 2.723 N/A LEU 112.A N LEU 109.A O no hydrogen 3.062 N/A THR 113.A N ARG 76.A O no hydrogen 3.025 N/A THR 113.A OG1 GLN 111.A O no hydrogen 3.072 N/A GLU 114.A N ARG 76.A O no hydrogen 3.191 N/A ILE 115.A N ILE 139.A O no hydrogen 2.924 N/A LEU 116.A N VAL 78.A O no hydrogen 2.979 N/A GLY 119.A N LYS 87.A O no hydrogen 3.169 N/A VAL 120.A N GLU 146.A O no hydrogen 3.301 N/A TYR 121.A N ILE 90.A O no hydrogen 2.759 N/A ILE 122.A N VAL 148.A O no hydrogen 2.865 N/A GLU 123.A N VAL 92.A O no hydrogen 3.067 N/A LYS 124.A N GLU 123.A OE1 no hydrogen 2.922 N/A ASN 125.A N ASP 151.A O no hydrogen 2.903 N/A ASN 125.A ND2 VAL 92.A O no hydrogen 3.125 N/A ASN 125.A ND2 ASN 152.A OD1 no hydrogen 2.954 N/A LYS 127.A NZ SER 100.A O no hydrogen 3.208 N/A LEU 128.A N ASN 125.A O no hydrogen 3.184 N/A CYS 129.A N ARG 105.A O no hydrogen 3.076 N/A CYS 129.A SG LYS 127.A O no hydrogen 3.648 N/A ASP 132.A N ASP 132.A OD1 no hydrogen 2.498 N/A THR 133.A OG1 CYS 167.A O no hydrogen 2.667 N/A ASP 135.A N GLN 176.A OE1 no hydrogen 3.006 N/A TRP 136.A NE1 MET 131.A O no hydrogen 3.127 N/A ARG 137.A NH1 ALA 145.A O no hydrogen 2.960 N/A ARG 137.A NH2 ALA 145.A O no hydrogen 2.839 N/A ASP 138.A N ASP 135.A O no hydrogen 2.819 N/A ILE 139.A N TRP 136.A O no hydrogen 2.962 N/A VAL 140.A N TRP 136.A O no hydrogen 2.925 N/A ARG 141.A N ILE 115.A O no hydrogen 2.970 N/A ARG 141.A NE LEU 116.A O no hydrogen 2.897 N/A ARG 141.A NH2 LEU 116.A O no hydrogen 3.010 N/A ASP 144.A N ASP 142.A OD1 no hydrogen 2.922 N/A ALA 145.A N ASP 142.A O no hydrogen 3.066 N/A VAL 148.A N VAL 120.A O no hydrogen 2.812 N/A LYS 150.A N ILE 122.A O no hydrogen 3.464 N/A ASP 151.A N GLU 123.A OE1 no hydrogen 2.886 N/A ASN 152.A N LYS 150.A O no hydrogen 2.794 N/A ASN 152.A ND2 ILE 122.A O no hydrogen 2.945 N/A GLY 153.A N ASN 125.A O no hydrogen 3.070 N/A ARG 154.A NH1 ASP 151.A OD1 no hydrogen 2.661 N/A ARG 154.A NH1 GLY 153.A O no hydrogen 2.924 N/A ARG 154.A NH2 ASP 151.A OD1 no hydrogen 2.701 N/A CYS 159.A SG HIS 130.A ND1 no hydrogen 3.980 N/A GLU 161.A N GLU 161.A OE1 no hydrogen 2.650 N/A VAL 162.A N HIS 160.A ND1 no hydrogen 3.054 N/A CYS 163.A N HIS 160.A O no hydrogen 2.807 N/A CYS 163.A SG GLY 171.A O no hydrogen 3.815 N/A LYS 164.A N GLU 161.A O no hydrogen 3.199 N/A ARG 166.A N CYS 163.A O no hydrogen 3.053 N/A ARG 166.A NH1 GLY 165.A O no hydrogen 3.018 N/A CYS 167.A N THR 133.A O no hydrogen 3.077 N/A CYS 167.A SG HIS 130.A ND1 no hydrogen 3.303 N/A CYS 167.A SG GLY 169.A O no hydrogen 2.988 N/A TRP 168.A N ASP 174.A O no hydrogen 2.776 N/A GLY 171.A N ASP 174.A OD2 no hydrogen 2.942 N/A GLU 173.A N GLU 173.A OE1 no hydrogen 2.594 N/A ASP 174.A N GLY 171.A O no hydrogen 3.109 N/A CYS 175.A N SER 172.A O no hydrogen 3.311 N/A CYS 175.A SG SER 172.A O no hydrogen 3.003 N/A GLN 176.A N ARG 166.A O no hydrogen 2.889 N/A THR 179.A N ASP 138.A OD2 no hydrogen 2.918 N/A THR 179.A OG1 HIS 190.A ND1 no hydrogen 2.700 N/A LYS 180.A N ASP 138.A OD1 no hydrogen 2.828 N/A LYS 180.A NZ ARG 137.A O no hydrogen 2.694 N/A THR 181.A N ASP 138.A OD1 no hydrogen 2.747 N/A THR 181.A OG1 ASP 138.A OD1 no hydrogen 3.114 N/A CYS 183.A N LYS 180.A O no hydrogen 3.105 N/A CYS 183.A SG THR 179.A O no hydrogen 2.985 N/A CYS 183.A SG GLY 189.A O no hydrogen 3.160 N/A GLN 186.A N GLN 186.A OE1 no hydrogen 2.566 N/A CYS 187.A N ALA 184.A O no hydrogen 2.933 N/A CYS 187.A SG HIS 190.A O no hydrogen 3.496 N/A HIS 190.A ND1 THR 179.A OG1 no hydrogen 2.700 N/A HIS 190.A NE2 GLU 114.A OE2 no hydrogen 2.638 N/A CYS 191.A N THR 179.A O no hydrogen 2.757 N/A PHE 192.A N GLN 198.A O no hydrogen 2.908 N/A ASN 195.A N GLN 198.A OE1 no hydrogen 2.937 N/A ASN 197.A N ASN 195.A OD1 no hydrogen 2.800 N/A GLN 198.A N ASN 195.A O no hydrogen 2.879 N/A CYS 199.A SG HIS 190.A O no hydrogen 3.679 N/A CYS 199.A SG CYS 200.A O no hydrogen 3.354 N/A CYS 200.A N HIS 190.A O no hydrogen 2.830 N/A GLU 203.A N HIS 201.A ND1 no hydrogen 3.004 N/A CYS 204.A N HIS 201.A O no hydrogen 2.902 N/A CYS 204.A SG GLY 206.A O no hydrogen 3.468 N/A CYS 204.A SG GLY 207.A O no hydrogen 3.371 N/A ALA 205.A N ALA 218.A O no hydrogen 2.769 N/A GLY 206.A N GLU 114.A OE1 no hydrogen 2.876 N/A CYS 208.A SG GLY 210.A O no hydrogen 2.993 N/A SER 209.A N ASP 215.A O no hydrogen 2.968 N/A SER 209.A OG ASP 215.A O no hydrogen 3.257 N/A GLN 212.A N ASP 215.A OD2 no hydrogen 2.965 N/A ASP 215.A N GLN 212.A O no hydrogen 3.151 N/A CYS 216.A SG ALA 205.A O no hydrogen 3.771 N/A CYS 216.A SG GLY 207.A O no hydrogen 3.755 N/A CYS 216.A SG ALA 218.A O no hydrogen 2.861 N/A PHE 217.A N GLY 207.A O no hydrogen 3.257 N/A CYS 219.A SG PHE 222.A O no hydrogen 3.837 N/A ARG 220.A N GLU 203.A O no hydrogen 2.935 N/A ARG 220.A NH1 ASP 202.A O no hydrogen 2.884 N/A HIS 221.A ND1 GLU 203.A OE1 no hydrogen 2.704 N/A PHE 222.A N VAL 229.A O no hydrogen 3.118 N/A ASN 223.A N GLY 257.A O no hydrogen 2.822 N/A ASP 224.A N ALA 227.A O no hydrogen 2.737 N/A GLY 226.A N ASN 223.A OD1 no hydrogen 3.054 N/A ALA 227.A N ASP 224.A O no hydrogen 2.949 N/A CYS 228.A N ASP 213.A O no hydrogen 2.927 N/A CYS 228.A SG ASP 213.A O no hydrogen 3.815 N/A VAL 229.A N PHE 222.A O no hydrogen 2.979 N/A CYS 232.A N GLN 254.A OE1 no hydrogen 3.192 N/A CYS 232.A SG TYR 253.A O no hydrogen 3.852 N/A GLN 234.A NE2 CYS 232.A O no hydrogen 2.884 N/A VAL 237.A N GLU 246.A O no hydrogen 2.717 N/A ASN 239.A N GLN 244.A O no hydrogen 2.904 N/A LEU 241.A N ASN 239.A OD1 no hydrogen 2.804 N/A THR 242.A N ASN 239.A OD1 no hydrogen 2.981 N/A PHE 243.A N ASN 239.A O no hydrogen 2.758 N/A GLN 244.A NE2 THR 242.A O no hydrogen 3.089 N/A GLU 246.A N VAL 237.A O no hydrogen 2.933 N/A ASN 248.A N PRO 235.A O no hydrogen 2.895 N/A ASN 248.A ND2 GLN 234.A O no hydrogen 2.848 N/A HIS 250.A N ASN 248.A OD1 no hydrogen 2.810 N/A LYS 252.A NZ ASP 224.A OD1 no hydrogen 2.800 N/A TYR 253.A N VAL 260.A O no hydrogen 2.782 N/A GLN 254.A N THR 272.A O no hydrogen 2.933 N/A GLN 254.A NE2 SER 273.A OG no hydrogen 2.958 N/A TYR 255.A N VAL 258.A O no hydrogen 3.131 N/A VAL 258.A N TYR 255.A O no hydrogen 3.015 N/A CYS 259.A N ASN 223.A O no hydrogen 3.355 N/A VAL 260.A N TYR 253.A O no hydrogen 2.980 N/A CYS 263.A SG PRO 264.A O no hydrogen 3.920 N/A HIS 265.A NE2 SER 419.A O no hydrogen 3.007 N/A ASN 266.A ND2 GLY 388.A O no hydrogen 3.086 N/A PHE 267.A N PRO 264.A O no hydrogen 3.109 N/A VAL 269.A N LYS 291.A O no hydrogen 2.910 N/A ASP 270.A N SER 273.A O no hydrogen 2.891 N/A GLN 271.A N ASP 270.A OD1 no hydrogen 2.792 N/A SER 273.A N ASP 270.A O no hydrogen 2.870 N/A CYS 274.A N GLN 254.A O no hydrogen 2.886 N/A VAL 275.A N VAL 268.A O no hydrogen 2.926 N/A ARG 276.A NE ARG 390.A O no hydrogen 2.910 N/A LYS 282.A N PRO 279.A O no hydrogen 2.986 N/A LYS 282.A NZ ASP 281.A OD2 no hydrogen 2.796 N/A MET 283.A N GLU 294.A O no hydrogen 2.808 N/A VAL 285.A N MET 292.A O no hydrogen 2.868 N/A LYS 287.A N LEU 290.A O no hydrogen 3.003 N/A LYS 287.A NZ GLU 294.A OE2 no hydrogen 2.692 N/A LYS 291.A NZ ASP 286.A OD1 no hydrogen 2.775 N/A MET 292.A N VAL 285.A O no hydrogen 2.873 N/A CYS 293.A N VAL 269.A O no hydrogen 2.961 N/A CYS 293.A SG VAL 269.A O no hydrogen 3.863 N/A GLU 294.A N MET 283.A O no hydrogen 2.886 N/A LYS 298.A NZ VAL 321.A O no hydrogen 2.901 N/A CYS 300.A N LYS 298.A O no hydrogen 2.893 N/A GLY 302.A N LEU 327.A O no hydrogen 3.052 N/A THR 303.A N ASN 329.A O no hydrogen 2.980 N/A THR 303.A OG1 ASP 331.A OD1 no hydrogen 2.689 N/A GLY 304.A N PHE 309.A O no hydrogen 2.871 N/A SER 307.A N GLY 304.A O no hydrogen 3.242 N/A SER 307.A OG GLY 302.A O no hydrogen 2.677 N/A PHE 309.A N SER 307.A OG no hydrogen 3.320 N/A THR 311.A OG1 VAL 312.A O no hydrogen 2.790 N/A THR 311.A OG1 ASP 331.A O no hydrogen 3.361 N/A VAL 312.A N ASP 331.A O no hydrogen 2.916 N/A SER 314.A N ASP 313.A OD1 no hydrogen 2.586 N/A SER 314.A OG ASP 313.A OD1 no hydrogen 3.557 N/A SER 314.A OG PRO 346.A O no hydrogen 2.655 N/A SER 315.A OG ASN 316.A OD1 no hydrogen 3.070 N/A ASN 316.A N ASP 313.A O no hydrogen 2.973 N/A ASN 316.A ND2 THR 311.A O no hydrogen 2.982 N/A ILE 317.A N ASP 313.A O no hydrogen 2.821 N/A GLY 319.A N ASN 316.A O no hydrogen 3.040 N/A PHE 320.A N ILE 317.A O no hydrogen 3.178 N/A VAL 321.A N ASP 318.A O no hydrogen 3.320 N/A CYS 323.A N PHE 320.A O no hydrogen 3.016 N/A CYS 323.A SG LYS 325.A O no hydrogen 3.603 N/A LYS 325.A NZ GLU 284.A OE1 no hydrogen 2.784 N/A ILE 326.A N GLU 361.A O no hydrogen 2.818 N/A LEU 327.A N CYS 300.A O no hydrogen 2.834 N/A GLY 328.A N ILE 326.A O no hydrogen 3.001 N/A ASN 329.A ND2 SER 391.A OG no hydrogen 3.005 N/A LEU 330.A N TYR 365.A O no hydrogen 2.890 N/A ASP 331.A N THR 303.A OG1 no hydrogen 2.802 N/A PHE 332.A N ASN 367.A O no hydrogen 2.784 N/A LEU 333.A N THR 311.A OG1 no hydrogen 3.134 N/A GLY 336.A N LEU 333.A O no hydrogen 2.902 N/A LEU 337.A N ILE 334.A O no hydrogen 3.069 N/A ASN 338.A N ILE 334.A O no hydrogen 2.999 N/A GLY 339.A N THR 335.A O no hydrogen 2.975 N/A ASP 340.A N ILE 345.A O no hydrogen 2.742 N/A TRP 342.A N ASP 340.A OD1 no hydrogen 3.152 N/A HIS 343.A N ASP 340.A O no hydrogen 2.944 N/A LYS 344.A N PRO 341.A O no hydrogen 3.010 N/A ILE 345.A N ASP 340.A O no hydrogen 3.117 N/A LEU 348.A N LEU 337.A O no hydrogen 3.034 N/A GLU 351.A N ASP 349.A OD1 no hydrogen 2.925 N/A LYS 352.A N ASP 349.A O no hydrogen 2.818 N/A LYS 352.A NZ ASP 318.A OD1 no hydrogen 2.857 N/A LEU 353.A N PRO 350.A O no hydrogen 3.202 N/A ASN 354.A N GLU 351.A O no hydrogen 3.370 N/A ASN 354.A ND2 GLU 351.A O no hydrogen 2.547 N/A ASN 354.A ND2 GLU 351.A OE1 no hydrogen 3.093 N/A VAL 355.A N LYS 352.A O no hydrogen 3.263 N/A PHE 356.A N LEU 353.A O no hydrogen 2.974 N/A ARG 357.A N ASN 354.A O no hydrogen 3.109 N/A ARG 357.A NE ASN 354.A OD1 no hydrogen 2.755 N/A ARG 357.A NH2 ASN 354.A OD1 no hydrogen 2.992 N/A THR 358.A OG1 CYS 323.A O no hydrogen 2.685 N/A THR 358.A OG1 VAL 355.A O no hydrogen 3.452 N/A VAL 359.A N PHE 356.A O no hydrogen 3.134 N/A ARG 360.A N THR 324.A O no hydrogen 2.784 N/A GLU 361.A N THR 324.A O no hydrogen 3.208 N/A ILE 362.A N THR 386.A O no hydrogen 3.288 N/A THR 363.A N ILE 326.A O no hydrogen 3.099 N/A THR 363.A OG1 ILE 326.A O no hydrogen 3.153 N/A GLY 364.A N GLY 328.A O no hydrogen 3.053 N/A TYR 365.A N ASN 329.A OD1 no hydrogen 2.942 N/A TYR 365.A OH ASP 331.A OD1 no hydrogen 2.999 N/A TYR 365.A OH ASP 331.A OD2 no hydrogen 2.825 N/A LEU 366.A N SER 398.A O no hydrogen 2.906 N/A ASN 367.A N LEU 330.A O no hydrogen 2.893 N/A ASN 367.A ND2 ASP 331.A OD2 no hydrogen 2.921 N/A ILE 368.A N LEU 400.A O no hydrogen 2.816 N/A GLN 369.A N PHE 332.A O no hydrogen 2.940 N/A GLN 369.A NE2 ASN 367.A OD1 no hydrogen 3.087 N/A TRP 371.A NE1 ASN 377.A O no hydrogen 2.858 N/A HIS 374.A NE2 GLU 351.A OE2 no hydrogen 3.091 N/A MET 375.A N PRO 372.A O no hydrogen 3.008 N/A HIS 376.A ND1 ASN 406.A O no hydrogen 2.764 N/A SER 379.A N ASN 377.A OD1 no hydrogen 3.077 N/A SER 379.A OG ASN 377.A OD1 no hydrogen 2.610 N/A PHE 381.A N PHE 378.A O no hydrogen 2.882 N/A SER 382.A N SER 379.A O no hydrogen 2.838 N/A SER 382.A OG SER 379.A O no hydrogen 3.037 N/A LEU 384.A N PHE 381.A O no hydrogen 2.837 N/A THR 385.A N ARG 360.A O no hydrogen 2.748 N/A THR 385.A OG1 ARG 360.A O no hydrogen 2.988 N/A THR 386.A N ARG 360.A O no hydrogen 3.295 N/A THR 386.A OG1 GLU 417.A O no hydrogen 3.234 N/A ILE 387.A N GLU 417.A O no hydrogen 3.205 N/A GLY 388.A N ILE 362.A O no hydrogen 2.738 N/A GLY 389.A N GLY 364.A O no hydrogen 3.166 N/A ARG 390.A N THR 363.A O no hydrogen 2.986 N/A ARG 390.A NE ASN 266.A O no hydrogen 2.843 N/A ARG 390.A NH1 ARG 276.A O no hydrogen 2.807 N/A ARG 390.A NH1 GLU 284.A OE2 no hydrogen 2.705 N/A ARG 390.A NH2 GLU 284.A OE1 no hydrogen 2.884 N/A ARG 390.A NH2 GLU 284.A OE2 no hydrogen 3.484 N/A SER 391.A OG ASN 329.A OD1 no hydrogen 3.263 N/A TYR 393.A N PHE 397.A O no hydrogen 2.814 N/A ARG 395.A N LEU 392.A O no hydrogen 3.029 N/A GLY 396.A N TYR 393.A O no hydrogen 2.952 N/A PHE 397.A N TYR 393.A O no hydrogen 3.085 N/A SER 398.A N ARG 422.A O no hydrogen 2.845 N/A SER 398.A OG ALA 420.A O no hydrogen 2.652 N/A SER 398.A OG ARG 422.A O no hydrogen 3.485 N/A LEU 399.A N ARG 422.A O no hydrogen 3.410 N/A LEU 400.A N LEU 366.A O no hydrogen 2.834 N/A ILE 401.A N TYR 424.A O no hydrogen 2.867 N/A MET 402.A N ILE 368.A O no hydrogen 2.996 N/A LYS 403.A N SER 426.A O no hydrogen 3.190 N/A ASN 404.A N ASN 428.A OD1 no hydrogen 2.789 N/A ASN 404.A ND2 ILE 368.A O no hydrogen 3.494 N/A ASN 404.A ND2 ASN 428.A OD1 no hydrogen 2.998 N/A ASN 406.A ND2 PRO 373.A O no hydrogen 2.942 N/A VAL 407.A N ASN 404.A O no hydrogen 3.328 N/A THR 408.A N HIS 376.A O no hydrogen 2.872 N/A THR 408.A OG1 HIS 376.A O no hydrogen 3.407 N/A SER 409.A N HIS 376.A O no hydrogen 3.423 N/A LEU 410.A N TRP 479.A O no hydrogen 3.068 N/A GLY 411.A N TRP 479.A O no hydrogen 3.200 N/A ARG 413.A NE GLY 484.A O no hydrogen 2.730 N/A ARG 413.A NH2 GLY 484.A O no hydrogen 2.993 N/A SER 414.A N SER 382.A O no hydrogen 3.190 N/A SER 414.A OG SER 382.A O no hydrogen 2.894 N/A LEU 415.A N PHE 412.A O no hydrogen 2.899 N/A LYS 416.A N THR 385.A O no hydrogen 2.884 N/A GLU 417.A N THR 385.A O no hydrogen 3.500 N/A ILE 418.A N VAL 442.A O no hydrogen 2.894 N/A SER 419.A N ILE 387.A O no hydrogen 3.063 N/A ARG 422.A N GLY 396.A O no hydrogen 2.788 N/A ILE 423.A N ARG 450.A O no hydrogen 3.012 N/A TYR 424.A N LEU 399.A O no hydrogen 2.873 N/A ILE 425.A N ASP 452.A O no hydrogen 2.851 N/A SER 426.A N ILE 401.A O no hydrogen 3.118 N/A SER 426.A OG TYR 424.A OH no hydrogen 3.055 N/A ALA 427.A N HIS 455.A O no hydrogen 2.672 N/A ASN 428.A N ASN 456.A OD1 no hydrogen 2.941 N/A ASN 428.A ND2 ILE 401.A O no hydrogen 3.049 N/A ASN 428.A ND2 ASN 456.A OD1 no hydrogen 3.260 N/A ARG 429.A NE LEU 405.A O no hydrogen 2.930 N/A ARG 429.A NH2 ASN 406.A OD1 no hydrogen 3.290 N/A LEU 431.A N ASN 428.A O no hydrogen 3.024 N/A CYS 432.A N THR 408.A O no hydrogen 2.877 N/A CYS 432.A SG LYS 467.A O no hydrogen 3.741 N/A TYR 433.A N THR 408.A O no hydrogen 3.470 N/A HIS 435.A NE2 ARG 457.A O no hydrogen 2.642 N/A LEU 437.A N HIS 434.A O no hydrogen 3.256 N/A ASN 438.A N GLY 476.A O no hydrogen 2.846 N/A LYS 441.A N ASN 438.A O no hydrogen 3.050 N/A LYS 441.A NZ SER 475.A O no hydrogen 2.582 N/A VAL 442.A N TRP 439.A O no hydrogen 3.003 N/A LEU 443.A N TRP 439.A O no hydrogen 2.786 N/A ARG 444.A N ILE 418.A O no hydrogen 3.078 N/A ARG 444.A NH1 GLU 417.A OE1 no hydrogen 3.204 N/A ARG 444.A NH2 LYS 441.A O no hydrogen 2.945 N/A THR 447.A N GLU 448.A OE1 no hydrogen 2.856 N/A GLU 448.A N GLU 448.A OE1 no hydrogen 2.558 N/A GLU 449.A N GLU 449.A OE1 no hydrogen 2.585 N/A ARG 450.A N THR 447.A O no hydrogen 2.867 N/A ARG 450.A NE GLY 421.A O no hydrogen 3.055 N/A ARG 450.A NH1 ARG 444.A O no hydrogen 2.687 N/A ARG 450.A NH1 PRO 446.A O no hydrogen 2.703 N/A ARG 450.A NH2 GLY 421.A O no hydrogen 2.915 N/A ARG 450.A NH2 ARG 444.A O no hydrogen 3.352 N/A ASP 452.A N ILE 423.A O no hydrogen 3.044 N/A LYS 454.A N ASP 452.A OD1 no hydrogen 3.062 N/A ASN 456.A ND2 ILE 425.A O no hydrogen 2.886 N/A ASN 456.A ND2 ILE 453.A O no hydrogen 2.801 N/A ARG 457.A N ASN 428.A O no hydrogen 3.321 N/A ARG 457.A NE GLN 430.A O no hydrogen 2.932 N/A ARG 457.A NH2 GLN 430.A O no hydrogen 2.723 N/A ARG 457.A NH2 GLN 430.A OE1 no hydrogen 2.627 N/A ARG 460.A NE ASP 461.A OD1 no hydrogen 2.978 N/A ARG 460.A NH2 ASP 461.A OD1 no hydrogen 3.526 N/A ARG 460.A NH2 ASP 461.A OD2 no hydrogen 3.067 N/A CYS 462.A N PRO 458.A O no hydrogen 3.027 N/A CYS 462.A SG CYS 432.A O no hydrogen 3.084 N/A CYS 462.A SG LYS 467.A O no hydrogen 3.238 N/A VAL 463.A N ARG 459.A O no hydrogen 2.947 N/A ALA 464.A N ARG 460.A O no hydrogen 2.958 N/A GLU 465.A N ASP 461.A O no hydrogen 2.903 N/A GLY 466.A N VAL 463.A O no hydrogen 2.805 N/A LYS 467.A N CYS 462.A O no hydrogen 2.982 N/A LYS 467.A NZ GLU 465.A OE1 no hydrogen 2.874 N/A VAL 468.A N GLY 466.A O no hydrogen 2.886 N/A CYS 469.A SG ASP 470.A O no hydrogen 3.802 N/A CYS 469.A SG GLY 480.A O no hydrogen 3.355 N/A CYS 469.A SG GLY 482.A O no hydrogen 3.750 N/A ASP 470.A N PRO 481.A O no hydrogen 3.330 N/A LEU 472.A N ASP 470.A OD1 no hydrogen 2.856 N/A CYS 473.A N ASP 470.A O no hydrogen 3.018 N/A CYS 473.A SG SER 474.A O no hydrogen 3.619 N/A CYS 473.A SG GLY 477.A O no hydrogen 3.233 N/A CYS 473.A SG SER 488.A O no hydrogen 3.521 N/A SER 474.A N SER 488.A O no hydrogen 2.840 N/A GLY 477.A N SER 474.A O no hydrogen 3.416 N/A TRP 479.A N GLN 485.A O no hydrogen 2.874 N/A GLY 482.A N GLN 485.A OE1 no hydrogen 2.968 N/A GLN 485.A N GLY 482.A O no hydrogen 3.052 N/A CYS 486.A N PRO 483.A O no hydrogen 3.369 N/A CYS 486.A SG SER 488.A O no hydrogen 2.905 N/A LEU 487.A N GLY 477.A O no hydrogen 3.190 N/A CYS 489.A SG LEU 472.A O no hydrogen 3.822 N/A CYS 489.A SG TYR 492.A O no hydrogen 3.039 N/A CYS 489.A SG VAL 499.A O no hydrogen 3.731 N/A ARG 490.A N LEU 472.A O no hydrogen 3.190 N/A ARG 490.A NE PRO 471.A O no hydrogen 2.885 N/A ASN 491.A ND2 THR 500.A O no hydrogen 2.783 N/A TYR 492.A N VAL 499.A O no hydrogen 3.462 N/A SER 493.A N ALA 516.A O no hydrogen 2.901 N/A SER 493.A OG GLU 517.A OE1 no hydrogen 2.710 N/A ARG 494.A N VAL 497.A O no hydrogen 2.778 N/A ARG 494.A NE GLU 511.A OE2 no hydrogen 3.063 N/A ARG 494.A NH2 HIS 501.A O no hydrogen 3.098 N/A ARG 494.A NH2 GLU 511.A OE1 no hydrogen 2.990 N/A GLY 495.A N GLU 517.A OE2 no hydrogen 2.662 N/A VAL 497.A N ARG 494.A O no hydrogen 3.005 N/A CYS 498.A N PRO 483.A O no hydrogen 3.040 N/A CYS 498.A SG LEU 472.A O no hydrogen 3.338 N/A VAL 499.A N TYR 492.A O no hydrogen 2.957 N/A THR 500.A OG1 HIS 501.A ND1 no hydrogen 2.822 N/A HIS 501.A ND1 THR 500.A OG1 no hydrogen 2.822 N/A ASN 503.A N GLU 511.A OE1 no hydrogen 2.856 N/A PHE 504.A N CYS 502.A O no hydrogen 2.950 N/A GLY 507.A N ASN 506.A OD1 no hydrogen 2.664 N/A GLU 508.A N GLU 508.A OE1 no hydrogen 2.620 N/A ARG 510.A N GLU 508.A O no hydrogen 2.928 N/A ARG 510.A NE MET 528.A O no hydrogen 2.964 N/A ARG 510.A NH1 GLY 507.A O no hydrogen 2.525 N/A ARG 510.A NH2 MET 528.A O no hydrogen 2.702 N/A GLU 511.A N ASN 503.A O no hydrogen 2.719 N/A PHE 512.A N PHE 519.A O no hydrogen 2.712 N/A HIS 514.A N GLU 517.A O no hydrogen 3.125 N/A GLU 517.A N HIS 514.A O no hydrogen 2.904 N/A CYS 518.A N SER 493.A O no hydrogen 2.883 N/A CYS 518.A SG SER 493.A O no hydrogen 3.396 N/A PHE 519.A N PHE 512.A O no hydrogen 3.053 N/A CYS 521.A N ARG 510.A O no hydrogen 2.895 N/A GLU 524.A N HIS 522.A ND1 no hydrogen 2.980 N/A CYS 525.A N HIS 522.A O no hydrogen 2.851 N/A CYS 525.A SG GLN 526.A O no hydrogen 3.798 N/A CYS 525.A SG THR 533.A O no hydrogen 3.504 N/A GLN 526.A N GLN 544.A O no hydrogen 3.092 N/A GLN 526.A NE2 PRO 527.A O no hydrogen 3.224 N/A MET 528.A N THR 533.A OG1 no hydrogen 3.108 N/A GLY 530.A N LEU 505.A O no hydrogen 3.460 N/A THR 533.A N PHE 504.A O no hydrogen 3.292 N/A THR 533.A OG1 PHE 504.A O no hydrogen 3.485 N/A CYS 534.A SG GLY 536.A O no hydrogen 3.133 N/A ASN 535.A N THR 541.A O no hydrogen 2.992 N/A THR 541.A N GLY 538.A O no hydrogen 3.345 N/A THR 541.A OG1 GLY 538.A O no hydrogen 2.849 N/A CYS 542.A SG GLN 526.A O no hydrogen 3.946 N/A CYS 542.A SG THR 533.A O no hydrogen 3.701 N/A CYS 542.A SG GLN 544.A O no hydrogen 2.838 N/A ALA 543.A N THR 533.A O no hydrogen 3.258 N/A CYS 545.A SG PHE 548.A O no hydrogen 3.118 N/A ALA 546.A N GLU 524.A O no hydrogen 3.172 N/A PHE 548.A N VAL 555.A O no hydrogen 3.069 N/A ARG 549.A N ASN 577.A O no hydrogen 2.841 N/A ARG 549.A NE GLY 551.A O no hydrogen 2.955 N/A ASP 550.A N HIS 553.A O no hydrogen 2.779 N/A HIS 553.A N ASP 550.A O no hydrogen 3.003 N/A CYS 554.A N SER 539.A O no hydrogen 3.130 N/A CYS 554.A SG GLU 524.A O no hydrogen 3.040 N/A CYS 554.A SG PHE 548.A O no hydrogen 4.023 N/A VAL 555.A N PHE 548.A O no hydrogen 2.870 N/A GLY 561.A N ILE 569.A O no hydrogen 2.894 N/A VAL 562.A N ILE 569.A O no hydrogen 3.286 N/A GLY 564.A N GLY 567.A O no hydrogen 2.986 N/A GLY 567.A N GLY 564.A O no hydrogen 3.110 N/A ILE 569.A N VAL 562.A O no hydrogen 2.610 N/A TYR 570.A OH GLN 588.A OE1 no hydrogen 2.682 N/A LYS 571.A N PRO 559.A O no hydrogen 2.984 N/A LYS 571.A NZ ASP 550.A OD1 no hydrogen 2.410 N/A LYS 571.A NZ ASP 550.A OD2 no hydrogen 3.303 N/A TYR 572.A N ARG 580.A O no hydrogen 2.701 N/A ASP 574.A N GLU 578.A O no hydrogen 2.745 N/A VAL 575.A N ASP 574.A OD1 no hydrogen 2.577 N/A ASN 577.A N ASP 574.A O no hydrogen 2.886 N/A CYS 579.A N ARG 549.A O no hydrogen 2.780 N/A CYS 579.A SG ARG 549.A O no hydrogen 3.564 N/A ARG 580.A N TYR 572.A O no hydrogen 2.768 N/A ARG 580.A NH1 GLU 578.A OE1 no hydrogen 3.502 N/A ARG 580.A NH1 CYS 579.A O no hydrogen 2.870 N/A ARG 580.A NH2 GLU 578.A OE1 no hydrogen 2.945 N/A CYS 582.A N TYR 570.A O no hydrogen 2.914 N/A CYS 582.A SG TYR 570.A O no hydrogen 3.516 N/A GLU 584.A N GLU 584.A OE1 no hydrogen 2.666 N/A ASN 585.A N HIS 583.A ND1 no hydrogen 3.046 N/A CYS 586.A N HIS 583.A O no hydrogen 3.025 N/A CYS 586.A SG HIS 583.A O no hydrogen 3.299 N/A THR 587.A OG1 LEU 599.A O no hydrogen 2.555 N/A CYS 590.A SG GLY 592.A O no hydrogen 3.036 N/A LYS 591.A N ASP 597.A O no hydrogen 2.902 N/A LYS 591.A NZ ASP 597.A OD1 no hydrogen 2.746 N/A GLU 594.A N ASP 597.A OD2 no hydrogen 3.078 N/A GLN 596.A N GLN 596.A OE1 no hydrogen 2.654 N/A ASP 597.A N GLU 594.A O no hydrogen 3.050 N/A CYS 598.A N LEU 595.A O no hydrogen 3.081 N/A CYS 598.A SG GLU 594.A O no hydrogen 3.820 N/A CYS 598.A SG LEU 595.A O no hydrogen 3.115 N/A LEU 599.A N GLY 589.A O no hydrogen 3.100 N/A