Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1x39_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): TYR 2.A OH ASP 7.A OD2 no hydrogen 2.643 N/A TYR 5.A N ASP 18.A OD1 no hydrogen 3.046 N/A TYR 5.A OH LEU 86.A O no hydrogen 2.662 N/A LYS 6.A N VAL 3.A O no hydrogen 3.188 N/A ASP 7.A N LEU 4.A O no hydrogen 2.886 N/A THR 9.A N ASP 7.A OD1 no hydrogen 3.003 N/A THR 9.A OG1 ASP 7.A OD1 no hydrogen 2.665 N/A THR 9.A OG1 ASP 7.A OD2 no hydrogen 3.316 N/A LYS 10.A N ASP 7.A O no hydrogen 3.081 N/A ARG 15.A N PRO 11.A O no hydrogen 2.969 N/A ARG 15.A NE TYR 5.A O no hydrogen 2.884 N/A ARG 15.A NH1 GLU 360.A OE1 no hydrogen 2.955 N/A ARG 15.A NH1 GLU 360.A OE2 no hydrogen 3.469 N/A ARG 15.A NH2 TYR 5.A O no hydrogen 2.904 N/A ARG 15.A NH2 GLU 360.A OE2 no hydrogen 2.918 N/A VAL 16.A N VAL 12.A O no hydrogen 2.795 N/A ALA 17.A N GLU 13.A O no hydrogen 2.992 N/A ASP 18.A N ASP 14.A O no hydrogen 2.974 N/A LEU 19.A N ARG 15.A O no hydrogen 3.012 N/A LEU 20.A N VAL 16.A O no hydrogen 2.921 N/A GLY 21.A N ALA 17.A O no hydrogen 3.146 N/A ARG 22.A N LEU 19.A O no hydrogen 2.940 N/A ARG 22.A NE ASP 18.A OD1 no hydrogen 2.859 N/A ARG 22.A NH1 ASP 18.A OD1 no hydrogen 3.021 N/A ARG 22.A NH1 ASP 18.A OD2 no hydrogen 3.095 N/A MET 23.A N LEU 20.A O no hydrogen 3.204 N/A THR 24.A N GLU 27.A OE1 no hydrogen 2.897 N/A GLU 27.A N THR 24.A OG1 no hydrogen 3.069 N/A LYS 28.A N THR 24.A O no hydrogen 2.905 N/A LYS 28.A NZ ASP 343.A OD1 no hydrogen 2.853 N/A ILE 29.A N LEU 25.A O no hydrogen 2.890 N/A GLY 30.A N ALA 26.A O no hydrogen 2.919 N/A GLN 31.A N GLU 27.A O no hydrogen 3.121 N/A MET 32.A N LYS 28.A O no hydrogen 3.367 N/A MET 32.A N ILE 29.A O no hydrogen 3.019 N/A THR 33.A N GLY 30.A O no hydrogen 3.005 N/A THR 33.A OG1 ILE 29.A O no hydrogen 2.845 N/A GLN 34.A N ILE 315.A O no hydrogen 2.942 N/A GLN 34.A NE2 SER 52.A OG no hydrogen 2.920 N/A ILE 35.A N SER 52.A O no hydrogen 3.029 N/A GLU 36.A N PRO 318.A O no hydrogen 2.861 N/A ARG 37.A N LEU 54.A O no hydrogen 3.001 N/A ARG 37.A NH2 SER 59.A OG no hydrogen 2.955 N/A LEU 38.A N GLU 36.A OE1 no hydrogen 2.970 N/A VAL 39.A N GLU 36.A O no hydrogen 2.982 N/A ALA 40.A N ARG 37.A O no hydrogen 3.133 N/A VAL 44.A N THR 41.A OG1 no hydrogen 2.983 N/A LEU 45.A N THR 41.A O no hydrogen 3.010 N/A ARG 46.A N PRO 42.A O no hydrogen 3.033 N/A ARG 46.A NE SER 83.A OG no hydrogen 2.783 N/A ARG 46.A NH2 SER 83.A OG no hydrogen 3.372 N/A ASP 47.A N ASP 43.A O no hydrogen 2.774 N/A ASN 48.A N VAL 44.A O no hydrogen 3.116 N/A ASN 48.A ND2 VAL 44.A O no hydrogen 2.873 N/A PHE 49.A N ARG 46.A O no hydrogen 3.175 N/A ILE 50.A N LEU 45.A O no hydrogen 3.112 N/A GLY 51.A N GLY 30.A O no hydrogen 2.836 N/A SER 52.A N THR 33.A O no hydrogen 3.241 N/A SER 52.A OG LEU 53.A O no hydrogen 3.490 N/A SER 52.A OG ILE 91.A O no hydrogen 2.725 N/A LEU 53.A N ILE 91.A O no hydrogen 3.127 N/A LEU 54.A N ILE 35.A O no hydrogen 3.021 N/A SER 55.A N GLY 93.A O no hydrogen 3.147 N/A SER 55.A OG SER 59.A O no hydrogen 2.674 N/A SER 55.A OG TYR 92.A OH no hydrogen 2.697 N/A GLY 56.A N GLU 36.A OE2 no hydrogen 2.760 N/A SER 59.A N GLY 56.A O no hydrogen 2.991 N/A SER 59.A OG GLU 36.A OE1 no hydrogen 2.819 N/A SER 59.A OG GLU 36.A OE2 no hydrogen 3.120 N/A ARG 62.A NE GLU 69.A OE1 no hydrogen 2.679 N/A ARG 62.A NH2 GLU 69.A OE2 no hydrogen 3.378 N/A LYS 63.A NZ GLU 433.A OE2 no hydrogen 2.928 N/A ALA 65.A N ARG 62.A O no hydrogen 3.308 N/A THR 66.A N GLU 69.A OE2 no hydrogen 3.051 N/A LYS 68.A NZ ASP 72.A OD1 no hydrogen 3.449 N/A LYS 68.A NZ ASP 72.A OD2 no hydrogen 2.581 N/A GLU 69.A N THR 66.A OG1 no hydrogen 3.041 N/A TRP 70.A N THR 66.A O no hydrogen 3.133 N/A GLN 71.A N ALA 67.A O no hydrogen 2.960 N/A GLN 71.A NE2 ALA 137.A O no hydrogen 2.862 N/A GLN 71.A NE2 ASP 365.A O no hydrogen 2.975 N/A ASP 72.A N LYS 68.A O no hydrogen 2.880 N/A MET 73.A N GLU 69.A O no hydrogen 3.020 N/A VAL 74.A N TRP 70.A O no hydrogen 2.949 N/A ASP 75.A N GLN 71.A O no hydrogen 2.843 N/A GLY 76.A N ASP 72.A O no hydrogen 2.963 N/A PHE 77.A N MET 73.A O no hydrogen 3.190 N/A GLN 78.A N VAL 74.A O no hydrogen 2.858 N/A GLN 78.A NE2 MET 90.A O no hydrogen 2.949 N/A GLN 78.A NE2 PRO 362.A O no hydrogen 2.971 N/A LYS 79.A N ASP 75.A O no hydrogen 2.816 N/A ALA 80.A N GLY 76.A O no hydrogen 3.396 N/A CYS 81.A N PHE 77.A O no hydrogen 3.129 N/A CYS 81.A SG ILE 50.A O no hydrogen 3.967 N/A CYS 81.A SG PHE 77.A O no hydrogen 3.545 N/A MET 82.A N GLN 78.A O no hydrogen 2.782 N/A SER 83.A N ALA 80.A O no hydrogen 3.150 N/A SER 83.A OG ALA 80.A O no hydrogen 2.655 N/A THR 84.A N CYS 81.A O no hydrogen 3.278 N/A THR 84.A OG1 CYS 81.A O no hydrogen 2.936 N/A ARG 85.A NE GLU 27.A OE2 no hydrogen 2.902 N/A ARG 85.A NH2 ARG 22.A O no hydrogen 2.910 N/A ARG 85.A NH2 GLU 27.A OE1 no hydrogen 2.878 N/A ARG 85.A NH2 GLU 27.A OE2 no hydrogen 3.408 N/A GLY 87.A N THR 84.A O no hydrogen 3.125 N/A GLY 87.A N THR 84.A OG1 no hydrogen 3.017 N/A MET 90.A N GLN 78.A OE1 no hydrogen 2.785 N/A ILE 91.A N GLY 51.A O no hydrogen 3.284 N/A TYR 92.A N GLN 141.A OE1 no hydrogen 2.859 N/A TYR 92.A OH SER 55.A OG no hydrogen 2.697 N/A GLY 93.A N LEU 53.A O no hydrogen 2.873 N/A ILE 94.A N TYR 142.A O no hydrogen 3.038 N/A ALA 96.A N ILE 94.A O no hydrogen 3.062 N/A HIS 98.A ND1 PHE 109.A O no hydrogen 3.017 N/A HIS 98.A NE2 TRP 430.A O no hydrogen 2.634 N/A GLN 100.A NE2 THR 138.A OG1 no hydrogen 2.849 N/A ASN 101.A ND2 ASP 95.A O no hydrogen 3.138 N/A ASN 101.A ND2 GLY 99.A O no hydrogen 3.123 N/A VAL 103.A N GLN 100.A O no hydrogen 3.089 N/A GLY 105.A N THR 442.A OG1 no hydrogen 2.934 N/A ALA 106.A N VAL 103.A O no hydrogen 3.161 N/A THR 107.A N GLU 134.A OE1 no hydrogen 2.957 N/A THR 107.A OG1 GLU 134.A OE2 no hydrogen 2.734 N/A ILE 108.A N SER 548.A OG no hydrogen 2.943 N/A PHE 109.A N HIS 98.A O no hydrogen 2.945 N/A HIS 111.A N LEU 545.A O no hydrogen 3.085 N/A HIS 111.A NE2 GLY 429.A O no hydrogen 2.840 N/A ASN 112.A ND2 GLU 161.A O no hydrogen 2.827 N/A VAL 113.A N TYR 160.A O no hydrogen 2.992 N/A LEU 115.A N HIS 111.A O no hydrogen 3.247 N/A GLY 116.A N ASN 112.A O no hydrogen 2.826 N/A ALA 117.A N VAL 113.A O no hydrogen 3.200 N/A THR 118.A N LEU 115.A O no hydrogen 3.036 N/A THR 118.A OG1 LEU 115.A O no hydrogen 2.630 N/A ARG 119.A N GLY 116.A O no hydrogen 3.240 N/A ARG 119.A NH1 GLY 116.A O no hydrogen 3.015 N/A ARG 119.A NH1 ARG 566.A O no hydrogen 2.838 N/A ARG 119.A NH1 LEU 567.A O no hydrogen 3.527 N/A ARG 119.A NH2 LEU 567.A O no hydrogen 2.792 N/A ASP 120.A N THR 118.A OG1 no hydrogen 3.119 N/A LEU 123.A N ASP 120.A OD1 no hydrogen 3.044 N/A VAL 124.A N ASP 120.A O no hydrogen 3.199 N/A LYS 125.A N PRO 121.A O no hydrogen 2.855 N/A LYS 125.A NZ ASP 183.A OD1 no hydrogen 2.867 N/A LYS 125.A NZ ASP 183.A OD2 no hydrogen 2.936 N/A ARG 126.A N TYR 122.A O no hydrogen 2.933 N/A ARG 126.A NH1 GLU 383.A OE2 no hydrogen 3.020 N/A ARG 126.A NH2 GLU 383.A OE1 no hydrogen 3.071 N/A ILE 127.A N LEU 123.A O no hydrogen 2.918 N/A GLY 128.A N VAL 124.A O no hydrogen 2.916 N/A GLU 129.A N LYS 125.A O no hydrogen 2.929 N/A ALA 130.A N ARG 126.A O no hydrogen 2.964 N/A THR 131.A N ILE 127.A O no hydrogen 2.799 N/A THR 131.A OG1 ILE 127.A O no hydrogen 2.818 N/A ALA 132.A N GLY 128.A O no hydrogen 2.878 N/A LEU 133.A N GLU 129.A O no hydrogen 3.335 N/A GLU 134.A N ALA 130.A O no hydrogen 3.024 N/A VAL 135.A N THR 131.A O no hydrogen 2.825 N/A ARG 136.A N ALA 132.A O no hydrogen 2.867 N/A ARG 136.A NE LYS 200.A O no hydrogen 2.759 N/A ARG 136.A NH2 LYS 200.A O no hydrogen 3.089 N/A ALA 137.A N LEU 133.A O no hydrogen 2.804 N/A THR 138.A N VAL 135.A O no hydrogen 3.020 N/A THR 138.A OG1 VAL 135.A O no hydrogen 2.715 N/A GLY 139.A N ARG 136.A O no hydrogen 3.028 N/A ILE 140.A N VAL 135.A O no hydrogen 3.284 N/A TYR 142.A OH THR 248.A OG1 no hydrogen 2.739 N/A ALA 143.A N ALA 202.A O no hydrogen 2.952 N/A PHE 144.A N ILE 94.A O no hydrogen 2.871 N/A ALA 145.A N ALA 143.A O no hydrogen 2.880 N/A CYS 147.A SG GLU 161.A O no hydrogen 3.590 N/A CYS 147.A SG LYS 206.A O no hydrogen 3.801 N/A ILE 148.A N LYS 206.A O no hydrogen 2.759 N/A CYS 151.A N SER 162.A OG no hydrogen 3.008 N/A CYS 151.A SG ASP 153.A O no hydrogen 3.275 N/A ARG 152.A N GLY 212.A O no hydrogen 2.824 N/A ARG 152.A NH2 GLU 165.A O no hydrogen 2.769 N/A ARG 155.A N ASP 153.A OD2 no hydrogen 3.153 N/A ARG 155.A NE ASP 153.A OD1 no hydrogen 3.419 N/A ARG 155.A NE ASP 153.A OD2 no hydrogen 2.969 N/A ARG 155.A NH2 ASP 153.A OD1 no hydrogen 2.751 N/A TRP 156.A N ASP 153.A O no hydrogen 3.137 N/A GLY 157.A N ASP 495.A OD1 no hydrogen 2.881 N/A ARG 158.A NE GLU 161.A OE2 no hydrogen 2.927 N/A ARG 158.A NH1 GLU 161.A OE2 no hydrogen 3.021 N/A CYS 159.A N TRP 156.A O no hydrogen 3.150 N/A TYR 160.A OH TYR 489.A O no hydrogen 2.729 N/A GLU 161.A N ARG 158.A O no hydrogen 2.862 N/A SER 162.A N CYS 159.A O no hydrogen 3.050 N/A SER 162.A OG ALA 149.A O no hydrogen 2.756 N/A SER 164.A N SER 162.A OG no hydrogen 3.394 N/A SER 164.A OG PRO 568.A O no hydrogen 2.645 N/A ASP 166.A N SER 164.A OG no hydrogen 2.883 N/A ARG 168.A N ASP 166.A OD1 no hydrogen 3.014 N/A ILE 169.A N ASP 166.A O no hydrogen 2.976 N/A VAL 170.A N ASP 166.A O no hydrogen 3.236 N/A GLN 171.A N ARG 167.A O no hydrogen 2.771 N/A GLN 171.A NE2 ARG 167.A O no hydrogen 3.495 N/A SER 172.A N ARG 168.A O no hydrogen 3.102 N/A SER 172.A OG ILE 169.A O no hydrogen 2.604 N/A MET 173.A N ILE 169.A O no hydrogen 3.047 N/A MET 173.A N VAL 170.A O no hydrogen 3.085 N/A THR 174.A N GLN 171.A O no hydrogen 3.231 N/A THR 174.A OG1 GLN 171.A O no hydrogen 2.606 N/A LEU 176.A N MET 173.A O no hydrogen 3.136 N/A ILE 177.A N THR 174.A O no hydrogen 2.978 N/A GLY 179.A N GLU 175.A O no hydrogen 3.307 N/A LEU 180.A N LEU 176.A O no hydrogen 2.836 N/A GLN 181.A N ILE 177.A O no hydrogen 2.822 N/A GLY 182.A N PRO 178.A O no hydrogen 2.801 N/A SER 190.A OG ASP 243.A OD1 no hydrogen 2.690 N/A GLY 191.A N MET 242.A O no hydrogen 2.915 N/A MET 192.A N THR 189.A O no hydrogen 3.098 N/A PHE 194.A N GLY 245.A O no hydrogen 2.975 N/A ALA 196.A N GLN 181.A O no hydrogen 2.826 N/A LYS 200.A N GLY 197.A O no hydrogen 3.128 N/A LYS 200.A NZ GLY 179.A O no hydrogen 2.860 N/A VAL 201.A N LEU 180.A O no hydrogen 2.974 N/A ALA 202.A N GLN 141.A O no hydrogen 2.966 N/A CYS 204.A N ALA 145.A O no hydrogen 2.731 N/A ALA 205.A N THR 248.A O no hydrogen 3.094 N/A LYS 206.A N PRO 146.A O no hydrogen 3.095 N/A LYS 206.A NZ PHE 144.A O no hydrogen 2.876 N/A HIS 207.A N ASP 211.A OD2 no hydrogen 2.915 N/A HIS 207.A ND1 ASP 211.A OD2 no hydrogen 2.804 N/A PHE 208.A N MET 250.A O no hydrogen 2.771 N/A GLY 213.A N GLY 210.A O no hydrogen 3.031 N/A THR 214.A OG1 ILE 218.A O no hydrogen 2.665 N/A VAL 215.A N ASN 222.A O no hydrogen 2.856 N/A GLY 217.A N THR 214.A O no hydrogen 3.071 N/A ILE 218.A N VAL 215.A O no hydrogen 3.033 N/A ASN 219.A N ASP 495.A OD2 no hydrogen 2.842 N/A ASN 221.A N ILE 218.A O no hydrogen 3.254 N/A THR 223.A N SER 255.A O no hydrogen 2.839 N/A THR 223.A OG1 GLY 210.A O no hydrogen 2.682 N/A ILE 225.A N ASN 257.A OD1 no hydrogen 3.147 N/A GLY 229.A N ASN 226.A OD1 no hydrogen 2.844 N/A LEU 230.A N ASN 226.A O no hydrogen 2.968 N/A MET 231.A N ARG 227.A O no hydrogen 2.803 N/A ASN 232.A N GLU 228.A O no hydrogen 2.950 N/A ILE 233.A N GLY 229.A O no hydrogen 3.031 N/A HIS 234.A N LEU 230.A O no hydrogen 2.982 N/A MET 235.A N LEU 230.A O no hydrogen 3.077 N/A TYR 238.A N MET 235.A O no hydrogen 2.854 N/A LYS 239.A N PRO 236.A O no hydrogen 3.025 N/A LYS 239.A NZ ASP 243.A OD1 no hydrogen 3.056 N/A LYS 239.A NZ ASP 243.A OD2 no hydrogen 3.432 N/A ASN 240.A N PRO 236.A O no hydrogen 3.355 N/A ALA 241.A N ALA 237.A O no hydrogen 2.867 N/A MET 242.A N TYR 238.A O no hydrogen 2.918 N/A ASP 243.A N LYS 239.A O no hydrogen 2.946 N/A LYS 244.A N ASN 240.A O no hydrogen 3.097 N/A LYS 244.A N ALA 241.A O no hydrogen 3.119 N/A LYS 244.A NZ THR 174.A OG1 no hydrogen 2.830 N/A LYS 244.A NZ GLU 175.A OE1 no hydrogen 2.743 N/A GLY 245.A N MET 242.A O no hydrogen 3.105 N/A VAL 246.A N ALA 241.A O no hydrogen 3.077 N/A SER 247.A OG PHE 194.A O no hydrogen 3.208 N/A THR 248.A N ALA 203.A O no hydrogen 3.192 N/A THR 248.A OG1 TYR 142.A OH no hydrogen 2.739 N/A THR 248.A OG1 ALA 203.A O no hydrogen 2.912 N/A VAL 249.A N PHE 281.A O no hydrogen 3.127 N/A MET 250.A N ALA 205.A O no hydrogen 3.098 N/A ILE 251.A N ILE 283.A O no hydrogen 2.947 N/A SER 252.A N PHE 208.A O no hydrogen 2.875 N/A SER 252.A OG SER 254.A OG no hydrogen 2.584 N/A TYR 253.A OH TRP 286.A O no hydrogen 2.566 N/A SER 254.A N SER 252.A OG no hydrogen 3.008 N/A SER 254.A OG SER 252.A OG no hydrogen 2.584 N/A SER 255.A N ASN 221.A O no hydrogen 2.909 N/A TRP 256.A N VAL 259.A O no hydrogen 2.873 N/A TRP 256.A NE1 ILE 225.A O no hydrogen 2.856 N/A ASN 257.A N THR 223.A O no hydrogen 2.923 N/A ASN 257.A ND2 ILE 225.A O no hydrogen 2.954 N/A GLY 258.A N ASN 222.A OD1 no hydrogen 2.826 N/A VAL 259.A N TRP 256.A O no hydrogen 3.091 N/A LYS 260.A NZ ARG 291.A O no hydrogen 2.991 N/A MET 261.A N SER 254.A O no hydrogen 3.064 N/A ALA 263.A N LYS 260.A O no hydrogen 2.958 N/A ASN 264.A N MET 261.A O no hydrogen 3.121 N/A LEU 267.A N ASN 264.A OD1 no hydrogen 2.914 N/A VAL 268.A N ASN 264.A O no hydrogen 2.989 N/A THR 269.A N GLN 265.A O no hydrogen 2.827 N/A THR 269.A OG1 ALA 310.A O no hydrogen 2.642 N/A GLY 270.A N GLN 265.A O no hydrogen 3.037 N/A LEU 272.A N LEU 267.A O no hydrogen 2.828 N/A LYS 273.A N VAL 268.A O no hydrogen 3.145 N/A LYS 273.A NZ GLY 311.A O no hydrogen 2.680 N/A LYS 273.A NZ ASP 313.A OD1 no hydrogen 3.320 N/A LYS 273.A NZ ASP 313.A OD2 no hydrogen 2.718 N/A LYS 273.A NZ ASP 344.A OD2 no hydrogen 3.071 N/A ASP 274.A N THR 269.A O no hydrogen 2.783 N/A THR 275.A N TYR 271.A O no hydrogen 2.936 N/A THR 275.A OG1 GLY 270.A O no hydrogen 2.819 N/A LEU 276.A N TYR 271.A O no hydrogen 2.869 N/A LYS 277.A NZ ASP 274.A O no hydrogen 2.751 N/A PHE 278.A N LEU 272.A O no hydrogen 3.203 N/A LYS 279.A N GLY 191.A O no hydrogen 2.701 N/A PHE 281.A N SER 247.A O no hydrogen 3.256 N/A VAL 282.A N ASP 313.A OD1 no hydrogen 2.725 N/A ILE 283.A N VAL 249.A O no hydrogen 2.867 N/A SER 284.A N MET 314.A O no hydrogen 2.983 N/A SER 284.A OG ASP 285.A O no hydrogen 2.759 N/A TRP 286.A N ASP 285.A OD1 no hydrogen 2.681 N/A GLU 287.A N MET 316.A O no hydrogen 3.300 N/A GLY 288.A N ASP 285.A O no hydrogen 2.984 N/A ASP 290.A N ASP 290.A OD1 no hydrogen 2.605 N/A ARG 291.A N GLU 287.A O no hydrogen 3.148 N/A ARG 291.A N GLY 288.A O no hydrogen 3.282 N/A ARG 291.A NE GLU 220.A OE1 no hydrogen 3.097 N/A ARG 291.A NH1 GLU 220.A OE1 no hydrogen 2.865 N/A ILE 292.A N ILE 289.A O no hydrogen 3.124 N/A THR 293.A OG1 ASP 290.A O no hydrogen 3.205 N/A THR 293.A OG1 PRO 295.A O no hydrogen 2.790 N/A GLY 297.A N ASP 290.A O no hydrogen 2.835 N/A SER 298.A N PRO 295.A O no hydrogen 3.283 N/A SER 298.A OG PRO 295.A O no hydrogen 2.858 N/A SER 301.A OG HIS 331.A NE2 no hydrogen 3.087 N/A TYR 302.A N ASP 299.A OD1 no hydrogen 3.072 N/A SER 303.A N ASP 299.A O no hydrogen 3.010 N/A SER 303.A OG ILE 289.A O no hydrogen 2.770 N/A SER 303.A OG ASP 299.A O no hydrogen 3.419 N/A VAL 304.A N TYR 300.A O no hydrogen 2.940 N/A LYS 305.A N SER 301.A O no hydrogen 3.068 N/A ALA 306.A N TYR 302.A O no hydrogen 2.715 N/A SER 307.A N SER 303.A O no hydrogen 3.061 N/A SER 307.A OG SER 303.A O no hydrogen 2.778 N/A SER 307.A OG VAL 304.A O no hydrogen 3.253 N/A ILE 308.A N VAL 304.A O no hydrogen 3.038 N/A LEU 309.A N LYS 305.A O no hydrogen 3.018 N/A ALA 310.A N ALA 306.A O no hydrogen 2.920 N/A GLY 311.A N SER 307.A O no hydrogen 3.275 N/A GLY 311.A N ILE 308.A O no hydrogen 3.134 N/A LEU 312.A N SER 307.A O no hydrogen 3.176 N/A ASP 313.A N VAL 282.A O no hydrogen 2.836 N/A MET 314.A N VAL 282.A O no hydrogen 2.931 N/A ILE 315.A N MET 32.A O no hydrogen 2.834 N/A MET 316.A N SER 284.A OG no hydrogen 2.869 N/A VAL 317.A N GLN 34.A O no hydrogen 3.077 N/A PHE 324.A N LYS 320.A O no hydrogen 3.117 N/A ILE 325.A N TYR 321.A O no hydrogen 2.848 N/A SER 326.A N GLN 322.A O no hydrogen 2.893 N/A ILE 327.A N GLN 323.A O no hydrogen 2.878 N/A LEU 328.A N PHE 324.A O no hydrogen 2.966 N/A THR 329.A N ILE 325.A O no hydrogen 2.916 N/A THR 329.A OG1 ILE 325.A O no hydrogen 2.703 N/A GLY 330.A N SER 326.A O no hydrogen 2.981 N/A HIS 331.A N ILE 327.A O no hydrogen 2.980 N/A VAL 332.A N LEU 328.A O no hydrogen 3.062 N/A ASN 333.A N THR 329.A O no hydrogen 2.804 N/A GLY 334.A N GLY 330.A O no hydrogen 2.851 N/A GLY 335.A N VAL 332.A O no hydrogen 3.080 N/A VAL 336.A N HIS 331.A O no hydrogen 2.840 N/A ILE 337.A N HIS 331.A O no hydrogen 3.241 N/A ARG 341.A N PRO 338.A O no hydrogen 3.063 N/A ARG 341.A NH1 ASP 313.A OD2 no hydrogen 2.835 N/A ARG 341.A NH1 ASP 344.A OD2 no hydrogen 2.702 N/A ARG 341.A NH2 ILE 308.A O no hydrogen 2.895 N/A ARG 341.A NH2 LEU 312.A O no hydrogen 2.829 N/A ASP 343.A N MET 339.A O no hydrogen 2.808 N/A ASP 344.A N SER 340.A O no hydrogen 2.957 N/A ALA 345.A N ARG 341.A O no hydrogen 3.076 N/A VAL 346.A N ILE 342.A O no hydrogen 2.962 N/A THR 347.A N ASP 343.A O no hydrogen 2.860 N/A THR 347.A OG1 ASP 343.A O no hydrogen 2.783 N/A ARG 348.A N ASP 344.A O no hydrogen 3.097 N/A ARG 348.A NE ASP 344.A OD1 no hydrogen 3.089 N/A ARG 348.A NE ASP 344.A OD2 no hydrogen 3.250 N/A ARG 348.A NH1 PHE 278.A O no hydrogen 2.760 N/A ARG 348.A NH1 GLY 280.A O no hydrogen 2.953 N/A ARG 348.A NH2 PHE 278.A O no hydrogen 3.221 N/A ILE 349.A N ALA 345.A O no hydrogen 3.077 N/A LEU 350.A N VAL 346.A O no hydrogen 2.816 N/A ARG 351.A N THR 347.A O no hydrogen 2.817 N/A ARG 351.A NE GLU 13.A OE2 no hydrogen 2.730 N/A ARG 351.A NH1 LYS 279.A O no hydrogen 2.901 N/A ARG 351.A NH2 GLU 13.A OE1 no hydrogen 2.893 N/A VAL 352.A N ARG 348.A O no hydrogen 3.118 N/A LYS 353.A N ILE 349.A O no hydrogen 3.058 N/A LYS 353.A NZ GLN 31.A OE1 no hydrogen 2.792 N/A LYS 353.A NZ GLY 51.A O no hydrogen 2.730 N/A LYS 353.A NZ PRO 89.A O no hydrogen 2.788 N/A PHE 354.A N LEU 350.A O no hydrogen 2.760 N/A THR 355.A N ARG 351.A O no hydrogen 2.859 N/A THR 355.A OG1 ARG 351.A O no hydrogen 2.719 N/A MET 356.A N VAL 352.A O no hydrogen 3.033 N/A GLY 357.A N PHE 354.A O no hydrogen 3.093 N/A LEU 358.A N LYS 353.A O no hydrogen 3.068 N/A GLU 360.A N GLY 357.A O no hydrogen 2.889 N/A ASN 361.A N GLY 357.A O no hydrogen 2.868 N/A ALA 364.A N ASP 75.A OD1 no hydrogen 2.902 N/A ALA 367.A N ASP 365.A OD1 no hydrogen 3.045 N/A MET 368.A N ASP 365.A O no hydrogen 2.871 N/A ALA 369.A N PRO 366.A O no hydrogen 3.227 N/A GLN 371.A N MET 368.A O no hydrogen 2.891 N/A LEU 372.A N ALA 369.A O no hydrogen 3.249 N/A GLY 373.A N GLU 134.A OE1 no hydrogen 3.044 N/A LYS 374.A N GLN 371.A O no hydrogen 3.278 N/A GLN 375.A NE2 ASP 379.A OD1 no hydrogen 2.944 N/A GLU 376.A N GLU 376.A OE1 no hydrogen 2.685 N/A ARG 378.A N LYS 374.A O no hydrogen 3.046 N/A ARG 378.A NE GLY 373.A O no hydrogen 3.056 N/A ARG 378.A NH1 VAL 443.A O no hydrogen 3.313 N/A ARG 378.A NH1 GLU 549.A OE2 no hydrogen 2.855 N/A ASP 379.A N GLN 375.A O no hydrogen 2.784 N/A LEU 380.A N GLU 376.A O no hydrogen 3.124 N/A ALA 381.A N HIS 377.A O no hydrogen 2.920 N/A ARG 382.A N ARG 378.A O no hydrogen 2.820 N/A ARG 382.A NE ASP 555.A OD2 no hydrogen 2.786 N/A ARG 382.A NH2 ASP 555.A OD1 no hydrogen 2.891 N/A GLU 383.A N ASP 379.A O no hydrogen 3.021 N/A ALA 384.A N LEU 380.A O no hydrogen 2.919 N/A ALA 385.A N ALA 381.A O no hydrogen 2.858 N/A ARG 386.A N ARG 382.A O no hydrogen 3.086 N/A LYS 387.A N GLU 383.A O no hydrogen 2.978 N/A LYS 387.A NZ ASP 120.A OD2 no hydrogen 3.434 N/A LYS 387.A NZ GLU 383.A OE2 no hydrogen 2.696 N/A SER 388.A N ALA 384.A O no hydrogen 2.907 N/A SER 388.A N ALA 385.A O no hydrogen 3.205 N/A SER 388.A OG ALA 385.A O no hydrogen 2.654 N/A LEU 389.A N ARG 386.A O no hydrogen 3.315 N/A VAL 390.A N ALA 542.A O no hydrogen 2.860 N/A LEU 392.A N LEU 540.A O no hydrogen 2.907 N/A LYS 393.A NZ LEU 534.A O no hydrogen 2.683 N/A LYS 393.A NZ SER 537.A O no hydrogen 2.865 N/A ASN 394.A ND2 LEU 404.A O no hydrogen 2.941 N/A GLY 395.A N ASP 538.A O no hydrogen 2.697 N/A LYS 396.A NZ ALA 536.A O no hydrogen 3.071 N/A THR 397.A OG1 THR 399.A OG1 no hydrogen 3.125 N/A THR 397.A OG1 ASP 400.A OD1 no hydrogen 2.921 N/A THR 399.A N THR 397.A OG1 no hydrogen 3.351 N/A THR 399.A OG1 THR 397.A OG1 no hydrogen 3.125 N/A ASP 400.A N THR 397.A O no hydrogen 3.267 N/A LEU 404.A N ASN 394.A OD1 no hydrogen 2.800 N/A LEU 406.A N LEU 557.A O no hydrogen 2.855 N/A LYS 408.A NZ ASP 560.A OD1 no hydrogen 2.865 N/A LYS 408.A NZ ASP 560.A OD2 no hydrogen 3.336 N/A LYS 412.A NZ GLY 475.A O no hydrogen 2.798 N/A ILE 413.A N VAL 460.A O no hydrogen 2.804 N/A LEU 414.A N TYR 479.A O no hydrogen 3.061 N/A VAL 415.A N VAL 462.A O no hydrogen 2.805 N/A ALA 416.A N ILE 481.A O no hydrogen 2.839 N/A GLY 417.A N GLU 465.A O no hydrogen 2.947 N/A SER 418.A OG HIS 419.A ND1 no hydrogen 2.766 N/A HIS 419.A N ALA 483.A O no hydrogen 2.952 N/A HIS 419.A ND1 SER 418.A OG no hydrogen 2.766 N/A HIS 419.A NE2 GLU 486.A O no hydrogen 2.769 N/A ALA 420.A N GLY 417.A O no hydrogen 3.286 N/A ASN 422.A ND2 THR 438.A OG1 no hydrogen 2.929 N/A GLY 424.A N GLY 439.A O no hydrogen 2.876 N/A TYR 425.A N ASN 422.A OD1 no hydrogen 2.919 N/A GLN 426.A N ASN 422.A O no hydrogen 3.147 N/A GLN 426.A NE2 THR 445.A O no hydrogen 2.967 N/A GLN 426.A NE2 GLY 547.A O no hydrogen 2.821 N/A CYS 427.A N LEU 423.A O no hydrogen 3.087 N/A CYS 427.A N GLY 424.A O no hydrogen 3.264 N/A CYS 427.A SG LEU 423.A O no hydrogen 3.426 N/A GLY 428.A N GLY 424.A O no hydrogen 3.023 N/A TRP 430.A N TRP 434.A O no hydrogen 2.951 N/A TRP 430.A NE1 GLU 161.A OE2 no hydrogen 2.991 N/A THR 431.A N GLU 433.A O no hydrogen 3.210 N/A THR 431.A OG1 HIS 98.A NE2 no hydrogen 3.109 N/A THR 431.A OG1 CYS 427.A O no hydrogen 3.566 N/A THR 431.A OG1 GLY 428.A O no hydrogen 3.012 N/A THR 431.A OG1 GLY 429.A O no hydrogen 3.205 N/A ILE 432.A N ASN 101.A O no hydrogen 2.763 N/A GLU 433.A N THR 431.A O no hydrogen 2.748 N/A TRP 434.A NE1 GLU 491.A OE2 no hydrogen 2.872 N/A GLN 435.A NE2 THR 490.A O no hydrogen 2.922 N/A GLY 436.A N GLU 433.A O no hydrogen 3.058 N/A THR 438.A N ASP 437.A OD1 no hydrogen 2.759 N/A GLY 439.A N ASN 422.A OD1 no hydrogen 2.843 N/A ARG 440.A NH2 GLY 444.A O no hydrogen 3.225 N/A VAL 443.A N THR 442.A OG1 no hydrogen 2.771 N/A THR 445.A N SER 548.A O no hydrogen 2.819 N/A THR 446.A N GLU 449.A OE1 no hydrogen 2.910 N/A THR 446.A OG1 ASP 421.A OD1 no hydrogen 2.771 N/A LEU 448.A N ALA 420.A O no hydrogen 2.745 N/A GLU 449.A N THR 446.A OG1 no hydrogen 3.215 N/A ALA 450.A N THR 446.A O no hydrogen 2.886 N/A VAL 451.A N ILE 447.A O no hydrogen 2.843 N/A LYS 452.A N LEU 448.A O no hydrogen 3.002 N/A ALA 453.A N GLU 449.A O no hydrogen 3.005 N/A ALA 454.A N VAL 451.A O no hydrogen 2.986 N/A VAL 455.A N VAL 451.A O no hydrogen 3.100 N/A ASP 456.A N LYS 408.A O no hydrogen 2.931 N/A SER 458.A N ASP 456.A OD2 no hydrogen 3.009 N/A SER 458.A OG ASP 456.A OD2 no hydrogen 2.689 N/A THR 459.A N ASP 456.A O no hydrogen 2.968 N/A VAL 460.A N PRO 411.A O no hydrogen 3.141 N/A VAL 462.A N ILE 413.A O no hydrogen 2.937 N/A ALA 464.A N VAL 415.A O no hydrogen 3.075 N/A PHE 471.A N ASP 468.A OD2 no hydrogen 2.979 N/A VAL 472.A N ASP 468.A O no hydrogen 3.361 N/A LYS 473.A N ALA 469.A O no hydrogen 2.997 N/A SER 474.A N GLU 470.A O no hydrogen 3.062 N/A SER 474.A OG GLU 470.A O no hydrogen 2.890 N/A GLY 475.A N VAL 472.A O no hydrogen 3.203 N/A SER 478.A N LYS 412.A O no hydrogen 2.825 N/A TYR 479.A OH PRO 407.A O no hydrogen 2.714 N/A ALA 480.A N ARG 517.A O no hydrogen 2.931 N/A ILE 481.A N LEU 414.A O no hydrogen 2.813 N/A VAL 482.A N ALA 519.A O no hydrogen 2.938 N/A ALA 483.A N ALA 416.A O no hydrogen 2.878 N/A VAL 484.A N VAL 521.A O no hydrogen 3.113 N/A GLU 486.A N ILE 523.A O no hydrogen 2.903 N/A TYR 489.A OH GLU 486.A OE1 no hydrogen 2.609 N/A THR 490.A N GLN 435.A OE1 no hydrogen 2.897 N/A THR 490.A OG1 TYR 160.A OH no hydrogen 3.189 N/A THR 490.A OG1 TRP 434.A O no hydrogen 2.737 N/A THR 492.A OG1 ASN 219.A OD1 no hydrogen 2.982 N/A GLY 494.A N GLU 491.A O no hydrogen 2.894 N/A ASP 495.A N THR 492.A O no hydrogen 2.935 N/A ASN 496.A N ARG 155.A O no hydrogen 2.977 N/A ASN 498.A N ASN 496.A OD1 no hydrogen 2.916 N/A LEU 499.A N ASN 496.A OD1 no hydrogen 2.819 N/A THR 500.A N ASN 498.A OD1 no hydrogen 3.031 N/A GLY 505.A N GLU 503.A OE1 no hydrogen 3.072 N/A LEU 506.A N GLU 503.A OE2 no hydrogen 2.735 N/A SER 507.A N GLU 503.A OE1 no hydrogen 2.961 N/A SER 507.A OG GLU 503.A OE1 no hydrogen 3.079 N/A THR 508.A OG1 ASN 466.A OD1 no hydrogen 2.366 N/A VAL 509.A N GLY 505.A O no hydrogen 3.062 N/A GLN 510.A N LEU 506.A O no hydrogen 2.862 N/A ALA 511.A N SER 507.A O no hydrogen 2.933 N/A VAL 512.A N THR 508.A O no hydrogen 2.905 N/A CYS 513.A N VAL 509.A O no hydrogen 2.844 N/A CYS 513.A SG VAL 509.A O no hydrogen 3.117 N/A GLY 514.A N GLN 510.A O no hydrogen 2.961 N/A GLY 515.A N VAL 512.A O no hydrogen 2.983 N/A VAL 516.A N VAL 512.A O no hydrogen 3.133 N/A ARG 517.A NE SER 478.A O no hydrogen 2.918 N/A CYS 518.A N ASP 538.A OD1 no hydrogen 2.892 N/A CYS 518.A SG ASP 538.A OD1 no hydrogen 3.685 N/A ALA 519.A N ALA 480.A O no hydrogen 2.899 N/A THR 520.A N ALA 539.A O no hydrogen 2.858 N/A THR 520.A OG1 SER 537.A OG no hydrogen 2.762 N/A VAL 521.A N VAL 482.A O no hydrogen 2.749 N/A LEU 522.A N VAL 541.A O no hydrogen 2.801 N/A ILE 523.A N VAL 484.A O no hydrogen 2.826 N/A SER 524.A N TRP 544.A O no hydrogen 3.040 N/A SER 524.A OG ARG 526.A O no hydrogen 2.697 N/A GLY 525.A N GLU 486.A OE1 no hydrogen 2.804 N/A ARG 526.A NE GLU 486.A OE2 no hydrogen 3.088 N/A ARG 526.A NH1 PRO 154.A O no hydrogen 3.005 N/A ARG 526.A NH1 GLY 494.A O no hydrogen 2.973 N/A ARG 526.A NH2 GLU 486.A OE2 no hydrogen 3.186 N/A ARG 526.A NH2 GLY 494.A O no hydrogen 2.846 N/A VAL 529.A N LEU 499.A O no hydrogen 2.844 N/A GLN 531.A N GLN 531.A OE1 no hydrogen 2.811 N/A GLN 531.A NE2 LYS 573.A O no hydrogen 2.911 N/A LEU 534.A N VAL 530.A O no hydrogen 2.866 N/A ALA 535.A N GLN 531.A O no hydrogen 2.865 N/A ALA 536.A N PRO 532.A O no hydrogen 3.248 N/A SER 537.A N LEU 533.A O no hydrogen 3.177 N/A SER 537.A N LEU 534.A O no hydrogen 3.172 N/A SER 537.A OG THR 520.A OG1 no hydrogen 2.762 N/A SER 537.A OG LEU 533.A O no hydrogen 2.667 N/A ALA 539.A N CYS 518.A O no hydrogen 3.165 N/A LEU 540.A N LYS 393.A O no hydrogen 3.003 N/A VAL 541.A N THR 520.A O no hydrogen 2.865 N/A ALA 542.A N VAL 390.A O no hydrogen 2.834 N/A ALA 543.A N LEU 522.A O no hydrogen 2.923 N/A GLY 547.A N GLN 426.A O no hydrogen 3.168 N/A SER 548.A N ILE 108.A O no hydrogen 2.885 N/A SER 548.A OG ILE 108.A O no hydrogen 3.251 N/A SER 548.A OG GLU 549.A OE2 no hydrogen 2.764 N/A GLY 550.A N THR 445.A O no hydrogen 2.903 N/A GLY 552.A N GLU 549.A O no hydrogen 2.988 N/A VAL 553.A N GLY 550.A O no hydrogen 3.034 N/A THR 554.A OG1 GLN 551.A O no hydrogen 3.195 N/A ASP 555.A N GLN 551.A O no hydrogen 2.864 N/A ALA 556.A N VAL 553.A O no hydrogen 3.267 N/A LEU 557.A N VAL 553.A O no hydrogen 3.076 N/A PHE 558.A N THR 554.A O no hydrogen 2.943 N/A GLY 559.A N ALA 556.A O no hydrogen 3.155 N/A PHE 561.A N ASP 555.A O no hydrogen 3.131 N/A PHE 563.A N THR 599.A OG1 no hydrogen 2.999 N/A ARG 566.A N ALA 117.A O no hydrogen 3.044 N/A LEU 567.A N TYR 595.A O no hydrogen 2.818 N/A ARG 569.A NH1 CYS 151.A O no hydrogen 2.964 N/A ARG 569.A NH2 CYS 151.A O no hydrogen 2.729 N/A THR 570.A N GLU 165.A OE2 no hydrogen 2.837 N/A THR 570.A OG1 GLU 165.A OE1 no hydrogen 2.636 N/A THR 570.A OG1 GLU 165.A OE2 no hydrogen 3.498 N/A THR 570.A OG1 TYR 587.A OH no hydrogen 2.607 N/A TRP 571.A N PHE 591.A O no hydrogen 2.894 N/A TRP 571.A NE1 VAL 528.A O no hydrogen 2.833 N/A LYS 573.A N GLN 577.A OE1 no hydrogen 2.740 N/A LYS 573.A NZ ASP 588.A OD1 no hydrogen 2.953 N/A LYS 573.A NZ ASP 588.A OD2 no hydrogen 3.530 N/A SER 574.A N GLN 577.A OE1 no hydrogen 3.193 N/A SER 574.A OG ASP 576.A OD2 no hydrogen 2.344 N/A GLN 577.A N SER 574.A O no hydrogen 3.104 N/A GLN 577.A NE2 ASP 588.A O no hydrogen 2.880 N/A LEU 578.A N VAL 575.A O no hydrogen 3.068 N/A ASN 581.A N ASP 584.A OD2 no hydrogen 2.878 N/A ASN 581.A ND2 ARG 152.A O no hydrogen 3.518 N/A VAL 582.A N GLU 165.A OE1 no hydrogen 3.077 N/A ASP 584.A N ASN 581.A O no hydrogen 3.030 N/A TYR 587.A OH THR 570.A OG1 no hydrogen 2.607 N/A LEU 590.A N TRP 571.A O no hydrogen 2.814 N/A PHE 591.A N TRP 571.A O no hydrogen 3.198 N/A LEU 593.A N TYR 587.A OH no hydrogen 3.237 N/A GLY 594.A N LEU 567.A O no hydrogen 2.776 N/A TYR 595.A N ARG 592.A O no hydrogen 3.093 N/A TYR 595.A OH LEU 392.A O no hydrogen 2.898 N/A LEU 597.A N LEU 391.A O no hydrogen 2.912 N/A THR 602.A N GLY 559.A O no hydrogen 2.773 N/A THR 602.A OG1 GLY 559.A O no hydrogen 3.451 N/A