Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4wpv_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): HIS 4.A NE2 GLY 162.A O no hydrogen 2.951 N/A LEU 7.A N HIS 4.A ND1 no hydrogen 2.949 N/A LEU 8.A N HIS 4.A O no hydrogen 2.996 N/A SER 9.A N GLN 5.A O no hydrogen 2.759 N/A SER 9.A OG GLN 5.A O no hydrogen 2.820 N/A TRP 10.A N GLY 6.A O no hydrogen 3.061 N/A VAL 11.A N LEU 7.A O no hydrogen 2.903 N/A GLU 12.A N LEU 8.A O no hydrogen 2.951 N/A GLU 13.A N SER 9.A O no hydrogen 3.001 N/A VAL 14.A N TRP 10.A O no hydrogen 2.881 N/A ALA 15.A N VAL 11.A O no hydrogen 2.875 N/A GLU 16.A N GLU 12.A O no hydrogen 2.922 N/A LEU 17.A N GLU 13.A O no hydrogen 3.218 N/A THR 18.A N VAL 14.A O no hydrogen 2.845 N/A THR 18.A OG1 VAL 14.A O no hydrogen 3.291 N/A GLN 19.A N ALA 15.A O no hydrogen 2.848 N/A GLN 19.A NE2 GLU 16.A O no hydrogen 2.881 N/A ASP 21.A N ARG 111.A O no hydrogen 2.850 N/A VAL 24.A N MET 113.A O no hydrogen 2.898 N/A THR 26.A N VAL 115.A O no hydrogen 2.973 N/A THR 26.A OG1 VAL 115.A O no hydrogen 3.335 N/A ASP 27.A N GLU 32.A OE2 no hydrogen 2.868 N/A GLY 28.A N GLU 32.A OE1 no hydrogen 2.815 N/A SER 29.A N ASP 27.A OD1 no hydrogen 2.910 N/A SER 29.A OG ASP 27.A OD1 no hydrogen 2.758 N/A GLU 32.A N SER 29.A OG no hydrogen 3.141 N/A PHE 33.A N SER 29.A O no hydrogen 3.003 N/A GLN 34.A N GLU 30.A O no hydrogen 3.008 N/A GLN 34.A NE2 GLU 30.A OE2 no hydrogen 3.080 N/A ARG 35.A N GLU 31.A O no hydrogen 3.105 N/A ARG 35.A NE GLU 31.A OE2 no hydrogen 3.118 N/A ARG 35.A NH2 GLU 31.A OE1 no hydrogen 3.012 N/A ARG 35.A NH2 GLU 31.A OE2 no hydrogen 2.809 N/A LEU 36.A N GLU 32.A O no hydrogen 2.900 N/A CYS 37.A N PHE 33.A O no hydrogen 2.976 N/A CYS 37.A SG PHE 33.A O no hydrogen 3.282 N/A ASP 38.A N GLN 34.A O no hydrogen 2.909 N/A GLN 39.A N ARG 35.A O no hydrogen 3.141 N/A GLN 39.A NE2 GLU 138.A OE1 no hydrogen 2.383 N/A LEU 40.A N LEU 36.A O no hydrogen 2.932 N/A VAL 41.A N CYS 37.A O no hydrogen 2.880 N/A GLU 42.A N ASP 38.A O no hydrogen 2.935 N/A ALA 43.A N GLN 39.A O no hydrogen 2.966 N/A GLY 44.A N VAL 41.A O no hydrogen 3.107 N/A THR 45.A OG1 ALA 183.A O no hydrogen 2.618 N/A PHE 46.A N LEU 40.A O no hydrogen 3.078 N/A ILE 47.A N LEU 59.A O no hydrogen 2.942 N/A ARG 48.A NH1 TYR 58.A OH no hydrogen 3.006 N/A LEU 49.A N SER 57.A O no hydrogen 2.934 N/A ASN 50.A N GLY 340.A O no hydrogen 2.935 N/A ASN 50.A ND2 ASP 339.A O no hydrogen 2.826 N/A GLU 52.A N ASN 50.A OD1 no hydrogen 2.920 N/A LYS 53.A N ASN 50.A O no hydrogen 3.054 N/A HIS 54.A N ASN 50.A O no hydrogen 2.997 N/A ASN 56.A ND2 ASN 328.A OD1 no hydrogen 2.912 N/A SER 57.A OG LYS 55.A O no hydrogen 2.860 N/A TYR 58.A N THR 329.A O no hydrogen 2.951 N/A TYR 58.A OH ASN 56.A OD1 no hydrogen 3.350 N/A LEU 59.A N ILE 47.A O no hydrogen 2.952 N/A ALA 60.A N PHE 331.A O no hydrogen 2.837 N/A SER 62.A N ASN 333.A OD1 no hydrogen 2.788 N/A SER 62.A OG ASP 63.A O no hydrogen 3.161 N/A SER 62.A OG ASP 66.A O no hydrogen 2.943 N/A SER 65.A N ASP 63.A OD1 no hydrogen 2.902 N/A SER 65.A OG ASP 63.A OD1 no hydrogen 2.729 N/A ASP 66.A N ASP 63.A O no hydrogen 2.864 N/A VAL 70.A N ASN 211.A OD1 no hydrogen 3.124 N/A ARG 73.A N VAL 70.A O no hydrogen 3.211 N/A ARG 73.A NE LYS 190.A O no hydrogen 2.740 N/A ARG 73.A NH2 LYS 190.A O no hydrogen 3.004 N/A THR 74.A N ALA 71.A O no hydrogen 2.971 N/A THR 74.A OG1 VAL 70.A O no hydrogen 2.724 N/A TYR 75.A N ILE 192.A O no hydrogen 2.843 N/A ILE 76.A N ASN 89.A O no hydrogen 2.803 N/A CYS 77.A N HIS 194.A O no hydrogen 2.825 N/A CYS 77.A SG MET 91.A O no hydrogen 3.474 N/A SER 78.A OG LYS 80.A O no hydrogen 2.772 N/A ALA 79.A N GLU 197.A OE2 no hydrogen 2.837 N/A ASP 83.A N LYS 80.A O no hydrogen 3.112 N/A ALA 84.A N GLU 81.A O no hydrogen 2.917 N/A GLY 85.A N GLU 81.A O no hydrogen 3.025 N/A ASN 88.A N GLY 85.A O no hydrogen 3.114 N/A ASN 88.A ND2 ALA 84.A O no hydrogen 2.911 N/A ASN 88.A ND2 LEU 450.A O no hydrogen 3.180 N/A ASN 89.A ND2 THR 74.A O no hydrogen 2.965 N/A TRP 90.A NE1 SER 78.A O no hydrogen 2.842 N/A GLU 95.A N ASP 92.A OD1 no hydrogen 2.992 N/A MET 96.A N ASP 92.A O no hydrogen 2.985 N/A ARG 97.A N PRO 93.A O no hydrogen 2.887 N/A ARG 97.A NH2 GLU 200.A OE1 no hydrogen 3.247 N/A SER 98.A N GLY 94.A O no hydrogen 3.057 N/A ILE 99.A N GLU 95.A O no hydrogen 3.156 N/A MET 100.A N MET 96.A O no hydrogen 2.845 N/A LYS 101.A N ARG 97.A O no hydrogen 2.815 N/A ASP 102.A N SER 98.A O no hydrogen 3.328 N/A LEU 103.A N ILE 99.A O no hydrogen 3.097 N/A TYR 104.A N MET 100.A O no hydrogen 2.859 N/A TYR 104.A OH SER 203.A O no hydrogen 2.768 N/A ARG 105.A N LYS 101.A O no hydrogen 3.209 N/A ARG 105.A N ASP 102.A O no hydrogen 3.366 N/A ARG 105.A NH1 ASP 102.A OD1 no hydrogen 3.028 N/A ARG 105.A NH2 ASP 102.A OD1 no hydrogen 2.951 N/A GLY 106.A N LEU 17.A O no hydrogen 2.891 N/A CYS 107.A N TYR 104.A O no hydrogen 3.031 N/A CYS 107.A SG TYR 104.A O no hydrogen 3.276 N/A CYS 107.A SG SER 170.A OG no hydrogen 3.288 N/A MET 108.A N THR 18.A O no hydrogen 2.957 N/A ARG 109.A N GLY 106.A O no hydrogen 3.319 N/A ARG 109.A NH1 GLU 176.A OE1 no hydrogen 3.356 N/A ARG 109.A NH1 GLU 176.A OE2 no hydrogen 3.198 N/A ARG 109.A NH2 GLU 176.A OE1 no hydrogen 2.965 N/A GLY 110.A N ASP 21.A OD1 no hydrogen 3.189 N/A ARG 111.A N MET 108.A O no hydrogen 2.951 N/A ARG 111.A NE ALA 173.A O no hydrogen 2.968 N/A ARG 111.A NH1 ASP 181.A OD2 no hydrogen 2.803 N/A ARG 111.A NH2 ALA 173.A O no hydrogen 2.829 N/A ARG 111.A NH2 ASP 181.A OD1 no hydrogen 2.973 N/A ARG 111.A NH2 ASP 181.A OD2 no hydrogen 3.522 N/A MET 113.A N ARG 22.A O no hydrogen 2.895 N/A TYR 114.A N THR 135.A O no hydrogen 2.733 N/A VAL 115.A N VAL 24.A O no hydrogen 2.719 N/A VAL 116.A N GLU 133.A O no hydrogen 2.820 N/A PHE 118.A N GLY 131.A O no hydrogen 2.844 N/A CYS 119.A N ARG 149.A O no hydrogen 2.916 N/A CYS 119.A SG MET 120.A O no hydrogen 3.956 N/A CYS 119.A SG GLY 121.A O no hydrogen 3.423 N/A MET 120.A N LYS 129.A O no hydrogen 2.861 N/A GLY 121.A N PRO 301.A O no hydrogen 2.920 N/A ALA 125.A N PRO 122.A O no hydrogen 3.336 N/A LYS 129.A NZ GLU 231.A OE1 no hydrogen 2.937 N/A LYS 129.A NZ GLU 231.A OE2 no hydrogen 3.295 N/A GLY 131.A N PHE 118.A O no hydrogen 2.851 N/A VAL 132.A N VAL 165.A O no hydrogen 2.967 N/A GLU 133.A N VAL 116.A O no hydrogen 2.887 N/A ILE 134.A N ALA 167.A O no hydrogen 2.785 N/A THR 135.A N TYR 114.A O no hydrogen 2.959 N/A THR 135.A OG1 HIS 169.A ND1 no hydrogen 2.811 N/A SER 137.A N THR 135.A OG1 no hydrogen 2.978 N/A TYR 139.A OH THR 332.A OG1 no hydrogen 2.607 N/A VAL 140.A N SER 137.A OG no hydrogen 3.086 N/A VAL 141.A N SER 137.A O no hydrogen 3.130 N/A VAL 142.A N GLU 138.A O no hydrogen 3.106 N/A SER 143.A N TYR 139.A O no hydrogen 3.063 N/A SER 143.A OG TYR 139.A O no hydrogen 3.519 N/A MET 144.A N VAL 140.A O no hydrogen 2.816 N/A ARG 145.A N VAL 141.A O no hydrogen 3.009 N/A ARG 145.A NE GLY 28.A O no hydrogen 2.846 N/A ARG 145.A NH2 GLY 28.A O no hydrogen 3.079 N/A MET 147.A N SER 143.A O no hydrogen 2.877 N/A THR 148.A N MET 144.A O no hydrogen 2.967 N/A THR 148.A OG1 MET 144.A O no hydrogen 2.784 N/A ARG 149.A NH1 GLU 302.A O no hydrogen 3.184 N/A ARG 149.A NH2 ASP 393.A OD2 no hydrogen 2.830 N/A GLY 151.A N PRO 117.A O no hydrogen 2.773 N/A LYS 152.A N ASP 27.A O no hydrogen 3.013 N/A LYS 152.A NZ GLU 156.A OE2 no hydrogen 3.388 N/A LEU 155.A N GLY 151.A O no hydrogen 3.047 N/A GLU 156.A N LYS 152.A O no hydrogen 2.930 N/A LYS 157.A N ALA 153.A O no hydrogen 3.113 N/A LYS 157.A NZ LEU 123.A O no hydrogen 3.132 N/A LYS 157.A NZ ALA 125.A O no hydrogen 3.296 N/A MET 158.A N ALA 154.A O no hydrogen 3.202 N/A MET 158.A N LEU 155.A O no hydrogen 3.106 N/A GLY 159.A N GLU 156.A O no hydrogen 3.010 N/A GLY 162.A N MET 158.A O no hydrogen 2.875 N/A VAL 165.A N LEU 130.A O no hydrogen 2.960 N/A ALA 167.A N VAL 132.A O no hydrogen 3.010 N/A LEU 168.A N ILE 201.A O no hydrogen 2.800 N/A HIS 169.A N ILE 134.A O no hydrogen 2.795 N/A HIS 169.A ND1 THR 135.A OG1 no hydrogen 2.811 N/A HIS 169.A NE2 SER 206.A O no hydrogen 2.693 N/A SER 170.A N SER 203.A O no hydrogen 3.193 N/A SER 170.A OG ASP 136.A OD2 no hydrogen 2.691 N/A VAL 171.A N ASP 136.A OD1 no hydrogen 2.900 N/A GLY 172.A N SER 170.A OG no hydrogen 2.960 N/A LEU 175.A N ARG 109.A O no hydrogen 2.797 N/A GLU 176.A N GLN 179.A OE1 no hydrogen 2.837 N/A GLN 179.A N GLU 176.A O no hydrogen 2.922 N/A VAL 182.A N ASP 181.A OD1 no hydrogen 2.885 N/A TRP 184.A NE1 ASP 66.A OD2 no hydrogen 2.822 N/A CYS 186.A SG TRP 184.A O no hydrogen 4.039 N/A SER 187.A N GLY 205.A O no hydrogen 2.881 N/A SER 187.A OG THR 189.A O no hydrogen 3.450 N/A THR 189.A N SER 187.A OG no hydrogen 2.999 N/A LYS 190.A NZ SER 65.A O no hydrogen 2.848 N/A TYR 191.A N TYR 204.A O no hydrogen 2.998 N/A ILE 192.A N ARG 73.A O no hydrogen 2.894 N/A THR 193.A N TRP 202.A O no hydrogen 2.754 N/A HIS 194.A N TYR 75.A O no hydrogen 2.949 N/A HIS 194.A ND1 TYR 75.A O no hydrogen 2.914 N/A PHE 195.A N GLU 200.A O no hydrogen 2.830 N/A GLU 197.A N GLU 197.A OE1 no hydrogen 2.786 N/A THR 198.A OG1 PHE 195.A O no hydrogen 3.464 N/A THR 198.A OG1 GLU 200.A OE1 no hydrogen 2.988 N/A ARG 199.A N PRO 196.A O no hydrogen 3.268 N/A ARG 199.A NH1 PRO 196.A O no hydrogen 2.869 N/A ARG 199.A NH2 ASP 230.A OD2 no hydrogen 2.925 N/A GLU 200.A N PHE 195.A O no hydrogen 3.148 N/A ILE 201.A N LYS 166.A O no hydrogen 2.922 N/A TRP 202.A N THR 193.A O no hydrogen 2.823 N/A SER 203.A N LEU 168.A O no hydrogen 2.746 N/A SER 203.A OG ASN 211.A O no hydrogen 2.679 N/A TYR 204.A N TYR 191.A O no hydrogen 2.847 N/A GLY 205.A N SER 170.A O no hydrogen 2.836 N/A SER 206.A OG ASP 66.A OD1 no hydrogen 2.560 N/A SER 206.A OG ASP 66.A OD2 no hydrogen 3.383 N/A GLY 207.A N ASP 66.A OD2 no hydrogen 2.849 N/A TYR 208.A N SER 206.A OG no hydrogen 2.949 N/A TYR 208.A OH ASN 375.A O no hydrogen 2.723 N/A ASN 211.A N TYR 208.A O no hydrogen 2.869 N/A ASN 211.A ND2 ALA 68.A O no hydrogen 3.002 N/A ASN 211.A ND2 SER 206.A OG no hydrogen 2.978 N/A ALA 212.A N GLY 209.A O no hydrogen 3.043 N/A LEU 213.A N GLY 209.A O no hydrogen 2.821 N/A LEU 214.A N GLU 133.A OE1 no hydrogen 3.131 N/A LYS 216.A N LEU 213.A O no hydrogen 2.993 N/A LYS 216.A NZ LYS 216.A O no hydrogen 3.038 N/A LYS 216.A NZ ASP 284.A OD2 no hydrogen 2.581 N/A LYS 216.A NZ GLU 302.A OE1 no hydrogen 2.873 N/A LYS 216.A NZ GLU 302.A OE2 no hydrogen 3.066 N/A LYS 217.A NZ HIS 237.A NE2 no hydrogen 3.430 N/A CYS 218.A SG HIS 194.A NE2 no hydrogen 3.346 N/A CYS 218.A SG GLY 210.A O no hydrogen 3.638 N/A TYR 219.A N LEU 214.A O no hydrogen 2.906 N/A TYR 219.A OH LEU 130.A O no hydrogen 2.774 N/A SER 220.A N GLY 215.A O no hydrogen 3.054 N/A SER 220.A OG GLY 215.A O no hydrogen 2.665 N/A LEU 221.A N LYS 217.A O no hydrogen 3.046 N/A ARG 222.A N LYS 217.A O no hydrogen 3.049 N/A ARG 222.A NE PRO 448.A O no hydrogen 3.223 N/A ARG 222.A NH1 HIS 194.A NE2 no hydrogen 3.189 N/A ARG 222.A NH2 PRO 448.A O no hydrogen 2.972 N/A ILE 223.A N CYS 218.A O no hydrogen 2.876 N/A ALA 224.A N TYR 219.A O no hydrogen 2.941 N/A SER 225.A N LEU 221.A O no hydrogen 2.842 N/A SER 225.A OG LEU 221.A O no hydrogen 2.869 N/A SER 225.A OG ARG 222.A O no hydrogen 2.982 N/A ALA 226.A N ARG 222.A O no hydrogen 3.420 N/A MET 227.A N ILE 223.A O no hydrogen 2.970 N/A ALA 228.A N ALA 224.A O no hydrogen 2.773 N/A HIS 229.A N SER 225.A O no hydrogen 2.955 N/A ASP 230.A N ALA 226.A O no hydrogen 3.200 N/A GLU 231.A N MET 227.A O no hydrogen 2.840 N/A GLY 232.A N ALA 228.A O no hydrogen 2.917 N/A TRP 233.A N ALA 228.A O no hydrogen 3.053 N/A TRP 233.A NE1 GLU 231.A OE1 no hydrogen 2.878 N/A LEU 234.A N MET 288.A O no hydrogen 2.899 N/A GLU 236.A N ALA 286.A O no hydrogen 2.875 N/A HIS 237.A ND1 ALA 445.A O no hydrogen 2.814 N/A HIS 237.A NE2 ASP 284.A OD1 no hydrogen 3.108 N/A LEU 239.A N ALA 255.A O no hydrogen 2.903 N/A ILE 240.A N GLY 282.A O no hydrogen 2.979 N/A LEU 241.A N PHE 253.A O no hydrogen 2.866 N/A LYS 242.A N GLU 279.A O no hydrogen 2.802 N/A LYS 242.A NZ GLU 279.A OE1 no hydrogen 3.540 N/A LYS 242.A NZ GLU 391.A OE1 no hydrogen 2.972 N/A LYS 242.A NZ GLU 391.A OE2 no hydrogen 3.145 N/A LEU 243.A N TYR 251.A O no hydrogen 2.780 N/A ILE 244.A N ARG 277.A O no hydrogen 2.816 N/A SER 245.A N LYS 249.A O no hydrogen 3.000 N/A ASN 248.A N SER 245.A O no hydrogen 2.789 N/A TYR 251.A N LEU 243.A O no hydrogen 2.718 N/A TYR 251.A OH GLU 510.A OE2 no hydrogen 2.502 N/A PHE 253.A N LEU 241.A O no hydrogen 2.843 N/A ALA 254.A N GLY 402.A O no hydrogen 3.091 N/A ALA 255.A N LEU 239.A O no hydrogen 3.021 N/A ALA 256.A N LEU 404.A O no hydrogen 2.864 N/A CYS 261.A SG SER 259.A O no hydrogen 3.507 N/A CYS 261.A SG SER 434.A OG no hydrogen 3.698 N/A LYS 263.A NZ HIS 237.A O no hydrogen 3.543 N/A LYS 263.A NZ ASP 284.A O no hydrogen 3.169 N/A LYS 263.A NZ ASP 284.A OD1 no hydrogen 3.294 N/A LEU 266.A N GLY 262.A O no hydrogen 3.208 N/A ALA 267.A N LYS 263.A O no hydrogen 2.967 N/A MET 268.A N THR 264.A O no hydrogen 3.129 N/A LEU 269.A N LEU 266.A O no hydrogen 3.140 N/A THR 272.A N SER 499.A OG no hydrogen 3.233 N/A THR 272.A OG1 GLY 496.A O no hydrogen 3.555 N/A THR 272.A OG1 GLU 497.A OE2 no hydrogen 2.700 N/A THR 272.A OG1 SER 499.A OG no hydrogen 3.323 N/A TRP 276.A N ILE 273.A O no hydrogen 3.443 N/A ARG 277.A N ILE 244.A O no hydrogen 2.961 N/A ARG 277.A NH1 ASN 248.A OD1 no hydrogen 3.252 N/A ARG 277.A NH2 ASN 248.A OD1 no hydrogen 2.917 N/A ARG 277.A NH2 GLY 275.A O no hydrogen 3.006 N/A GLU 279.A N LYS 242.A O no hydrogen 2.798 N/A THR 280.A N ILE 387.A O no hydrogen 2.883 N/A LEU 281.A N ILE 240.A O no hydrogen 2.942 N/A GLY 282.A N THR 280.A OG1 no hydrogen 2.988 N/A ALA 286.A N GLU 236.A O no hydrogen 2.909 N/A TRP 287.A N VAL 299.A O no hydrogen 2.831 N/A TRP 287.A NE1 SER 220.A O no hydrogen 2.894 N/A MET 288.A N LEU 234.A O no hydrogen 2.806 N/A ARG 289.A N TYR 297.A O no hydrogen 2.935 N/A GLY 291.A N ARG 295.A O no hydrogen 2.817 N/A GLY 294.A N GLY 291.A O no hydrogen 3.074 N/A ARG 295.A N ASP 293.A OD1 no hydrogen 2.997 N/A ARG 295.A NE ASP 293.A OD2 no hydrogen 3.116 N/A ARG 295.A NH2 ASP 293.A OD2 no hydrogen 3.455 N/A ARG 295.A NH2 TYR 297.A OH no hydrogen 3.163 N/A TYR 297.A N ARG 289.A O no hydrogen 2.830 N/A TYR 297.A OH ASP 293.A OD1 no hydrogen 3.398 N/A TYR 297.A OH ASP 293.A OD2 no hydrogen 2.495 N/A ALA 298.A N VAL 398.A O no hydrogen 2.861 N/A VAL 299.A N TRP 287.A O no hydrogen 2.860 N/A ASN 300.A ND2 LEU 281.A O no hydrogen 2.916 N/A GLU 302.A N ASN 300.A OD1 no hydrogen 2.817 N/A PHE 303.A N MET 147.A O no hydrogen 2.890 N/A PHE 305.A N THR 380.A O no hydrogen 2.765 N/A GLY 307.A N TYR 378.A O no hydrogen 2.957 N/A ALA 309.A N SER 376.A O no hydrogen 2.785 N/A GLY 311.A N GLU 345.A O no hydrogen 2.982 N/A THR 312.A N ALA 309.A O no hydrogen 2.859 N/A THR 312.A OG1 VAL 308.A O no hydrogen 3.109 N/A THR 312.A OG1 ALA 309.A O no hydrogen 2.848 N/A ASN 313.A ND2 GLY 346.A O no hydrogen 2.883 N/A TRP 314.A N GLU 348.A OE2 no hydrogen 2.957 N/A LYS 315.A N GLU 348.A OE1 no hydrogen 2.991 N/A SER 316.A N ASN 313.A OD1 no hydrogen 2.868 N/A SER 316.A OG ASN 313.A OD1 no hydrogen 3.418 N/A ASN 317.A N ASN 313.A O no hydrogen 2.910 N/A ASN 317.A ND2 THR 264.A O no hydrogen 3.413 N/A ASN 317.A ND2 ASN 265.A OD1 no hydrogen 3.488 N/A ASN 319.A ND2 MET 268.A O no hydrogen 3.105 N/A ALA 320.A N ASN 317.A OD1 no hydrogen 2.939 N/A MET 321.A N ASN 317.A O no hydrogen 3.148 N/A ARG 322.A N PRO 318.A O no hydrogen 2.810 N/A THR 323.A N ASN 319.A O no hydrogen 3.064 N/A THR 323.A OG1 ASN 319.A O no hydrogen 2.842 N/A ILE 324.A N ALA 320.A O no hydrogen 3.001 N/A ALA 325.A N MET 321.A O no hydrogen 2.837 N/A ALA 326.A N THR 323.A O no hydrogen 3.409 N/A GLY 327.A N ILE 324.A O no hydrogen 2.944 N/A ASN 328.A N LYS 55.A O no hydrogen 2.773 N/A ASN 328.A ND2 GLN 384.A OE1 no hydrogen 2.602 N/A THR 329.A N SER 57.A OG no hydrogen 3.091 N/A THR 329.A OG1 GLY 327.A O no hydrogen 2.802 N/A THR 329.A OG1 THR 380.A OG1 no hydrogen 2.877 N/A VAL 330.A N CYS 379.A O no hydrogen 3.048 N/A PHE 331.A N TYR 58.A O no hydrogen 2.841 N/A THR 332.A N ARG 377.A O no hydrogen 2.918 N/A THR 332.A OG1 TYR 139.A OH no hydrogen 2.607 N/A ASN 333.A N ALA 60.A O no hydrogen 2.879 N/A ASN 333.A ND2 SER 62.A OG no hydrogen 2.872 N/A ALA 335.A N TRP 343.A O no hydrogen 2.932 N/A LEU 336.A N ILE 355.A O no hydrogen 2.919 N/A THR 337.A N ASP 341.A O no hydrogen 2.907 N/A THR 337.A OG1 ASP 339.A OD1 no hydrogen 2.519 N/A GLY 340.A N THR 337.A O no hydrogen 3.067 N/A ASP 341.A N THR 337.A OG1 no hydrogen 2.883 N/A VAL 342.A N ASP 341.A OD1 no hydrogen 2.720 N/A TRP 343.A N ALA 335.A O no hydrogen 2.986 N/A TRP 343.A NE1 LEU 347.A O no hydrogen 3.074 N/A TRP 344.A NE1 THR 312.A O no hydrogen 2.721 N/A GLU 345.A N GLU 345.A OE1 no hydrogen 2.847 N/A LEU 347.A N TRP 344.A O no hydrogen 3.018 N/A GLU 348.A N GLU 348.A OE2 no hydrogen 2.802 N/A GLN 352.A NE2 ASP 350.A O no hydrogen 2.915 N/A HIS 353.A ND1 ASP 338.A OD1 no hydrogen 2.737 N/A HIS 353.A NE2 ASP 361.A OD1 no hydrogen 2.714 N/A LEU 354.A N TRP 362.A O no hydrogen 2.853 N/A ILE 355.A N LEU 336.A O no hydrogen 2.951 N/A ASP 356.A N ASN 360.A O no hydrogen 2.761 N/A TRP 357.A N ALA 371.A O no hydrogen 2.910 N/A LYS 358.A N ASP 356.A OD1 no hydrogen 2.910 N/A GLY 359.A N ASP 356.A O no hydrogen 2.995 N/A ASN 360.A N ASP 356.A OD1 no hydrogen 2.929 N/A TRP 362.A N LEU 354.A O no hydrogen 2.808 N/A TRP 362.A NE1 THR 369.A O no hydrogen 3.101 N/A TYR 363.A N THR 367.A OG1 no hydrogen 2.809 N/A PHE 364.A N GLN 352.A O no hydrogen 2.975 N/A THR 367.A N TYR 363.A O no hydrogen 3.064 N/A THR 367.A OG1 TYR 363.A O no hydrogen 3.528 N/A ALA 371.A N GLU 345.A OE2 no hydrogen 2.771 N/A ALA 372.A N GLU 345.A OE1 no hydrogen 3.069 N/A HIS 373.A N ASN 333.A O no hydrogen 2.963 N/A ASN 375.A N HIS 373.A ND1 no hydrogen 2.917 N/A ASN 375.A ND2 VAL 67.A O no hydrogen 2.917 N/A SER 376.A N HIS 373.A O no hydrogen 2.978 N/A SER 376.A OG HIS 373.A O no hydrogen 2.715 N/A ARG 377.A N THR 332.A O no hydrogen 2.973 N/A ARG 377.A NE ASN 375.A O no hydrogen 3.310 N/A ARG 377.A NH1 ASN 375.A OD1 no hydrogen 2.927 N/A ARG 377.A NH2 PHE 306.A O no hydrogen 3.164 N/A TYR 378.A N GLY 307.A O no hydrogen 2.991 N/A CYS 379.A N VAL 330.A O no hydrogen 2.856 N/A CYS 379.A SG SER 143.A O no hydrogen 4.044 N/A THR 380.A N PHE 305.A O no hydrogen 2.963 N/A THR 380.A OG1 THR 329.A OG1 no hydrogen 2.877 N/A MET 382.A N PHE 303.A O no hydrogen 3.177 N/A GLN 384.A NE2 THR 323.A O no hydrogen 3.096 N/A GLN 384.A NE2 GLY 327.A O no hydrogen 2.996 N/A CYS 385.A N MET 382.A O no hydrogen 3.016 N/A CYS 385.A SG THR 323.A OG1 no hydrogen 3.568 N/A LEU 388.A N CYS 385.A O no hydrogen 3.096 N/A ALA 389.A N THR 280.A O no hydrogen 2.940 N/A GLU 391.A N GLU 391.A OE1 no hydrogen 2.801 N/A TRP 392.A N ALA 389.A O no hydrogen 3.014 N/A ASP 394.A N GLU 391.A O no hydrogen 3.064 N/A GLN 396.A N ASP 394.A OD1 no hydrogen 2.931 N/A GLY 397.A N ASP 394.A O no hydrogen 3.042 N/A VAL 398.A N ALA 298.A O no hydrogen 2.979 N/A ILE 400.A N LEU 296.A O no hydrogen 2.778 N/A SER 401.A N TYR 252.A O no hydrogen 2.880 N/A ILE 403.A N LYS 475.A O no hydrogen 2.889 N/A LEU 404.A N ALA 254.A O no hydrogen 2.845 N/A PHE 405.A N PHE 477.A O no hydrogen 2.891 N/A GLY 406.A N ALA 256.A O no hydrogen 2.995 N/A ARG 408.A N SER 434.A OG no hydrogen 2.852 N/A ARG 408.A NE ALA 260.A O no hydrogen 3.233 N/A ARG 408.A NH2 ALA 260.A O no hydrogen 3.115 N/A ARG 409.A N ASN 480.A OD1 no hydrogen 3.232 N/A ARG 409.A NH1 GLU 555.A OE2 no hydrogen 2.937 N/A ARG 409.A NH2 GLU 555.A OE1 no hydrogen 2.841 N/A THR 411.A OG1 THR 412.A OG1 no hydrogen 2.867 N/A THR 412.A OG1 THR 411.A OG1 no hydrogen 2.867 N/A VAL 413.A N THR 411.A O no hydrogen 2.821 N/A LEU 415.A N ALA 544.A O no hydrogen 2.928 N/A THR 417.A N PHE 478.A O no hydrogen 2.970 N/A GLU 418.A N THR 522.A O no hydrogen 2.716 N/A ALA 419.A N VAL 476.A O no hydrogen 2.830 N/A ARG 420.A N HIS 424.A ND1 no hydrogen 2.887 N/A TRP 422.A NE1 TRP 461.A O no hydrogen 2.919 N/A GLN 423.A NE2 GLU 577.A OE1 no hydrogen 2.839 N/A HIS 424.A N ASP 421.A OD1 no hydrogen 2.894 N/A GLY 425.A N ASP 421.A O no hydrogen 2.919 N/A VAL 426.A N TRP 422.A O no hydrogen 2.829 N/A PHE 427.A N GLN 423.A O no hydrogen 3.068 N/A ILE 428.A N HIS 424.A O no hydrogen 2.864 N/A GLY 429.A N GLY 425.A O no hydrogen 2.993 N/A ALA 430.A N VAL 426.A O no hydrogen 2.780 N/A THR 431.A N PHE 427.A O no hydrogen 2.988 N/A THR 431.A OG1 PHE 427.A O no hydrogen 2.813 N/A LEU 432.A N GLY 429.A O no hydrogen 3.174 N/A SER 434.A N ARG 440.A O no hydrogen 2.853 N/A GLU 435.A N ARG 408.A O no hydrogen 2.875 N/A GLN 436.A N ASN 438.A O no hydrogen 2.832 N/A ARG 440.A N SER 434.A O no hydrogen 2.800 N/A ARG 441.A NH1 THR 431.A O no hydrogen 2.737 N/A ARG 441.A NH1 GLU 555.A OE2 no hydrogen 3.365 N/A ARG 441.A NH2 GLU 555.A OE2 no hydrogen 2.775 N/A ASP 442.A N LEU 432.A O no hydrogen 2.855 N/A MET 444.A N GLY 429.A O no hydrogen 3.002 N/A ALA 445.A N ASP 442.A O no hydrogen 2.948 N/A MET 446.A N PRO 443.A O no hydrogen 2.837 N/A LEU 447.A N ASP 442.A OD1 no hydrogen 2.891 N/A PHE 449.A N MET 446.A O no hydrogen 2.851 N/A GLY 451.A N SER 225.A OG no hydrogen 2.911 N/A ASN 453.A ND2 ILE 82.A O no hydrogen 2.830 N/A GLY 455.A N ASN 453.A OD1 no hydrogen 2.728 N/A ASP 456.A N ASN 453.A OD1 no hydrogen 3.217 N/A TYR 457.A N ASN 453.A O no hydrogen 2.941 N/A TYR 457.A OH GLU 236.A OE1 no hydrogen 2.565 N/A PHE 458.A N VAL 454.A O no hydrogen 3.021 N/A GLN 459.A N GLY 455.A O no hydrogen 2.977 N/A GLN 459.A NE2 GLN 459.A O no hydrogen 3.542 N/A GLN 459.A NE2 ASN 463.A OD1 no hydrogen 2.918 N/A HIS 460.A N ASP 456.A O no hydrogen 2.886 N/A HIS 460.A NE2 TRP 233.A O no hydrogen 2.729 N/A TRP 461.A N TYR 457.A O no hydrogen 3.084 N/A TRP 461.A NE1 GLU 236.A OE2 no hydrogen 2.972 N/A ILE 462.A N PHE 458.A O no hydrogen 2.982 N/A ASN 463.A N GLN 459.A O no hydrogen 2.742 N/A LEU 464.A N HIS 460.A O no hydrogen 3.013 N/A GLY 465.A N TRP 461.A O no hydrogen 3.377 N/A LYS 466.A N ILE 462.A O no hydrogen 3.017 N/A HIS 467.A N ASN 463.A O no hydrogen 3.147 N/A ALA 468.A N GLY 465.A O no hydrogen 3.214 N/A SER 471.A N ASP 469.A OD1 no hydrogen 3.178 N/A SER 471.A OG ASP 469.A OD1 no hydrogen 2.956 N/A LYS 472.A N ASP 469.A O no hydrogen 2.941 N/A LYS 472.A NZ ASP 293.A O no hydrogen 2.890 N/A LEU 473.A N GLU 470.A O no hydrogen 3.372 N/A LYS 475.A N SER 401.A O no hydrogen 3.059 N/A PHE 477.A N ILE 403.A O no hydrogen 2.909 N/A PHE 478.A N THR 417.A O no hydrogen 2.887 N/A VAL 479.A N PHE 405.A O no hydrogen 2.822 N/A ASN 480.A N LEU 415.A O no hydrogen 2.928 N/A ASN 480.A ND2 ARG 409.A O no hydrogen 2.874 N/A ASN 480.A ND2 VAL 413.A O no hydrogen 2.932 N/A PHE 482.A N ASN 480.A OD1 no hydrogen 3.016 N/A ARG 483.A NH1 ALA 544.A O no hydrogen 3.081 N/A ARG 483.A NH1 ALA 546.A O no hydrogen 2.751 N/A ARG 483.A NH2 ALA 546.A O no hydrogen 3.326 N/A ARG 484.A N LYS 410.A O no hydrogen 2.854 N/A ARG 484.A NE GLY 488.A O no hydrogen 2.726 N/A ARG 484.A NH2 GLY 488.A O no hydrogen 2.938 N/A GLY 485.A N ARG 489.A O no hydrogen 2.928 N/A GLY 488.A N GLY 485.A O no hydrogen 2.890 N/A ARG 489.A N ASP 487.A OD1 no hydrogen 3.050 N/A LEU 491.A N ARG 483.A O no hydrogen 3.042 N/A TRP 492.A NE1 ASN 498.A OD1 no hydrogen 2.841 N/A GLU 497.A N GLY 494.A O no hydrogen 3.038 N/A ASN 498.A N PHE 495.A O no hydrogen 2.909 N/A SER 499.A N GLY 496.A O no hydrogen 2.991 N/A SER 499.A OG GLY 496.A O no hydrogen 2.750 N/A ARG 500.A N GLU 497.A O no hydrogen 2.928 N/A ARG 500.A NE GLU 497.A OE2 no hydrogen 2.775 N/A ARG 500.A NH1 ASP 530.A O no hydrogen 2.865 N/A ARG 500.A NH1 ASP 532.A O no hydrogen 2.951 N/A ARG 500.A NH2 GLU 497.A OE2 no hydrogen 3.561 N/A ARG 500.A NH2 ASP 532.A O no hydrogen 3.103 N/A LEU 502.A N ASN 498.A O no hydrogen 3.007 N/A LYS 503.A N SER 499.A O no hydrogen 2.904 N/A LYS 503.A NZ ASP 530.A OD1 no hydrogen 2.770 N/A TRP 504.A N ARG 500.A O no hydrogen 3.287 N/A TRP 504.A NE1 GLY 514.A O no hydrogen 2.901 N/A ILE 505.A N VAL 501.A O no hydrogen 2.966 N/A VAL 506.A N LEU 502.A O no hydrogen 2.897 N/A ASP 507.A N LYS 503.A O no hydrogen 2.845 N/A ARG 508.A N TRP 504.A O no hydrogen 2.778 N/A ARG 508.A NE GLU 418.A OE2 no hydrogen 2.828 N/A ARG 508.A NH1 ALA 513.A O no hydrogen 2.913 N/A ARG 508.A NH2 GLU 418.A OE2 no hydrogen 3.221 N/A ILE 509.A N ILE 505.A O no hydrogen 3.008 N/A GLU 510.A N VAL 506.A O no hydrogen 3.042 N/A HIS 511.A N ARG 508.A O no hydrogen 3.035 N/A LYS 512.A N ASP 507.A O no hydrogen 2.750 N/A ALA 516.A N VAL 523.A O no hydrogen 2.802 N/A THR 518.A N GLY 521.A O no hydrogen 2.991 N/A THR 518.A OG1 GLY 521.A O no hydrogen 2.721 N/A ILE 520.A N THR 518.A OG1 no hydrogen 3.169 N/A GLY 521.A N THR 518.A O no hydrogen 3.249 N/A THR 522.A N GLU 418.A O no hydrogen 2.906 N/A VAL 523.A N ALA 516.A O no hydrogen 2.994 N/A ALA 525.A N ASP 528.A OD2 no hydrogen 2.869 N/A ASP 528.A N ALA 525.A O no hydrogen 2.895 N/A LEU 529.A N VAL 526.A O no hydrogen 3.054 N/A ASP 532.A N ASP 530.A OD2 no hydrogen 2.977 N/A LEU 534.A N LEU 531.A O no hydrogen 3.038 N/A VAL 536.A N LEU 534.A O no hydrogen 2.922 N/A ALA 539.A N ASP 537.A OD1 no hydrogen 3.114 N/A ASP 540.A N ASP 537.A O no hydrogen 2.944 N/A VAL 541.A N ASP 537.A O no hydrogen 3.271 N/A ALA 542.A N ALA 538.A O no hydrogen 2.868 N/A ALA 543.A N ALA 539.A O no hydrogen 2.990 N/A ALA 544.A N ASP 540.A O no hydrogen 2.886 N/A LEU 545.A N VAL 541.A O no hydrogen 3.053 N/A LEU 545.A N ALA 542.A O no hydrogen 3.079 N/A ALA 546.A N ALA 543.A O no hydrogen 3.295 N/A GLU 551.A N ASP 548.A OD2 no hydrogen 2.948 N/A TRP 552.A N ASP 548.A O no hydrogen 3.029 N/A TRP 552.A NE1 THR 412.A O no hydrogen 2.983 N/A ARG 553.A N ALA 549.A O no hydrogen 2.830 N/A ARG 553.A NE GLY 586.A O no hydrogen 2.831 N/A ARG 553.A NH1 ASP 550.A OD1 no hydrogen 2.878 N/A ARG 553.A NH2 LEU 585.A O no hydrogen 2.955 N/A GLN 554.A N ASP 550.A O no hydrogen 3.162 N/A GLU 555.A N GLU 551.A O no hydrogen 3.171 N/A GLU 555.A N TRP 552.A O no hydrogen 3.108 N/A LEU 556.A N TRP 552.A O no hydrogen 3.196 N/A ILE 559.A N GLU 555.A O no hydrogen 3.045 N/A GLU 560.A N LEU 556.A O no hydrogen 2.802 N/A GLU 561.A N PRO 557.A O no hydrogen 3.009 N/A TRP 562.A N LEU 558.A O no hydrogen 3.190 N/A TRP 562.A NE1 ALA 430.A O no hydrogen 2.875 N/A LEU 563.A N ILE 559.A O no hydrogen 2.895 N/A GLN 564.A N GLU 560.A O no hydrogen 2.915 N/A GLN 564.A NE2 GLU 560.A OE2 no hydrogen 2.969 N/A PHE 565.A N GLU 561.A O no hydrogen 3.074 N/A VAL 566.A N TRP 562.A O no hydrogen 2.973 N/A LYS 569.A NZ GLU 568.A OE2 no hydrogen 2.505 N/A LEU 570.A N GLY 567.A O no hydrogen 3.083 N/A VAL 574.A N PRO 571.A O no hydrogen 3.014 N/A LYS 575.A N PRO 571.A O no hydrogen 3.235 N/A LYS 575.A NZ ASP 579.A OD1 no hydrogen 2.761 N/A LYS 575.A NZ ASP 579.A OD2 no hydrogen 3.289 N/A ASP 576.A N THR 572.A O no hydrogen 2.750 N/A GLU 577.A N GLY 573.A O no hydrogen 3.390 N/A PHE 578.A N VAL 574.A O no hydrogen 3.109 N/A ASP 579.A N LYS 575.A O no hydrogen 2.923 N/A ALA 580.A N ASP 576.A O no hydrogen 2.941 N/A LEU 581.A N GLU 577.A O no hydrogen 3.026 N/A LYS 582.A N PHE 578.A O no hydrogen 2.986 N/A GLU 583.A N ASP 579.A O no hydrogen 2.921 N/A ARG 584.A N ALA 580.A O no hydrogen 2.960 N/A ARG 584.A NE PRO 519.A O no hydrogen 2.790 N/A ARG 584.A NH2 PRO 519.A O no hydrogen 3.045 N/A LEU 585.A N LEU 581.A O no hydrogen 3.004 N/A GLY 586.A N LYS 582.A O no hydrogen 3.122 N/A