Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 2vbf_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLY 4.A N HIS 1.A O no hydrogen 2.865 N/A LEU 5.A N SER 3.A OG no hydrogen 3.258 N/A TYR 7.A OH ASP 15.A OD2 no hydrogen 2.559 N/A THR 8.A N ASP 11.A OD2 no hydrogen 2.859 N/A THR 8.A OG1 ASP 11.A OD2 no hydrogen 2.746 N/A THR 8.A OG1 ALA 174.A O no hydrogen 3.379 N/A VAL 9.A N ALA 176.A O no hydrogen 2.862 N/A GLY 10.A N ALA 174.A O no hydrogen 2.917 N/A ASP 11.A N THR 8.A OG1 no hydrogen 3.159 N/A TYR 12.A N THR 8.A O no hydrogen 2.938 N/A TYR 12.A OH ASP 152.A OD1 no hydrogen 3.319 N/A TYR 12.A OH ASP 152.A OD2 no hydrogen 2.640 N/A LEU 13.A N VAL 9.A O no hydrogen 2.919 N/A LEU 14.A N GLY 10.A O no hydrogen 3.012 N/A ASP 15.A N ASP 11.A O no hydrogen 2.800 N/A ARG 16.A N TYR 12.A O no hydrogen 2.980 N/A ARG 16.A NE ASP 152.A OD1 no hydrogen 2.910 N/A ARG 16.A NH1 GLU 19.A OE1 no hydrogen 3.065 N/A ARG 16.A NH1 GLU 19.A OE2 no hydrogen 2.759 N/A ARG 16.A NH1 LEU 183.A O no hydrogen 2.838 N/A ARG 16.A NH2 TYR 12.A OH no hydrogen 3.468 N/A ARG 16.A NH2 ASP 152.A OD1 no hydrogen 3.519 N/A ARG 16.A NH2 ASP 152.A OD2 no hydrogen 2.942 N/A ARG 16.A NH2 LEU 183.A O no hydrogen 3.129 N/A LEU 17.A N LEU 13.A O no hydrogen 2.912 N/A HIS 18.A N LEU 14.A O no hydrogen 2.915 N/A GLU 19.A N ASP 15.A O no hydrogen 2.982 N/A LEU 20.A N ARG 16.A O no hydrogen 3.144 N/A GLY 21.A N HIS 18.A O no hydrogen 2.903 N/A ILE 22.A N LEU 17.A O no hydrogen 3.256 N/A GLU 23.A N TYR 64.A OH no hydrogen 3.004 N/A ILE 25.A N LYS 47.A O no hydrogen 2.911 N/A PHE 26.A N ALA 72.A O no hydrogen 3.168 N/A GLY 27.A N ASN 51.A OD1 no hydrogen 2.952 N/A VAL 28.A N LEU 74.A O no hydrogen 3.152 N/A GLY 30.A N ASN 33.A OD1 no hydrogen 3.030 N/A TYR 32.A OH HIS 117.A O no hydrogen 2.808 N/A ASN 33.A N GLY 30.A O no hydrogen 2.844 N/A ASN 33.A ND2 VAL 28.A O no hydrogen 3.369 N/A LEU 37.A N ASN 33.A O no hydrogen 2.900 N/A ASP 38.A N LEU 34.A O no hydrogen 2.975 N/A GLN 39.A NE2 THR 8.A OG1 no hydrogen 2.852 N/A ILE 40.A N PHE 36.A O no hydrogen 3.155 N/A ILE 41.A N LEU 37.A O no hydrogen 2.895 N/A SER 42.A N ASP 38.A O no hydrogen 2.984 N/A SER 42.A OG ASP 38.A O no hydrogen 3.107 N/A ARG 43.A N ILE 40.A O no hydrogen 3.248 N/A ARG 43.A NE ASP 45.A OD1 no hydrogen 2.961 N/A ARG 43.A NH1 ASP 15.A OD1 no hydrogen 2.943 N/A ARG 43.A NH2 ASP 15.A OD1 no hydrogen 3.064 N/A ARG 43.A NH2 ASP 45.A OD1 no hydrogen 3.426 N/A ARG 43.A NH2 ASP 45.A OD2 no hydrogen 3.012 N/A GLU 44.A N GLU 44.A OE1 no hydrogen 2.768 N/A LYS 47.A N GLU 23.A O no hydrogen 2.990 N/A LYS 47.A NZ GLU 444.A OE1 no hydrogen 2.710 N/A ILE 49.A N ILE 25.A O no hydrogen 2.901 N/A ASN 51.A N GLY 27.A O no hydrogen 2.820 N/A ASN 51.A ND2 GLU 437.A OE1 no hydrogen 3.128 N/A ALA 52.A N GLU 437.A OE1 no hydrogen 3.164 N/A ALA 52.A N GLU 437.A OE2 no hydrogen 3.121 N/A ASN 53.A N GLU 437.A OE2 no hydrogen 3.427 N/A GLU 54.A N GLU 54.A OE1 no hydrogen 2.743 N/A ASN 56.A N ASN 53.A OD1 no hydrogen 2.837 N/A ASN 56.A ND2 GLN 436.A OE1 no hydrogen 3.373 N/A ASN 56.A ND2 GLU 437.A OE2 no hydrogen 2.812 N/A ALA 57.A N ASN 53.A O no hydrogen 3.083 N/A SER 58.A N GLU 54.A O no hydrogen 2.964 N/A SER 58.A OG LEU 55.A O no hydrogen 2.620 N/A SER 58.A OG ALA 84.A O no hydrogen 3.355 N/A TYR 59.A N LEU 55.A O no hydrogen 3.059 N/A TYR 59.A OH SER 402.A OG no hydrogen 2.786 N/A MET 60.A N ASN 56.A O no hydrogen 2.807 N/A ALA 61.A N ALA 57.A O no hydrogen 2.880 N/A ASP 62.A N SER 58.A O no hydrogen 3.053 N/A GLY 63.A N TYR 59.A O no hydrogen 3.044 N/A TYR 64.A N MET 60.A O no hydrogen 2.945 N/A TYR 64.A OH GLU 24.A OE1 no hydrogen 2.671 N/A ALA 65.A N ALA 61.A O no hydrogen 2.838 N/A ARG 66.A N ASP 62.A O no hydrogen 2.978 N/A ARG 66.A NE ASP 62.A OD1 no hydrogen 2.873 N/A ARG 66.A NH1 GLY 396.A O no hydrogen 3.011 N/A ARG 66.A NH2 GLU 94.A OE1 no hydrogen 2.878 N/A THR 67.A N TYR 64.A O no hydrogen 3.133 N/A THR 67.A OG1 SER 413.A OG no hydrogen 2.597 N/A LYS 68.A N TYR 64.A O no hydrogen 2.685 N/A LYS 68.A NZ GLU 23.A OE1 no hydrogen 3.109 N/A LYS 68.A NZ ALA 416.A O no hydrogen 3.325 N/A LYS 69.A N ALA 65.A O no hydrogen 2.788 N/A LYS 69.A NZ ARG 66.A O no hydrogen 2.800 N/A LYS 69.A NZ ILE 216.A O no hydrogen 2.890 N/A LYS 69.A NZ GLU 221.A OE1 no hydrogen 3.319 N/A LYS 69.A NZ GLU 221.A OE2 no hydrogen 2.777 N/A ALA 71.A N PRO 97.A O no hydrogen 3.031 N/A PHE 73.A N VAL 99.A O no hydrogen 2.980 N/A LEU 74.A N PHE 26.A O no hydrogen 2.808 N/A THR 75.A N ILE 101.A O no hydrogen 2.898 N/A THR 75.A OG1 GLU 100.A OE2 no hydrogen 2.846 N/A PHE 77.A N GLY 103.A O no hydrogen 2.779 N/A GLY 78.A N GLU 81.A OE1 no hydrogen 2.916 N/A VAL 79.A N PHE 77.A O no hydrogen 2.832 N/A GLY 80.A N THR 76.A O no hydrogen 3.002 N/A GLU 81.A N THR 76.A O no hydrogen 3.147 N/A LEU 82.A N GLY 78.A O no hydrogen 2.917 N/A SER 83.A N VAL 79.A O no hydrogen 3.359 N/A SER 83.A OG VAL 79.A O no hydrogen 2.731 N/A ALA 84.A N GLY 80.A O no hydrogen 3.156 N/A ALA 84.A N GLU 81.A O no hydrogen 3.083 N/A ILE 85.A N LEU 82.A O no hydrogen 3.506 N/A ASN 86.A ND2 SER 402.A OG no hydrogen 2.889 N/A LEU 88.A N ALA 84.A O no hydrogen 3.118 N/A ALA 89.A N ILE 85.A O no hydrogen 2.821 N/A GLY 90.A N ASN 86.A O no hydrogen 3.067 N/A SER 91.A N GLY 87.A O no hydrogen 3.028 N/A SER 91.A OG ASP 62.A OD2 no hydrogen 2.665 N/A SER 91.A OG GLY 87.A O no hydrogen 3.305 N/A TYR 92.A N LEU 88.A O no hydrogen 2.886 N/A ALA 93.A N ALA 89.A O no hydrogen 2.799 N/A GLU 94.A N GLY 90.A O no hydrogen 2.949 N/A ASN 95.A N TYR 92.A O no hydrogen 3.250 N/A ASN 95.A ND2 ASN 95.A O no hydrogen 2.901 N/A ASN 95.A ND2 GLU 161.A O no hydrogen 2.899 N/A ASN 95.A ND2 ARG 162.A O no hydrogen 2.992 N/A LEU 96.A N SER 91.A O no hydrogen 2.757 N/A VAL 98.A N LEU 96.A O no hydrogen 2.908 N/A VAL 99.A N ALA 71.A O no hydrogen 2.863 N/A GLU 100.A N VAL 165.A O no hydrogen 2.971 N/A ILE 101.A N PHE 73.A O no hydrogen 2.911 N/A VAL 102.A N ILE 167.A O no hydrogen 2.752 N/A GLY 103.A N THR 75.A O no hydrogen 2.923 N/A SER 104.A N LEU 169.A O no hydrogen 3.099 N/A SER 107.A N ASP 172.A OD2 no hydrogen 2.884 N/A SER 107.A OG ASP 172.A OD1 no hydrogen 3.026 N/A SER 107.A OG ASP 172.A OD2 no hydrogen 3.275 N/A LYS 108.A NZ ASP 112.A OD2 no hydrogen 3.091 N/A VAL 109.A N THR 106.A OG1 no hydrogen 3.233 N/A GLN 110.A N THR 106.A O no hydrogen 2.990 N/A GLN 110.A NE2 SER 104.A OG no hydrogen 3.044 N/A GLN 110.A NE2 PRO 105.A O no hydrogen 2.792 N/A ASN 111.A N SER 107.A O no hydrogen 2.889 N/A ASP 112.A N LYS 108.A O no hydrogen 2.910 N/A GLY 113.A N GLN 110.A O no hydrogen 3.172 N/A LYS 114.A N VAL 109.A O no hydrogen 3.482 N/A HIS 117.A NE2 ASP 31.A OD1 no hydrogen 2.761 N/A THR 119.A OG1 VAL 116.A O no hydrogen 2.698 N/A ALA 121.A N THR 119.A OG1 no hydrogen 3.157 N/A ASP 124.A N ASP 122.A OD1 no hydrogen 3.035 N/A LYS 126.A N ASP 124.A OD1 no hydrogen 2.848 N/A HIS 127.A NE2 ASP 122.A OD2 no hydrogen 2.694 N/A LYS 130.A N LYS 126.A O no hydrogen 3.227 N/A MET 131.A N HIS 127.A O no hydrogen 2.992 N/A HIS 132.A N MET 129.A O no hydrogen 2.985 N/A HIS 132.A ND1 PHE 128.A O no hydrogen 2.764 N/A GLU 133.A N LYS 130.A O no hydrogen 2.980 N/A VAL 135.A N HIS 132.A O no hydrogen 3.126 N/A THR 136.A OG1 HIS 132.A O no hydrogen 2.674 N/A ALA 137.A N PRO 164.A O no hydrogen 2.847 N/A ARG 139.A NE THR 136.A OG1 no hydrogen 2.956 N/A ARG 139.A NH2 THR 136.A O no hydrogen 2.963 N/A ARG 139.A NH2 THR 136.A OG1 no hydrogen 3.193 N/A THR 140.A N TYR 166.A O no hydrogen 2.994 N/A THR 140.A OG1 GLU 150.A OE1 no hydrogen 2.630 N/A LEU 142.A N ASN 168.A O no hydrogen 2.995 N/A THR 143.A N ASN 146.A OD1 no hydrogen 2.853 N/A ASN 146.A N THR 143.A OG1 no hydrogen 2.912 N/A ASN 146.A ND2 LEU 141.A O no hydrogen 3.247 N/A GLU 150.A N ASN 146.A O no hydrogen 2.897 N/A ILE 151.A N ALA 147.A O no hydrogen 2.817 N/A ASP 152.A N THR 148.A O no hydrogen 3.100 N/A ARG 153.A N TYR 149.A O no hydrogen 2.767 N/A ARG 153.A NE GLU 150.A OE2 no hydrogen 3.090 N/A ARG 153.A NH2 ARG 139.A O no hydrogen 2.967 N/A ARG 153.A NH2 GLU 150.A OE1 no hydrogen 2.952 N/A VAL 154.A N GLU 150.A O no hydrogen 2.951 N/A LEU 155.A N ILE 151.A O no hydrogen 2.974 N/A SER 156.A N ASP 152.A O no hydrogen 2.823 N/A SER 156.A OG ASP 152.A O no hydrogen 2.728 N/A GLN 157.A N ARG 153.A O no hydrogen 3.064 N/A GLN 157.A NE2 GLU 161.A OE2 no hydrogen 2.288 N/A LEU 158.A N VAL 154.A O no hydrogen 2.902 N/A LEU 159.A N LEU 155.A O no hydrogen 2.963 N/A LYS 160.A N SER 156.A O no hydrogen 2.903 N/A GLU 161.A N GLN 157.A O no hydrogen 3.053 N/A ARG 162.A N LEU 158.A O no hydrogen 2.756 N/A ARG 162.A NE LEU 159.A O no hydrogen 2.742 N/A ARG 162.A NH2 LEU 159.A O no hydrogen 3.294 N/A LYS 163.A NZ ASN 95.A OD1 no hydrogen 2.800 N/A VAL 165.A N VAL 98.A O no hydrogen 3.010 N/A TYR 166.A N ALA 138.A O no hydrogen 3.119 N/A TYR 166.A OH GLU 81.A OE2 no hydrogen 2.422 N/A ILE 167.A N GLU 100.A O no hydrogen 2.909 N/A ASN 168.A N THR 140.A O no hydrogen 2.812 N/A ASN 168.A ND2 SER 104.A OG no hydrogen 2.625 N/A LEU 169.A N VAL 102.A O no hydrogen 2.760 N/A VAL 171.A N SER 104.A O no hydrogen 3.104 N/A VAL 173.A N PRO 170.A O no hydrogen 3.023 N/A ALA 174.A N PRO 170.A O no hydrogen 3.340 N/A ALA 176.A N VAL 173.A O no hydrogen 3.020 N/A ALA 178.A N TYR 7.A O no hydrogen 3.003 N/A LYS 180.A NZ ASP 15.A OD2 no hydrogen 2.682 N/A SER 184.A OG GLU 186.A O no hydrogen 3.379 N/A LEU 185.A N GLU 19.A OE1 no hydrogen 3.347 N/A ASN 187.A ND2 ASN 187.A O no hydrogen 2.656 N/A THR 189.A OG1 ASP 316.A O no hydrogen 2.575 N/A GLN 191.A N ASN 187.A O no hydrogen 2.922 N/A VAL 192.A N THR 188.A O no hydrogen 2.854 N/A ILE 193.A N THR 189.A O no hydrogen 2.732 N/A LEU 194.A N GLU 190.A O no hydrogen 3.033 N/A SER 195.A N GLN 191.A O no hydrogen 2.935 N/A SER 195.A OG GLN 191.A O no hydrogen 2.989 N/A LYS 196.A N VAL 192.A O no hydrogen 2.994 N/A ILE 197.A N ILE 193.A O no hydrogen 2.959 N/A GLU 198.A N LEU 194.A O no hydrogen 2.854 N/A GLU 199.A N SER 195.A O no hydrogen 2.893 N/A SER 200.A N LYS 196.A O no hydrogen 2.941 N/A SER 200.A OG LYS 196.A O no hydrogen 2.701 N/A LEU 201.A N ILE 197.A O no hydrogen 2.859 N/A LYS 202.A N GLU 198.A O no hydrogen 2.997 N/A LYS 202.A NZ GLU 198.A OE2 no hydrogen 2.811 N/A LYS 202.A NZ LYS 330.A O no hydrogen 2.826 N/A ASN 203.A N GLU 199.A O no hydrogen 2.991 N/A GLN 205.A N ASP 273.A OD2 no hydrogen 2.849 N/A LYS 206.A N ASP 273.A OD1 no hydrogen 2.870 N/A LYS 206.A NZ SER 271.A OG no hydrogen 2.763 N/A VAL 208.A N PHE 274.A O no hydrogen 3.003 N/A VAL 209.A N PRO 234.A O no hydrogen 2.922 N/A ILE 210.A N LEU 276.A O no hydrogen 2.772 N/A ALA 211.A N THR 236.A O no hydrogen 3.068 N/A GLY 212.A N LEU 278.A O no hydrogen 2.899 N/A GLU 214.A N GLY 279.A O no hydrogen 3.030 N/A VAL 215.A N GLY 212.A O no hydrogen 3.120 N/A SER 217.A N HIS 213.A O no hydrogen 3.008 N/A SER 217.A OG ASN 95.A O no hydrogen 2.631 N/A SER 217.A OG HIS 213.A O no hydrogen 3.206 N/A PHE 218.A N GLU 214.A O no hydrogen 3.310 N/A GLY 219.A N ILE 216.A O no hydrogen 3.029 N/A LEU 220.A N VAL 215.A O no hydrogen 2.955 N/A GLU 221.A N GLU 221.A OE1 no hydrogen 2.846 N/A VAL 224.A N LEU 220.A O no hydrogen 2.987 N/A THR 225.A N GLU 221.A O no hydrogen 2.880 N/A THR 225.A OG1 GLU 221.A O no hydrogen 3.011 N/A GLN 226.A N LYS 222.A O no hydrogen 2.963 N/A PHE 227.A N THR 223.A O no hydrogen 3.010 N/A VAL 228.A N VAL 224.A O no hydrogen 2.869 N/A SER 229.A N THR 225.A O no hydrogen 2.843 N/A SER 229.A OG.B THR 225.A O no hydrogen 3.181 N/A GLU 230.A N GLN 226.A O no hydrogen 2.971 N/A THR 231.A N PHE 227.A O no hydrogen 3.096 N/A THR 231.A OG1 PHE 227.A O no hydrogen 2.820 N/A THR 231.A OG1 VAL 228.A O no hydrogen 3.505 N/A LYS 232.A N VAL 228.A O no hydrogen 2.815 N/A ILE 235.A N SER 251.A O no hydrogen 2.947 N/A THR 236.A N VAL 209.A O no hydrogen 2.937 N/A THR 236.A OG1 THR 237.A O no hydrogen 3.403 N/A THR 236.A OG1 GLY 254.A O no hydrogen 2.660 N/A THR 237.A OG1 LEU 238.A O no hydrogen 2.862 N/A ASN 239.A ND2 SER 285.A O no hydrogen 2.964 N/A LYS 242.A NZ GLU 247.A OE1 no hydrogen 3.187 N/A LYS 242.A NZ GLU 247.A OE2 no hydrogen 2.728 N/A LYS 242.A NZ SER 384.A O no hydrogen 2.914 N/A LYS 242.A NZ ILE 386.A O no hydrogen 2.775 N/A SER 243.A OG LYS 242.A O no hydrogen 2.584 N/A SER 243.A OG PHE 394.A O no hydrogen 3.365 N/A ALA 244.A N GLY 241.A O no hydrogen 2.898 N/A ASP 246.A N THR 225.A OG1 no hydrogen 2.967 N/A SER 248.A N ASP 246.A OD1 no hydrogen 2.964 N/A SER 248.A OG ASP 246.A OD1 no hydrogen 2.754 N/A SER 251.A OG LEU 233.A O no hydrogen 2.731 N/A PHE 252.A N LEU 249.A O no hydrogen 3.082 N/A LEU 253.A N ILE 235.A O no hydrogen 2.816 N/A TYR 256.A N THR 237.A O no hydrogen 2.975 N/A TYR 256.A OH GLU 270.A OE2 no hydrogen 2.547 N/A ASN 257.A N SER 261.A OG no hydrogen 2.763 N/A LYS 259.A N THR 291.A OG1 no hydrogen 2.830 N/A LEU 260.A N ASN 257.A O no hydrogen 3.128 N/A SER 261.A N GLY 258.A O no hydrogen 3.037 N/A SER 261.A OG GLY 258.A O no hydrogen 2.682 N/A SER 264.A N GLU 262.A OE2 no hydrogen 2.949 N/A SER 264.A OG GLU 262.A OE1 no hydrogen 2.555 N/A SER 264.A OG GLU 262.A OE2 no hydrogen 3.080 N/A LEU 265.A N GLU 262.A OE1 no hydrogen 3.075 N/A LYS 266.A N GLU 262.A O no hydrogen 2.894 N/A ASN 267.A N ILE 263.A O no hydrogen 2.918 N/A PHE 268.A N SER 264.A O no hydrogen 3.063 N/A VAL 269.A N LEU 265.A O no hydrogen 2.960 N/A GLU 270.A N LYS 266.A O no hydrogen 3.028 N/A SER 271.A N ASN 267.A O no hydrogen 3.064 N/A SER 271.A N PHE 268.A O no hydrogen 3.261 N/A SER 271.A OG ASN 267.A O no hydrogen 2.713 N/A SER 271.A OG PHE 268.A O no hydrogen 3.241 N/A ALA 272.A N VAL 269.A O no hydrogen 3.402 N/A ASP 273.A N LYS 206.A O no hydrogen 3.056 N/A ILE 275.A N LYS 298.A O no hydrogen 2.860 N/A LEU 276.A N VAL 208.A O no hydrogen 2.990 N/A MET 277.A N ILE 300.A O no hydrogen 2.954 N/A LEU 278.A N ILE 210.A O no hydrogen 2.791 N/A GLY 279.A N LEU 302.A O no hydrogen 2.735 N/A THR 283.A N SER 286.A OG no hydrogen 3.144 N/A THR 283.A OG1 SER 286.A OG no hydrogen 2.749 N/A SER 285.A N ASP 284.A OD1 no hydrogen 2.831 N/A SER 285.A OG ASP 284.A OD1 no hydrogen 3.401 N/A SER 286.A N THR 283.A O no hydrogen 3.243 N/A SER 286.A OG THR 283.A O no hydrogen 3.281 N/A SER 286.A OG THR 283.A OG1 no hydrogen 2.749 N/A THR 287.A N ASP 284.A O no hydrogen 3.437 N/A THR 287.A OG1 THR 283.A O no hydrogen 2.741 N/A GLY 288.A N ASN 257.A OD1 no hydrogen 2.756 N/A ALA 289.A N ASP 284.A O no hydrogen 2.885 N/A PHE 290.A N THR 287.A OG1 no hydrogen 2.836 N/A THR 291.A N THR 287.A O no hydrogen 2.934 N/A THR 291.A OG1 THR 287.A O no hydrogen 3.157 N/A THR 291.A OG1 GLY 288.A O no hydrogen 2.796 N/A HIS 293.A N TYR 256.A OH no hydrogen 2.951 N/A ASN 297.A N ASP 295.A OD1 no hydrogen 2.876 N/A LYS 298.A N ASP 295.A O no hydrogen 2.950 N/A MET 299.A N GLU 296.A O no hydrogen 3.199 N/A ILE 300.A N ILE 275.A O no hydrogen 2.918 N/A SER 301.A N ILE 308.A O no hydrogen 2.961 N/A LEU 302.A N MET 277.A O no hydrogen 2.813 N/A ASN 303.A N GLU 306.A O no hydrogen 2.849 N/A ASN 303.A ND2 GLU 214.A OE1 no hydrogen 3.001 N/A ASN 303.A ND2 VAL 280.A O no hydrogen 2.923 N/A ILE 304.A N GLU 214.A OE1 no hydrogen 2.857 N/A GLY 307.A N VAL 314.A O no hydrogen 2.867 N/A ILE 308.A N SER 301.A O no hydrogen 2.890 N/A ILE 309.A N LYS 312.A O no hydrogen 2.883 N/A PHE 310.A N MET 299.A O no hydrogen 2.921 N/A ASN 311.A ND2 ASN 297.A OD1 no hydrogen 2.675 N/A LYS 312.A N ILE 309.A O no hydrogen 3.012 N/A VAL 314.A N GLY 307.A O no hydrogen 2.854 N/A PHE 317.A N GLU 315.A O no hydrogen 2.972 N/A ASP 318.A N GLU 190.A OE2 no hydrogen 2.705 N/A ARG 320.A NH1 GLU 186.A OE2 no hydrogen 3.475 N/A ALA 321.A N ASP 318.A OD2 no hydrogen 2.775 N/A VAL 322.A N ASP 318.A O no hydrogen 3.010 N/A VAL 323.A N PHE 319.A O no hydrogen 2.961 N/A SER 324.A N ARG 320.A O no hydrogen 2.926 N/A SER 324.A OG.A ARG 320.A O no hydrogen 2.903 N/A SER 324.A OG.A ALA 321.A O no hydrogen 3.117 N/A SER 324.A OG.B ARG 320.A O no hydrogen 3.016 N/A SER 325.A N VAL 322.A O no hydrogen 3.031 N/A SER 325.A OG.A ALA 321.A O no hydrogen 3.281 N/A SER 325.A OG.A VAL 322.A O no hydrogen 2.560 N/A SER 325.A OG.B ALA 321.A O no hydrogen 2.720 N/A LEU 326.A N VAL 323.A O no hydrogen 3.221 N/A SER 327.A OG GLU 230.A OE1 no hydrogen 3.253 N/A GLU 328.A N SER 325.A O no hydrogen 3.127 N/A LEU 329.A N LEU 326.A O no hydrogen 3.079 N/A TYR 334.A N THR 231.A O no hydrogen 2.890 N/A TYR 334.A OH GLN 337.A O no hydrogen 2.587 N/A TYR 338.A OH LYS 232.A O no hydrogen 2.533 N/A LYS 341.A NZ PHE 252.A O no hydrogen 2.713 N/A PHE 346.A N GLU 345.A OE1 no hydrogen 2.809 N/A SER 349.A N GLU 501.A OE1 no hydrogen 2.939 N/A SER 349.A OG GLU 501.A OE1 no hydrogen 3.200 N/A ALA 351.A N SER 349.A OG no hydrogen 3.077 N/A LEU 353.A N ARG 499.A O no hydrogen 2.790 N/A GLN 355.A N ASP 529.A OD2 no hydrogen 2.725 N/A GLN 355.A NE2 THR 378.A OG1 no hydrogen 3.002 N/A ARG 357.A NE GLU 501.A OE2 no hydrogen 2.919 N/A ARG 357.A NH1 GLN 360.A OE1.B no hydrogen 3.458 N/A ARG 357.A NH2 ILE 347.A O no hydrogen 2.937 N/A ARG 357.A NH2 GLU 501.A OE1 no hydrogen 3.098 N/A LEU 358.A N SER 354.A O no hydrogen 2.837 N/A TRP 359.A N GLN 355.A O no hydrogen 3.185 N/A TRP 359.A NE1 GLN 355.A OE1 no hydrogen 2.953 N/A GLN 360.A N ASP 356.A O no hydrogen 3.243 N/A GLN 360.A NE2.A GLU 345.A O no hydrogen 2.627 N/A ALA 361.A N ARG 357.A O no hydrogen 2.897 N/A VAL 362.A N LEU 358.A O no hydrogen 2.916 N/A GLU 363.A N TRP 359.A O no hydrogen 2.947 N/A SER 364.A N GLN 360.A O no hydrogen 3.070 N/A LEU 365.A N ALA 361.A O no hydrogen 2.887 N/A THR 366.A N VAL 362.A O no hydrogen 2.807 N/A THR 366.A OG1 VAL 362.A O no hydrogen 2.812 N/A GLN 367.A N GLU 370.A OE1 no hydrogen 2.717 N/A SER 368.A OG.B SER 390.A OG no hydrogen 2.613 N/A ASN 369.A N SER 390.A O no hydrogen 3.084 N/A GLU 370.A N SER 392.A OG no hydrogen 3.164 N/A THR 371.A N ARG 421.A O no hydrogen 2.922 N/A THR 371.A OG1 SER 420.A OG no hydrogen 2.812 N/A ILE 372.A N ARG 393.A O no hydrogen 2.842 N/A VAL 373.A N LEU 423.A O no hydrogen 2.823 N/A ALA 374.A N ILE 395.A O no hydrogen 3.003 N/A GLU 375.A N PHE 425.A O no hydrogen 2.964 N/A GLN 376.A N GLU 375.A OE2 no hydrogen 2.827 N/A PHE 380.A N GLU 375.A O no hydrogen 2.774 N/A PHE 381.A N GLY 377.A O no hydrogen 3.317 N/A GLY 382.A N THR 378.A O no hydrogen 2.861 N/A ALA 383.A N SER 379.A O no hydrogen 2.773 N/A SER 384.A N PHE 380.A O no hydrogen 2.887 N/A SER 384.A OG PHE 381.A O no hydrogen 3.273 N/A THR 385.A OG1 GLY 382.A O no hydrogen 3.468 N/A ILE 386.A N ALA 383.A O no hydrogen 3.166 N/A PHE 387.A N GLU 363.A OE2 no hydrogen 2.822 N/A LEU 388.A N GLU 247.A OE1 no hydrogen 2.885 N/A LYS 389.A NZ SER 364.A O no hydrogen 3.406 N/A LYS 389.A NZ THR 366.A O no hydrogen 2.728 N/A SER 390.A OG SER 368.A OG.B no hydrogen 2.613 N/A ASN 391.A N ASP 246.A OD2 no hydrogen 2.735 N/A SER 392.A N LYS 389.A O no hydrogen 3.182 N/A SER 392.A OG GLN 367.A O no hydrogen 2.966 N/A SER 392.A OG GLU 370.A O no hydrogen 3.389 N/A ARG 393.A N GLU 370.A O no hydrogen 2.839 N/A ARG 393.A NH2 ASP 417.A OD2 no hydrogen 2.837 N/A PHE 394.A N SER 243.A OG no hydrogen 3.048 N/A ILE 395.A N ILE 372.A O no hydrogen 2.809 N/A LEU 399.A N GLU 94.A OE2 no hydrogen 2.894 N/A TRP 400.A N GLU 94.A OE2 no hydrogen 2.990 N/A TRP 400.A NE1 ASN 86.A OD1 no hydrogen 2.944 N/A SER 402.A N GLN 397.A OE1 no hydrogen 2.956 N/A SER 402.A OG TYR 59.A OH no hydrogen 2.786 N/A GLY 404.A N GLU 375.A OE1 no hydrogen 2.907 N/A TYR 405.A N SER 402.A O no hydrogen 3.098 N/A TYR 405.A OH ASP 62.A OD1 no hydrogen 2.643 N/A THR 406.A N GLU 375.A OE1 no hydrogen 3.053 N/A THR 406.A OG1 GLU 375.A OE1 no hydrogen 2.717 N/A PHE 407.A N GLY 404.A O no hydrogen 3.404 N/A ALA 409.A N TYR 405.A O no hydrogen 3.041 N/A ALA 410.A N THR 406.A O no hydrogen 2.767 N/A LEU 411.A N PHE 407.A O no hydrogen 3.246 N/A GLY 412.A N PRO 408.A O no hydrogen 2.856 N/A SER 413.A N ALA 409.A O no hydrogen 2.914 N/A SER 413.A OG THR 67.A OG1 no hydrogen 2.597 N/A SER 413.A OG HIS 422.A NE2 no hydrogen 2.656 N/A GLN 414.A N ALA 410.A O no hydrogen 2.895 N/A GLN 414.A NE2 GLN 414.A O no hydrogen 2.871 N/A GLN 414.A NE2 SER 420.A O no hydrogen 3.018 N/A ILE 415.A N LEU 411.A O no hydrogen 2.967 N/A ALA 416.A N GLY 412.A O no hydrogen 2.970 N/A ASP 417.A N SER 413.A O no hydrogen 3.056 N/A GLU 419.A N ASP 417.A OD1 no hydrogen 3.078 N/A SER 420.A N ASP 417.A O no hydrogen 3.128 N/A SER 420.A OG ASN 369.A O no hydrogen 3.565 N/A SER 420.A OG THR 371.A OG1 no hydrogen 2.812 N/A ARG 421.A NE ASN 447.A O no hydrogen 2.713 N/A ARG 421.A NH1 ALA 511.A O no hydrogen 2.954 N/A ARG 421.A NH1 ASP 514.A O no hydrogen 3.378 N/A ARG 421.A NH2 ASN 447.A O no hydrogen 3.083 N/A ARG 421.A NH2 ALA 511.A O no hydrogen 3.527 N/A ARG 421.A NH2 ASP 514.A O no hydrogen 3.108 N/A HIS 422.A N GLN 414.A OE1 no hydrogen 2.991 N/A HIS 422.A ND1 SER 420.A O no hydrogen 2.736 N/A HIS 422.A NE2 SER 413.A OG no hydrogen 2.656 N/A LEU 423.A N THR 371.A O no hydrogen 2.804 N/A LEU 424.A N ILE 449.A O no hydrogen 2.846 N/A PHE 425.A N VAL 373.A O no hydrogen 2.843 N/A ILE 426.A N PHE 451.A O no hydrogen 3.067 N/A ASP 428.A N ILE 453.A O no hydrogen 3.013 N/A GLY 429.A N ASP 428.A OD1 no hydrogen 3.014 N/A LEU 431.A N GLY 427.A O no hydrogen 2.893 N/A GLN 432.A N ASP 428.A O no hydrogen 3.335 N/A GLN 432.A NE2 PRO 475.A O no hydrogen 2.823 N/A GLN 432.A NE2 TYR 479.A OH no hydrogen 3.043 N/A LEU 433.A N SER 430.A O no hydrogen 3.090 N/A THR 434.A N LEU 431.A O no hydrogen 3.136 N/A THR 434.A OG1 GLY 404.A O no hydrogen 2.812 N/A GLU 437.A N THR 434.A O no hydrogen 3.352 N/A LEU 438.A N VAL 435.A O no hydrogen 3.011 N/A GLY 439.A N GLN 436.A O no hydrogen 3.346 N/A SER 441.A N GLU 437.A O no hydrogen 3.091 N/A SER 441.A OG LEU 438.A O no hydrogen 2.728 N/A ILE 442.A N LEU 438.A O no hydrogen 3.174 N/A ILE 442.A N GLY 439.A O no hydrogen 3.201 N/A ARG 443.A N GLY 439.A O no hydrogen 2.970 N/A ARG 443.A NE GLU 444.A OE2 no hydrogen 2.880 N/A ARG 443.A NH1 GLY 50.A O no hydrogen 3.488 N/A ARG 443.A NH2 GLY 50.A O no hydrogen 2.877 N/A ARG 443.A NH2 GLU 444.A OE2 no hydrogen 3.087 N/A GLU 444.A N LEU 440.A O no hydrogen 2.856 N/A LYS 445.A N ILE 442.A O no hydrogen 3.137 N/A LEU 446.A N SER 441.A O no hydrogen 3.141 N/A ILE 449.A N HIS 422.A O no hydrogen 2.817 N/A CYS 450.A N TYR 519.A O no hydrogen 2.789 N/A PHE 451.A N LEU 424.A O no hydrogen 2.707 N/A ILE 452.A N ILE 521.A O no hydrogen 2.837 N/A ILE 453.A N ILE 426.A O no hydrogen 2.857 N/A ASN 454.A N LEU 523.A O no hydrogen 2.723 N/A ASN 454.A ND2 GLU 522.A OE2 no hydrogen 2.822 N/A ASP 456.A N ASN 454.A OD1 no hydrogen 3.128 N/A GLY 457.A N ASP 428.A OD2 no hydrogen 2.995 N/A TYR 458.A N ASN 472.A O no hydrogen 2.962 N/A THR 459.A OG1 LYS 527.A O no hydrogen 2.820 N/A ARG 462.A N TYR 458.A O no hydrogen 2.956 N/A ARG 462.A NH1 PRO 467.A O no hydrogen 2.837 N/A ARG 462.A NH2 ASP 456.A O no hydrogen 2.928 N/A ARG 462.A NH2 ASP 473.A OD1 no hydrogen 2.882 N/A GLU 463.A N THR 459.A O no hydrogen 2.984 N/A ILE 464.A N VAL 460.A O no hydrogen 3.218 N/A ILE 464.A N GLU 461.A O no hydrogen 3.061 N/A HIS 465.A N GLU 461.A O no hydrogen 2.867 N/A GLN 469.A N GLY 466.A O no hydrogen 2.993 N/A ASN 472.A N GLN 469.A O no hydrogen 3.059 N/A ASN 472.A ND2 HIS 465.A O no hydrogen 3.253 N/A ASN 472.A ND2 GLY 466.A O no hydrogen 2.888 N/A ASP 473.A N SER 470.A O no hydrogen 3.096 N/A SER 480.A N GLU 522.A OE1 no hydrogen 3.017 N/A LYS 481.A N ASN 478.A O no hydrogen 2.980 N/A LEU 482.A N TYR 479.A O no hydrogen 3.182 N/A THR 485.A N LYS 481.A O no hydrogen 3.160 N/A THR 485.A OG1 LYS 481.A O no hydrogen 3.230 N/A PHE 486.A N LEU 482.A O no hydrogen 2.851 N/A GLY 487.A N GLU 484.A O no hydrogen 3.100 N/A ALA 488.A N PRO 483.A O no hydrogen 2.826 N/A THR 489.A OG1 ASP 491.A OD1 no hydrogen 2.348 N/A ARG 492.A N THR 489.A O no hydrogen 2.922 N/A ARG 492.A NH1 LEU 446.A O no hydrogen 2.986 N/A ARG 492.A NH1 ASN 447.A OD1 no hydrogen 3.061 N/A ARG 492.A NH2 ASN 447.A OD1 no hydrogen 2.971 N/A VAL 493.A N THR 489.A O no hydrogen 3.009 N/A VAL 494.A N MET 518.A O no hydrogen 2.885 N/A SER 495.A OG SER 480.A O no hydrogen 3.341 N/A LYS 496.A N TRP 520.A O no hydrogen 2.993 N/A LYS 496.A NZ GLU 510.A OE1 no hydrogen 3.376 N/A LYS 496.A NZ GLU 510.A OE2 no hydrogen 3.038 N/A VAL 498.A N GLU 522.A O no hydrogen 2.790 N/A ARG 499.A N GLU 503.A OE1 no hydrogen 2.770 N/A THR 500.A N GLU 503.A OE1 no hydrogen 3.193 N/A GLU 501.A N ALA 351.A O no hydrogen 2.988 N/A GLU 503.A N THR 500.A OG1 no hydrogen 3.220 N/A PHE 504.A N THR 500.A O no hydrogen 3.022 N/A VAL 505.A N GLU 501.A O no hydrogen 3.065 N/A SER 506.A N ASN 502.A O no hydrogen 3.023 N/A VAL 507.A N GLU 503.A O no hydrogen 2.999 N/A MET 508.A N PHE 504.A O no hydrogen 2.849 N/A LYS 509.A N VAL 505.A O no hydrogen 3.035 N/A GLU 510.A N SER 506.A O no hydrogen 3.004 N/A ALA 511.A N VAL 507.A O no hydrogen 2.777 N/A GLN 512.A N MET 508.A O no hydrogen 2.878 N/A GLN 512.A NE2 LEU 365.A O no hydrogen 3.617 N/A GLN 512.A NE2 GLU 370.A OE2 no hydrogen 2.346 N/A ALA 513.A N LYS 509.A O no hydrogen 2.932 N/A ASP 514.A N GLU 510.A O no hydrogen 3.120 N/A ARG 517.A NE ASP 514.A OD2 no hydrogen 2.919 N/A ARG 517.A NH1 GLU 490.A O no hydrogen 2.863 N/A ARG 517.A NH2 ASP 514.A OD2 no hydrogen 3.042 N/A MET 518.A N ARG 492.A O no hydrogen 2.963 N/A TYR 519.A N PRO 448.A O no hydrogen 3.019 N/A TYR 519.A OH ASP 514.A OD2 no hydrogen 2.501 N/A TRP 520.A N VAL 494.A O no hydrogen 2.891 N/A TRP 520.A NE1 TYR 479.A O no hydrogen 2.825 N/A ILE 521.A N CYS 450.A O no hydrogen 2.817 N/A GLU 522.A N LYS 496.A O no hydrogen 2.844 N/A LEU 523.A N ILE 452.A O no hydrogen 2.767 N/A VAL 524.A N VAL 498.A O no hydrogen 2.982 N/A LEU 525.A N ASN 454.A O no hydrogen 3.037 N/A LYS 527.A NZ ASP 456.A OD2 no hydrogen 2.967 N/A GLU 528.A N GLU 528.A OE1 no hydrogen 2.885 N/A ASP 529.A N GLU 526.A O no hydrogen 3.101 N/A LYS 532.A N ASP 356.A OD1 no hydrogen 2.995 N/A LYS 532.A NZ ASP 356.A OD2 no hydrogen 2.810 N/A LYS 535.A N PRO 531.A O no hydrogen 3.043 N/A LYS 536.A N LYS 532.A O no hydrogen 3.331 N/A MET 537.A N LEU 533.A O no hydrogen 2.922 N/A GLY 538.A N LEU 534.A O no hydrogen 2.787 N/A LYS 539.A NZ GLU 463.A O no hydrogen 2.796 N/A LEU 540.A N LYS 536.A O no hydrogen 3.409 N/A PHE 541.A N MET 537.A O no hydrogen 2.851 N/A ALA 542.A N GLY 538.A O no hydrogen 3.062 N/A GLU 543.A N LYS 539.A O no hydrogen 3.015 N/A GLN 544.A N LEU 540.A O no hydrogen 3.001 N/A GLN 544.A NE2 ASP 284.A OD2 no hydrogen 2.858 N/A ASN 545.A N PHE 541.A O no hydrogen 3.238 N/A ASN 545.A N ALA 542.A O no hydrogen 3.191 N/A LYS 546.A N GLU 543.A O no hydrogen 3.095 N/A