Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 8po8_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLN 1.A N GLN 45.A OE1 no hydrogen 3.456 N/A LYS 3.A N GLN 2.A OE1 no hydrogen 3.000 N/A LEU 4.A N GLN 41.A OE1 no hydrogen 2.759 N/A ALA 8.A N THR 5.A OG1 no hydrogen 3.069 N/A LEU 9.A N THR 5.A O no hydrogen 3.189 N/A GLN 10.A N PHE 6.A O no hydrogen 2.896 N/A GLN 10.A NE2 SER 25.A OG no hydrogen 3.036 N/A GLN 11.A N THR 7.A O no hydrogen 3.030 N/A ARG 12.A N LEU 9.A O no hydrogen 3.006 N/A ARG 12.A NH2 ASP 52.A OD1 no hydrogen 2.112 N/A LEU 13.A N GLN 10.A O no hydrogen 3.055 N/A SER 15.A N ARG 12.A O no hydrogen 3.131 N/A LEU 16.A N LEU 13.A O no hydrogen 3.153 N/A LEU 18.A N LYS 119.A O no hydrogen 2.961 N/A ARG 21.A N MET 17.A O no hydrogen 2.718 N/A LEU 22.A N LEU 18.A O no hydrogen 2.878 N/A ARG 23.A N ARG 19.A O no hydrogen 3.058 N/A PHE 24.A N ASP 20.A O no hydrogen 2.913 N/A SER 25.A N ARG 21.A O no hydrogen 2.981 N/A ARG 26.A N LEU 22.A O no hydrogen 3.059 N/A ARG 27.A N ARG 23.A O no hydrogen 2.874 N/A ARG 27.A NH2 GLU 50.A OE1 no hydrogen 3.390 N/A LEU 28.A N PHE 24.A O no hydrogen 2.826 N/A HIS 29.A N SER 25.A O no hydrogen 2.962 N/A GLY 30.A N ARG 26.A O no hydrogen 3.125 N/A VAL 31.A N ARG 27.A O no hydrogen 3.128 N/A LYS 32.A N LEU 28.A O no hydrogen 3.193 N/A LYS 32.A N HIS 29.A O no hydrogen 3.097 N/A LYS 33.A N GLY 30.A O no hydrogen 2.712 N/A VAL 34.A N VAL 31.A O no hydrogen 3.034 N/A LYS 35.A NZ LYS 33.A O no hydrogen 2.870 N/A ASP 38.A N ASN 36.A OD1 no hydrogen 3.147 N/A GLN 40.A N ASN 36.A O no hydrogen 2.960 N/A GLN 40.A NE2 VAL 31.A O no hydrogen 2.643 N/A GLN 41.A N PRO 37.A O no hydrogen 2.868 N/A ALA 42.A N ASP 38.A O no hydrogen 2.965 N/A ILE 43.A N ALA 39.A O no hydrogen 2.914 N/A PHE 44.A N GLN 40.A O no hydrogen 2.847 N/A GLN 45.A N GLN 41.A O no hydrogen 2.827 N/A GLN 45.A NE2 GLN 2.A O no hydrogen 3.113 N/A GLU 46.A N ALA 42.A O no hydrogen 3.009 N/A MET 47.A N ILE 43.A O no hydrogen 2.621 N/A ALA 48.A N PHE 44.A O no hydrogen 2.730 N/A GLU 50.A N GLU 46.A O no hydrogen 3.232 N/A ILE 51.A N MET 47.A O no hydrogen 2.850 N/A ASP 52.A N ALA 48.A O no hydrogen 2.913 N/A GLN 53.A N LYS 49.A O no hydrogen 2.883 N/A ALA 54.A N GLU 50.A O no hydrogen 2.751 N/A ALA 55.A N ILE 51.A O no hydrogen 2.816 N/A GLY 56.A N GLN 53.A O no hydrogen 2.941 N/A LYS 57.A N ALA 54.A O no hydrogen 3.025 N/A VAL 58.A N ALA 55.A O no hydrogen 3.259 N/A LEU 60.A N GLY 56.A O no hydrogen 3.055 N/A ARG 61.A N LYS 57.A O no hydrogen 3.171 N/A ARG 61.A NE ILE 118.A O no hydrogen 2.728 N/A ARG 61.A NH1 ASP 163.A O no hydrogen 2.715 N/A ARG 61.A NH1 THR 165.A O no hydrogen 3.194 N/A ARG 61.A NH2 GLY 117.A O no hydrogen 2.702 N/A ARG 61.A NH2 THR 165.A O no hydrogen 2.940 N/A GLU 62.A N VAL 58.A O no hydrogen 2.890 N/A ALA 63.A N LEU 59.A O no hydrogen 3.031 N/A ALA 64.A N ARG 61.A O no hydrogen 3.072 N/A ARG 65.A N GLU 62.A O no hydrogen 3.082 N/A TYR 70.A OH GLU 113.A OE1 no hydrogen 2.873 N/A LEU 74.A N PRO 71.A O no hydrogen 3.489 N/A VAL 76.A N SER 101.A O no hydrogen 3.023 N/A SER 77.A OG PRO 71.A O no hydrogen 2.606 N/A GLN 78.A N LEU 74.A O no hydrogen 2.869 N/A GLN 78.A NE2 ASP 72.A O no hydrogen 3.258 N/A LYS 79.A N PRO 75.A O no hydrogen 2.942 N/A LYS 79.A N VAL 76.A O no hydrogen 3.215 N/A LYS 79.A NZ GLU 245.A O no hydrogen 3.511 N/A LYS 79.A NZ SER 247.A O no hydrogen 2.798 N/A LYS 80.A N SER 77.A O no hydrogen 3.337 N/A LYS 80.A NZ GLU 113.A OE1 no hydrogen 2.969 N/A LYS 80.A NZ GLU 113.A OE2 no hydrogen 3.001 N/A GLN 81.A NE2 GLU 85.A OE2 no hydrogen 2.610 N/A ILE 83.A N LYS 79.A O no hydrogen 3.029 N/A LEU 84.A N LYS 80.A O no hydrogen 2.712 N/A GLU 85.A N GLN 81.A O no hydrogen 2.904 N/A ALA 86.A N ASP 82.A O no hydrogen 2.983 N/A ILE 87.A N ILE 83.A O no hydrogen 2.972 N/A ARG 88.A N LEU 84.A O no hydrogen 2.923 N/A ARG 88.A NE ASP 89.A OD1 no hydrogen 2.716 N/A ARG 88.A NE ASP 89.A OD2 no hydrogen 3.450 N/A ARG 88.A NH2 ASP 89.A OD1 no hydrogen 3.504 N/A ARG 88.A NH2 ASP 89.A OD2 no hydrogen 2.833 N/A ASP 89.A N GLU 85.A O no hydrogen 3.068 N/A GLN 91.A NE2 ARG 217.A O no hydrogen 2.947 N/A GLN 91.A NE2 LEU 220.A O no hydrogen 2.788 N/A VAL 93.A N ILE 222.A O no hydrogen 3.044 N/A ILE 94.A N PRO 242.A O no hydrogen 2.934 N/A VAL 95.A N ILE 224.A O no hydrogen 2.829 N/A ALA 96.A N ILE 244.A O no hydrogen 2.977 N/A GLY 97.A N SER 226.A O no hydrogen 3.369 N/A GLU 98.A N SER 247.A OG no hydrogen 2.704 N/A THR 99.A OG1 THR 350.A O no hydrogen 2.850 N/A SER 101.A OG GLU 98.A O no hydrogen 3.088 N/A SER 101.A OG VAL 246.A O no hydrogen 3.406 N/A LYS 103.A NZ GLY 97.A O no hydrogen 2.920 N/A LYS 103.A NZ GLU 98.A O no hydrogen 2.918 N/A THR 104.A OG1 ASP 194.A OD1 no hydrogen 3.501 N/A THR 104.A OG1 ASP 194.A OD2 no hydrogen 2.527 N/A GLN 106.A N GLY 102.A O no hydrogen 3.144 N/A GLN 106.A NE2 THR 105.A OG1 no hydrogen 2.990 N/A GLN 106.A NE2 GLU 142.A OE1 no hydrogen 2.867 N/A LEU 107.A N LYS 103.A O no hydrogen 3.106 N/A LYS 109.A NZ THR 69.A O no hydrogen 2.883 N/A LYS 109.A NZ GLN 106.A OE1 no hydrogen 2.844 N/A LYS 109.A NZ GLU 142.A OE1 no hydrogen 2.462 N/A ILE 110.A N GLN 106.A O no hydrogen 3.080 N/A CYS 111.A N LEU 107.A O no hydrogen 3.157 N/A CYS 111.A SG LEU 107.A O no hydrogen 3.539 N/A MET 112.A N PRO 108.A O no hydrogen 3.143 N/A GLU 113.A N LYS 109.A O no hydrogen 2.871 N/A LEU 114.A N ILE 110.A O no hydrogen 2.971 N/A GLY 115.A N MET 112.A O no hydrogen 2.918 N/A ARG 116.A N CYS 111.A O no hydrogen 2.962 N/A ARG 116.A NE ASP 189.A O no hydrogen 3.320 N/A ARG 116.A NE THR 190.A OG1 no hydrogen 2.788 N/A ARG 116.A NH2 ASP 189.A O no hydrogen 2.653 N/A ARG 116.A NH2 ASP 219.A O no hydrogen 3.007 N/A GLY 117.A N ASP 189.A OD2 no hydrogen 3.054 N/A LYS 119.A NZ ASP 14.A O no hydrogen 3.143 N/A LEU 121.A N GLN 187.A O no hydrogen 2.797 N/A ILE 122.A N MET 166.A O no hydrogen 2.778 N/A GLY 123.A N THR 190.A O no hydrogen 2.807 N/A HIS 124.A N LYS 168.A O no hydrogen 2.936 N/A HIS 124.A NE2 ASP 194.A OD2 no hydrogen 2.914 N/A THR 125.A N ILE 192.A O no hydrogen 2.773 N/A THR 125.A OG1 ILE 192.A O no hydrogen 3.429 N/A GLN 126.A N MET 170.A O no hydrogen 2.813 N/A GLN 126.A NE2 ASP 194.A OD2 no hydrogen 2.947 N/A ARG 129.A NH1 GLU 584.A OE2 no hydrogen 3.047 N/A ARG 129.A NH2 GLU 584.A OE1 no hydrogen 2.968 N/A ARG 129.A NH2 GLU 584.A OE2 no hydrogen 3.500 N/A ALA 132.A N ARG 128.A O no hydrogen 3.208 N/A ARG 133.A N ARG 129.A O no hydrogen 3.048 N/A ARG 133.A NH2 ASN 326.A OD1 no hydrogen 3.179 N/A THR 134.A N LEU 130.A O no hydrogen 2.883 N/A THR 134.A OG1 LEU 130.A O no hydrogen 2.850 N/A VAL 135.A N ALA 131.A O no hydrogen 2.760 N/A ALA 136.A N ALA 132.A O no hydrogen 3.134 N/A ASN 137.A N ARG 133.A O no hydrogen 2.993 N/A ARG 138.A N THR 134.A O no hydrogen 2.949 N/A ARG 138.A NE GLU 142.A OE2 no hydrogen 2.922 N/A ARG 138.A NH1 GLU 141.A OE2 no hydrogen 3.028 N/A ILE 139.A N VAL 135.A O no hydrogen 2.866 N/A ALA 140.A N ALA 136.A O no hydrogen 3.011 N/A GLU 141.A N ASN 137.A O no hydrogen 2.886 N/A GLU 142.A N ARG 138.A O no hydrogen 2.826 N/A LEU 143.A N ILE 139.A O no hydrogen 2.903 N/A LYS 144.A N GLU 141.A O no hydrogen 2.744 N/A THR 145.A N ALA 140.A O no hydrogen 2.817 N/A THR 145.A OG1 ALA 140.A O no hydrogen 3.071 N/A GLY 148.A N ILE 151.A O no hydrogen 2.779 N/A GLY 149.A N GLU 146.A O no hydrogen 2.971 N/A GLY 152.A N VAL 167.A O no hydrogen 2.793 N/A TYR 153.A N HIS 160.A O no hydrogen 2.953 N/A TYR 153.A OH SER 158.A OG no hydrogen 3.328 N/A LYS 154.A N LEU 169.A O no hydrogen 2.659 N/A LYS 154.A NZ GLU 178.A OE2 no hydrogen 2.880 N/A VAL 155.A N SER 158.A O no hydrogen 2.998 N/A SER 158.A N VAL 155.A O no hydrogen 3.246 N/A SER 158.A OG TYR 153.A OH no hydrogen 3.328 N/A HIS 160.A N TYR 153.A O no hydrogen 2.813 N/A SER 162.A N THR 165.A OG1 no hydrogen 2.783 N/A SER 162.A OG GLY 148.A O no hydrogen 2.700 N/A SER 162.A OG THR 165.A OG1 no hydrogen 3.353 N/A ASN 164.A N SER 162.A OG no hydrogen 3.380 N/A THR 165.A N SER 162.A O no hydrogen 2.986 N/A THR 165.A OG1 GLY 148.A O no hydrogen 3.293 N/A THR 165.A OG1 GLY 149.A O no hydrogen 2.986 N/A THR 165.A OG1 SER 162.A O no hydrogen 3.087 N/A THR 165.A OG1 SER 162.A OG no hydrogen 3.353 N/A MET 166.A N CYS 150.A O no hydrogen 2.600 N/A VAL 167.A N CYS 150.A O no hydrogen 2.938 N/A LYS 168.A N ILE 122.A O no hydrogen 2.921 N/A LYS 168.A NZ GLU 178.A OE2 no hydrogen 2.663 N/A LYS 168.A NZ GLN 187.A OE1 no hydrogen 2.805 N/A LYS 168.A NZ TYR 188.A OH no hydrogen 2.886 N/A LEU 169.A N GLY 152.A O no hydrogen 2.852 N/A MET 170.A N HIS 124.A O no hydrogen 3.007 N/A ASP 172.A N GLN 126.A O no hydrogen 2.843 N/A ILE 174.A N THR 171.A OG1 no hydrogen 3.090 N/A LEU 175.A N THR 171.A O no hydrogen 3.226 N/A LEU 176.A N ASP 172.A O no hydrogen 3.052 N/A ALA 177.A N GLY 173.A O no hydrogen 2.968 N/A GLU 178.A N ILE 174.A O no hydrogen 3.094 N/A GLU 178.A N LEU 175.A O no hydrogen 3.117 N/A ILE 179.A N LEU 176.A O no hydrogen 3.127 N/A GLN 181.A N GLU 178.A O no hydrogen 3.381 N/A ASP 182.A N GLU 178.A O no hydrogen 3.116 N/A ASP 182.A N ILE 179.A O no hydrogen 3.106 N/A ARG 183.A NH1 GLN 180.A OE1 no hydrogen 3.452 N/A ARG 183.A NH1 GLY 441.A O no hydrogen 3.193 N/A LEU 185.A N ASP 182.A O no hydrogen 3.217 N/A MET 186.A N ASP 182.A OD1 no hydrogen 3.138 N/A GLN 187.A N ASP 182.A OD2 no hydrogen 3.137 N/A TYR 188.A N LEU 185.A O no hydrogen 2.930 N/A TYR 188.A OH GLU 178.A OE1 no hydrogen 2.373 N/A TYR 188.A OH GLU 178.A OE2 no hydrogen 3.361 N/A ASP 189.A N LEU 121.A O no hydrogen 2.973 N/A THR 190.A N LEU 121.A O no hydrogen 3.334 N/A THR 190.A OG1 ASP 189.A OD1 no hydrogen 2.628 N/A ILE 191.A N LYS 221.A O no hydrogen 2.988 N/A ILE 192.A N GLY 123.A O no hydrogen 2.656 N/A ILE 193.A N ILE 223.A O no hydrogen 3.018 N/A ASP 194.A N THR 125.A O no hydrogen 3.213 N/A GLU 195.A N ASP 194.A OD1 no hydrogen 2.746 N/A ALA 196.A N THR 225.A O no hydrogen 2.959 N/A HIS 197.A NE2 THR 350.A OG1 no hydrogen 2.825 N/A GLU 198.A N GLU 195.A O no hydrogen 2.918 N/A ARG 199.A N ALA 196.A O no hydrogen 3.069 N/A ARG 199.A NE ASP 204.A OD1 no hydrogen 2.770 N/A ARG 199.A NH1 GLU 452.A OE1 no hydrogen 3.054 N/A ARG 199.A NH2 ASP 204.A OD1 no hydrogen 3.380 N/A ARG 199.A NH2 ASP 204.A OD2 no hydrogen 2.803 N/A ARG 199.A NH2 GLU 452.A OE1 no hydrogen 3.467 N/A LEU 201.A N GLU 424.A OE1 no hydrogen 2.905 N/A ASN 202.A ND2 ASP 172.A OD1 no hydrogen 2.887 N/A ILE 203.A N SER 200.A OG no hydrogen 3.190 N/A ASP 204.A N SER 200.A O no hydrogen 2.969 N/A PHE 205.A N LEU 201.A O no hydrogen 2.780 N/A LEU 206.A N ASN 202.A O no hydrogen 3.077 N/A LEU 207.A N ILE 203.A O no hydrogen 2.838 N/A GLY 208.A N ASP 204.A O no hydrogen 2.808 N/A TYR 209.A N PHE 205.A O no hydrogen 2.851 N/A TYR 209.A OH ARG 183.A O no hydrogen 2.713 N/A LEU 210.A N LEU 206.A O no hydrogen 2.688 N/A LYS 211.A N LEU 207.A O no hydrogen 3.091 N/A LYS 211.A NZ HIS 237.A O no hydrogen 2.981 N/A GLU 212.A N GLY 208.A O no hydrogen 3.139 N/A LEU 213.A N TYR 209.A O no hydrogen 2.817 N/A LEU 214.A N LEU 210.A O no hydrogen 2.999 N/A ARG 216.A N LEU 213.A O no hydrogen 2.776 N/A ARG 217.A N LEU 214.A O no hydrogen 2.862 N/A ARG 217.A NE ASP 219.A OD1 no hydrogen 2.766 N/A ARG 217.A NH1 LEU 184.A O no hydrogen 2.619 N/A ARG 217.A NH1 LEU 185.A O no hydrogen 2.948 N/A ARG 217.A NH1 TYR 188.A O no hydrogen 3.433 N/A ARG 217.A NH2 TYR 188.A O no hydrogen 2.969 N/A ARG 217.A NH2 ASP 219.A OD1 no hydrogen 3.050 N/A LEU 220.A N ARG 217.A O no hydrogen 3.034 N/A LYS 221.A N ASP 189.A O no hydrogen 3.249 N/A LYS 221.A NZ ILE 87.A O no hydrogen 2.813 N/A LYS 221.A NZ ARG 88.A O no hydrogen 2.755 N/A LYS 221.A NZ HIS 90.A O no hydrogen 2.661 N/A ILE 222.A N GLN 91.A O no hydrogen 2.769 N/A ILE 223.A N ILE 191.A O no hydrogen 2.977 N/A ILE 224.A N VAL 93.A O no hydrogen 2.802 N/A THR 225.A N ILE 193.A O no hydrogen 3.013 N/A SER 226.A N VAL 95.A O no hydrogen 3.155 N/A SER 226.A OG ALA 227.A O no hydrogen 2.702 N/A ALA 227.A N HIS 197.A ND1 no hydrogen 2.974 N/A THR 228.A OG1 GLU 98.A OE1 no hydrogen 3.517 N/A THR 228.A OG1 GLU 245.A OE1 no hydrogen 3.446 N/A ILE 229.A N ALA 227.A O no hydrogen 2.837 N/A GLU 232.A N GLU 232.A OE1 no hydrogen 2.578 N/A ARG 233.A N ASP 230.A O no hydrogen 3.309 N/A ARG 233.A NE ASP 230.A OD2 no hydrogen 3.077 N/A ARG 233.A NH2 ASP 230.A OD2 no hydrogen 3.514 N/A SER 235.A N PRO 231.A O no hydrogen 3.013 N/A SER 235.A OG ALA 241.A O no hydrogen 2.435 N/A ARG 236.A N GLU 232.A O no hydrogen 2.806 N/A HIS 237.A N ARG 233.A O no hydrogen 3.027 N/A HIS 237.A NE2 PRO 449.A O no hydrogen 3.075 N/A PHE 238.A N PHE 234.A O no hydrogen 3.135 N/A ALA 241.A N SER 235.A O no hydrogen 3.108 N/A ILE 244.A N ILE 94.A O no hydrogen 2.805 N/A VAL 246.A N ALA 96.A O no hydrogen 2.884 N/A SER 247.A N GLU 245.A OE2 no hydrogen 2.687 N/A SER 247.A OG GLU 245.A OE2 no hydrogen 2.346 N/A GLU 254.A N GLY 403.A O no hydrogen 2.896 N/A ARG 256.A N CYS 405.A O no hydrogen 3.081 N/A ARG 256.A NE GLU 254.A OE2 no hydrogen 2.775 N/A ARG 256.A NH1 GLU 281.A OE2 no hydrogen 3.131 N/A ARG 256.A NH2 GLU 254.A OE1 no hydrogen 3.469 N/A ARG 256.A NH2 GLU 254.A OE2 no hydrogen 3.570 N/A ARG 256.A NH2 GLU 285.A OE2 no hydrogen 3.247 N/A ARG 258.A N ARG 407.A O no hydrogen 2.818 N/A ARG 258.A NE GLU 281.A OE1 no hydrogen 2.959 N/A ARG 258.A NE GLU 281.A OE2 no hydrogen 3.082 N/A ARG 258.A NH1 TYR 257.A O no hydrogen 3.017 N/A ARG 258.A NH2 GLU 281.A OE2 no hydrogen 2.488 N/A ALA 264.A N ASP 270.A OD1 no hydrogen 2.736 N/A GLU 268.A N ASP 266.A OD1 no hydrogen 3.212 N/A ASP 270.A N ASP 266.A O no hydrogen 2.722 N/A GLN 271.A N THR 267.A O no hydrogen 3.389 N/A LEU 272.A N GLU 268.A O no hydrogen 3.291 N/A GLN 273.A N ARG 269.A O no hydrogen 2.861 N/A ALA 274.A N ASP 270.A O no hydrogen 3.184 N/A ILE 275.A N GLN 271.A O no hydrogen 3.004 N/A PHE 276.A N LEU 272.A O no hydrogen 2.831 N/A ASP 277.A N GLN 273.A O no hydrogen 2.819 N/A ALA 278.A N ALA 274.A O no hydrogen 2.896 N/A VAL 279.A N ILE 275.A O no hydrogen 2.882 N/A ASP 280.A N PHE 276.A O no hydrogen 2.940 N/A GLU 281.A N ASP 277.A O no hydrogen 2.997 N/A LEU 282.A N ALA 278.A O no hydrogen 2.974 N/A SER 283.A N VAL 279.A O no hydrogen 3.015 N/A SER 283.A OG VAL 279.A O no hydrogen 3.077 N/A SER 283.A OG ASP 280.A O no hydrogen 2.800 N/A GLN 284.A NE2 ASP 280.A O no hydrogen 3.652 N/A GLU 285.A N LEU 282.A O no hydrogen 2.822 N/A SER 286.A OG TYR 359.A OH no hydrogen 3.359 N/A ILE 290.A N ARG 340.A O no hydrogen 3.103 N/A LEU 291.A N TYR 359.A O no hydrogen 2.939 N/A ILE 292.A N VAL 342.A O no hydrogen 2.758 N/A PHE 293.A N ILE 361.A O no hydrogen 3.025 N/A MET 294.A N ALA 344.A O no hydrogen 2.701 N/A SER 295.A N GLU 299.A OE1 no hydrogen 2.777 N/A SER 295.A OG GLU 299.A OE1 no hydrogen 2.652 N/A ARG 298.A N ASP 573.A OD2 no hydrogen 3.380 N/A ARG 298.A NH1 GLN 572.A OE1 no hydrogen 2.812 N/A ARG 298.A NH2 GLN 572.A OE1 no hydrogen 2.705 N/A ILE 300.A N GLY 296.A O no hydrogen 3.146 N/A ARG 301.A N GLU 297.A O no hydrogen 2.915 N/A ASP 302.A N ARG 298.A O no hydrogen 3.024 N/A THR 303.A N GLU 299.A O no hydrogen 2.874 N/A THR 303.A OG1 GLU 299.A O no hydrogen 2.737 N/A ALA 304.A N ILE 300.A O no hydrogen 2.796 N/A ASP 305.A N ARG 301.A O no hydrogen 2.877 N/A ALA 306.A N ASP 302.A O no hydrogen 2.920 N/A LEU 307.A N THR 303.A O no hydrogen 2.936 N/A ASN 308.A N ALA 304.A O no hydrogen 3.108 N/A LYS 309.A N ASP 305.A O no hydrogen 3.237 N/A LEU 310.A N LEU 307.A O no hydrogen 3.209 N/A ASN 311.A N ASN 308.A O no hydrogen 3.239 N/A THR 315.A OG1 ARG 313.A O no hydrogen 2.993 N/A GLU 316.A N ARG 339.A O no hydrogen 2.848 N/A LEU 318.A N ILE 341.A O no hydrogen 2.839 N/A LEU 320.A N LEU 343.A O no hydrogen 2.924 N/A ALA 322.A N GLU 297.A OE1 no hydrogen 2.714 N/A LEU 324.A N TYR 321.A O no hydrogen 3.107 N/A SER 327.A N SER 325.A OG no hydrogen 3.098 N/A GLN 329.A N SER 325.A O no hydrogen 2.653 N/A ASN 330.A N SER 327.A O no hydrogen 2.985 N/A ARG 331.A NH2 GLU 316.A OE2 no hydrogen 2.895 N/A PHE 333.A N ASN 330.A O no hydrogen 2.991 N/A GLN 334.A N ARG 331.A O no hydrogen 2.994 N/A HIS 336.A NE2 ASP 289.A OD2 no hydrogen 2.441 N/A ARG 339.A N HIS 314.A O no hydrogen 2.975 N/A ARG 339.A NE THR 315.A OG1 no hydrogen 3.197 N/A ARG 339.A NH2 THR 315.A OG1 no hydrogen 2.993 N/A ARG 340.A N ASP 289.A OD1 no hydrogen 2.692 N/A ARG 340.A NE GLU 316.A OE1 no hydrogen 3.103 N/A ARG 340.A NH1 ARG 331.A O no hydrogen 2.928 N/A ARG 340.A NH2 GLU 316.A OE1 no hydrogen 3.090 N/A ILE 341.A N GLU 316.A O no hydrogen 2.717 N/A VAL 342.A N ILE 290.A O no hydrogen 2.741 N/A LEU 343.A N LEU 318.A O no hydrogen 3.156 N/A ALA 344.A N ILE 292.A O no hydrogen 3.047 N/A VAL 347.A N THR 345.A OG1 no hydrogen 3.347 N/A ALA 348.A N THR 345.A O no hydrogen 3.146 N/A GLU 349.A N ASN 346.A O no hydrogen 2.834 N/A THR 350.A OG1 GLU 195.A OE1 no hydrogen 2.944 N/A THR 350.A OG1 HIS 197.A NE2 no hydrogen 2.825 N/A SER 351.A OG VAL 347.A O no hydrogen 2.463 N/A LEU 352.A N VAL 347.A O no hydrogen 3.151 N/A LYS 358.A N ASP 289.A O no hydrogen 3.099 N/A LYS 358.A NZ SER 286.A OG no hydrogen 2.912 N/A LYS 358.A NZ GLU 402.A O no hydrogen 3.011 N/A TYR 359.A N ASP 289.A O no hydrogen 3.135 N/A TYR 359.A OH SER 286.A O no hydrogen 2.537 N/A VAL 360.A N ILE 404.A O no hydrogen 3.030 N/A ILE 361.A N LEU 291.A O no hydrogen 2.954 N/A ASP 362.A N ILE 406.A O no hydrogen 2.900 N/A GLY 364.A N ASP 362.A OD1 no hydrogen 2.572 N/A ALA 366.A N GLU 383.A O no hydrogen 3.194 N/A ARG 367.A NE GLU 570.A OE1 no hydrogen 2.729 N/A ARG 367.A NH2 ASP 573.A OD2 no hydrogen 2.660 N/A ILE 368.A N PRO 381.A O no hydrogen 3.100 N/A ARG 370.A N ARG 379.A O no hydrogen 2.959 N/A ARG 370.A NE GLU 383.A OE1 no hydrogen 3.132 N/A ARG 370.A NE GLU 383.A OE2 no hydrogen 2.752 N/A ARG 370.A NH1 ASP 422.A OD2 no hydrogen 3.132 N/A ARG 370.A NH2 GLU 383.A OE2 no hydrogen 2.454 N/A TYR 371.A N ARG 427.A O no hydrogen 3.075 N/A SER 372.A N VAL 377.A O no hydrogen 2.942 N/A SER 372.A OG THR 375.A OG1 no hydrogen 3.233 N/A THR 375.A N SER 372.A OG no hydrogen 3.421 N/A THR 375.A OG1 SER 372.A OG no hydrogen 3.233 N/A VAL 377.A N SER 372.A O no hydrogen 3.374 N/A GLN 378.A N ASP 496.A OD2 no hydrogen 2.790 N/A GLN 378.A NE2 SER 369.A OG no hydrogen 2.873 N/A GLN 378.A NE2 ARG 427.A O no hydrogen 2.934 N/A ARG 379.A N ARG 370.A O no hydrogen 3.048 N/A LEU 380.A N SER 523.A O no hydrogen 2.869 N/A GLU 383.A N ALA 366.A O no hydrogen 3.122 N/A ILE 385.A N GLY 364.A O no hydrogen 2.855 N/A SER 386.A OG SER 389.A OG no hydrogen 3.298 N/A SER 386.A OG THR 421.A OG1 no hydrogen 2.658 N/A GLN 387.A N PRO 418.A O no hydrogen 2.840 N/A GLN 387.A NE2 LEU 415.A O no hydrogen 2.939 N/A GLN 387.A NE2 ARG 417.A O no hydrogen 2.942 N/A ALA 388.A N GLU 419.A O no hydrogen 3.032 N/A SER 389.A N SER 386.A OG no hydrogen 3.215 N/A SER 389.A OG GLU 349.A OE2 no hydrogen 3.251 N/A SER 389.A OG SER 386.A OG no hydrogen 3.298 N/A SER 389.A OG THR 421.A OG1 no hydrogen 3.411 N/A ALA 390.A N SER 386.A O no hydrogen 2.999 N/A ASN 391.A N GLN 387.A O no hydrogen 3.034 N/A GLN 392.A N ALA 388.A O no hydrogen 3.013 N/A ARG 393.A N SER 389.A O no hydrogen 2.855 N/A ARG 393.A NE GLU 349.A OE1 no hydrogen 3.000 N/A ARG 393.A NH1 ASP 362.A OD1 no hydrogen 2.781 N/A ARG 393.A NH1 THR 365.A O no hydrogen 3.468 N/A ARG 393.A NH2 THR 365.A O no hydrogen 2.894 N/A LYS 394.A N ALA 390.A O no hydrogen 2.857 N/A LYS 394.A NZ ASN 391.A OD1 no hydrogen 3.457 N/A GLY 395.A N ASN 391.A O no hydrogen 2.673 N/A ARG 396.A N ARG 393.A O no hydrogen 3.193 N/A ARG 396.A NH1 GLU 349.A O no hydrogen 2.876 N/A ARG 396.A NH1 GLN 392.A OE1 no hydrogen 3.109 N/A ARG 396.A NH2 GLU 98.A OE2 no hydrogen 3.027 N/A CYS 397.A N LYS 394.A O no hydrogen 3.308 N/A CYS 397.A SG LYS 394.A O no hydrogen 3.480 N/A GLY 398.A N GLY 395.A O no hydrogen 2.974 N/A ARG 399.A NH1 ILE 357.A O no hydrogen 3.203 N/A ILE 404.A N LYS 358.A O no hydrogen 3.386 N/A CYS 405.A N GLU 254.A O no hydrogen 2.842 N/A ILE 406.A N VAL 360.A O no hydrogen 2.716 N/A ARG 407.A N ARG 256.A O no hydrogen 2.841 N/A ARG 407.A NH1 TYR 257.A OH no hydrogen 3.058 N/A ARG 407.A NH2 ASN 391.A OD1 no hydrogen 2.857 N/A LEU 408.A N ASP 362.A O no hydrogen 3.110 N/A TYR 409.A OH ASP 362.A OD2 no hydrogen 2.842 N/A ASP 413.A N SER 410.A OG no hydrogen 3.209 N/A PHE 414.A N SER 410.A O no hydrogen 2.953 N/A LEU 415.A N GLU 411.A O no hydrogen 2.826 N/A SER 416.A N ASP 412.A O no hydrogen 2.796 N/A SER 416.A OG ASP 412.A O no hydrogen 3.280 N/A SER 416.A OG ASP 413.A O no hydrogen 2.519 N/A ARG 417.A N PHE 414.A O no hydrogen 3.240 N/A ARG 417.A NE ASP 413.A O no hydrogen 3.194 N/A ARG 417.A NE ASP 413.A OD1 no hydrogen 2.901 N/A ARG 417.A NH1 GLY 364.A O no hydrogen 2.914 N/A ARG 417.A NH1 ILE 385.A O no hydrogen 3.162 N/A ARG 417.A NH2 ASP 413.A OD1 no hydrogen 2.853 N/A THR 421.A OG1 SER 386.A OG no hydrogen 2.658 N/A THR 421.A OG1 SER 389.A OG no hydrogen 3.411 N/A GLU 424.A N ARG 199.A O no hydrogen 2.981 N/A LEU 426.A N PRO 423.A O no hydrogen 2.804 N/A ARG 427.A N GLU 424.A O no hydrogen 2.891 N/A ARG 427.A NE ASP 422.A O no hydrogen 2.821 N/A ARG 427.A NH1 SER 369.A O no hydrogen 2.906 N/A ARG 427.A NH2 ASP 422.A O no hydrogen 3.158 N/A THR 428.A OG1 GLU 424.A O no hydrogen 2.939 N/A ASN 429.A N GLN 378.A OE1 no hydrogen 2.936 N/A ASN 429.A ND2 GLN 378.A OE1 no hydrogen 3.264 N/A ASN 429.A ND2 SER 432.A OG no hydrogen 2.791 N/A SER 432.A N ASN 429.A OD1 no hydrogen 3.005 N/A VAL 433.A N ASN 429.A O no hydrogen 3.301 N/A ILE 434.A N LEU 430.A O no hydrogen 2.778 N/A LEU 435.A N ALA 431.A O no hydrogen 2.913 N/A GLN 436.A N SER 432.A O no hydrogen 2.923 N/A MET 437.A N VAL 433.A O no hydrogen 2.901 N/A THR 438.A N ILE 434.A O no hydrogen 2.883 N/A THR 438.A OG1 ILE 434.A O no hydrogen 2.938 N/A ALA 439.A N LEU 435.A O no hydrogen 2.900 N/A LEU 440.A N GLN 436.A O no hydrogen 3.164 N/A LEU 440.A N MET 437.A O no hydrogen 3.138 N/A GLY 441.A N THR 438.A O no hydrogen 3.377 N/A LEU 442.A N MET 437.A O no hydrogen 2.957 N/A ALA 446.A N ASP 444.A OD2 no hydrogen 3.218 N/A ALA 447.A N ASP 444.A O no hydrogen 3.290 N/A PHE 450.A N PHE 448.A O no hydrogen 2.853 N/A ARG 457.A N ASP 455.A OD1 no hydrogen 2.829 N/A ASN 458.A N ASP 455.A O no hydrogen 3.175 N/A ILE 459.A N LYS 456.A O no hydrogen 3.440 N/A GLY 462.A N ASN 458.A O no hydrogen 3.037 N/A VAL 463.A N ILE 459.A O no hydrogen 3.037 N/A ARG 464.A N GLN 460.A O no hydrogen 3.031 N/A ARG 464.A NH2 ASP 461.A OD1 no hydrogen 2.417 N/A LEU 465.A N ASP 461.A O no hydrogen 3.130 N/A LEU 466.A N GLY 462.A O no hydrogen 3.068 N/A GLU 467.A N VAL 463.A O no hydrogen 2.815 N/A GLU 468.A N ARG 464.A O no hydrogen 2.770 N/A LEU 469.A N LEU 465.A O no hydrogen 2.869 N/A GLY 470.A N GLU 467.A O no hydrogen 2.991 N/A ALA 471.A N LEU 466.A O no hydrogen 2.728 N/A ILE 472.A N LEU 466.A O no hydrogen 3.390 N/A THR 473.A N LYS 482.A O no hydrogen 2.907 N/A ALA 478.A N ASP 475.A O no hydrogen 2.429 N/A SER 479.A OG GLN 477.A O no hydrogen 3.087 N/A LYS 482.A N THR 473.A O no hydrogen 3.131 N/A THR 484.A N ALA 471.A O no hydrogen 3.017 N/A THR 484.A OG1 GLY 470.A O no hydrogen 2.785 N/A GLY 487.A N THR 484.A OG1 no hydrogen 3.208 N/A ARG 488.A N THR 484.A O no hydrogen 3.028 N/A ARG 488.A NH2 ALA 439.A O no hydrogen 3.035 N/A GLN 489.A N PRO 485.A O no hydrogen 3.178 N/A LEU 490.A N LEU 486.A O no hydrogen 2.818 N/A SER 491.A N GLY 487.A O no hydrogen 2.727 N/A SER 491.A OG GLY 487.A O no hydrogen 3.111 N/A LEU 493.A N LEU 490.A O no hydrogen 3.186 N/A VAL 495.A N LEU 493.A O no hydrogen 2.769 N/A ARG 498.A N ASP 496.A OD1 no hydrogen 2.927 N/A ALA 500.A N ASP 496.A O no hydrogen 2.684 N/A ARG 501.A N PRO 497.A O no hydrogen 3.065 N/A ARG 501.A NE ARG 501.A O no hydrogen 3.473 N/A MET 502.A N ARG 498.A O no hydrogen 3.283 N/A VAL 503.A N LEU 499.A O no hydrogen 2.986 N/A LEU 504.A N ALA 500.A O no hydrogen 3.042 N/A GLU 505.A N ARG 501.A O no hydrogen 2.900 N/A ALA 506.A N MET 502.A O no hydrogen 2.735 N/A GLN 507.A N VAL 503.A O no hydrogen 3.194 N/A GLN 507.A N LEU 504.A O no hydrogen 3.007 N/A LYS 508.A N GLU 505.A O no hydrogen 3.159 N/A HIS 509.A N ALA 506.A O no hydrogen 2.986 N/A HIS 509.A ND1 GLU 505.A O no hydrogen 3.062 N/A CYS 511.A N ALA 506.A O no hydrogen 3.217 N/A CYS 511.A SG ALA 506.A O no hydrogen 3.859 N/A ARG 513.A N ASN 590.A OD1 no hydrogen 2.947 N/A ARG 513.A NH1 ASN 540.A OD1 no hydrogen 3.460 N/A ARG 513.A NH2 ASN 540.A OD1 no hydrogen 2.600 N/A GLU 514.A N GLU 514.A OE1 no hydrogen 2.640 N/A ALA 515.A N CYS 511.A O no hydrogen 2.972 N/A MET 516.A N VAL 512.A O no hydrogen 2.882 N/A ILE 517.A N ARG 513.A O no hydrogen 2.947 N/A ILE 518.A N GLU 514.A O no hydrogen 2.941 N/A THR 519.A N ALA 515.A O no hydrogen 2.860 N/A THR 519.A OG1 ALA 515.A O no hydrogen 2.871 N/A SER 520.A N MET 516.A O no hydrogen 2.984 N/A SER 520.A OG MET 516.A O no hydrogen 2.932 N/A SER 520.A OG ILE 517.A O no hydrogen 3.415 N/A ALA 521.A N ILE 517.A O no hydrogen 3.265 N/A LEU 522.A N ILE 518.A O no hydrogen 2.985 N/A SER 523.A N THR 519.A O no hydrogen 3.158 N/A SER 523.A OG THR 519.A O no hydrogen 2.801 N/A ARG 528.A NH2 ASP 526.A OD2 no hydrogen 3.069 N/A PHE 532.A N GLU 529.A O no hydrogen 3.034 N/A PHE 535.A N ASP 531.A O no hydrogen 3.403 N/A VAL 536.A N PHE 532.A O no hydrogen 3.123 N/A ASN 537.A N LEU 533.A O no hydrogen 2.938 N/A ASN 537.A ND2 TYR 596.A OH no hydrogen 2.782 N/A LEU 538.A N ALA 534.A O no hydrogen 2.937 N/A TRP 539.A N PHE 535.A O no hydrogen 2.942 N/A ASN 540.A N VAL 536.A O no hydrogen 2.809 N/A TYR 541.A N ASN 537.A O no hydrogen 2.951 N/A LEU 542.A N LEU 538.A O no hydrogen 2.936 N/A GLY 543.A N TRP 539.A O no hydrogen 2.917 N/A GLU 544.A N ASN 540.A O no hydrogen 3.092 N/A GLN 545.A N TYR 541.A O no hydrogen 3.030 N/A GLN 546.A N LEU 542.A O no hydrogen 2.894 N/A GLN 546.A NE2 GLN 572.A OE1 no hydrogen 3.187 N/A LYS 547.A N GLY 543.A O no hydrogen 3.183 N/A LYS 547.A NZ GLY 543.A O no hydrogen 3.298 N/A ALA 548.A N GLU 544.A O no hydrogen 3.017 N/A LEU 549.A N GLN 545.A O no hydrogen 3.373 N/A ALA 553.A N SER 550.A OG no hydrogen 2.943 N/A PHE 554.A N SER 550.A O no hydrogen 2.692 N/A ARG 555.A N SER 551.A O no hydrogen 3.431 N/A ARG 556.A N ASN 552.A O no hydrogen 3.464 N/A LEU 557.A N PHE 554.A O no hydrogen 2.970 N/A CYS 558.A N PHE 554.A O no hydrogen 3.229 N/A CYS 558.A SG PHE 554.A O no hydrogen 3.705 N/A ARG 559.A N ARG 555.A O no hydrogen 3.420 N/A ARG 559.A NH1 ASP 266.A OD2 no hydrogen 3.171 N/A THR 560.A N ARG 556.A O no hydrogen 3.218 N/A THR 560.A OG1 ARG 556.A O no hydrogen 3.203 N/A TYR 562.A N ASP 561.A OD1 no hydrogen 2.456 N/A TYR 565.A OH ASP 302.A OD2 no hydrogen 2.596 N/A ARG 567.A N ASN 564.A OD1 no hydrogen 2.859 N/A ARG 567.A NH1 ASP 526.A O no hydrogen 2.725 N/A VAL 568.A N ASN 564.A O no hydrogen 3.071 N/A ARG 569.A N TYR 565.A O no hydrogen 2.937 N/A ARG 569.A NH1 ASP 302.A OD2 no hydrogen 3.041 N/A GLU 570.A N LEU 566.A O no hydrogen 2.961 N/A TRP 571.A N ARG 567.A O no hydrogen 2.901 N/A TRP 571.A NE1 ILE 517.A O no hydrogen 3.184 N/A GLN 572.A N VAL 568.A O no hydrogen 2.973 N/A GLN 572.A NE2 GLN 546.A OE1 no hydrogen 3.205 N/A ASP 573.A N ARG 569.A O no hydrogen 2.837 N/A ILE 574.A N GLU 570.A O no hydrogen 2.892 N/A TYR 575.A N TRP 571.A O no hydrogen 2.980 N/A THR 576.A N GLN 572.A O no hydrogen 3.005 N/A THR 576.A OG1 GLN 572.A O no hydrogen 3.014 N/A GLN 577.A N ASP 573.A O no hydrogen 3.135 N/A GLN 577.A NE2 ASP 573.A O no hydrogen 3.255 N/A GLN 577.A NE2 ASP 573.A OD1 no hydrogen 2.930 N/A LEU 578.A N ILE 574.A O no hydrogen 2.859 N/A ARG 579.A N TYR 575.A O no hydrogen 2.721 N/A GLN 580.A N THR 576.A O no hydrogen 2.983 N/A GLN 580.A NE2 GLU 584.A OE2 no hydrogen 2.667 N/A VAL 581.A N GLN 577.A O no hydrogen 3.228 N/A VAL 582.A N LEU 578.A O no hydrogen 2.947 N/A LYS 583.A N ARG 579.A O no hydrogen 2.972 N/A GLU 584.A N GLN 580.A O no hydrogen 3.089 N/A LEU 585.A N VAL 581.A O no hydrogen 3.270 N/A LEU 585.A N VAL 582.A O no hydrogen 3.178 N/A GLY 586.A N LYS 583.A O no hydrogen 2.812 N/A ILE 587.A N VAL 582.A O no hydrogen 3.214 N/A ASN 590.A ND2 GLU 514.A OE1 no hydrogen 3.078 N/A ASN 590.A ND2 GLU 592.A O no hydrogen 2.958 N/A ALA 594.A N GLU 514.A OE2 no hydrogen 2.812 N/A GLU 598.A N GLU 595.A O no hydrogen 3.144 N/A HIS 600.A N ARG 597.A O no hydrogen 3.348 N/A ALA 602.A N ILE 599.A O no hydrogen 2.763 N/A LEU 603.A N HIS 600.A O no hydrogen 3.088 N/A