Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 2i1k_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): SER 2.A OG ILE 18.A O no hydrogen 3.182 N/A MET 3.A N ILE 18.A O no hydrogen 3.018 N/A ASN 4.A ND2 ASN 72.A OD1 no hydrogen 2.908 N/A VAL 5.A N PHE 16.A O no hydrogen 2.990 N/A ARG 6.A N LEU 74.A O no hydrogen 2.671 N/A ARG 6.A NE GLU 15.A OE2 no hydrogen 3.007 N/A VAL 7.A N LEU 14.A O no hydrogen 2.990 N/A THR 8.A N PHE 76.A O no hydrogen 2.913 N/A THR 9.A N ALA 12.A O no hydrogen 2.840 N/A THR 9.A OG1 ASP 11.A OD1 no hydrogen 2.702 N/A THR 9.A OG1 ALA 12.A O no hydrogen 3.352 N/A ASP 11.A N THR 9.A OG1 no hydrogen 3.279 N/A GLU 13.A N GLN 330.A OE1 no hydrogen 2.858 N/A LEU 14.A N VAL 7.A O no hydrogen 2.922 N/A PHE 16.A N VAL 5.A O no hydrogen 3.158 N/A ILE 18.A N MET 3.A O no hydrogen 2.818 N/A THR 22.A N GLN 19.A O no hydrogen 3.333 N/A THR 22.A OG1 GLN 19.A O no hydrogen 3.103 N/A THR 23.A N GLN 26.A OE1 no hydrogen 2.785 N/A GLY 24.A N LYS 61.A O no hydrogen 3.058 N/A LYS 25.A N THR 23.A OG1 no hydrogen 3.245 N/A LYS 25.A N LEU 59.A O no hydrogen 2.741 N/A LYS 25.A NZ ASP 29.A OD1 no hydrogen 3.215 N/A LYS 25.A NZ ASP 29.A OD2 no hydrogen 2.618 N/A LYS 25.A NZ THR 444.A O no hydrogen 2.753 N/A LYS 25.A NZ THR 444.A OG1 no hydrogen 3.020 N/A GLN 26.A N THR 23.A OG1 no hydrogen 3.188 N/A LEU 27.A N THR 23.A O no hydrogen 3.157 N/A PHE 28.A N GLY 24.A O no hydrogen 2.915 N/A ASP 29.A N LYS 25.A O no hydrogen 2.735 N/A GLN 30.A N GLN 26.A O no hydrogen 3.398 N/A VAL 31.A N LEU 27.A O no hydrogen 3.261 N/A VAL 32.A N PHE 28.A O no hydrogen 3.107 N/A LYS 33.A N ASP 29.A O no hydrogen 2.835 N/A LYS 33.A NZ ALA 441.A O no hydrogen 3.209 N/A THR 34.A N GLN 30.A O no hydrogen 3.354 N/A THR 34.A OG1 GLN 30.A O no hydrogen 3.005 N/A ILE 35.A N VAL 31.A O no hydrogen 3.288 N/A GLY 36.A N VAL 32.A O no hydrogen 2.684 N/A LEU 37.A N VAL 32.A O no hydrogen 2.998 N/A ARG 38.A N GLN 93.A OE1 no hydrogen 2.565 N/A ARG 38.A NH2 GLN 302.A OE1 no hydrogen 3.563 N/A GLU 39.A N GLN 93.A OE1 no hydrogen 3.243 N/A PHE 43.A N VAL 40.A O no hydrogen 3.037 N/A GLY 44.A N ARG 79.A O no hydrogen 2.984 N/A GLN 46.A N LYS 77.A O no hydrogen 2.900 N/A TYR 47.A N THR 55.A O no hydrogen 2.688 N/A TYR 47.A OH GLN 66.A O no hydrogen 3.143 N/A ASP 49.A N ASP 53.A O no hydrogen 3.218 N/A SER 50.A N ASP 67.A OD2 no hydrogen 3.339 N/A SER 50.A OG ASP 67.A OD1 no hydrogen 3.054 N/A SER 50.A OG ASP 67.A OD2 no hydrogen 2.431 N/A GLY 52.A N ASP 49.A O no hydrogen 2.835 N/A ASP 53.A N ASP 49.A OD1 no hydrogen 2.865 N/A THR 55.A N TYR 47.A O no hydrogen 2.814 N/A THR 55.A OG1 ASP 49.A OD2 no hydrogen 3.536 N/A THR 55.A OG1 ASP 53.A O no hydrogen 2.994 N/A ILE 57.A N LEU 45.A O no hydrogen 2.875 N/A LYS 58.A N GLN 66.A OE1 no hydrogen 2.847 N/A LEU 59.A N GLU 452.A OE2 no hydrogen 3.142 N/A VAL 63.A N THR 22.A O no hydrogen 2.920 N/A GLN 65.A N LYS 62.A O no hydrogen 2.899 N/A GLN 66.A N VAL 63.A O no hydrogen 3.106 N/A GLN 66.A NE2 LYS 58.A O no hydrogen 2.690 N/A GLN 66.A NE2 LYS 61.A O no hydrogen 2.892 N/A LYS 69.A N THR 48.A O no hydrogen 2.704 N/A LYS 69.A NZ GLU 71.A OE2 no hydrogen 3.544 N/A LEU 74.A N ASN 4.A O no hydrogen 2.859 N/A PHE 76.A N ARG 6.A O no hydrogen 2.768 N/A LYS 77.A N GLN 46.A O no hydrogen 3.015 N/A PHE 78.A N THR 8.A O no hydrogen 2.888 N/A ARG 79.A N GLY 44.A O no hydrogen 3.132 N/A ARG 79.A NH1 PHE 78.A O no hydrogen 3.239 N/A ALA 80.A N GLN 103.A OE1 no hydrogen 2.636 N/A LYS 81.A N PHE 42.A O no hydrogen 2.687 N/A PHE 82.A N PHE 42.A O no hydrogen 3.001 N/A ASP 86.A N GLU 90.A OE1 no hydrogen 3.105 N/A VAL 87.A N GLN 194.A OE1 no hydrogen 2.927 N/A ASP 89.A N ASP 86.A O no hydrogen 3.119 N/A GLU 90.A N ASP 86.A O no hydrogen 3.019 N/A GLU 90.A N VAL 87.A O no hydrogen 3.230 N/A LEU 91.A N VAL 87.A O no hydrogen 3.208 N/A ILE 92.A N GLU 39.A OE1 no hydrogen 3.052 N/A ILE 92.A N GLU 39.A OE2 no hydrogen 3.136 N/A GLN 93.A N GLU 39.A OE2 no hydrogen 2.762 N/A GLN 93.A NE2 GLY 36.A O no hydrogen 2.770 N/A THR 96.A OG1 GLU 39.A OE2 no hydrogen 2.886 N/A LEU 97.A N GLN 93.A O no hydrogen 3.334 N/A LYS 98.A N GLU 94.A O no hydrogen 2.927 N/A LYS 98.A NZ ASP 11.A OD2 no hydrogen 2.750 N/A LEU 99.A N ILE 95.A O no hydrogen 3.120 N/A PHE 100.A N THR 96.A O no hydrogen 3.171 N/A TYR 101.A N LEU 97.A O no hydrogen 2.966 N/A LEU 102.A N LYS 98.A O no hydrogen 2.871 N/A GLN 103.A N LEU 99.A O no hydrogen 2.946 N/A GLN 103.A NE2 ALA 80.A O no hydrogen 3.109 N/A GLN 103.A NE2 TYR 83.A OH no hydrogen 3.261 N/A VAL 104.A N PHE 100.A O no hydrogen 2.753 N/A LYS 105.A N TYR 101.A O no hydrogen 2.989 N/A ASN 106.A N LEU 102.A O no hydrogen 3.144 N/A ALA 107.A N GLN 103.A O no hydrogen 3.220 N/A ILE 108.A N VAL 104.A O no hydrogen 2.968 N/A LEU 109.A N LYS 105.A O no hydrogen 2.794 N/A SER 110.A N ASN 106.A O no hydrogen 2.928 N/A SER 110.A OG ASN 106.A O no hydrogen 2.692 N/A SER 110.A OG ALA 107.A O no hydrogen 3.401 N/A ASP 111.A N ILE 108.A O no hydrogen 3.282 N/A GLU 112.A N ALA 107.A O no hydrogen 2.864 N/A ILE 113.A N ALA 107.A O no hydrogen 3.290 N/A TYR 114.A OH ASP 510.A OD1 no hydrogen 2.654 N/A CYS 115.A SG PRO 116.A O no hydrogen 3.617 N/A CYS 115.A SG SER 120.A OG no hydrogen 3.509 N/A GLU 118.A N GLU 118.A OE1 no hydrogen 2.636 N/A SER 120.A N PRO 116.A O no hydrogen 2.852 N/A SER 120.A OG CYS 115.A O no hydrogen 3.474 N/A SER 120.A OG PRO 116.A O no hydrogen 3.352 N/A VAL 121.A N PRO 117.A O no hydrogen 2.859 N/A LEU 122.A N GLU 118.A O no hydrogen 3.059 N/A LEU 123.A N THR 119.A O no hydrogen 2.680 N/A ALA 124.A N SER 120.A O no hydrogen 2.917 N/A SER 125.A N VAL 121.A O no hydrogen 3.249 N/A SER 125.A N LEU 122.A O no hydrogen 3.165 N/A SER 125.A OG LEU 122.A O no hydrogen 2.628 N/A SER 125.A OG HIS 177.A NE2 no hydrogen 2.845 N/A TYR 126.A N LEU 122.A O no hydrogen 3.332 N/A ALA 127.A N LEU 123.A O no hydrogen 2.830 N/A VAL 128.A N ALA 124.A O no hydrogen 2.930 N/A GLN 129.A N SER 125.A O no hydrogen 3.273 N/A GLN 129.A NE2 ASP 134.A OD1 no hydrogen 2.810 N/A GLN 129.A NE2 MET 180.A O no hydrogen 3.001 N/A ALA 130.A N TYR 126.A O no hydrogen 2.956 N/A ARG 131.A N ALA 127.A O no hydrogen 3.065 N/A HIS 132.A N VAL 128.A O no hydrogen 2.759 N/A HIS 132.A NE2 ASP 148.A OD1 no hydrogen 3.105 N/A HIS 132.A NE2 ASP 148.A OD2 no hydrogen 2.908 N/A GLY 133.A N GLN 129.A O no hydrogen 2.807 N/A ASN 136.A N HIS 140.A ND1 no hydrogen 3.003 N/A ALA 138.A N ASN 136.A OD1 no hydrogen 3.126 N/A VAL 139.A N ASN 136.A O no hydrogen 3.024 N/A HIS 140.A N ASN 136.A O no hydrogen 2.658 N/A PHE 144.A N GLY 141.A O no hydrogen 3.284 N/A ALA 146.A N GLY 143.A O no hydrogen 3.123 N/A ASP 148.A N LEU 145.A O no hydrogen 3.145 N/A GLN 153.A NE2 ASP 157.A OD2 no hydrogen 3.304 N/A ARG 154.A NE ASP 111.A OD1 no hydrogen 3.489 N/A ARG 154.A NE ASP 111.A OD2 no hydrogen 3.282 N/A ARG 154.A NH1 CYS 115.A O no hydrogen 3.045 N/A ARG 154.A NH2 ASP 111.A OD1 no hydrogen 3.256 N/A ARG 154.A NH2 CYS 115.A O no hydrogen 3.179 N/A VAL 155.A N PRO 152.A O no hydrogen 2.947 N/A THR 156.A N PRO 152.A O no hydrogen 3.294 N/A THR 156.A N GLN 153.A O no hydrogen 3.066 N/A THR 156.A OG1 GLN 153.A O no hydrogen 2.985 N/A ASP 157.A N GLN 153.A O no hydrogen 2.926 N/A GLN 158.A NE2 LYS 505.A O no hydrogen 2.819 N/A GLN 158.A NE2 ASP 510.A OD2 no hydrogen 3.125 N/A HIS 159.A N THR 156.A O no hydrogen 3.407 N/A LYS 160.A N SER 500.A O no hydrogen 2.935 N/A SER 162.A N GLU 165.A OE1 no hydrogen 3.351 N/A ARG 163.A NE GLU 167.A OE2 no hydrogen 2.985 N/A ARG 163.A NH2 LEU 145.A O no hydrogen 2.977 N/A ARG 163.A NH2 ASP 148.A O no hydrogen 2.986 N/A GLU 165.A N SER 162.A OG no hydrogen 3.068 N/A TRP 166.A N SER 162.A O no hydrogen 3.058 N/A GLU 167.A N ARG 163.A O no hydrogen 2.971 N/A GLN 168.A N GLU 164.A O no hydrogen 3.069 N/A SER 169.A N GLU 165.A O no hydrogen 2.799 N/A ILE 170.A N TRP 166.A O no hydrogen 2.880 N/A THR 171.A N GLU 167.A O no hydrogen 2.771 N/A THR 171.A OG1 GLU 167.A O no hydrogen 2.514 N/A ASN 172.A N GLN 168.A O no hydrogen 2.944 N/A TRP 173.A N SER 169.A O no hydrogen 3.393 N/A TRP 174.A N ILE 170.A O no hydrogen 2.811 N/A TRP 174.A NE1 GLY 133.A O no hydrogen 2.872 N/A GLN 175.A N THR 171.A O no hydrogen 2.861 N/A GLU 176.A N TRP 173.A O no hydrogen 2.900 N/A HIS 177.A N TRP 174.A O no hydrogen 2.954 N/A HIS 177.A NE2 SER 125.A OG no hydrogen 2.845 N/A ARG 178.A N GLN 175.A O no hydrogen 3.377 N/A ARG 178.A NE HIS 135.A O no hydrogen 3.444 N/A GLY 179.A N ASP 134.A OD1 no hydrogen 2.750 N/A GLY 179.A N ASP 134.A OD2 no hydrogen 3.242 N/A MET 180.A N HIS 177.A O no hydrogen 3.172 N/A ALA 185.A N LEU 181.A O no hydrogen 3.133 N/A MET 186.A N ARG 182.A O no hydrogen 3.027 N/A MET 187.A N GLU 183.A O no hydrogen 3.059 N/A GLU 188.A N ASP 184.A O no hydrogen 2.695 N/A TYR 189.A N ALA 185.A O no hydrogen 2.940 N/A LEU 190.A N MET 186.A O no hydrogen 3.261 N/A LYS 191.A N MET 187.A O no hydrogen 2.802 N/A LYS 191.A NZ GLU 188.A OE1 no hydrogen 2.972 N/A LYS 191.A NZ GLU 188.A OE2 no hydrogen 3.222 N/A ILE 192.A N GLU 188.A O no hydrogen 3.048 N/A ALA 193.A N TYR 189.A O no hydrogen 2.836 N/A GLN 194.A N LEU 190.A O no hydrogen 2.796 N/A GLN 194.A NE2 ASP 86.A OD1 no hydrogen 3.237 N/A LEU 196.A N ALA 193.A O no hydrogen 2.938 N/A TYR 199.A N LEU 196.A O no hydrogen 3.195 N/A ASN 202.A N VAL 218.A O no hydrogen 3.008 N/A ASN 202.A ND2 VAL 218.A O no hydrogen 3.282 N/A TYR 203.A OH LYS 231.A O no hydrogen 2.652 N/A PHE 204.A N LEU 216.A O no hydrogen 2.883 N/A ILE 206.A N LEU 214.A O no hydrogen 2.867 N/A ARG 207.A N PHE 268.A O no hydrogen 3.147 N/A ARG 207.A NH2 GLU 213.A OE2 no hydrogen 3.356 N/A ASN 208.A ND2 PHE 542.A O no hydrogen 2.753 N/A ASN 208.A ND2 MET 545.A O no hydrogen 2.681 N/A LYS 210.A NZ ASN 544.A O no hydrogen 2.781 N/A ASN 211.A N ASN 208.A O no hydrogen 2.611 N/A THR 212.A N ASN 208.A OD1 no hydrogen 2.877 N/A THR 212.A OG1 ASN 208.A OD1 no hydrogen 3.478 N/A THR 212.A OG1 MET 545.A O no hydrogen 2.505 N/A THR 212.A OG1 MET 545.A OXT no hydrogen 2.931 N/A LEU 214.A N ILE 206.A O no hydrogen 2.800 N/A TRP 215.A N TYR 226.A O no hydrogen 2.911 N/A LEU 216.A N PHE 204.A O no hydrogen 2.834 N/A GLY 217.A N ASN 224.A O no hydrogen 2.710 N/A VAL 218.A N ASN 202.A O no hydrogen 3.011 N/A ASP 219.A N GLY 222.A O no hydrogen 3.094 N/A LEU 221.A N ASP 219.A OD1 no hydrogen 2.564 N/A GLY 222.A N ASP 219.A OD1 no hydrogen 2.728 N/A LEU 223.A N PHE 238.A O no hydrogen 2.826 N/A ASN 224.A N GLY 217.A O no hydrogen 2.808 N/A ILE 225.A N ILE 236.A O no hydrogen 2.893 N/A TYR 226.A N TRP 215.A O no hydrogen 2.799 N/A LYS 228.A NZ GLU 205.A OE1 no hydrogen 2.620 N/A ASP 230.A N GLU 227.A O no hydrogen 2.938 N/A LEU 232.A N ASP 230.A OD1 no hydrogen 3.012 N/A THR 233.A N ASP 230.A OD1 no hydrogen 3.116 N/A THR 233.A OG1 ASP 230.A OD2 no hydrogen 3.366 N/A LYS 235.A N ILE 225.A O no hydrogen 2.822 N/A GLY 237.A N ILE 530.A O no hydrogen 3.254 N/A PHE 238.A N LEU 223.A O no hydrogen 2.881 N/A TRP 240.A NE1 ASP 219.A O no hydrogen 2.974 N/A GLU 242.A N PRO 239.A O no hydrogen 3.010 N/A ILE 243.A N TRP 240.A O no hydrogen 3.196 N/A ARG 244.A N LYS 256.A O no hydrogen 3.076 N/A ASN 245.A N LYS 256.A O no hydrogen 3.165 N/A ASN 245.A ND2 SER 247.A OG no hydrogen 3.292 N/A ILE 246.A N GLY 460.A O no hydrogen 2.955 N/A SER 247.A N ILE 254.A O no hydrogen 3.249 N/A PHE 248.A N GLY 458.A O no hydrogen 3.091 N/A ASN 249.A N LYS 252.A O no hydrogen 2.789 N/A ASP 250.A N GLU 456.A O no hydrogen 2.681 N/A LYS 252.A N ASN 249.A O no hydrogen 2.869 N/A PHE 253.A N PHE 267.A O no hydrogen 2.844 N/A ILE 254.A N SER 247.A O no hydrogen 2.842 N/A ILE 255.A N PHE 265.A O no hydrogen 2.749 N/A LYS 256.A N ASN 245.A O no hydrogen 3.015 N/A ILE 258.A N GLU 242.A O no hydrogen 3.108 N/A LYS 261.A N ASP 259.A OD1 no hydrogen 3.127 N/A PHE 265.A N ILE 255.A O no hydrogen 2.865 N/A PHE 267.A N PHE 253.A O no hydrogen 3.046 N/A PHE 268.A N ARG 207.A O no hydrogen 2.817 N/A ALA 269.A N ARG 251.A O no hydrogen 2.911 N/A ARG 271.A NH2 ASP 53.A OD2 no hydrogen 3.462 N/A ASN 275.A N ARG 271.A O no hydrogen 3.449 N/A ASN 275.A ND2 ASP 250.A O no hydrogen 3.069 N/A LYS 276.A N VAL 272.A O no hydrogen 3.142 N/A ARG 277.A N ARG 273.A O no hydrogen 3.314 N/A ILE 278.A N VAL 274.A O no hydrogen 3.008 N/A LEU 279.A N ASN 275.A O no hydrogen 3.029 N/A ALA 280.A N LYS 276.A O no hydrogen 2.987 N/A LEU 281.A N ARG 277.A O no hydrogen 3.182 N/A CYS 282.A N ILE 278.A O no hydrogen 2.890 N/A CYS 282.A SG ILE 278.A O no hydrogen 3.239 N/A MET 283.A N LEU 279.A O no hydrogen 2.777 N/A GLY 284.A N ALA 280.A O no hydrogen 2.752 N/A ASN 285.A N LEU 281.A O no hydrogen 2.841 N/A ASN 285.A ND2 LEU 281.A O no hydrogen 2.835 N/A HIS 286.A N CYS 282.A O no hydrogen 2.888 N/A HIS 286.A NE2 ALA 463.A O no hydrogen 2.987 N/A GLU 287.A N MET 283.A O no hydrogen 3.081 N/A LEU 288.A N GLY 284.A O no hydrogen 3.199 N/A TYR 289.A N ASN 285.A O no hydrogen 2.954 N/A TYR 289.A OH ASP 471.A OD2 no hydrogen 2.622 N/A MET 290.A N HIS 286.A O no hydrogen 3.062 N/A ARG 291.A N GLU 287.A O no hydrogen 3.121 N/A ARG 291.A NH1 HIS 448.A O no hydrogen 3.088 N/A ARG 291.A NH2 GLU 287.A OE2 no hydrogen 2.940 N/A ARG 291.A NH2 HIS 448.A O no hydrogen 3.287 N/A ARG 291.A NH2 HIS 449.A O no hydrogen 3.212 N/A ARG 292.A N LEU 288.A O no hydrogen 3.233 N/A ARG 292.A N TYR 289.A O no hydrogen 3.102 N/A ARG 292.A NE GLU 90.A OE2 no hydrogen 2.879 N/A ARG 292.A NH2 GLU 90.A OE2 no hydrogen 3.563 N/A ARG 293.A N MET 290.A O no hydrogen 3.089 N/A ARG 293.A NH1 GLU 85.A OE2 no hydrogen 3.206 N/A ARG 293.A NH2 GLU 85.A OE1 no hydrogen 3.050 N/A LYS 294.A N ARG 291.A O no hydrogen 3.114 N/A VAL 300.A N THR 297.A OG1 no hydrogen 3.136 N/A GLN 301.A N THR 297.A O no hydrogen 2.966 N/A GLN 302.A N ILE 298.A O no hydrogen 3.029 N/A MET 303.A N ASP 299.A O no hydrogen 2.924 N/A LYS 304.A N VAL 300.A O no hydrogen 2.988 N/A LYS 304.A NZ ASP 296.A OD2 no hydrogen 2.658 N/A ALA 305.A N GLN 301.A O no hydrogen 2.928 N/A GLN 306.A N GLN 302.A O no hydrogen 2.799 N/A ALA 307.A N MET 303.A O no hydrogen 2.676 N/A ARG 308.A N LYS 304.A O no hydrogen 3.053 N/A GLU 309.A N ALA 305.A O no hydrogen 3.105 N/A GLU 310.A N GLN 306.A O no hydrogen 2.857 N/A LYS 311.A N ALA 307.A O no hydrogen 2.981 N/A LYS 311.A NZ ASP 184.A OD1 no hydrogen 3.354 N/A LEU 312.A N ARG 308.A O no hydrogen 3.458 N/A ALA 313.A N GLU 309.A O no hydrogen 2.991 N/A LYS 314.A N GLU 310.A O no hydrogen 2.982 N/A LYS 314.A NZ GLU 94.A OE1 no hydrogen 3.152 N/A GLN 315.A N LYS 311.A O no hydrogen 3.129 N/A ALA 316.A N LEU 312.A O no hydrogen 3.191 N/A GLN 317.A N ALA 313.A O no hydrogen 3.240 N/A ARG 318.A N LYS 314.A O no hydrogen 3.120 N/A ALA 321.A N GLU 324.A OE1 no hydrogen 3.347 N/A ARG 325.A N ALA 321.A O no hydrogen 3.150 N/A ALA 326.A N ALA 322.A O no hydrogen 3.141 N/A GLU 327.A N ARG 323.A O no hydrogen 3.220 N/A LYS 328.A N GLU 324.A O no hydrogen 3.063 N/A LYS 329.A N ARG 325.A O no hydrogen 3.036 N/A LYS 329.A NZ GLU 332.A OE1 no hydrogen 3.158 N/A GLN 330.A N ALA 326.A O no hydrogen 2.926 N/A GLN 330.A NE2 GLU 13.A O no hydrogen 2.563 N/A GLN 330.A NE2 GLN 334.A OE1 no hydrogen 2.977 N/A GLN 331.A N GLU 327.A O no hydrogen 2.934 N/A GLU 332.A N LYS 328.A O no hydrogen 2.788 N/A TYR 333.A N LYS 329.A O no hydrogen 3.037 N/A TYR 333.A OH ASP 11.A OD2 no hydrogen 2.784 N/A GLN 334.A N GLN 330.A O no hydrogen 3.170 N/A ASP 335.A N GLN 331.A O no hydrogen 2.862 N/A ARG 336.A N GLU 332.A O no hydrogen 2.973 N/A ARG 336.A NE THR 34.A O no hydrogen 2.725 N/A ARG 336.A NH2 LYS 33.A O no hydrogen 2.841 N/A ARG 336.A NH2 THR 34.A O no hydrogen 3.119 N/A LEU 337.A N TYR 333.A O no hydrogen 3.004 N/A ARG 338.A N GLN 334.A O no hydrogen 2.942 N/A ARG 338.A NH1 ASP 335.A OD1 no hydrogen 2.992 N/A GLN 339.A N ASP 335.A O no hydrogen 2.951 N/A MET 340.A N ARG 336.A O no hydrogen 2.732 N/A GLN 341.A N LEU 337.A O no hydrogen 2.929 N/A GLN 341.A NE2 ALA 17.A O no hydrogen 3.334 N/A GLN 341.A NE2 GLN 30.A OE1 no hydrogen 2.813 N/A GLU 342.A N ARG 338.A O no hydrogen 3.040 N/A GLU 343.A N GLN 339.A O no hydrogen 2.861 N/A MET 344.A N MET 340.A O no hydrogen 2.895 N/A GLU 345.A N GLN 341.A O no hydrogen 3.208 N/A ARG 346.A N GLU 342.A O no hydrogen 3.031 N/A SER 347.A N GLU 343.A O no hydrogen 2.966 N/A SER 347.A OG GLU 343.A O no hydrogen 3.165 N/A GLN 348.A N MET 344.A O no hydrogen 2.775 N/A ALA 349.A N GLU 345.A O no hydrogen 2.942 N/A ASN 350.A N ARG 346.A O no hydrogen 2.794 N/A LEU 351.A N SER 347.A O no hydrogen 3.033 N/A LEU 352.A N GLN 348.A O no hydrogen 3.070 N/A GLU 353.A N ALA 349.A O no hydrogen 2.800 N/A ALA 354.A N ASN 350.A O no hydrogen 2.922 N/A GLN 355.A N LEU 351.A O no hydrogen 2.859 N/A ASP 356.A N LEU 352.A O no hydrogen 3.071 N/A MET 357.A N GLU 353.A O no hydrogen 3.137 N/A ILE 358.A N ALA 354.A O no hydrogen 2.880 N/A LEU 359.A N GLN 355.A O no hydrogen 2.861 N/A ARG 360.A N ASP 356.A O no hydrogen 2.874 N/A LEU 361.A N MET 357.A O no hydrogen 2.749 N/A GLU 362.A N ILE 358.A O no hydrogen 3.035 N/A GLU 363.A N LEU 359.A O no hydrogen 3.231 N/A GLN 364.A N ARG 360.A O no hydrogen 3.142 N/A LEU 365.A N LEU 361.A O no hydrogen 2.822 N/A GLN 367.A N GLU 363.A O no hydrogen 3.049 N/A LEU 368.A N GLN 364.A O no hydrogen 2.944 N/A GLN 369.A N LEU 365.A O no hydrogen 3.258 N/A ALA 370.A N ARG 366.A O no hydrogen 2.868 N/A ALA 371.A N GLN 367.A O no hydrogen 3.123 N/A LYS 372.A N LEU 368.A O no hydrogen 3.165 N/A LYS 372.A NZ ASP 415.A OD1 no hydrogen 3.469 N/A LYS 372.A NZ ASP 415.A OD2 no hydrogen 2.993 N/A GLU 373.A N GLN 369.A O no hydrogen 2.973 N/A GLU 374.A N ALA 370.A O no hydrogen 3.201 N/A LEU 375.A N ALA 371.A O no hydrogen 3.064 N/A GLU 376.A N LYS 372.A O no hydrogen 2.807 N/A GLN 377.A N GLU 373.A O no hydrogen 3.230 N/A ARG 378.A N GLU 374.A O no hydrogen 2.947 N/A GLN 379.A N LEU 375.A O no hydrogen 2.794 N/A GLN 379.A NE2 GLN 408.A OE1 no hydrogen 2.990 N/A ASN 380.A N GLU 376.A O no hydrogen 3.046 N/A GLU 381.A N GLN 377.A O no hydrogen 2.931 N/A LEU 382.A N ARG 378.A O no hydrogen 2.689 N/A GLN 383.A N GLN 379.A O no hydrogen 2.888 N/A ALA 384.A N ASN 380.A O no hydrogen 3.199 N/A MET 385.A N GLU 381.A O no hydrogen 3.148 N/A MET 386.A N LEU 382.A O no hydrogen 3.104 N/A GLN 387.A N GLN 383.A O no hydrogen 3.010 N/A ARG 388.A N ALA 384.A O no hydrogen 3.276 N/A LEU 389.A N MET 385.A O no hydrogen 2.871 N/A GLU 390.A N MET 386.A O no hydrogen 3.086 N/A THR 392.A N ARG 388.A O no hydrogen 3.399 N/A THR 392.A OG1 ARG 388.A O no hydrogen 2.906 N/A ILE 397.A N LEU 393.A O no hydrogen 3.278 N/A ALA 399.A N ASP 395.A O no hydrogen 3.309 N/A LYS 400.A N GLU 396.A O no hydrogen 3.088 N/A GLN 401.A N ILE 397.A O no hydrogen 3.178 N/A GLU 402.A N ARG 398.A O no hydrogen 2.977 N/A GLU 403.A N ALA 399.A O no hydrogen 3.410 N/A VAL 404.A N LYS 400.A O no hydrogen 3.100 N/A SER 405.A N GLN 401.A O no hydrogen 3.292 N/A SER 405.A OG GLN 401.A O no hydrogen 3.490 N/A ARG 406.A N GLU 402.A O no hydrogen 2.979 N/A ILE 407.A N GLU 403.A O no hydrogen 3.041 N/A GLN 408.A N VAL 404.A O no hydrogen 3.234 N/A GLN 409.A N SER 405.A O no hydrogen 3.000 N/A GLU 410.A N ARG 406.A O no hydrogen 3.301 N/A VAL 411.A N ILE 407.A O no hydrogen 3.079 N/A GLU 412.A N GLN 408.A O no hydrogen 3.006 N/A LEU 413.A N GLN 409.A O no hydrogen 3.059 N/A LYS 414.A N GLU 410.A O no hydrogen 3.163 N/A ASP 415.A N VAL 411.A O no hydrogen 2.968 N/A SER 416.A N GLU 412.A O no hydrogen 3.211 N/A SER 416.A N LEU 413.A O no hydrogen 3.198 N/A SER 416.A OG GLU 412.A O no hydrogen 2.970 N/A GLU 417.A N LEU 413.A O no hydrogen 3.151 N/A THR 418.A N LYS 414.A O no hydrogen 3.025 N/A THR 418.A OG1 LYS 414.A O no hydrogen 2.763 N/A ARG 419.A N ASP 415.A O no hydrogen 3.327 N/A ARG 420.A N SER 416.A O no hydrogen 3.189 N/A LEU 421.A N GLU 417.A O no hydrogen 2.811 N/A GLN 422.A N THR 418.A O no hydrogen 2.960 N/A GLU 424.A N ARG 420.A O no hydrogen 3.114 N/A VAL 425.A N LEU 421.A O no hydrogen 2.825 N/A GLU 426.A N GLN 422.A O no hydrogen 3.040 N/A ASP 427.A N GLU 423.A O no hydrogen 3.262 N/A ALA 428.A N GLU 424.A O no hydrogen 3.103 N/A ARG 429.A N VAL 425.A O no hydrogen 3.055 N/A ARG 430.A N GLU 426.A O no hydrogen 3.268 N/A LYS 431.A N ASP 427.A O no hydrogen 3.210 N/A LYS 431.A NZ GLU 353.A OE1 no hydrogen 2.767 N/A GLN 432.A N ALA 428.A O no hydrogen 2.852 N/A GLN 432.A NE2 GLN 355.A OE1 no hydrogen 3.525 N/A ASP 433.A N ARG 429.A O no hydrogen 2.962 N/A GLU 434.A N ARG 430.A O no hydrogen 3.000 N/A ALA 435.A N LYS 431.A O no hydrogen 3.045 N/A ALA 436.A N GLN 432.A O no hydrogen 2.887 N/A ALA 437.A N ASP 433.A O no hydrogen 2.870 N/A ALA 438.A N GLU 434.A O no hydrogen 2.904 N/A LEU 439.A N ALA 435.A O no hydrogen 2.899 N/A LEU 440.A N ALA 436.A O no hydrogen 2.948 N/A ALA 441.A N ALA 437.A O no hydrogen 2.711 N/A ALA 442.A N LEU 439.A O no hydrogen 3.052 N/A THR 443.A N LEU 440.A O no hydrogen 2.901 N/A THR 443.A OG1 LEU 440.A O no hydrogen 2.898 N/A THR 444.A N ASP 29.A OD2 no hydrogen 3.435 N/A THR 444.A OG1 ASP 29.A OD1 no hydrogen 2.462 N/A THR 444.A OG1 HIS 449.A NE2 no hydrogen 2.791 N/A HIS 448.A N PRO 445.A O no hydrogen 3.181 N/A HIS 448.A NE2 ASP 299.A OD2 no hydrogen 2.927 N/A HIS 449.A N GLN 446.A O no hydrogen 3.163 N/A HIS 449.A NE2 THR 444.A OG1 no hydrogen 2.791 N/A ALA 451.A N GLU 287.A OE1 no hydrogen 2.901 N/A GLY 460.A N ILE 246.A O no hydrogen 2.726 N/A LEU 462.A N ARG 244.A O no hydrogen 2.893 N/A VAL 473.A N ASP 471.A OD1 no hydrogen 3.175 N/A ASP 475.A N PRO 472.A O no hydrogen 3.325 N/A ARG 476.A NH1 GLU 85.A O no hydrogen 2.898 N/A ARG 476.A NH2 GLU 85.A O no hydrogen 3.042 N/A ARG 477.A NH1 ALA 474.A O no hydrogen 3.411 N/A ARG 477.A NH1 ARG 476.A O no hydrogen 3.472 N/A THR 478.A N GLU 481.A OE2 no hydrogen 2.870 N/A LEU 479.A N ASP 195.A OD2 no hydrogen 2.851 N/A GLU 481.A N THR 478.A O no hydrogen 2.808 N/A GLU 481.A N THR 478.A OG1 no hydrogen 3.349 N/A ARG 482.A N THR 478.A O no hydrogen 3.076 N/A ARG 482.A NE ARG 477.A O no hydrogen 3.044 N/A ARG 482.A NH2 ARG 477.A O no hydrogen 3.321 N/A ASN 483.A N LEU 479.A O no hydrogen 2.885 N/A HIS 487.A N ASN 483.A O no hydrogen 3.204 N/A ASN 488.A N GLU 484.A O no hydrogen 3.052 N/A GLN 489.A N ARG 485.A O no hydrogen 3.039 N/A GLN 489.A N LEU 486.A O no hydrogen 2.867 N/A LEU 490.A N LEU 486.A O no hydrogen 3.041 N/A LYS 491.A N HIS 487.A O no hydrogen 2.995 N/A ALA 492.A N ASN 488.A O no hydrogen 2.846 N/A LEU 493.A N GLN 489.A O no hydrogen 2.914 N/A LYS 494.A N LEU 490.A O no hydrogen 2.801 N/A GLN 495.A N LYS 491.A O no hydrogen 3.304 N/A ASP 496.A N ALA 492.A O no hydrogen 3.101 N/A LEU 497.A N LEU 493.A O no hydrogen 2.908 N/A ALA 498.A N LYS 494.A O no hydrogen 3.138 N/A ARG 499.A N ASP 496.A O no hydrogen 3.267 N/A SER 500.A N LEU 497.A O no hydrogen 3.280 N/A SER 500.A OG LEU 497.A O no hydrogen 3.559 N/A CYS 501.A N ALA 498.A O no hydrogen 3.217 N/A ASP 502.A N GLN 158.A O no hydrogen 2.922 N/A THR 504.A N ASP 502.A OD1 no hydrogen 3.230 N/A THR 504.A OG1 ASP 502.A OD1 no hydrogen 2.668 N/A THR 504.A OG1 ASP 502.A OD2 no hydrogen 3.295 N/A LYS 505.A N ASP 502.A O no hydrogen 2.777 N/A GLU 506.A N GLU 503.A O no hydrogen 3.452 N/A THR 507.A N ASP 510.A OD2 no hydrogen 2.744 N/A ASP 510.A N THR 507.A OG1 no hydrogen 3.218 N/A LYS 511.A N THR 507.A O no hydrogen 3.292 N/A LYS 511.A N ALA 508.A O no hydrogen 3.106 N/A ILE 512.A N ALA 508.A O no hydrogen 3.093 N/A HIS 513.A N MET 509.A O no hydrogen 2.922 N/A HIS 513.A ND1 GLU 197.A OE1 no hydrogen 3.146 N/A ARG 514.A N ASP 510.A O no hydrogen 3.103 N/A GLU 515.A N LYS 511.A O no hydrogen 3.031 N/A ASN 516.A N ILE 512.A O no hydrogen 3.021 N/A ASN 516.A ND2 GLU 197.A OE2 no hydrogen 3.381 N/A ASN 516.A ND2 THR 233.A OG1 no hydrogen 2.683 N/A VAL 517.A N HIS 513.A O no hydrogen 2.871 N/A ARG 518.A N ARG 514.A O no hydrogen 2.722 N/A ARG 518.A NH1 GLU 515.A OE2 no hydrogen 3.344 N/A GLN 519.A N GLU 515.A O no hydrogen 2.888 N/A GLN 519.A NE2 GLU 515.A OE2 no hydrogen 2.712 N/A GLY 520.A N VAL 517.A O no hydrogen 3.066 N/A ARG 521.A N ASN 516.A O no hydrogen 2.889 N/A LYS 523.A NZ LEU 196.A O no hydrogen 3.125 N/A LYS 523.A NZ TYR 199.A O no hydrogen 2.924 N/A TYR 524.A N ASP 522.A OD1 no hydrogen 2.983 N/A TYR 524.A OH ASP 195.A OD1 no hydrogen 2.609 N/A LYS 525.A N ASP 522.A OD1 no hydrogen 2.898 N/A LYS 525.A NZ GLU 481.A OE1 no hydrogen 2.717 N/A LYS 525.A NZ ASP 522.A OD2 no hydrogen 3.142 N/A THR 526.A N ASP 522.A O no hydrogen 2.941 N/A THR 526.A OG1 ASP 522.A O no hydrogen 3.115 N/A LEU 527.A N LYS 523.A O no hydrogen 3.232 N/A ARG 528.A N TYR 524.A O no hydrogen 2.795 N/A ARG 528.A NH1 VAL 473.A O no hydrogen 2.746 N/A ARG 528.A NH1 ARG 476.A O no hydrogen 2.878 N/A ARG 528.A NH2 ARG 476.A O no hydrogen 3.352 N/A GLU 529.A N LYS 525.A O no hydrogen 2.853 N/A ILE 530.A N THR 526.A O no hydrogen 3.035 N/A ARG 531.A N LEU 527.A O no hydrogen 3.201 N/A ARG 531.A N ARG 528.A O no hydrogen 3.331 N/A ARG 531.A NH2 LEU 221.A O no hydrogen 3.218 N/A LYS 532.A N GLU 529.A O no hydrogen 3.063 N/A THR 535.A OG1 GLU 242.A OE1 no hydrogen 3.523 N/A ARG 537.A N ASN 534.A OD1 no hydrogen 2.880 N/A ARG 538.A N ASN 534.A O no hydrogen 3.383 N/A ARG 538.A NE ARG 531.A O no hydrogen 2.673 N/A ARG 538.A NH1 GLU 242.A OE1 no hydrogen 3.153 N/A ARG 538.A NH2 GLU 242.A OE1 no hydrogen 3.054 N/A ARG 538.A NH2 GLY 533.A O no hydrogen 3.305 N/A VAL 539.A N THR 535.A O no hydrogen 3.058 N/A ASP 540.A N LYS 536.A O no hydrogen 2.932 N/A GLN 541.A N ARG 537.A O no hydrogen 2.967 N/A PHE 542.A N ARG 538.A O no hydrogen 3.139 N/A ASN 544.A N ASP 540.A O no hydrogen 3.085 N/A MET 545.A N GLN 541.A O no hydrogen 3.187 N/A