Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4cgy_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ALA 5.A N SER 2.A OG no hydrogen 3.352 N/A MET 6.A N SER 2.A O no hydrogen 2.968 N/A GLU 7.A N ARG 3.A O no hydrogen 2.893 N/A MET 8.A N ALA 4.A O no hydrogen 3.057 N/A ALA 9.A N ALA 5.A O no hydrogen 3.045 N/A LEU 10.A N MET 6.A O no hydrogen 2.863 N/A ARG 11.A N GLU 7.A O no hydrogen 3.137 N/A VAL 13.A N LEU 10.A O no hydrogen 2.880 N/A ARG 14.A N GLN 121.A OE1 no hydrogen 2.984 N/A LYS 15.A N GLN 121.A OE1 no hydrogen 2.827 N/A VAL 16.A N THR 63.A O no hydrogen 2.929 N/A LEU 17.A N ALA 122.A O no hydrogen 3.069 N/A CYS 18.A N VAL 65.A O no hydrogen 2.836 N/A CYS 18.A SG VAL 16.A O no hydrogen 3.855 N/A VAL 19.A N VAL 124.A O no hydrogen 3.173 N/A ALA 20.A N THR 67.A O no hydrogen 3.110 N/A LYS 22.A NZ THR 336.A OG1 no hydrogen 3.162 N/A ASN 23.A ND2 TYR 51.A OH no hydrogen 3.267 N/A ALA 25.A N LYS 22.A O no hydrogen 3.106 N/A ALA 26.A N LYS 22.A O no hydrogen 3.183 N/A LYS 27.A N ASN 23.A O no hydrogen 2.805 N/A GLY 28.A N ASP 24.A O no hydrogen 3.027 N/A ILE 29.A N ALA 25.A O no hydrogen 2.850 N/A ALA 30.A N ALA 26.A O no hydrogen 2.998 N/A ASP 31.A N LYS 27.A O no hydrogen 2.953 N/A LEU 32.A N GLY 28.A O no hydrogen 3.229 N/A LEU 33.A N ILE 29.A O no hydrogen 3.147 N/A SER 34.A N ALA 30.A O no hydrogen 3.119 N/A SER 34.A OG ALA 30.A O no hydrogen 2.675 N/A SER 34.A OG ASP 31.A O no hydrogen 3.531 N/A GLY 36.A N ASP 31.A O no hydrogen 2.955 N/A ARG 37.A N SER 34.A O no hydrogen 3.418 N/A MET 38.A N SER 34.A OG no hydrogen 3.155 N/A ARG 39.A N GLU 52.A O no hydrogen 2.845 N/A ARG 41.A N ILE 50.A O no hydrogen 2.648 N/A ARG 41.A NH1 GLU 116.A OE1 no hydrogen 2.984 N/A LEU 44.A N THR 112.A OG1 no hydrogen 3.081 N/A SER 45.A OG ASN 48.A OD1 no hydrogen 2.966 N/A ASN 48.A N SER 45.A O no hydrogen 3.376 N/A ASN 48.A ND2 SER 68.A OG no hydrogen 2.936 N/A ASN 48.A ND2 SER 70.A OG no hydrogen 3.047 N/A LYS 49.A N ASN 23.A OD1 no hydrogen 3.035 N/A LYS 49.A NZ GLU 42.A OE1 no hydrogen 3.049 N/A LYS 49.A NZ GLU 42.A OE2 no hydrogen 2.815 N/A LYS 49.A NZ LYS 46.A O no hydrogen 2.798 N/A ILE 50.A N ARG 41.A O no hydrogen 2.862 N/A TYR 51.A N MET 66.A O no hydrogen 2.803 N/A GLU 52.A N ARG 39.A O no hydrogen 3.057 N/A PHE 53.A N MET 64.A O no hydrogen 3.122 N/A TYR 55.A N VAL 62.A O no hydrogen 2.958 N/A HIS 56.A ND1 ASN 61.A OD1 no hydrogen 2.868 N/A LEU 57.A N GLN 60.A O no hydrogen 2.936 N/A GLN 60.A N LEU 57.A O no hydrogen 2.774 N/A GLN 60.A NE2 VAL 13.A O no hydrogen 3.474 N/A VAL 62.A N TYR 55.A O no hydrogen 2.831 N/A THR 63.A N ARG 14.A O no hydrogen 2.861 N/A THR 63.A OG1 ASP 54.A OD1 no hydrogen 3.282 N/A MET 64.A N PHE 53.A O no hydrogen 2.774 N/A VAL 65.A N VAL 16.A O no hydrogen 2.857 N/A MET 66.A N TYR 51.A O no hydrogen 3.098 N/A THR 67.A N CYS 18.A O no hydrogen 2.867 N/A THR 67.A OG1 LYS 49.A O no hydrogen 3.262 N/A SER 68.A N THR 67.A OG1 no hydrogen 2.735 N/A VAL 69.A N ALA 20.A O no hydrogen 3.074 N/A SER 70.A OG ASN 48.A OD1 no hydrogen 3.431 N/A GLY 71.A N GLU 21.A O no hydrogen 3.011 N/A HIS 72.A ND1 GLU 139.A OE2 no hydrogen 2.804 N/A HIS 72.A NE2 GLU 132.A OE1 no hydrogen 2.791 N/A LEU 73.A N GLU 139.A OE1 no hydrogen 2.820 N/A LEU 74.A N GLU 139.A OE1 no hydrogen 3.288 N/A ALA 75.A N TYR 101.A O no hydrogen 2.729 N/A ASP 77.A N GLU 99.A O no hydrogen 3.104 N/A PHE 78.A N ASP 77.A OD1 no hydrogen 2.770 N/A GLN 79.A N GLU 97.A O no hydrogen 3.115 N/A PHE 82.A N GLN 79.A O no hydrogen 3.253 N/A ARG 83.A N GLN 79.A O no hydrogen 3.277 N/A ARG 83.A N MET 80.A O no hydrogen 3.222 N/A ARG 83.A NE PHE 78.A O no hydrogen 3.226 N/A ARG 83.A NH2 PHE 78.A O no hydrogen 2.790 N/A SER 87.A N LYS 84.A O no hydrogen 3.196 N/A SER 87.A OG GLN 81.A O no hydrogen 2.773 N/A SER 87.A OG LYS 84.A O no hydrogen 2.660 N/A CYS 88.A SG PHE 82.A O no hydrogen 3.944 N/A LEU 91.A N ASN 89.A OD1 no hydrogen 3.249 N/A VAL 92.A N ASN 89.A O no hydrogen 2.952 N/A LEU 93.A N PRO 90.A O no hydrogen 3.175 N/A PHE 94.A N LEU 91.A O no hydrogen 3.449 N/A GLU 95.A N VAL 92.A O no hydrogen 3.032 N/A ALA 96.A N VAL 92.A O no hydrogen 2.850 N/A GLU 99.A N ASP 77.A O no hydrogen 2.819 N/A LYS 100.A NZ GLU 139.A OE2 no hydrogen 3.217 N/A LYS 100.A NZ ASP 185.A OD1 no hydrogen 3.397 N/A TYR 101.A N ALA 75.A O no hydrogen 2.793 N/A CYS 102.A SG LEU 73.A O no hydrogen 3.539 N/A CYS 102.A SG PRO 103.A O no hydrogen 3.832 N/A PHE 106.A N PRO 103.A O no hydrogen 2.900 N/A VAL 107.A N GLU 104.A O no hydrogen 3.413 N/A LYS 110.A N PHE 106.A O no hydrogen 3.014 N/A LYS 110.A NZ GLU 114.A OE2 no hydrogen 2.904 N/A LYS 111.A N VAL 107.A O no hydrogen 2.877 N/A THR 112.A N ASP 108.A O no hydrogen 3.021 N/A THR 112.A OG1 ASP 108.A O no hydrogen 2.684 N/A LEU 113.A N ILE 109.A O no hydrogen 3.030 N/A GLU 114.A N LYS 110.A O no hydrogen 3.074 N/A ARG 115.A N LYS 111.A O no hydrogen 2.942 N/A ARG 115.A NH1 GLU 42.A O no hydrogen 3.561 N/A ARG 115.A NH1 GLU 116.A OE2 no hydrogen 2.793 N/A GLU 116.A N THR 112.A O no hydrogen 2.967 N/A THR 117.A N LEU 113.A O no hydrogen 2.942 N/A THR 117.A OG1 LEU 113.A O no hydrogen 2.634 N/A GLN 119.A N GLU 116.A O no hydrogen 3.041 N/A CYS 120.A N THR 117.A O no hydrogen 3.231 N/A CYS 120.A SG GLU 116.A O no hydrogen 3.312 N/A GLN 121.A N LYS 15.A O no hydrogen 2.965 N/A GLN 121.A NE2 GLN 119.A O no hydrogen 3.363 N/A LEU 123.A N GLN 152.A O no hydrogen 2.804 N/A VAL 124.A N LEU 17.A O no hydrogen 2.947 N/A ILE 125.A N LEU 154.A O no hydrogen 3.049 N/A TRP 126.A N VAL 19.A O no hydrogen 2.787 N/A THR 127.A OG1 GLY 133.A O no hydrogen 2.714 N/A ASP 128.A N GLU 21.A OE1 no hydrogen 2.992 N/A CYS 129.A SG ALA 156.A O no hydrogen 3.899 N/A CYS 129.A SG PHE 158.A O no hydrogen 3.469 N/A ASP 130.A N ASP 128.A O no hydrogen 3.002 N/A GLY 133.A N ASP 130.A OD1 no hydrogen 2.882 N/A GLU 134.A N ASP 130.A O no hydrogen 2.908 N/A ASN 135.A N ARG 131.A O no hydrogen 3.058 N/A ASN 135.A ND2 SER 181.A O no hydrogen 3.047 N/A ASN 135.A ND2 SER 181.A OG no hydrogen 3.374 N/A ASN 135.A ND2 ASP 185.A OD1 no hydrogen 3.262 N/A ILE 136.A N GLU 132.A O no hydrogen 2.836 N/A GLY 137.A N GLY 133.A O no hydrogen 2.988 N/A PHE 138.A N GLU 134.A O no hydrogen 3.009 N/A GLU 139.A N ASN 135.A O no hydrogen 3.016 N/A ILE 140.A N ILE 136.A O no hydrogen 3.027 N/A ILE 141.A N GLY 137.A O no hydrogen 2.969 N/A HIS 142.A N PHE 138.A O no hydrogen 3.051 N/A VAL 143.A N GLU 139.A O no hydrogen 3.426 N/A CYS 144.A N ILE 140.A O no hydrogen 3.163 N/A CYS 144.A SG THR 117.A OG1 no hydrogen 3.207 N/A CYS 144.A SG ILE 140.A O no hydrogen 3.318 N/A LYS 145.A N ILE 141.A O no hydrogen 2.813 N/A LYS 145.A NZ PRO 149.A O no hydrogen 3.134 N/A LYS 145.A NZ LEU 151.A O no hydrogen 2.920 N/A ALA 146.A N HIS 142.A O no hydrogen 3.232 N/A VAL 147.A N CYS 144.A O no hydrogen 3.025 N/A LYS 148.A N CYS 144.A O no hydrogen 3.001 N/A LYS 148.A NZ ARG 118.A O no hydrogen 3.458 N/A LYS 148.A NZ CYS 120.A O no hydrogen 2.743 N/A LEU 151.A N LYS 148.A O no hydrogen 3.268 N/A GLN 152.A NE2 ALA 9.A O no hydrogen 2.969 N/A LEU 154.A N LEU 123.A O no hydrogen 2.784 N/A ARG 155.A N THR 174.A O no hydrogen 2.776 N/A ARG 155.A NE GLU 134.A OE1 no hydrogen 2.935 N/A ARG 155.A NH1 ILE 125.A O no hydrogen 3.481 N/A ARG 155.A NH1 THR 127.A O no hydrogen 2.773 N/A ARG 155.A NH2 THR 127.A O no hydrogen 3.253 N/A ARG 155.A NH2 ASP 128.A O no hydrogen 3.182 N/A ARG 155.A NH2 GLU 134.A OE1 no hydrogen 3.031 N/A ALA 156.A N ILE 125.A O no hydrogen 2.999 N/A SER 159.A OG ALA 393.A O no hydrogen 3.365 N/A SER 159.A OG HIS 394.A ND1 no hydrogen 3.043 N/A THR 162.A OG1 GLU 160.A OE2 no hydrogen 2.823 N/A VAL 166.A N THR 162.A O no hydrogen 3.134 N/A ARG 167.A N PRO 163.A O no hydrogen 3.222 N/A THR 168.A N HIS 164.A O no hydrogen 3.087 N/A THR 168.A OG1 HIS 164.A O no hydrogen 2.735 N/A ALA 169.A N ALA 165.A O no hydrogen 3.045 N/A CYS 170.A SG VAL 166.A O no hydrogen 3.527 N/A GLU 171.A N THR 168.A O no hydrogen 3.193 N/A ASN 172.A N ALA 169.A O no hydrogen 3.322 N/A ASN 172.A ND2 THR 168.A O no hydrogen 2.885 N/A LEU 173.A N TYR 58.A OH no hydrogen 2.967 N/A THR 174.A N ARG 155.A O no hydrogen 2.884 N/A GLU 175.A N THR 174.A OG1 no hydrogen 2.830 N/A ASP 177.A N GLU 134.A OE2 no hydrogen 2.799 N/A GLN 178.A NE2 GLN 178.A O no hydrogen 3.637 N/A GLN 178.A NE2 ASP 182.A OD1 no hydrogen 3.396 N/A ARG 179.A N ASP 177.A OD1 no hydrogen 3.261 N/A ASP 182.A N GLN 178.A O no hydrogen 2.876 N/A ALA 183.A N ARG 179.A O no hydrogen 3.226 N/A VAL 184.A N VAL 180.A O no hydrogen 3.309 N/A ASP 185.A N SER 181.A O no hydrogen 3.070 N/A VAL 186.A N ASP 182.A O no hydrogen 2.859 N/A ARG 187.A N ALA 183.A O no hydrogen 3.069 N/A ARG 187.A NH1 ASP 191.A OD2 no hydrogen 3.231 N/A ARG 187.A NH2 GLU 132.A OE2 no hydrogen 2.806 N/A GLN 188.A N VAL 184.A O no hydrogen 2.803 N/A GLN 188.A NE2 ASN 135.A OD1 no hydrogen 3.576 N/A GLU 189.A N ASP 185.A O no hydrogen 3.082 N/A LEU 190.A N VAL 186.A O no hydrogen 2.960 N/A ASP 191.A N ARG 187.A O no hydrogen 2.939 N/A LEU 192.A N GLN 188.A O no hydrogen 3.158 N/A ARG 193.A N GLU 189.A O no hydrogen 3.011 N/A ARG 193.A NE LEU 93.A O no hydrogen 3.273 N/A ARG 193.A NE PHE 94.A O no hydrogen 3.059 N/A ILE 194.A N LEU 190.A O no hydrogen 2.886 N/A GLY 195.A N ASP 191.A O no hydrogen 2.969 N/A ALA 196.A N LEU 192.A O no hydrogen 2.842 N/A ALA 197.A N ARG 193.A O no hydrogen 3.106 N/A PHE 198.A N ILE 194.A O no hydrogen 3.199 N/A THR 199.A N GLY 195.A O no hydrogen 2.950 N/A THR 199.A OG1 GLY 195.A O no hydrogen 2.649 N/A ARG 200.A N ALA 196.A O no hydrogen 2.930 N/A ARG 200.A NH1 PHE 82.A O no hydrogen 3.004 N/A ARG 200.A NH2 PHE 82.A O no hydrogen 3.348 N/A PHE 201.A N ALA 197.A O no hydrogen 3.123 N/A GLN 202.A N PHE 198.A O no hydrogen 3.117 N/A GLN 202.A NE2 ILE 219.A O no hydrogen 3.147 N/A THR 203.A N THR 199.A O no hydrogen 2.816 N/A THR 203.A OG1 THR 199.A O no hydrogen 2.829 N/A THR 203.A OG1 ILE 219.A O no hydrogen 2.731 N/A LEU 204.A N ARG 200.A O no hydrogen 3.163 N/A ARG 205.A N PHE 201.A O no hydrogen 3.193 N/A ARG 205.A NE ASP 608.A OD1 no hydrogen 3.154 N/A ARG 205.A NH2 ASP 608.A OD2 no hydrogen 2.803 N/A LEU 206.A N GLN 202.A O no hydrogen 2.811 N/A GLN 207.A N THR 203.A O no hydrogen 2.956 N/A GLN 207.A NE2 GLN 217.A O no hydrogen 2.771 N/A ARG 208.A N LEU 204.A O no hydrogen 3.345 N/A ARG 208.A N ARG 205.A O no hydrogen 3.049 N/A ILE 209.A N ARG 205.A O no hydrogen 2.968 N/A PHE 210.A N LEU 206.A O no hydrogen 2.801 N/A GLU 212.A N GLU 212.A OE1 no hydrogen 2.941 N/A LEU 214.A N PHE 210.A O no hydrogen 3.010 N/A GLN 217.A N LEU 214.A O no hydrogen 3.366 N/A ILE 219.A N THR 203.A OG1 no hydrogen 3.166 N/A SER 220.A OG GLN 225.A OE1 no hydrogen 3.086 N/A TYR 221.A N THR 199.A OG1 no hydrogen 2.985 N/A SER 223.A OG ASP 191.A OD1 no hydrogen 3.410 N/A CYS 224.A SG HIS 521.A ND1 no hydrogen 3.303 N/A PHE 226.A N GLY 222.A O no hydrogen 3.134 N/A THR 228.A N CYS 224.A O no hydrogen 3.312 N/A THR 228.A OG1 CYS 224.A O no hydrogen 2.682 N/A LEU 229.A N GLN 225.A O no hydrogen 3.025 N/A GLY 230.A N PHE 226.A O no hydrogen 2.905 N/A PHE 231.A N PRO 227.A O no hydrogen 3.304 N/A VAL 233.A N LEU 229.A O no hydrogen 2.982 N/A GLU 234.A N GLY 230.A O no hydrogen 2.871 N/A ARG 235.A N PHE 231.A O no hydrogen 3.079 N/A ARG 235.A NH1 LYS 496.A O no hydrogen 2.805 N/A PHE 236.A N VAL 232.A O no hydrogen 3.195 N/A LYS 237.A N VAL 233.A O no hydrogen 2.952 N/A LYS 237.A NZ GLU 550.A OE1 no hydrogen 2.792 N/A ALA 238.A N GLU 234.A O no hydrogen 3.123 N/A ILE 239.A N ARG 235.A O no hydrogen 3.200 N/A GLN 240.A N PHE 236.A O no hydrogen 2.973 N/A ALA 241.A N LYS 237.A O no hydrogen 2.881 N/A PHE 242.A N ALA 238.A O no hydrogen 2.966 N/A PHE 242.A N ILE 239.A O no hydrogen 3.279 N/A GLU 245.A N THR 492.A OG1 no hydrogen 2.761 N/A PHE 247.A N GLY 490.A O no hydrogen 2.951 N/A HIS 248.A N LEU 270.A O no hydrogen 2.770 N/A HIS 248.A ND1 ASP 489.A OD1 no hydrogen 2.942 N/A ARG 249.A N VAL 488.A O no hydrogen 3.199 N/A ARG 249.A NH1 GLU 262.A OE2 no hydrogen 3.307 N/A LYS 251.A N GLU 486.A O no hydrogen 3.115 N/A THR 253.A N THR 484.A O no hydrogen 3.118 N/A THR 253.A OG1 THR 484.A OG1 no hydrogen 2.657 N/A HIS 254.A N VAL 261.A O no hydrogen 2.788 N/A HIS 254.A ND1 TYR 474.A OH no hydrogen 2.857 N/A HIS 256.A N GLY 259.A O no hydrogen 3.030 N/A GLY 259.A N HIS 256.A O no hydrogen 3.033 N/A VAL 261.A N HIS 254.A O no hydrogen 2.805 N/A PHE 263.A N VAL 252.A O no hydrogen 2.832 N/A ASN 264.A N VAL 446.A O no hydrogen 2.794 N/A TRP 265.A NE1 GLU 443.A OE1 no hydrogen 3.129 N/A LYS 266.A N ARG 444.A O no hydrogen 2.829 N/A LYS 266.A NZ GLU 437.A OE2 no hydrogen 3.516 N/A ARG 267.A NH1 GLU 443.A OE1 no hydrogen 2.864 N/A HIS 268.A N TRP 265.A O no hydrogen 2.906 N/A ARG 269.A N ARG 267.A O no hydrogen 2.812 N/A LEU 270.A N HIS 248.A O no hydrogen 2.905 N/A ALA 275.A N ASN 272.A OD1 no hydrogen 2.943 N/A CYS 276.A N ASN 272.A O no hydrogen 3.308 N/A LEU 277.A N HIS 273.A O no hydrogen 2.792 N/A VAL 278.A N THR 274.A O no hydrogen 3.057 N/A TYR 280.A N CYS 276.A O no hydrogen 2.847 N/A TYR 280.A OH VAL 485.A O no hydrogen 3.054 N/A GLN 281.A N LEU 277.A O no hydrogen 2.911 N/A LEU 282.A N VAL 278.A O no hydrogen 3.282 N/A CYS 283.A N TYR 280.A O no hydrogen 2.945 N/A CYS 283.A SG LEU 279.A O no hydrogen 3.479 N/A CYS 283.A SG ILE 440.A O no hydrogen 3.654 N/A VAL 284.A N TYR 280.A O no hydrogen 3.090 N/A ALA 289.A N PHE 480.A O no hydrogen 2.945 N/A THR 290.A N ASP 439.A O no hydrogen 3.155 N/A THR 290.A OG1 HIS 479.A ND1 no hydrogen 3.147 N/A VAL 291.A N SER 478.A O no hydrogen 2.826 N/A VAL 292.A N GLU 437.A O no hydrogen 2.809 N/A GLU 293.A N GLU 437.A O no hydrogen 3.477 N/A VAL 294.A N GLN 476.A OE1 no hydrogen 3.265 N/A ARG 295.A N THR 435.A O no hydrogen 2.920 N/A ARG 295.A NH2 GLU 293.A OE2 no hydrogen 2.999 N/A SER 296.A OG GLU 433.A O no hydrogen 3.023 N/A SER 296.A OG THR 434.A OG1 no hydrogen 3.138 N/A LYS 297.A N GLU 433.A O no hydrogen 2.925 N/A LYS 299.A N GLY 431.A O no hydrogen 3.120 N/A LYS 301.A N ALA 429.A O no hydrogen 2.859 N/A LYS 301.A NZ HIS 465.A O no hydrogen 3.253 N/A ARG 303.A N ASP 428.A OD1 no hydrogen 2.787 N/A ARG 303.A NE THR 383.A O no hydrogen 3.362 N/A ARG 303.A NE CYS 424.A O no hydrogen 2.912 N/A ARG 303.A NH1 ASP 428.A OD1 no hydrogen 3.258 N/A ARG 303.A NH2 THR 383.A O no hydrogen 2.887 N/A ALA 306.A N ARG 385.A O no hydrogen 2.865 N/A THR 309.A N THR 345.A O no hydrogen 3.110 N/A THR 309.A OG1 PRO 343.A O no hydrogen 2.697 N/A THR 309.A OG1 THR 345.A O no hydrogen 2.972 N/A GLU 311.A N ASP 308.A OD1 no hydrogen 3.389 N/A LEU 312.A N ASP 308.A O no hydrogen 3.131 N/A GLU 313.A N THR 309.A O no hydrogen 2.934 N/A LYS 314.A N VAL 310.A O no hydrogen 3.001 N/A LYS 314.A NZ GLU 508.A OE1 no hydrogen 3.109 N/A LEU 315.A N GLU 311.A O no hydrogen 2.947 N/A ALA 316.A N LEU 312.A O no hydrogen 2.864 N/A ARG 318.A N LYS 314.A O no hydrogen 3.031 N/A LYS 319.A N LEU 315.A O no hydrogen 2.762 N/A LYS 319.A NZ TYR 463.A O no hydrogen 2.825 N/A LEU 320.A N ALA 316.A O no hydrogen 3.115 N/A ARG 321.A N SER 317.A O no hydrogen 3.201 N/A ILE 322.A N ALA 316.A O no hydrogen 3.002 N/A ALA 324.A N GLU 500.A OE1 no hydrogen 2.830 N/A GLU 326.A N ASN 323.A O no hydrogen 2.921 N/A THR 327.A N ASN 323.A O no hydrogen 3.076 N/A THR 327.A OG1 ASN 323.A O no hydrogen 3.468 N/A MET 328.A N ALA 324.A O no hydrogen 3.122 N/A ARG 329.A NE GLU 326.A OE1 no hydrogen 3.326 N/A ARG 329.A NE GLU 326.A OE2 no hydrogen 3.382 N/A ARG 329.A NH2 GLU 326.A OE2 no hydrogen 3.020 N/A ILE 330.A N GLU 326.A O no hydrogen 2.930 N/A ALA 331.A N THR 327.A O no hydrogen 2.794 N/A GLU 332.A N MET 328.A O no hydrogen 3.102 N/A LYS 333.A N ARG 329.A O no hydrogen 3.076 N/A LYS 333.A NZ GLU 410.A OE2 no hydrogen 2.913 N/A LEU 334.A N ILE 330.A O no hydrogen 2.859 N/A TYR 335.A N ALA 331.A O no hydrogen 3.112 N/A TYR 335.A OH ASP 128.A OD1 no hydrogen 3.115 N/A THR 336.A N GLU 332.A O no hydrogen 2.995 N/A THR 336.A OG1 GLU 332.A O no hydrogen 2.700 N/A GLN 337.A N LYS 333.A O no hydrogen 3.053 N/A GLY 338.A N TYR 335.A O no hydrogen 3.006 N/A TYR 339.A N LEU 334.A O no hydrogen 2.849 N/A ILE 340.A N LEU 334.A O no hydrogen 3.383 N/A SER 341.A N HIS 398.A O no hydrogen 3.125 N/A SER 341.A OG PRO 396.A O no hydrogen 3.255 N/A SER 341.A OG HIS 398.A ND1 no hydrogen 3.330 N/A TYR 342.A N SER 159.A O no hydrogen 2.724 N/A TYR 342.A OH ASP 130.A OD2 no hydrogen 2.758 N/A ARG 344.A NE GLU 332.A OE2 no hydrogen 3.406 N/A ARG 344.A NH2 GLU 332.A OE2 no hydrogen 3.390 N/A THR 345.A N THR 309.A OG1 no hydrogen 2.843 N/A THR 345.A OG1 ASP 391.A OD2 no hydrogen 3.117 N/A THR 347.A N THR 345.A OG1 no hydrogen 2.964 N/A THR 347.A OG1 THR 345.A OG1 no hydrogen 3.038 N/A THR 347.A OG1 HIS 394.A O no hydrogen 2.846 N/A ASN 348.A N LYS 389.A O no hydrogen 3.128 N/A PHE 350.A N ASN 386.A OD1 no hydrogen 2.746 N/A VAL 358.A N ASN 355.A OD1 no hydrogen 3.151 N/A VAL 360.A N LEU 356.A O no hydrogen 2.991 N/A GLU 361.A N THR 357.A O no hydrogen 2.983 N/A GLN 362.A N VAL 358.A O no hydrogen 2.883 N/A GLN 363.A N VAL 360.A O no hydrogen 2.924 N/A GLN 363.A NE2 TYR 414.A OH no hydrogen 3.092 N/A THR 364.A N GLU 361.A O no hydrogen 3.217 N/A THR 364.A OG1 GLU 361.A O no hydrogen 2.684 N/A ASP 366.A N GLN 363.A O no hydrogen 3.315 N/A ARG 368.A N ASP 366.A OD2 no hydrogen 2.819 N/A ARG 368.A NE ASP 366.A OD2 no hydrogen 2.934 N/A ARG 368.A NH2 ASP 366.A OD1 no hydrogen 2.813 N/A TRP 369.A N ASP 366.A OD2 no hydrogen 3.302 N/A TRP 369.A NE1 GLN 363.A OE1 no hydrogen 2.754 N/A GLY 370.A N ASP 366.A O no hydrogen 2.822 N/A ALA 373.A N TRP 369.A O no hydrogen 3.086 N/A GLN 374.A N GLY 370.A O no hydrogen 3.037 N/A GLN 374.A NE2 GLU 378.A OE2 no hydrogen 3.112 N/A SER 375.A N ALA 371.A O no hydrogen 3.015 N/A ILE 376.A N PHE 372.A O no hydrogen 3.169 N/A ILE 376.A N ALA 373.A O no hydrogen 3.212 N/A LEU 377.A N ALA 373.A O no hydrogen 3.476 N/A GLU 378.A N GLN 374.A O no hydrogen 2.937 N/A ARG 379.A N SER 375.A O no hydrogen 3.007 N/A ARG 379.A NH1 GLN 427.A OE1 no hydrogen 3.341 N/A ARG 379.A NH1 ASN 456.A OD1 no hydrogen 3.488 N/A GLY 381.A N ILE 376.A O no hydrogen 2.974 N/A THR 383.A N CYS 425.A O no hydrogen 2.890 N/A THR 383.A OG1 CYS 425.A O no hydrogen 3.427 N/A THR 383.A OG1 SER 426.A O no hydrogen 3.322 N/A ARG 385.A NH1 ARG 303.A O no hydrogen 2.925 N/A GLY 387.A N ASN 348.A O no hydrogen 2.790 N/A LYS 389.A N ASN 348.A OD1 no hydrogen 2.858 N/A ASP 391.A N THR 347.A OG1 no hydrogen 3.116 N/A GLN 392.A N SER 390.A OG no hydrogen 3.274 N/A ALA 393.A N ASP 391.A OD1 no hydrogen 2.827 N/A HIS 394.A N ASP 391.A OD1 no hydrogen 2.785 N/A HIS 394.A ND1 SER 159.A OG no hydrogen 3.043 N/A HIS 394.A NE2 CYS 129.A O no hydrogen 2.663 N/A ILE 397.A N LEU 307.A O no hydrogen 2.805 N/A HIS 398.A N SER 341.A OG no hydrogen 3.245 N/A HIS 398.A ND1 PRO 396.A O no hydrogen 2.890 N/A THR 400.A N TYR 339.A O no hydrogen 2.895 N/A THR 400.A OG1 GLY 338.A O no hydrogen 2.722 N/A TYR 402.A OH ASP 366.A OD1 no hydrogen 2.640 N/A ASN 405.A N THR 403.A OG1 no hydrogen 3.356 N/A GLN 411.A N GLN 407.A O no hydrogen 3.385 N/A GLN 411.A NE2 GLU 415.A OE1 no hydrogen 3.247 N/A ARG 412.A N GLY 408.A O no hydrogen 3.253 N/A ARG 412.A NH1 LEU 320.A O no hydrogen 3.008 N/A ARG 412.A NH1 ASP 409.A OD1 no hydrogen 3.294 N/A ARG 412.A NH2 LEU 320.A O no hydrogen 2.740 N/A LEU 413.A N ASP 409.A O no hydrogen 2.990 N/A TYR 414.A N GLU 410.A O no hydrogen 3.149 N/A TYR 414.A OH LYS 401.A O no hydrogen 2.605 N/A GLU 415.A N GLN 411.A O no hydrogen 2.845 N/A PHE 416.A N ARG 412.A O no hydrogen 3.089 N/A ILE 417.A N LEU 413.A O no hydrogen 2.958 N/A VAL 418.A N TYR 414.A O no hydrogen 2.858 N/A ARG 419.A N GLU 415.A O no hydrogen 2.934 N/A ARG 419.A NE GLU 415.A OE2 no hydrogen 2.814 N/A ARG 419.A NH1 VAL 460.A O no hydrogen 2.777 N/A HIS 420.A N PHE 416.A O no hydrogen 2.941 N/A HIS 420.A ND1 TYR 461.A OH no hydrogen 3.093 N/A HIS 420.A NE2 GLN 305.A O no hydrogen 2.887 N/A PHE 421.A N ILE 417.A O no hydrogen 3.120 N/A LEU 422.A N VAL 418.A O no hydrogen 2.978 N/A ALA 423.A N ARG 419.A O no hydrogen 2.871 N/A CYS 424.A N HIS 420.A O no hydrogen 2.837 N/A CYS 424.A SG ARG 385.A O no hydrogen 3.542 N/A CYS 425.A N PHE 421.A O no hydrogen 3.085 N/A CYS 425.A SG PHE 421.A O no hydrogen 3.258 N/A SER 426.A N ALA 423.A O no hydrogen 3.204 N/A SER 426.A OG GLN 427.A O no hydrogen 3.174 N/A ALA 429.A N LYS 301.A O no hydrogen 2.878 N/A GLN 430.A N ALA 454.A O no hydrogen 2.839 N/A GLY 431.A N LYS 299.A O no hydrogen 2.716 N/A GLN 432.A N MET 451.A O no hydrogen 2.864 N/A GLU 433.A N LYS 297.A O no hydrogen 2.901 N/A THR 434.A N GLY 449.A O no hydrogen 2.823 N/A THR 434.A OG1 SER 296.A OG no hydrogen 3.138 N/A THR 435.A N ARG 295.A O no hydrogen 2.795 N/A VAL 436.A N ALA 447.A O no hydrogen 2.893 N/A GLU 437.A N GLU 293.A O no hydrogen 2.829 N/A ILE 438.A N PHE 445.A O no hydrogen 2.860 N/A ASP 439.A N THR 290.A O no hydrogen 3.052 N/A ILE 440.A N GLU 443.A O no hydrogen 2.828 N/A GLN 442.A N ASP 439.A OD1 no hydrogen 3.063 N/A GLU 443.A N ILE 440.A O no hydrogen 3.103 N/A ARG 444.A NE ASP 439.A OD2 no hydrogen 2.944 N/A ARG 444.A NH1 GLU 437.A OE2 no hydrogen 2.851 N/A PHE 445.A N ILE 438.A O no hydrogen 2.939 N/A VAL 446.A N ASN 264.A O no hydrogen 2.789 N/A ALA 447.A N VAL 436.A O no hydrogen 3.033 N/A GLY 449.A N THR 434.A O no hydrogen 2.788 N/A LEU 450.A N LYS 469.A O no hydrogen 2.789 N/A MET 451.A N GLN 432.A O no hydrogen 3.011 N/A ILE 452.A N ASP 468.A OD1 no hydrogen 2.737 N/A LEU 453.A N GLN 430.A O no hydrogen 2.791 N/A ALA 454.A N GLN 430.A O no hydrogen 3.087 N/A ARG 455.A NH1 TRP 466.A O no hydrogen 3.149 N/A ARG 455.A NH2 TRP 466.A O no hydrogen 3.470 N/A ASN 456.A ND2 ASP 428.A O no hydrogen 2.521 N/A TYR 457.A N GLN 427.A O no hydrogen 3.099 N/A TYR 457.A OH ASP 464.A OD2 no hydrogen 3.103 N/A LEU 458.A N ARG 455.A O no hydrogen 3.123 N/A ASP 459.A N ASN 456.A O no hydrogen 2.887 N/A VAL 460.A N TYR 457.A O no hydrogen 3.185 N/A TYR 461.A N TYR 457.A O no hydrogen 3.120 N/A TYR 461.A OH HIS 420.A ND1 no hydrogen 3.093 N/A ASP 464.A N TYR 461.A O no hydrogen 3.497 N/A SER 467.A OG HIS 465.A NE2 no hydrogen 2.828 N/A LYS 469.A N LEU 450.A O no hydrogen 2.771 N/A LYS 469.A NZ HIS 448.A O no hydrogen 3.206 N/A TYR 474.A OH HIS 254.A ND1 no hydrogen 2.857 N/A GLY 477.A N VAL 291.A O no hydrogen 2.957 N/A SER 478.A N GLU 475.A O no hydrogen 3.046 N/A SER 478.A OG GLU 475.A O no hydrogen 2.695 N/A HIS 479.A ND1 THR 290.A OG1 no hydrogen 3.147 N/A PHE 480.A N ALA 289.A O no hydrogen 2.813 N/A SER 483.A OG ASP 255.A OD1 no hydrogen 3.032 N/A SER 483.A OG ASP 255.A OD2 no hydrogen 3.046 N/A THR 484.A N THR 253.A O no hydrogen 3.360 N/A THR 484.A OG1 THR 253.A OG1 no hydrogen 2.657 N/A THR 484.A OG1 GLU 486.A OE2 no hydrogen 2.698 N/A GLU 486.A N LYS 251.A O no hydrogen 2.941 N/A VAL 488.A N ARG 249.A O no hydrogen 3.186 N/A GLY 490.A N PHE 247.A O no hydrogen 2.909 N/A THR 492.A N GLU 245.A O no hydrogen 2.960 N/A THR 492.A OG1 GLU 245.A O no hydrogen 3.522 N/A THR 499.A N ASP 502.A OD2 no hydrogen 3.417 N/A ASP 502.A N THR 499.A OG1 no hydrogen 3.228 N/A LEU 503.A N THR 499.A O no hydrogen 2.851 N/A ILE 504.A N GLU 500.A O no hydrogen 2.795 N/A ALA 505.A N ALA 501.A O no hydrogen 3.037 N/A LEU 506.A N ASP 502.A O no hydrogen 3.167 N/A MET 507.A N LEU 503.A O no hydrogen 3.011 N/A GLU 508.A N ILE 504.A O no hydrogen 2.791 N/A LYS 509.A N ALA 505.A O no hydrogen 3.003 N/A HIS 510.A N LEU 506.A O no hydrogen 3.158 N/A GLY 511.A N GLU 508.A O no hydrogen 3.146 N/A ILE 512.A N MET 507.A O no hydrogen 3.058 N/A GLY 513.A N GLU 569.A OE2 no hydrogen 2.975 N/A THR 514.A N GLU 569.A OE1 no hydrogen 2.858 N/A THR 514.A OG1 GLU 569.A OE1 no hydrogen 2.701 N/A THR 517.A N GLY 513.A O no hydrogen 3.012 N/A THR 517.A OG1 THR 514.A O no hydrogen 2.938 N/A HIS 521.A N HIS 518.A O no hydrogen 3.278 N/A ILE 522.A N HIS 518.A O no hydrogen 3.171 N/A GLU 523.A N ALA 519.A O no hydrogen 2.832 N/A THR 524.A N GLU 520.A O no hydrogen 3.099 N/A THR 524.A OG1 GLU 520.A O no hydrogen 2.684 N/A ILE 525.A N HIS 521.A O no hydrogen 3.324 N/A LYS 526.A N ILE 522.A O no hydrogen 3.210 N/A ALA 527.A N GLU 523.A O no hydrogen 2.909 N/A ARG 528.A N THR 524.A O no hydrogen 2.965 N/A ARG 528.A NH1 SER 220.A OG no hydrogen 3.135 N/A MET 529.A N LYS 526.A O no hydrogen 3.181 N/A TYR 530.A N ILE 525.A O no hydrogen 3.153 N/A TYR 530.A OH SER 220.A O no hydrogen 2.684 N/A VAL 531.A N ILE 525.A O no hydrogen 3.275 N/A GLY 532.A N LEU 540.A O no hydrogen 2.818 N/A THR 534.A N ARG 538.A O no hydrogen 2.814 N/A THR 534.A OG1 ARG 538.A O no hydrogen 3.299 N/A ARG 538.A N THR 534.A OG1 no hydrogen 2.864 N/A ARG 538.A NE LEU 497.A O no hydrogen 2.787 N/A ARG 538.A NH1 ASP 536.A OD1 no hydrogen 3.551 N/A ARG 538.A NH1 ASP 536.A OD2 no hydrogen 3.458 N/A PHE 539.A N LEU 498.A O no hydrogen 2.752 N/A LEU 540.A N GLY 532.A O no hydrogen 2.809 N/A GLY 542.A N TYR 530.A O no hydrogen 2.787 N/A MET 546.A N GLY 542.A O no hydrogen 2.865 N/A GLY 547.A N HIS 543.A O no hydrogen 2.897 N/A LEU 548.A N LEU 544.A O no hydrogen 2.981 N/A VAL 549.A N GLY 545.A O no hydrogen 3.336 N/A GLU 550.A N MET 546.A O no hydrogen 3.035 N/A GLY 551.A N GLY 547.A O no hydrogen 2.903 N/A TYR 552.A N LEU 548.A O no hydrogen 3.011 N/A TYR 552.A OH GLN 202.A OE1 no hydrogen 2.679 N/A ASP 553.A N VAL 549.A O no hydrogen 3.020 N/A SER 554.A OG GLY 551.A O no hydrogen 2.784 N/A MET 555.A N TYR 552.A O no hydrogen 3.095 N/A MET 559.A N TYR 557.A O no hydrogen 2.914 N/A SER 560.A N ASP 553.A OD1 no hydrogen 3.064 N/A SER 560.A OG ASP 553.A OD1 no hydrogen 3.153 N/A SER 560.A OG ASP 553.A OD2 no hydrogen 2.739 N/A LYS 561.A N GLU 558.A O no hydrogen 3.416 N/A LYS 561.A NZ GLU 558.A OE1 no hydrogen 3.502 N/A ARG 565.A NE GLU 569.A OE2 no hydrogen 2.765 N/A ARG 565.A NH1 ASP 191.A OD1 no hydrogen 3.050 N/A ARG 565.A NH1 SER 223.A OG no hydrogen 2.801 N/A ARG 565.A NH2 GLU 569.A OE2 no hydrogen 3.390 N/A ALA 566.A N PRO 562.A O no hydrogen 2.911 N/A GLU 567.A N ASP 563.A O no hydrogen 3.162 N/A LEU 568.A N LEU 564.A O no hydrogen 3.108 N/A GLU 569.A N ARG 565.A O no hydrogen 2.835 N/A ALA 570.A N ALA 566.A O no hydrogen 2.910 N/A ASP 571.A N GLU 567.A O no hydrogen 3.084 N/A LEU 572.A N LEU 568.A O no hydrogen 3.150 N/A LYS 573.A N GLU 569.A O no hydrogen 3.250 N/A LYS 573.A NZ ASP 577.A OD1 no hydrogen 3.456 N/A LYS 573.A NZ ASP 577.A OD2 no hydrogen 3.552 N/A LEU 574.A N ALA 570.A O no hydrogen 3.217 N/A ILE 575.A N ASP 571.A O no hydrogen 3.046 N/A CYS 576.A N LEU 572.A O no hydrogen 3.313 N/A CYS 576.A SG LEU 572.A O no hydrogen 3.409 N/A ASP 577.A N LYS 573.A O no hydrogen 3.292 N/A GLY 578.A N ILE 575.A O no hydrogen 3.126 N/A LYS 579.A N LEU 574.A O no hydrogen 2.924 N/A LYS 579.A NZ ASP 577.A OD2 no hydrogen 3.217 N/A LYS 580.A NZ ASP 571.A OD1 no hydrogen 3.146 N/A LYS 580.A NZ GLN 588.A OE1 no hydrogen 3.543 N/A LYS 582.A NZ ASP 182.A OD1 no hydrogen 3.473 N/A LYS 582.A NZ ASP 182.A OD2 no hydrogen 3.242 N/A VAL 584.A N ASP 581.A OD2 no hydrogen 3.118 N/A LEU 586.A N LYS 582.A O no hydrogen 3.110 N/A ARG 587.A N PHE 583.A O no hydrogen 3.200 N/A GLN 588.A N VAL 584.A O no hydrogen 2.840 N/A GLN 589.A N VAL 585.A O no hydrogen 2.818 N/A GLN 589.A NE2 ASP 571.A OD2 no hydrogen 3.238 N/A VAL 590.A N LEU 586.A O no hydrogen 3.069 N/A GLN 591.A N ARG 587.A O no hydrogen 3.111 N/A LYS 592.A N GLN 588.A O no hydrogen 3.007 N/A TYR 593.A N GLN 589.A O no hydrogen 2.962 N/A LYS 594.A N VAL 590.A O no hydrogen 2.776 N/A LYS 594.A NZ GLU 95.A OE1 no hydrogen 3.077 N/A LYS 594.A NZ GLU 95.A OE2 no hydrogen 2.891 N/A GLN 595.A N GLN 591.A O no hydrogen 3.147 N/A VAL 596.A N LYS 592.A O no hydrogen 3.272 N/A PHE 597.A N TYR 593.A O no hydrogen 2.917 N/A ILE 598.A N LYS 594.A O no hydrogen 2.901 N/A GLU 599.A N GLN 595.A O no hydrogen 2.999 N/A ALA 600.A N VAL 596.A O no hydrogen 3.075 N/A VAL 601.A N PHE 597.A O no hydrogen 2.890 N/A ALA 602.A N ILE 598.A O no hydrogen 3.153 N/A LYS 603.A N GLU 599.A O no hydrogen 3.143 N/A LYS 603.A NZ MET 555.A O no hydrogen 3.207 N/A ALA 604.A N VAL 601.A O no hydrogen 3.326 N/A LYS 606.A N LYS 603.A O no hydrogen 3.000 N/A LYS 606.A NZ SER 554.A O no hydrogen 3.559 N/A LEU 607.A N ALA 604.A O no hydrogen 3.169 N/A GLU 609.A N LYS 605.A O no hydrogen 3.107 N/A ALA 610.A N LYS 606.A O no hydrogen 3.018 N/A LEU 611.A N LEU 607.A O no hydrogen 3.228 N/A ALA 612.A N ASP 608.A O no hydrogen 2.855 N/A TYR 614.A N LEU 611.A O no hydrogen 2.882 N/A TYR 614.A OH GLU 550.A OE2 no hydrogen 2.743 N/A PHE 615.A N LEU 611.A O no hydrogen 2.962 N/A GLY 616.A N ALA 612.A O no hydrogen 2.836 N/A