Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3eyp_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): CYS 5.A N LEU 388.A O no hydrogen 2.825 N/A CYS 5.A SG HIS 390.A O no hydrogen 3.952 N/A SER 10.A N GLN 13.A OE1 no hydrogen 2.868 N/A ARG 12.A NE ASP 204.A OD2 no hydrogen 3.481 N/A ARG 12.A NH1 PRO 189.A O no hydrogen 3.325 N/A ARG 12.A NH2 ASP 204.A OD1 no hydrogen 3.254 N/A GLN 13.A N SER 10.A OG no hydrogen 3.183 N/A GLN 13.A NE2 ASP 204.A O no hydrogen 2.748 N/A GLN 13.A NE2 TYR 248.A O no hydrogen 2.839 N/A LEU 14.A N SER 10.A O no hydrogen 2.919 N/A GLU 15.A N ALA 11.A O no hydrogen 3.009 N/A TRP 16.A N ARG 12.A O no hydrogen 3.006 N/A TRP 16.A NE1 GLU 252.A OE1 no hydrogen 3.039 N/A TYR 17.A N GLN 13.A O no hydrogen 2.978 N/A TYR 17.A OH ASN 288.A O no hydrogen 2.751 N/A ASN 18.A N LEU 14.A O no hydrogen 3.153 N/A ARG 19.A N TRP 16.A O no hydrogen 3.101 N/A ARG 19.A NE GLU 15.A OE2 no hydrogen 2.660 N/A ARG 19.A NH1 GLU 161.A OE1 no hydrogen 2.708 N/A ARG 19.A NH2 GLU 15.A OE1 no hydrogen 2.829 N/A ARG 19.A NH2 GLU 15.A OE2 no hydrogen 3.412 N/A ARG 19.A NH2 TRP 160.A O no hydrogen 2.853 N/A GLU 20.A N TYR 17.A O no hydrogen 3.306 N/A MET 21.A N ARG 19.A O no hydrogen 2.727 N/A ILE 22.A N LEU 291.A O no hydrogen 2.725 N/A ALA 23.A N ALA 69.A O no hydrogen 2.735 N/A PHE 24.A N LEU 293.A O no hydrogen 2.841 N/A PHE 25.A N ILE 71.A O no hydrogen 2.899 N/A HIS 26.A N ASN 294.A OD1 no hydrogen 3.100 N/A HIS 26.A ND1 ASN 294.A OD1 no hydrogen 2.803 N/A PHE 27.A N THR 73.A OG1 no hydrogen 3.059 N/A GLY 28.A N THR 31.A OG1 no hydrogen 3.274 N/A THR 31.A N GLY 28.A O no hydrogen 3.192 N/A THR 31.A OG1 GLY 28.A O no hydrogen 3.137 N/A PHE 32.A N ILE 29.A O no hydrogen 2.922 N/A GLU 33.A N ASN 30.A O no hydrogen 3.038 N/A TYR 35.A OH.B GLU 267.A OE2 no hydrogen 2.892 N/A ASN 37.A ND2 SER 260.A OG no hydrogen 3.224 N/A LYS 42.A N ASP 40.A OD1 no hydrogen 2.888 N/A THR 45.A OG1 ASN 94.A O no hydrogen 2.680 N/A ALA 46.A N SER 44.A OG no hydrogen 3.329 N/A ILE 47.A N SER 44.A O no hydrogen 3.073 N/A PHE 48.A N THR 45.A O no hydrogen 3.106 N/A ALA 52.A N ARG 300.A O no hydrogen 2.772 N/A ASP 54.A N GLY 301.A O no hydrogen 3.508 N/A ARG 56.A N ASP 54.A OD1 no hydrogen 2.870 N/A ARG 56.A NE GLU 114.A OE1 no hydrogen 2.879 N/A ARG 56.A NE GLU 114.A OE2 no hydrogen 3.075 N/A ARG 56.A NH1 GLU 114.A OE2 no hydrogen 2.632 N/A GLN 57.A N ASP 54.A O no hydrogen 3.000 N/A GLN 57.A NE2 ILE 303.A O no hydrogen 2.903 N/A TRP 58.A NE1 GLY 301.A O no hydrogen 2.870 N/A MET 59.A N CYS 55.A O no hydrogen 3.053 N/A GLN 60.A N ARG 56.A O no hydrogen 2.883 N/A GLN 60.A NE2 TYR 115.A OH no hydrogen 2.681 N/A THR 61.A N GLN 57.A O no hydrogen 3.168 N/A THR 61.A OG1 GLN 57.A O no hydrogen 3.465 N/A THR 61.A OG1 SER 308.A OG no hydrogen 2.640 N/A LEU 62.A N TRP 58.A O no hydrogen 3.305 N/A LYS 63.A N MET 59.A O no hydrogen 2.861 N/A LYS 63.A NZ TYR 115.A O no hydrogen 2.525 N/A ALA 64.A N GLN 60.A O no hydrogen 3.027 N/A ALA 65.A N LEU 62.A O no hydrogen 3.099 N/A GLY 66.A N LYS 63.A O no hydrogen 3.072 N/A ILE 67.A N LEU 62.A O no hydrogen 2.938 N/A ALA 70.A N LYS 118.A O no hydrogen 2.934 N/A ILE 71.A N ALA 23.A O no hydrogen 2.824 N/A LEU 72.A N GLY 120.A O no hydrogen 3.101 N/A THR 73.A N PHE 25.A O no hydrogen 3.074 N/A THR 73.A OG1 PHE 25.A O no hydrogen 3.359 N/A THR 73.A OG1 PHE 27.A O no hydrogen 2.836 N/A THR 73.A OG1 THR 73.A O no hydrogen 2.653 N/A ALA 74.A N TYR 122.A O no hydrogen 2.882 N/A LYS 75.A N TYR 122.A O no hydrogen 3.402 N/A LYS 75.A NZ GLY 124.A O no hydrogen 2.967 N/A LYS 75.A NZ ASP 127.A OD2 no hydrogen 2.922 N/A LYS 75.A NZ TYR 141.A OH no hydrogen 2.942 N/A GLY 79.A N HIS 76.A O no hydrogen 2.869 N/A PHE 80.A N ASP 78.A OD1 no hydrogen 2.875 N/A CYS 81.A N TYR 90.A O no hydrogen 2.946 N/A CYS 81.A SG GLY 79.A O no hydrogen 3.760 N/A CYS 81.A SG TYR 144.A OH no hydrogen 3.918 N/A CYS 81.A SG GLN 148.A OE1 no hydrogen 3.714 N/A LEU 82.A N ALA 74.A O no hydrogen 2.932 N/A TRP 83.A NE1 GLU 151.A OE1 no hydrogen 2.928 N/A SER 85.A N TRP 83.A O no hydrogen 2.839 N/A SER 85.A OG GLU 151.A OE1 no hydrogen 2.820 N/A LYS 86.A N GLU 151.A OE2 no hydrogen 2.942 N/A LYS 86.A NZ GLU 151.A OE2 no hydrogen 2.688 N/A TYR 87.A N SER 85.A OG no hydrogen 3.010 N/A TYR 90.A N THR 88.A OG1 no hydrogen 2.937 N/A TYR 90.A OH ALA 43.A O no hydrogen 2.660 N/A VAL 92.A N CYS 81.A O no hydrogen 3.057 N/A LYS 93.A N SER 91.A OG no hydrogen 2.949 N/A LYS 93.A NZ SER 85.A O no hydrogen 3.279 N/A LYS 93.A NZ THR 88.A O no hydrogen 3.317 N/A ASN 94.A N SER 91.A O no hydrogen 2.952 N/A ASN 94.A ND2 ASP 89.A O no hydrogen 2.896 N/A ASN 94.A ND2 ASP 89.A OD1 no hydrogen 3.122 N/A ALA 95.A N VAL 92.A O no hydrogen 3.042 N/A TRP 97.A N PHE 48.A O no hydrogen 3.203 N/A LYS 98.A NZ GLU 107.A OE2 no hydrogen 2.890 N/A ASN 99.A N ALA 96.A O no hydrogen 2.947 N/A GLY 100.A N TRP 97.A O no hydrogen 2.938 N/A LYS 101.A N LYS 98.A O no hydrogen 2.966 N/A LYS 101.A NZ ASN 99.A OD1 no hydrogen 2.749 N/A VAL 104.A N LEU 82.A O no hydrogen 2.948 N/A ARG 106.A N ASP 103.A OD1 no hydrogen 2.881 N/A ARG 106.A NH1 ASP 155.A O no hydrogen 2.929 N/A ARG 106.A NH2 ASP 155.A O no hydrogen 2.928 N/A GLU 107.A N ASP 103.A O no hydrogen 3.179 N/A PHE 108.A N VAL 104.A O no hydrogen 2.863 N/A VAL 109.A N VAL 105.A O no hydrogen 2.892 N/A ASP 110.A N ARG 106.A O no hydrogen 2.871 N/A ALA 111.A N GLU 107.A O no hydrogen 2.918 N/A CYS 112.A N PHE 108.A O no hydrogen 2.882 N/A CYS 112.A SG PHE 108.A O no hydrogen 3.522 N/A GLU 113.A N VAL 109.A O no hydrogen 3.072 N/A GLU 114.A N ASP 110.A O no hydrogen 2.897 N/A TYR 115.A N ALA 111.A O no hydrogen 2.953 N/A TYR 115.A N CYS 112.A O no hydrogen 3.136 N/A GLY 116.A N GLU 113.A O no hydrogen 3.129 N/A LEU 117.A N CYS 112.A O no hydrogen 2.855 N/A LYS 118.A N PRO 68.A O no hydrogen 3.007 N/A LYS 118.A NZ GLU 15.A OE2 no hydrogen 2.828 N/A GLY 120.A N ALA 70.A O no hydrogen 2.614 N/A ILE 121.A N GLU 161.A O no hydrogen 2.879 N/A TYR 122.A N LEU 72.A O no hydrogen 2.918 N/A TYR 122.A OH ASP 165.A OD2 no hydrogen 2.641 N/A GLY 124.A N LYS 75.A O no hydrogen 2.871 N/A ARG 128.A N ALA 77.A O no hydrogen 2.671 N/A ARG 128.A NH1 GLU 38.A OE1 no hydrogen 2.924 N/A ARG 128.A NH1 GLY 39.A O no hydrogen 2.896 N/A ARG 128.A NH2 GLU 38.A OE1 no hydrogen 2.986 N/A HIS 129.A N ASP 127.A OD1 no hydrogen 2.965 N/A HIS 129.A ND1 GLY 41.A O no hydrogen 2.801 N/A GLU 130.A N ASP 127.A OD1 no hydrogen 2.999 N/A HIS 131.A N ASP 127.A O no hydrogen 3.164 N/A LEU 132.A N HIS 129.A O no hydrogen 2.998 N/A SER 133.A N GLU 130.A O no hydrogen 3.109 N/A LEU 135.A N SER 133.A OG no hydrogen 2.970 N/A TYR 136.A N SER 133.A O no hydrogen 3.150 N/A ARG 140.A N THR 137.A OG1 no hydrogen 3.045 N/A TYR 141.A N THR 137.A O no hydrogen 2.838 N/A TYR 141.A OH PRO 125.A O no hydrogen 2.672 N/A LYS 142.A N THR 138.A O no hydrogen 2.799 N/A LYS 142.A NZ GLU 139.A OE1 no hydrogen 3.200 N/A LYS 142.A NZ GLU 139.A OE2 no hydrogen 2.735 N/A GLU 143.A N GLU 139.A O no hydrogen 3.278 N/A TYR 144.A N ARG 140.A O no hydrogen 3.023 N/A TYR 145.A N TYR 141.A O no hydrogen 2.863 N/A TYR 145.A OH LEU 123.A O no hydrogen 2.605 N/A ALA 146.A N LYS 142.A O no hydrogen 3.042 N/A HIS 147.A N GLU 143.A O no hydrogen 2.945 N/A GLN 148.A N TYR 144.A O no hydrogen 3.052 N/A GLN 148.A NE2 SER 85.A OG no hydrogen 3.130 N/A LEU 149.A N TYR 145.A O no hydrogen 2.833 N/A GLY 150.A N ALA 146.A O no hydrogen 2.930 N/A GLU 151.A N HIS 147.A O no hydrogen 3.148 N/A LEU 152.A N GLN 148.A O no hydrogen 2.932 N/A MET 153.A N LEU 149.A O no hydrogen 2.791 N/A SER 154.A N GLU 151.A O no hydrogen 3.338 N/A SER 154.A OG GLY 150.A O no hydrogen 2.574 N/A ASP 155.A N GLU 151.A O no hydrogen 3.003 N/A TYR 156.A OH ASP 103.A OD2 no hydrogen 2.675 N/A LYS 158.A NZ ASP 190.A OD2 no hydrogen 2.767 N/A ILE 159.A N GLN 188.A OE1 no hydrogen 2.968 N/A TRP 160.A N ALA 119.A O no hydrogen 2.825 N/A THR 162.A N VAL 192.A O no hydrogen 2.856 N/A TRP 163.A N ILE 121.A O no hydrogen 2.878 N/A TRP 163.A NE1 GLU 252.A OE2 no hydrogen 2.799 N/A TRP 164.A N PHE 194.A O no hydrogen 2.948 N/A ALA 167.A N ASP 165.A OD1 no hydrogen 2.949 N/A ALA 169.A N GLY 166.A O no hydrogen 2.945 N/A LEU 172.A N ALA 169.A O no hydrogen 3.049 N/A THR 174.A OG1 ASN 198.A O no hydrogen 2.881 N/A TYR 177.A N THR 173.A O no hydrogen 3.309 N/A ARG 178.A N THR 174.A O no hydrogen 2.931 N/A HIS 179.A N PRO 175.A O no hydrogen 3.249 N/A TRP 180.A N VAL 176.A O no hydrogen 3.233 N/A TRP 180.A NE1 LYS 142.A O no hydrogen 3.159 N/A TYR 181.A N TYR 177.A O no hydrogen 2.694 N/A LYS 182.A N ARG 178.A O no hydrogen 2.944 N/A VAL 184.A N TRP 180.A O no hydrogen 3.090 N/A ARG 185.A N TYR 181.A O no hydrogen 2.871 N/A ARG 185.A NH1 CYS 191.A O no hydrogen 3.073 N/A ARG 185.A NH1 ASP 204.A OD2 no hydrogen 3.343 N/A ARG 185.A NH2 GLN 188.A O no hydrogen 3.205 N/A ARG 185.A NH2 CYS 191.A O no hydrogen 2.299 N/A GLU 186.A N LYS 182.A O no hydrogen 3.009 N/A LYS 187.A N ILE 183.A O no hydrogen 3.031 N/A LYS 187.A NZ SER 154.A OG no hydrogen 2.810 N/A GLN 188.A N VAL 184.A O no hydrogen 2.731 N/A GLN 188.A NE2 MET 153.A O no hydrogen 2.831 N/A GLN 188.A NE2 GLY 157.A O no hydrogen 3.063 N/A CYS 191.A N GLN 188.A O no hydrogen 2.877 N/A CYS 191.A SG THR 162.A OG1 no hydrogen 3.267 N/A CYS 191.A SG VAL 192.A O no hydrogen 3.688 N/A VAL 192.A N TRP 160.A O no hydrogen 3.091 N/A ILE 193.A N ASP 204.A OD2 no hydrogen 2.749 N/A PHE 194.A N THR 162.A O no hydrogen 3.009 N/A GLY 195.A N VAL 205.A O no hydrogen 3.200 N/A THR 196.A OG1 TRP 164.A O no hydrogen 2.862 N/A LYS 197.A NZ GLY 166.A O no hydrogen 2.767 N/A LYS 197.A NZ ASP 170.A OD1 no hydrogen 3.034 N/A ASN 198.A ND2 LEU 172.A O no hydrogen 2.744 N/A SER 199.A N THR 196.A O no hydrogen 3.091 N/A SER 199.A OG THR 196.A O no hydrogen 2.667 N/A TYR 200.A N LYS 197.A O no hydrogen 3.091 N/A PHE 202.A N SER 199.A O no hydrogen 2.767 N/A ASP 204.A N ILE 193.A O no hydrogen 2.781 N/A VAL 205.A N ILE 193.A O no hydrogen 3.113 N/A ARG 206.A N PRO 250.A O no hydrogen 2.847 N/A ARG 206.A NE LEU 238.A O no hydrogen 2.911 N/A ARG 206.A NH1 TRP 220.A O no hydrogen 2.968 N/A ARG 206.A NH1 ILE 249.A O no hydrogen 2.881 N/A ARG 206.A NH2 TRP 220.A O no hydrogen 2.935 N/A ARG 206.A NH2 LEU 238.A O no hydrogen 3.111 N/A TRP 207.A NE1 ASP 254.A OD1 no hydrogen 3.018 N/A ASN 210.A ND2 GLU 214.A O no hydrogen 2.914 N/A ASN 210.A ND2 TYR 235.A OH no hydrogen 2.981 N/A ALA 212.A N ASN 210.A OD1 no hydrogen 2.804 N/A GLU 214.A N ASN 210.A OD1 no hydrogen 3.493 N/A ALA 215.A N THR 283.A O no hydrogen 2.904 N/A GLY 216.A N ASN 239.A O no hydrogen 2.901 N/A CYS 219.A SG ASN 239.A O no hydrogen 3.618 N/A TRP 220.A N GLU 240.A O no hydrogen 2.746 N/A ALA 221.A N HIS 390.A NE2 no hydrogen 3.039 N/A THR 222.A OG1 MET 242.A O no hydrogen 2.682 N/A THR 223.A N ALA 247.A O no hydrogen 2.941 N/A THR 223.A OG1 GLY 237.A O no hydrogen 2.604 N/A SER 225.A N ASP 246.A OD1 no hydrogen 2.935 N/A ALA 227.A N ASP 224.A O no hydrogen 2.983 N/A ILE 228.A N SER 225.A O no hydrogen 3.172 N/A ARG 229.A N SER 225.A O no hydrogen 3.281 N/A ARG 229.A NE ASP 230.A OD1 no hydrogen 3.014 N/A ARG 229.A NH1 ASP 230.A OD2 no hydrogen 2.988 N/A ASP 230.A N VAL 226.A O no hydrogen 2.769 N/A GLU 231.A N ILE 228.A O no hydrogen 3.338 N/A GLN 233.A N ASP 230.A O no hydrogen 2.887 N/A TYR 234.A N GLU 231.A O no hydrogen 3.004 N/A LEU 238.A N TYR 234.A O no hydrogen 3.012 N/A LEU 238.A N TYR 235.A O no hydrogen 3.114 N/A ASN 239.A N TYR 235.A O no hydrogen 2.715 N/A ASN 239.A ND2 MET 208.A O no hydrogen 2.891 N/A ASN 239.A ND2 GLU 214.A O no hydrogen 2.855 N/A GLU 240.A N LYS 236.A O no hydrogen 2.749 N/A GLY 241.A N LYS 236.A O no hydrogen 3.277 N/A MET 242.A N THR 222.A O no hydrogen 2.827 N/A GLY 245.A N MET 242.A O no hydrogen 2.964 N/A ASP 246.A N ASP 224.A OD1 no hydrogen 2.902 N/A ALA 247.A N THR 223.A O no hydrogen 2.979 N/A ILE 249.A N ALA 221.A O no hydrogen 2.954 N/A GLU 252.A N ARG 206.A O no hydrogen 2.757 N/A THR 253.A N VAL 290.A O no hydrogen 2.871 N/A THR 253.A OG1 SER 289.A OG no hydrogen 2.876 N/A VAL 255.A N LEU 292.A O no hydrogen 2.952 N/A SER 256.A OG ARG 258.A O no hydrogen 3.455 N/A SER 256.A OG SER 260.A O no hydrogen 2.726 N/A ILE 257.A N ASN 294.A O no hydrogen 3.006 N/A ARG 258.A N SER 256.A OG no hydrogen 3.320 N/A ARG 258.A NE ASP 307.A OD1 no hydrogen 3.415 N/A ARG 258.A NE ASP 307.A OD2 no hydrogen 2.744 N/A ARG 258.A NH1 HIS 264.A O no hydrogen 3.252 N/A ARG 258.A NH1 ASP 268.A OD1 no hydrogen 3.311 N/A ARG 258.A NH2 ASP 268.A OD1 no hydrogen 2.819 N/A ARG 258.A NH2 ASP 307.A OD1 no hydrogen 3.024 N/A SER 260.A N GLU 267.A OE1 no hydrogen 3.132 N/A SER 260.A OG GLU 267.A OE1 no hydrogen 3.568 N/A SER 260.A OG GLU 267.A OE2 no hydrogen 2.591 N/A TRP 261.A NE1 GLU 211.A OE1 no hydrogen 3.145 N/A PHE 262.A N ASN 37.A OD1 no hydrogen 3.401 N/A TYR 263.A OH ASP 268.A OD1 no hydrogen 2.623 N/A TYR 263.A OH ASP 268.A OD2 no hydrogen 3.013 N/A HIS 264.A NE2 ASN 37.A OD1 no hydrogen 2.774 N/A GLU 266.A N GLU 266.A OE1 no hydrogen 2.788 N/A GLU 267.A N HIS 264.A O no hydrogen 2.853 N/A ASP 268.A N ALA 265.A O no hydrogen 3.017 N/A ARG 270.A N GLU 267.A O no hydrogen 2.885 N/A LYS 272.A N ILE 257.A O no hydrogen 2.849 N/A LYS 272.A NZ SER 256.A O no hydrogen 2.723 N/A SER 273.A N GLU 276.A OE2 no hydrogen 2.934 N/A GLU 276.A N SER 273.A OG no hydrogen 3.025 N/A LEU 277.A N SER 273.A O no hydrogen 2.973 N/A TRP 278.A N VAL 274.A O no hydrogen 2.845 N/A TRP 278.A NE1 GLN 455.A OE1 no hydrogen 2.940 N/A ASP 279.A N ARG 275.A O no hydrogen 3.037 N/A ILE 280.A N GLU 276.A O no hydrogen 2.952 N/A TYR 281.A N LEU 277.A O no hydrogen 2.710 N/A CYS 282.A N TRP 278.A O no hydrogen 2.968 N/A CYS 282.A SG TRP 278.A O no hydrogen 3.417 N/A THR 283.A N ASP 279.A O no hydrogen 3.009 N/A THR 283.A N ILE 280.A O no hydrogen 3.029 N/A THR 283.A OG1 GLY 213.A O no hydrogen 2.763 N/A THR 283.A OG1 ASP 279.A O no hydrogen 3.201 N/A THR 283.A OG1 ILE 280.A O no hydrogen 3.253 N/A SER 284.A N TYR 281.A O no hydrogen 3.223 N/A SER 284.A OG ILE 280.A O no hydrogen 2.733 N/A SER 284.A OG TYR 281.A O no hydrogen 3.219 N/A GLY 286.A N TYR 281.A O no hydrogen 3.031 N/A ARG 287.A N SER 284.A O no hydrogen 2.998 N/A ARG 287.A NH1 GLU 214.A OE2.B no hydrogen 3.317 N/A ARG 287.A NH1 ALA 215.A O no hydrogen 2.684 N/A ASN 288.A N LYS 421.A O no hydrogen 3.063 N/A ASN 288.A ND2 CYS 219.A O no hydrogen 2.959 N/A SER 289.A N SER 284.A O no hydrogen 3.086 N/A SER 289.A OG ALA 251.A O no hydrogen 2.620 N/A SER 289.A OG THR 253.A OG1 no hydrogen 2.876 N/A SER 289.A OG VAL 290.A O no hydrogen 3.457 N/A VAL 290.A N SER 289.A OG no hydrogen 2.681 N/A LEU 291.A N GLU 20.A O no hydrogen 3.000 N/A LEU 292.A N THR 253.A O no hydrogen 2.870 N/A LEU 293.A N ILE 22.A O no hydrogen 2.943 N/A ASN 294.A N VAL 255.A O no hydrogen 2.867 N/A ASN 294.A ND2 SER 256.A OG no hydrogen 3.042 N/A ASN 294.A ND2 TRP 261.A O no hydrogen 2.842 N/A PHE 295.A N PHE 24.A O no hydrogen 2.977 N/A ASP 298.A N LEU 302.A O no hydrogen 2.868 N/A ARG 299.A NE THR 31.A O no hydrogen 2.953 N/A ARG 299.A NH1 GLU 34.A OE2.A no hydrogen 3.323 N/A ARG 299.A NH2 GLU 33.A O no hydrogen 2.819 N/A ARG 299.A NH2 GLU 34.A OE2.A no hydrogen 2.915 N/A ARG 300.A NE ASP 298.A OD2 no hydrogen 2.840 N/A ARG 300.A NH2 ASP 298.A OD2 no hydrogen 3.196 N/A GLY 301.A N ASP 298.A O no hydrogen 2.841 N/A LEU 302.A N ASP 298.A OD1 no hydrogen 2.895 N/A ILE 303.A N GLN 57.A OE1 no hydrogen 2.924 N/A SER 308.A N HIS 304.A O no hydrogen 3.029 N/A SER 308.A OG THR 61.A OG1 no hydrogen 2.640 N/A SER 308.A OG HIS 304.A O no hydrogen 3.354 N/A LEU 309.A N SER 305.A O no hydrogen 2.802 N/A HIS 310.A N THR 306.A O no hydrogen 2.956 N/A HIS 310.A ND1 LYS 272.A O no hydrogen 2.601 N/A ALA 311.A N ASP 307.A O no hydrogen 3.262 N/A ALA 312.A N SER 308.A O no hydrogen 2.909 N/A LEU 313.A N LEU 309.A O no hydrogen 2.843 N/A LEU 314.A N HIS 310.A O no hydrogen 2.945 N/A LYS 315.A N ALA 311.A O no hydrogen 3.171 N/A LYS 315.A NZ ASP 319.A OD1 no hydrogen 2.921 N/A GLN 316.A N ALA 312.A O no hydrogen 3.091 N/A GLN 316.A NE2.A GLU 320.A OE2 no hydrogen 2.884 N/A GLY 317.A N LEU 313.A O no hydrogen 2.838 N/A ILE 318.A N LEU 314.A O no hydrogen 2.842 N/A ASP 319.A N LYS 315.A O no hydrogen 2.784 N/A GLU 320.A N GLN 316.A O no hydrogen 2.884 N/A THR 321.A N GLY 317.A O no hydrogen 2.986 N/A THR 321.A OG1 GLY 317.A O no hydrogen 2.794 N/A PHE 322.A N ILE 318.A O no hydrogen 3.061 N/A SER 323.A OG GLU 320.A O no hydrogen 2.930 N/A ASN 325.A ND2 PHE 450.A O no hydrogen 3.000 N/A LEU 326.A N VAL 452.A O no hydrogen 2.918 N/A LEU 327.A N ASN 325.A OD1 no hydrogen 3.006 N/A ARG 328.A N ASN 325.A O no hydrogen 2.895 N/A ARG 328.A NH2 LEU 348.A O no hydrogen 2.989 N/A ALA 330.A N LEU 327.A O no hydrogen 2.999 N/A LYS 331.A N THR 370.A O no hydrogen 2.856 N/A LYS 333.A N ILE 368.A O no hydrogen 3.053 N/A THR 335.A N ASP 366.A O no hydrogen 2.895 N/A THR 335.A OG1 ASP 366.A O no hydrogen 3.516 N/A ASN 336.A ND2 GLU 362.A O no hydrogen 2.898 N/A ASN 336.A ND2 LYS 364.A O no hydrogen 2.812 N/A ARG 338.A N ALA 357.A O no hydrogen 2.817 N/A ARG 338.A NH1 GLY 358.A O no hydrogen 2.945 N/A ARG 338.A NH1 ASP 360.A OD1 no hydrogen 2.832 N/A ARG 338.A NH2 ASP 360.A OD1 no hydrogen 2.828 N/A ARG 338.A NH2 ASP 360.A OD2 no hydrogen 3.563 N/A TYR 342.A N GLY 339.A O no hydrogen 2.813 N/A SER 343.A N ALA 340.A O no hydrogen 3.259 N/A SER 343.A OG ALA 340.A O no hydrogen 3.481 N/A SER 343.A OG GLU 345.A OE1 no hydrogen 3.175 N/A GLU 345.A N GLU 345.A OE1 no hydrogen 2.834 N/A LYS 346.A N SER 343.A O no hydrogen 2.945 N/A LYS 346.A NZ ALA 340.A O no hydrogen 3.151 N/A LYS 346.A NZ SER 343.A OG no hydrogen 3.160 N/A MET 347.A N PRO 344.A O no hydrogen 3.168 N/A LEU 348.A N GLU 345.A O no hydrogen 3.092 N/A ASP 349.A N LYS 346.A O no hydrogen 3.260 N/A GLU 351.A N ASP 349.A OD1 no hydrogen 2.682 N/A THR 354.A OG1 ASP 349.A OD1 no hydrogen 3.154 N/A THR 354.A OG1 ASP 349.A OD2 no hydrogen 2.691 N/A PHE 356.A N ILE 447.A O no hydrogen 2.918 N/A ALA 357.A N TYR 342.A O no hydrogen 3.202 N/A GLY 358.A N PRO 445.A O no hydrogen 3.125 N/A LYS 359.A N ASN 336.A OD1 no hydrogen 2.797 N/A GLU 362.A N LYS 359.A O no hydrogen 2.986 N/A LYS 364.A N GLU 362.A OE1 no hydrogen 3.228 N/A LYS 364.A NZ GLN 439.A O no hydrogen 2.502 N/A ALA 365.A N ILE 438.A O no hydrogen 2.945 N/A ASP 366.A N THR 335.A OG1 no hydrogen 2.880 N/A ILE 367.A N LEU 436.A O no hydrogen 2.857 N/A ILE 368.A N LYS 333.A O no hydrogen 2.850 N/A PHE 369.A N VAL 434.A O no hydrogen 2.734 N/A THR 370.A N LYS 331.A O no hydrogen 2.803 N/A LEU 371.A N LYS 432.A O no hydrogen 3.022 N/A ILE 375.A N ALA 431.A O no hydrogen 2.802 N/A PHE 377.A N VAL 429.A O no hydrogen 2.926 N/A ASP 378.A N TYR 453.A O no hydrogen 2.996 N/A CYS 379.A SG VAL 424.A O no hydrogen 3.587 N/A LEU 380.A N VAL 424.A O no hydrogen 2.842 N/A MET 381.A N GLY 451.A O no hydrogen 3.106 N/A ILE 382.A N TRP 422.A O no hydrogen 3.034 N/A GLU 383.A N THR 449.A O no hydrogen 3.033 N/A GLU 384.A N GLY 419.A O no hydrogen 2.793 N/A VAL 385.A N ALA 446.A O no hydrogen 3.040 N/A GLU 387.A N GLU 387.A OE1 no hydrogen 2.789 N/A LEU 388.A N VAL 385.A O no hydrogen 2.970 N/A GLY 389.A N ILE 386.A O no hydrogen 2.977 N/A ARG 391.A N GLU 384.A OE2 no hydrogen 2.916 N/A ARG 391.A NE CYS 444.A O no hydrogen 2.769 N/A ARG 391.A NH1 CYS 444.A O no hydrogen 3.300 N/A ARG 391.A NH2 ALA 3.A O no hydrogen 2.967 N/A ARG 391.A NH2 LEU 388.A O no hydrogen 3.088 N/A THR 392.A N GLU 384.A OE2 no hydrogen 2.922 N/A THR 393.A N ASP 440.A O no hydrogen 2.779 N/A LYS 394.A N ASP 440.A O no hydrogen 3.054 N/A TRP 395.A N LYS 415.A O no hydrogen 2.874 N/A TRP 395.A NE1 ALA 417.A O no hydrogen 2.971 N/A SER 396.A N ARG 437.A O no hydrogen 2.946 N/A SER 396.A OG GLN 439.A OE1 no hydrogen 2.555 N/A VAL 397.A N ALA 412.A O no hydrogen 2.880 N/A GLU 398.A N ARG 435.A O no hydrogen 2.898 N/A TYR 399.A N ILE 407.A O no hydrogen 3.014 N/A THR 400.A N GLN 433.A O no hydrogen 2.916 N/A THR 400.A OG1 ASN 405.A O no hydrogen 2.781 N/A GLY 403.A N THR 400.A OG1 no hydrogen 2.970 N/A LYS 404.A N ASP 402.A OD1 no hydrogen 2.889 N/A ILE 407.A N TYR 399.A O no hydrogen 2.667 N/A GLU 411.A N GLU 411.A OE1 no hydrogen 2.683 N/A ALA 412.A N ILE 409.A O no hydrogen 2.859 N/A THR 413.A OG1 ILE 409.A O no hydrogen 2.723 N/A ASP 414.A N SER 396.A OG no hydrogen 2.954 N/A LYS 415.A N TRP 395.A O no hydrogen 2.766 N/A LYS 415.A NZ ASP 217.A OD1 no hydrogen 2.701 N/A LYS 415.A NZ ASP 217.A OD2 no hydrogen 3.472 N/A GLY 419.A N GLU 384.A OE1 no hydrogen 2.858 N/A HIS 420.A N ASN 288.A OD1 no hydrogen 2.878 N/A LYS 421.A NZ GLU 20.A OE2 no hydrogen 3.255 N/A LYS 421.A NZ GLU 383.A OE2 no hydrogen 2.965 N/A TRP 422.A N ILE 382.A O no hydrogen 2.920 N/A ILE 423.A N GLY 286.A O no hydrogen 2.993 N/A VAL 424.A N LEU 380.A O no hydrogen 2.732 N/A ARG 425.A NH1 ASP 279.A OD1 no hydrogen 2.719 N/A LEU 426.A N ASP 378.A O no hydrogen 3.120 N/A ALA 427.A N GLU 411.A OE2 no hydrogen 3.046 N/A VAL 429.A N PHE 377.A O no hydrogen 2.844 N/A ALA 431.A N ILE 375.A O no hydrogen 2.719 N/A LYS 432.A N THR 400.A O no hydrogen 2.763 N/A LYS 432.A NZ LEU 371.A O no hydrogen 3.004 N/A GLN 433.A N THR 400.A O no hydrogen 3.102 N/A GLN 433.A NE2 THR 370.A OG1 no hydrogen 2.765 N/A VAL 434.A N PHE 369.A O no hydrogen 2.928 N/A ARG 435.A N GLU 398.A O no hydrogen 2.771 N/A ARG 435.A NE GLU 398.A OE1 no hydrogen 2.812 N/A ARG 435.A NH1 GLU 398.A OE1 no hydrogen 2.748 N/A LEU 436.A N ILE 367.A O no hydrogen 2.724 N/A ARG 437.A N SER 396.A O no hydrogen 2.901 N/A ARG 437.A NE ASP 366.A OD1 no hydrogen 3.029 N/A ARG 437.A NH1 ASP 366.A OD2 no hydrogen 2.953 N/A ILE 438.A N ALA 365.A O no hydrogen 2.627 N/A GLN 439.A N LYS 394.A O no hydrogen 2.897 N/A ASP 440.A N LYS 394.A O no hydrogen 3.382 N/A GLY 441.A N ASP 440.A OD1 no hydrogen 2.880 N/A LYS 442.A N ARG 391.A O no hydrogen 2.817 N/A CYS 444.A SG GLY 358.A O no hydrogen 3.488 N/A ILE 447.A N PHE 356.A O no hydrogen 2.896 N/A HIS 448.A N GLU 383.A O no hydrogen 2.694 N/A HIS 448.A ND1 THR 354.A O no hydrogen 2.750 N/A THR 449.A N GLU 383.A O no hydrogen 3.367 N/A THR 449.A OG1 GLU 383.A OE1 no hydrogen 2.785 N/A PHE 450.A N MET 347.A O no hydrogen 3.048 N/A GLY 451.A N MET 381.A O no hydrogen 3.030 N/A VAL 452.A N ASN 325.A OD1 no hydrogen 3.284 N/A TYR 453.A N CYS 379.A O no hydrogen 2.800 N/A LYS 454.A NZ ASP 378.A OD2 no hydrogen 2.696 N/A LYS 454.A NZ GLN 455.A O no hydrogen 2.742 N/A GLN 455.A N ASP 378.A OD1 no hydrogen 2.745 N/A GLN 455.A NE2 ASP 378.A O no hydrogen 2.843 N/A SER 456.A N THR 321.A OG1 no hydrogen 2.817 N/A SER 456.A OG GLU 320.A OE1 no hydrogen 2.703 N/A VAL 458.A N SER 456.A OG no hydrogen 2.879 N/A PHE 459.A N SER 456.A O no hydrogen 3.004 N/A