Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1i2d_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): HIS 5.A N ASN 281.A OD1 no hydrogen 2.880 N/A HIS 5.A NE2 VAL 77.A O no hydrogen 2.814 N/A GLY 7.A N PRO 4.A O no hydrogen 3.118 N/A LYS 10.A N SER 52.A OG no hydrogen 2.579 N/A LYS 10.A NZ PRO 53.A O no hydrogen 2.721 N/A LYS 10.A NZ GLU 55.A OE2 no hydrogen 2.750 N/A ASP 11.A N LEU 9.A O no hydrogen 2.942 N/A LEU 12.A N LYS 10.A O no hydrogen 2.844 N/A LEU 13.A N MET 47.A O no hydrogen 3.104 N/A ALA 14.A N ASP 11.A OD1 no hydrogen 2.986 N/A ARG 15.A N ASP 11.A O no hydrogen 2.869 N/A ARG 15.A NE ASP 16.A OD1 no hydrogen 2.604 N/A ARG 15.A NH1 GLU 55.A OE1 no hydrogen 3.215 N/A ARG 15.A NH2 ASP 16.A OD1 no hydrogen 3.304 N/A ARG 15.A NH2 ASP 16.A OD2 no hydrogen 2.884 N/A ARG 15.A NH2 ILE 159.A O no hydrogen 2.984 N/A ASP 16.A N LEU 12.A O no hydrogen 3.023 N/A ALA 17.A N ALA 14.A O no hydrogen 3.400 N/A ARG 19.A N ASP 16.A O no hydrogen 3.121 N/A ARG 19.A NH1 GLU 160.A OE2 no hydrogen 3.139 N/A ARG 19.A NH2 ASP 16.A OD1 no hydrogen 3.277 N/A ARG 19.A NH2 GLU 160.A OE2 no hydrogen 2.812 N/A GLN 20.A N ALA 17.A O no hydrogen 3.284 N/A GLN 20.A NE2 VAL 162.A O no hydrogen 2.528 N/A LEU 23.A N ARG 19.A O no hydrogen 2.844 N/A ALA 24.A N GLN 20.A O no hydrogen 2.790 N/A ALA 25.A N ALA 21.A O no hydrogen 2.959 N/A GLU 26.A N GLU 22.A O no hydrogen 2.805 N/A ALA 27.A N LEU 23.A O no hydrogen 2.815 N/A ALA 27.A N ALA 24.A O no hydrogen 2.884 N/A GLU 28.A N ALA 24.A O no hydrogen 3.162 N/A GLU 28.A N ALA 25.A O no hydrogen 3.083 N/A SER 29.A N GLU 26.A O no hydrogen 3.197 N/A SER 29.A OG ALA 25.A O no hydrogen 3.423 N/A VAL 33.A N THR 103.A O no hydrogen 2.690 N/A LEU 35.A N ARG 105.A O no hydrogen 3.081 N/A THR 36.A N GLN 39.A OE1 no hydrogen 2.670 N/A GLN 39.A N THR 36.A OG1 no hydrogen 3.236 N/A GLN 39.A NE2 ASP 85.A O no hydrogen 3.447 N/A GLN 39.A NE2 ASP 85.A OD1 no hydrogen 3.146 N/A LEU 40.A N THR 36.A O no hydrogen 2.968 N/A CYS 41.A N GLU 37.A O no hydrogen 3.082 N/A ASP 42.A N ARG 38.A O no hydrogen 3.118 N/A LEU 43.A N GLN 39.A O no hydrogen 2.759 N/A GLU 44.A N LEU 40.A O no hydrogen 3.115 N/A LEU 45.A N CYS 41.A O no hydrogen 3.185 N/A ILE 46.A N ASP 42.A O no hydrogen 2.887 N/A MET 47.A N LEU 43.A O no hydrogen 2.883 N/A ASN 48.A N GLU 44.A O no hydrogen 3.074 N/A GLY 49.A N ILE 46.A O no hydrogen 3.024 N/A GLY 50.A N ASN 48.A OD1 no hydrogen 2.930 N/A PHE 51.A N LEU 45.A O no hydrogen 3.190 N/A SER 52.A N GLY 49.A O no hydrogen 2.855 N/A SER 52.A OG VAL 8.A O no hydrogen 3.548 N/A SER 52.A OG GLY 49.A O no hydrogen 2.762 N/A MET 58.A N ILE 82.A O no hydrogen 2.869 N/A ASN 59.A ND2 ASP 119.A OD1 no hydrogen 2.809 N/A GLN 60.A N ASP 120.A OD2 no hydrogen 2.799 N/A GLN 60.A NE2 ASP 64.A OD2 no hydrogen 3.008 N/A ASP 62.A N ASN 59.A OD1 no hydrogen 2.975 N/A TYR 63.A N ASN 59.A O no hydrogen 2.657 N/A TYR 63.A OH GLU 129.A OE1 no hydrogen 2.490 N/A ASP 64.A N GLN 60.A O no hydrogen 2.791 N/A ARG 65.A N ALA 61.A O no hydrogen 3.388 N/A VAL 66.A N ASP 62.A O no hydrogen 3.217 N/A VAL 66.A N TYR 63.A O no hydrogen 2.813 N/A CYS 67.A N TYR 63.A O no hydrogen 2.759 N/A CYS 67.A SG GLU 68.A OE2 no hydrogen 3.513 N/A GLU 68.A N ASP 64.A O no hydrogen 3.167 N/A ASP 69.A N ARG 65.A O no hydrogen 2.836 N/A ASN 70.A N VAL 66.A O no hydrogen 3.284 N/A ASN 70.A ND2 TYR 318.A OH no hydrogen 3.369 N/A ARG 71.A N ARG 65.A O no hydrogen 3.155 N/A ARG 71.A NH1 GLY 75.A O no hydrogen 2.960 N/A ARG 71.A NH1 GLU 321.A OE2 no hydrogen 2.579 N/A ARG 71.A NH2 GLU 321.A OE1 no hydrogen 2.645 N/A ARG 71.A NH2 GLU 321.A OE2 no hydrogen 2.921 N/A LEU 72.A N ASN 76.A O no hydrogen 2.806 N/A ALA 73.A N ASP 62.A OD1 no hydrogen 3.118 N/A GLY 75.A N LEU 72.A O no hydrogen 2.514 N/A ASN 76.A N ASP 74.A OD2 no hydrogen 2.904 N/A PHE 78.A N ASN 70.A O no hydrogen 2.946 N/A SER 79.A OG ARG 270.A O no hydrogen 2.913 N/A ALA 86.A N PHE 153.A O no hydrogen 2.648 N/A GLN 88.A NE2 GLN 88.A O no hydrogen 3.639 N/A GLN 88.A NE2 ASP 92.A OD1 no hydrogen 3.030 N/A GLN 88.A NE2 ASP 92.A OD2 no hydrogen 3.489 N/A GLU 89.A N GLU 89.A OE1 no hydrogen 2.623 N/A VAL 90.A N SER 87.A O no hydrogen 2.985 N/A ILE 91.A N SER 87.A O no hydrogen 3.015 N/A ASP 92.A N GLN 88.A O no hydrogen 2.985 N/A GLU 93.A N GLU 89.A O no hydrogen 2.895 N/A LYS 94.A N VAL 90.A O no hydrogen 2.937 N/A LYS 94.A NZ ALA 32.A O no hydrogen 2.894 N/A LYS 95.A N ASP 92.A O no hydrogen 2.795 N/A LEU 96.A N ILE 91.A O no hydrogen 2.812 N/A GLN 97.A N SER 100.A OG no hydrogen 3.355 N/A GLY 99.A N ILE 118.A O no hydrogen 2.842 N/A SER 100.A N GLN 97.A O no hydrogen 2.932 N/A SER 100.A OG GLN 97.A O no hydrogen 2.924 N/A ARG 101.A NE THR 117.A OG1 no hydrogen 3.236 N/A ARG 101.A NH1 GLU 26.A OE2 no hydrogen 2.671 N/A ARG 101.A NH2 THR 117.A OG1 no hydrogen 3.173 N/A ARG 101.A NH2 GLU 160.A OE1 no hydrogen 2.344 N/A ILE 102.A N LEU 116.A O no hydrogen 3.000 N/A THR 103.A N PRO 31.A O no hydrogen 3.106 N/A THR 103.A OG1 ALA 27.A O no hydrogen 2.799 N/A LEU 104.A N ALA 114.A O no hydrogen 2.721 N/A ARG 105.A N VAL 33.A O no hydrogen 2.890 N/A ARG 105.A NE ASN 112.A OD1 no hydrogen 3.204 N/A ARG 105.A NH2 ASN 112.A OD1 no hydrogen 2.987 N/A ASP 106.A N ARG 111.A O no hydrogen 2.854 N/A ARG 108.A N ASP 106.A OD1 no hydrogen 3.125 N/A ARG 108.A NE ASP 106.A OD1 no hydrogen 2.920 N/A ARG 108.A NH1 ASN 166.A O no hydrogen 2.791 N/A ARG 108.A NH1 HIS 167.A ND1 no hydrogen 3.402 N/A ARG 108.A NH2 ASP 106.A OD2 no hydrogen 2.732 N/A ARG 108.A NH2 ASN 166.A O no hydrogen 2.753 N/A ASP 110.A N ASP 106.A O no hydrogen 2.682 N/A ARG 111.A N ASP 109.A OD1 no hydrogen 3.501 N/A ARG 111.A NH2 LYS 164.A O no hydrogen 2.356 N/A LEU 113.A N LEU 104.A O no hydrogen 2.794 N/A ILE 115.A N GLU 160.A O no hydrogen 2.992 N/A LEU 116.A N ILE 102.A O no hydrogen 2.946 N/A THR 117.A N LYS 158.A O no hydrogen 3.093 N/A ILE 118.A N SER 100.A O no hydrogen 2.908 N/A ASP 119.A N GLY 156.A O no hydrogen 2.828 N/A TYR 122.A N TYR 154.A O no hydrogen 3.076 N/A TYR 122.A OH MET 58.A O no hydrogen 2.888 N/A ARG 123.A NE GLU 152.A OE2 no hydrogen 2.687 N/A LYS 126.A NZ LEU 146.A O no hydrogen 3.100 N/A LYS 126.A NZ VAL 150.A O no hydrogen 2.608 N/A LYS 126.A NZ LYS 151.A O no hydrogen 2.399 N/A THR 127.A N ASP 125.A OD1 no hydrogen 3.179 N/A LYS 128.A N ASP 125.A O no hydrogen 2.812 N/A GLU 129.A N ASP 125.A O no hydrogen 3.253 N/A ALA 130.A N LYS 126.A O no hydrogen 3.097 N/A LYS 131.A N THR 127.A O no hydrogen 2.974 N/A LEU 132.A N LYS 128.A O no hydrogen 2.601 N/A VAL 133.A N GLU 129.A O no hydrogen 2.797 N/A GLU 139.A N ASP 137.A OD2 no hydrogen 2.532 N/A HIS 140.A N ASP 137.A O no hydrogen 2.846 N/A HIS 140.A NE2 TYR 306.A OH no hydrogen 2.649 N/A ALA 142.A N HIS 140.A ND1 no hydrogen 3.016 N/A VAL 144.A N HIS 140.A O no hydrogen 2.898 N/A TYR 145.A N PRO 141.A O no hydrogen 2.943 N/A LEU 146.A N ALA 142.A O no hydrogen 2.758 N/A ASN 147.A N ILE 143.A O no hydrogen 3.039 N/A ASN 148.A N VAL 144.A O no hydrogen 2.943 N/A THR 149.A N TYR 145.A O no hydrogen 2.776 N/A VAL 150.A N TYR 145.A O no hydrogen 2.986 N/A LYS 151.A N ASP 85.A OD2 no hydrogen 2.595 N/A PHE 153.A N ALA 86.A O no hydrogen 2.904 N/A TYR 154.A N TYR 122.A O no hydrogen 2.784 N/A TYR 154.A OH GLU 129.A OE1 no hydrogen 2.482 N/A TYR 154.A OH GLU 129.A OE2 no hydrogen 3.289 N/A ILE 155.A N LEU 84.A O no hydrogen 2.766 N/A GLY 157.A N PHE 57.A O no hydrogen 2.852 N/A ILE 159.A N GLU 55.A O no hydrogen 3.073 N/A GLU 160.A N ILE 115.A O no hydrogen 2.913 N/A ALA 161.A N ASP 16.A OD2 no hydrogen 2.632 N/A VAL 162.A N LEU 113.A O no hydrogen 2.631 N/A ASN 163.A N LEU 113.A O no hydrogen 2.712 N/A ASN 163.A ND2 ASN 112.A O no hydrogen 2.647 N/A HIS 167.A NE2 GLU 44.A OE2 no hydrogen 2.940 N/A LEU 173.A N TYR 170.A O no hydrogen 2.963 N/A ARG 174.A N VAL 171.A O no hydrogen 3.359 N/A ARG 174.A NE ASP 169.A O no hydrogen 3.051 N/A ARG 174.A NH2 ASP 169.A OD1 no hydrogen 2.982 N/A ARG 174.A NH2 ASP 169.A OD2 no hydrogen 3.086 N/A THR 176.A N GLU 179.A OE1 no hydrogen 2.727 N/A GLU 179.A N THR 176.A OG1 no hydrogen 2.946 N/A LEU 180.A N THR 176.A O no hydrogen 2.812 N/A ARG 181.A N PRO 177.A O no hydrogen 2.935 N/A ARG 181.A NE ASN 281.A O no hydrogen 3.065 N/A ARG 181.A NH1 ASN 2.A O no hydrogen 2.859 N/A ARG 181.A NH2 ASN 2.A O no hydrogen 2.777 N/A ARG 181.A NH2 ASN 281.A O no hydrogen 3.134 N/A VAL 182.A N ALA 178.A O no hydrogen 3.022 N/A HIS 183.A N GLU 179.A O no hydrogen 2.838 N/A PHE 184.A N LEU 180.A O no hydrogen 2.728 N/A ASP 185.A N ARG 181.A O no hydrogen 3.078 N/A LYS 186.A N VAL 182.A O no hydrogen 2.873 N/A LEU 187.A N HIS 183.A O no hydrogen 2.780 N/A GLY 188.A N ASP 185.A O no hydrogen 2.653 N/A TRP 189.A N PHE 184.A O no hydrogen 2.828 N/A ARG 191.A NH1 GLN 217.A O no hydrogen 3.425 N/A VAL 192.A N THR 285.A OG1 no hydrogen 2.732 N/A VAL 193.A N ASN 219.A O no hydrogen 2.964 N/A ALA 194.A N HIS 286.A O no hydrogen 2.772 N/A PHE 195.A N LEU 221.A O no hydrogen 2.933 N/A THR 197.A OG1 ASN 199.A O no hydrogen 3.264 N/A ARG 198.A NE ASP 233.A OD1 no hydrogen 2.534 N/A ARG 198.A NH2 ASP 233.A OD1 no hydrogen 3.240 N/A ASN 199.A N THR 197.A OG1 no hydrogen 3.143 N/A HIS 202.A N HIS 205.A ND1 no hydrogen 2.967 N/A HIS 202.A ND1 SER 376.A OG no hydrogen 2.427 N/A ARG 203.A N PHE 375.A O no hydrogen 3.079 N/A ARG 206.A N HIS 202.A O no hydrogen 3.162 N/A ARG 206.A NE ARG 249.A O no hydrogen 3.068 N/A ARG 206.A NH1 GLU 207.A OE1 no hydrogen 3.248 N/A ARG 206.A NH2 ARG 249.A O no hydrogen 2.777 N/A GLU 207.A N ARG 203.A O no hydrogen 3.096 N/A LEU 208.A N ALA 204.A O no hydrogen 3.093 N/A THR 209.A N HIS 205.A O no hydrogen 3.095 N/A THR 209.A OG1 HIS 205.A O no hydrogen 3.224 N/A THR 209.A OG1 ARG 206.A O no hydrogen 2.645 N/A THR 209.A OG1 TYR 250.A OH no hydrogen 2.703 N/A VAL 210.A N ARG 206.A O no hydrogen 3.066 N/A ARG 211.A N GLU 207.A O no hydrogen 2.839 N/A ARG 211.A NH2 TYR 341.A O no hydrogen 3.430 N/A ALA 212.A N LEU 208.A O no hydrogen 2.768 N/A ALA 213.A N THR 209.A O no hydrogen 2.983 N/A ARG 214.A N VAL 210.A O no hydrogen 2.941 N/A SER 215.A N ARG 211.A O no hydrogen 2.896 N/A ARG 216.A N ALA 212.A O no hydrogen 2.761 N/A ARG 216.A NE SER 215.A OG no hydrogen 3.133 N/A ARG 216.A NH1 GLU 325.A OE2 no hydrogen 3.098 N/A GLN 217.A N ARG 214.A O no hydrogen 3.349 N/A GLN 217.A NE2 ARG 214.A O no hydrogen 2.782 N/A ALA 218.A N ALA 213.A O no hydrogen 2.833 N/A ASN 219.A N ARG 191.A O no hydrogen 2.988 N/A VAL 220.A N MET 254.A O no hydrogen 2.954 N/A LEU 221.A N VAL 193.A O no hydrogen 2.983 N/A ILE 222.A N VAL 256.A O no hydrogen 2.773 N/A HIS 223.A N PHE 195.A O no hydrogen 3.031 N/A VAL 225.A N THR 197.A O no hydrogen 2.954 N/A VAL 226.A N LEU 260.A O no hydrogen 2.893 N/A LEU 228.A N LEU 262.A O no hydrogen 2.977 N/A ASP 233.A N LYS 230.A O no hydrogen 3.384 N/A HIS 236.A NE2 ASP 169.A OD2 no hydrogen 2.688 N/A THR 238.A N ASP 235.A OD1 no hydrogen 2.850 N/A THR 238.A OG1 ASP 235.A OD1 no hydrogen 3.139 N/A THR 238.A OG1 ASP 235.A OD2 no hydrogen 2.552 N/A THR 238.A OG1 SER 387.A OG no hydrogen 2.784 N/A ARG 239.A N ASP 235.A O no hydrogen 3.095 N/A ARG 239.A NE ILE 234.A O no hydrogen 2.929 N/A ARG 239.A NH1 VAL 225.A O no hydrogen 3.018 N/A ARG 239.A NH1 TYR 243.A OH no hydrogen 3.134 N/A ARG 239.A NH2 VAL 225.A O no hydrogen 3.086 N/A VAL 240.A N HIS 236.A O no hydrogen 2.773 N/A ARG 241.A N PHE 237.A O no hydrogen 3.081 N/A ALA 242.A N THR 238.A O no hydrogen 2.836 N/A TYR 243.A N ARG 239.A O no hydrogen 2.687 N/A TYR 243.A OH ASN 199.A O no hydrogen 2.746 N/A GLN 244.A N VAL 240.A O no hydrogen 2.814 N/A ALA 245.A N ARG 241.A O no hydrogen 3.040 N/A ALA 245.A N ALA 242.A O no hydrogen 2.968 N/A LEU 246.A N ALA 242.A O no hydrogen 3.286 N/A LEU 246.A N TYR 243.A O no hydrogen 3.079 N/A LEU 247.A N TYR 243.A O no hydrogen 3.233 N/A ARG 249.A N LEU 246.A O no hydrogen 2.703 N/A ARG 249.A NH2 GLU 379.A OE2 no hydrogen 2.502 N/A TYR 250.A N LEU 247.A O no hydrogen 2.904 N/A TYR 250.A OH THR 209.A OG1 no hydrogen 2.703 N/A VAL 256.A N VAL 220.A O no hydrogen 2.823 N/A GLY 258.A N ILE 222.A O no hydrogen 2.975 N/A LEU 259.A N LEU 173.A O no hydrogen 2.801 N/A LEU 260.A N PRO 224.A O no hydrogen 3.019 N/A MET 264.A N LEU 228.A O no hydrogen 2.857 N/A ARG 265.A N GLU 271.A OE1 no hydrogen 2.731 N/A ARG 265.A NH1 ASP 42.A OD1 no hydrogen 3.047 N/A ARG 265.A NH1 ASP 42.A OD2 no hydrogen 3.514 N/A ARG 265.A NH1 ALA 263.A O no hydrogen 2.858 N/A ARG 265.A NH2 ASP 42.A OD2 no hydrogen 2.594 N/A MET 266.A N GLU 271.A OE1 no hydrogen 2.643 N/A GLY 267.A N GLU 271.A OE1 no hydrogen 3.107 N/A GLY 268.A N ALA 294.A O no hydrogen 2.962 N/A ARG 270.A NE ASN 70.A OD1 no hydrogen 2.976 N/A ARG 270.A NH2 VAL 66.A O no hydrogen 3.181 N/A ARG 270.A NH2 ASN 70.A OD1 no hydrogen 2.501 N/A GLU 271.A N GLY 267.A O no hydrogen 3.327 N/A ALA 272.A N GLY 268.A O no hydrogen 2.848 N/A ILE 273.A N PRO 269.A O no hydrogen 3.203 N/A TRP 274.A N ARG 270.A O no hydrogen 2.953 N/A HIS 275.A N GLU 271.A O no hydrogen 2.778 N/A HIS 275.A ND1 HIS 293.A NE2 no hydrogen 2.835 N/A HIS 275.A NE2 GLU 271.A OE2 no hydrogen 2.738 N/A ALA 276.A N ALA 272.A O no hydrogen 3.114 N/A ILE 277.A N ILE 273.A O no hydrogen 3.059 N/A ILE 278.A N TRP 274.A O no hydrogen 2.924 N/A ARG 279.A N HIS 275.A O no hydrogen 2.805 N/A ARG 279.A NE HIS 223.A ND1 no hydrogen 2.789 N/A ARG 279.A NH1 GLN 196.A OE1 no hydrogen 2.907 N/A ARG 279.A NH2 GLN 196.A OE1 no hydrogen 2.735 N/A ARG 279.A NH2 HIS 223.A ND1 no hydrogen 3.533 N/A ARG 279.A NH2 HIS 223.A O no hydrogen 2.851 N/A LYS 280.A N ALA 276.A O no hydrogen 2.963 N/A LYS 280.A NZ ASN 2.A OD1 no hydrogen 3.398 N/A LYS 280.A NZ ALA 3.A O no hydrogen 2.478 N/A LYS 280.A NZ GLY 323.A O no hydrogen 2.932 N/A ASN 281.A N ILE 277.A O no hydrogen 2.880 N/A ASN 281.A ND2 GLY 50.A O no hydrogen 2.692 N/A ASN 281.A ND2 SER 52.A O no hydrogen 3.117 N/A HIS 282.A N ILE 278.A O no hydrogen 2.928 N/A HIS 282.A ND1 ILE 278.A O no hydrogen 2.948 N/A GLY 283.A N LYS 280.A O no hydrogen 2.710 N/A ALA 284.A N ARG 279.A O no hydrogen 2.916 N/A THR 285.A N VAL 192.A O no hydrogen 2.934 N/A THR 285.A OG1 VAL 192.A O no hydrogen 3.269 N/A THR 285.A OG1 HIS 286.A ND1 no hydrogen 2.538 N/A HIS 286.A N VAL 192.A O no hydrogen 2.969 N/A HIS 286.A ND1 THR 285.A OG1 no hydrogen 2.538 N/A PHE 287.A N GLU 325.A O no hydrogen 2.935 N/A ILE 288.A N ALA 194.A O no hydrogen 3.182 N/A VAL 289.A N VAL 327.A O no hydrogen 2.995 N/A ARG 291.A NH1 ASP 292.A OD2 no hydrogen 3.440 N/A HIS 293.A NE2 HIS 275.A ND1 no hydrogen 2.835 N/A GLY 295.A N ASP 292.A O no hydrogen 2.889 N/A ASN 299.A N GLU 303.A O no hydrogen 2.617 N/A ASN 299.A ND2 ASP 137.A OD1 no hydrogen 3.073 N/A SER 300.A N GLU 139.A OE1 no hydrogen 2.600 N/A GLY 302.A N ASN 299.A O no hydrogen 3.024 N/A GLU 303.A N ASN 299.A OD1 no hydrogen 3.324 N/A PHE 305.A N GLY 297.A O no hydrogen 3.183 N/A TYR 306.A OH HIS 140.A NE2 no hydrogen 2.649 N/A GLY 307.A N ASP 310.A OD2 no hydrogen 2.894 N/A ASP 310.A N GLY 307.A O no hydrogen 3.366 N/A GLN 312.A N TYR 309.A O no hydrogen 3.121 N/A GLN 312.A NE2 VAL 289.A O no hydrogen 2.999 N/A GLN 312.A NE2 PHE 329.A O no hydrogen 2.911 N/A HIS 313.A N TYR 309.A O no hydrogen 3.318 N/A HIS 313.A N ASP 310.A O no hydrogen 2.841 N/A ALA 314.A N ASP 310.A O no hydrogen 2.901 N/A VAL 315.A N ALA 311.A O no hydrogen 3.104 N/A GLU 316.A N GLN 312.A O no hydrogen 3.166 N/A LYS 317.A N HIS 313.A O no hydrogen 2.831 N/A LYS 319.A N GLU 316.A O no hydrogen 2.734 N/A GLU 321.A N TYR 318.A O no hydrogen 2.755 N/A LEU 322.A N TYR 318.A O no hydrogen 3.061 N/A GLU 325.A N THR 285.A O no hydrogen 3.198 N/A VAL 327.A N PHE 287.A O no hydrogen 3.043 N/A PHE 329.A N VAL 289.A O no hydrogen 3.146 N/A GLN 330.A NE2 GLN 312.A OE1 no hydrogen 3.304 N/A MET 331.A N TYR 309.A OH no hydrogen 2.842 N/A THR 333.A N ARG 342.A O no hydrogen 2.920 N/A TYR 334.A OH ASP 339.A OD1 no hydrogen 2.436 N/A LEU 335.A N GLU 340.A O no hydrogen 2.721 N/A ASP 339.A N LEU 335.A O no hydrogen 2.543 N/A GLU 340.A N LEU 335.A O no hydrogen 3.213 N/A TYR 341.A OH TRP 374.A O no hydrogen 2.499 N/A ARG 342.A N THR 333.A O no hydrogen 3.125 N/A ARG 342.A NH1 GLN 346.A O no hydrogen 3.202 N/A ARG 342.A NH2 GLU 340.A OE2 no hydrogen 2.866 N/A VAL 344.A N MET 331.A O no hydrogen 2.962 N/A GLN 346.A N VAL 344.A O no hydrogen 2.345 N/A GLN 346.A NE2 ASP 345.A OD2 no hydrogen 3.306 N/A VAL 347.A N VAL 344.A O no hydrogen 2.974 N/A ALA 349.A N VAL 347.A O no hydrogen 2.632 N/A GLY 350.A N PRO 348.A O no hydrogen 2.245 N/A LEU 354.A N TYR 334.A O no hydrogen 2.866 N/A GLU 360.A N SER 357.A OG no hydrogen 2.982 N/A LEU 361.A N SER 357.A O no hydrogen 2.995 N/A ARG 362.A N GLY 358.A O no hydrogen 2.989 N/A ARG 362.A NH1 THR 359.A OG1 no hydrogen 3.260 N/A ARG 363.A N THR 359.A O no hydrogen 2.913 N/A ARG 364.A N GLU 360.A O no hydrogen 2.935 N/A ARG 364.A NE GLU 360.A OE2 no hydrogen 2.731 N/A ARG 364.A NH1 HIS 370.A O no hydrogen 3.063 N/A ARG 364.A NH2 GLU 360.A OE2 no hydrogen 2.890 N/A LEU 365.A N LEU 361.A O no hydrogen 2.784 N/A ARG 366.A N ARG 362.A O no hydrogen 2.930 N/A SER 367.A N ARG 363.A O no hydrogen 3.034 N/A SER 367.A OG ARG 363.A O no hydrogen 3.394 N/A SER 367.A OG ARG 364.A O no hydrogen 3.452 N/A ALA 369.A N SER 367.A OG no hydrogen 3.149 N/A PHE 375.A N PRO 372.A O no hydrogen 3.007 N/A SER 376.A N PRO 372.A O no hydrogen 3.363 N/A SER 376.A OG HIS 202.A ND1 no hydrogen 2.427 N/A VAL 380.A N TYR 377.A O no hydrogen 3.056 N/A VAL 381.A N TYR 377.A O no hydrogen 3.070 N/A LYS 382.A N PRO 378.A O no hydrogen 2.984 N/A ILE 383.A N GLU 379.A O no hydrogen 3.285 N/A LEU 384.A N VAL 380.A O no hydrogen 2.995 N/A ARG 385.A N VAL 381.A O no hydrogen 2.938 N/A ARG 385.A NH1 ALA 369.A O no hydrogen 3.405 N/A ARG 385.A NH2 ALA 369.A O no hydrogen 2.794 N/A GLU 386.A N LYS 382.A O no hydrogen 3.137 N/A SER 387.A N ILE 383.A O no hydrogen 3.319 N/A SER 387.A N LEU 384.A O no hydrogen 3.118 N/A SER 387.A OG THR 238.A OG1 no hydrogen 2.784 N/A ASN 388.A N LEU 384.A O no hydrogen 3.012 N/A ASN 388.A ND2 LEU 384.A O no hydrogen 3.128 N/A ARG 391.A N ARG 366.A O no hydrogen 2.924 N/A ARG 391.A NH1 GLN 566.A O no hydrogen 2.643 N/A THR 393.A N PRO 390.A O no hydrogen 2.802 N/A GLN 394.A N ARG 391.A O no hydrogen 3.155 N/A GLN 394.A NE2 PRO 389.A O no hydrogen 3.168 N/A PHE 396.A N ALA 469.A O no hydrogen 2.991 N/A THR 397.A N SER 495.A O no hydrogen 2.938 N/A THR 397.A OG1 THR 465.A OG1 no hydrogen 2.965 N/A ILE 398.A N VAL 471.A O no hydrogen 2.747 N/A PHE 399.A N PHE 497.A O no hydrogen 2.753 N/A LEU 400.A N ALA 473.A O no hydrogen 2.822 N/A THR 401.A N VAL 499.A O no hydrogen 3.089 N/A THR 401.A OG1 ILE 476.A O no hydrogen 2.621 N/A THR 401.A OG1 ALA 477.A O no hydrogen 3.067 N/A THR 401.A OG1 TYR 535.A OH no hydrogen 2.747 N/A GLY 402.A N ILE 476.A O no hydrogen 3.339 N/A ASN 405.A ND2 CYS 508.A O no hydrogen 3.008 N/A SER 406.A N TYR 403.A O no hydrogen 2.968 N/A SER 406.A OG TYR 403.A O no hydrogen 2.731 N/A LYS 408.A NZ ASP 409.A OD1 no hydrogen 3.105 N/A LYS 408.A NZ ALA 474.A O no hydrogen 2.987 N/A ILE 411.A N GLY 407.A O no hydrogen 2.854 N/A ALA 412.A N LYS 408.A O no hydrogen 2.896 N/A ARG 413.A N ASP 409.A O no hydrogen 3.226 N/A ALA 414.A N ALA 410.A O no hydrogen 3.105 N/A LEU 415.A N ILE 411.A O no hydrogen 2.877 N/A GLN 416.A N ALA 412.A O no hydrogen 2.894 N/A VAL 417.A N ARG 413.A O no hydrogen 3.087 N/A THR 418.A N ALA 414.A O no hydrogen 2.834 N/A THR 418.A OG1 ALA 414.A O no hydrogen 2.674 N/A LEU 419.A N LEU 415.A O no hydrogen 2.805 N/A ASN 420.A N GLN 416.A O no hydrogen 2.886 N/A GLN 421.A N VAL 417.A O no hydrogen 2.940 N/A GLN 422.A N THR 418.A O no hydrogen 2.926 N/A GLY 423.A N LEU 419.A O no hydrogen 2.867 N/A SER 428.A N ALA 470.A O no hydrogen 2.878 N/A LEU 430.A N ILE 472.A O no hydrogen 2.622 N/A GLY 432.A N ALA 474.A O no hydrogen 2.837 N/A VAL 435.A N LEU 431.A O no hydrogen 2.927 N/A ARG 436.A N GLY 432.A O no hydrogen 2.893 N/A ARG 436.A NH1 GLY 444.A O no hydrogen 3.110 N/A ARG 436.A NH2 GLY 444.A O no hydrogen 3.534 N/A HIS 437.A N ASP 433.A O no hydrogen 2.838 N/A GLU 438.A N THR 434.A O no hydrogen 2.632 N/A LEU 439.A N VAL 435.A O no hydrogen 2.681 N/A SER 440.A N VAL 435.A O no hydrogen 2.986 N/A SER 441.A OG GLU 442.A OE2 no hydrogen 2.983 N/A LEU 443.A N SER 440.A O no hydrogen 3.180 N/A GLY 444.A N ASP 449.A OD2 no hydrogen 2.541 N/A ARG 447.A NH1 GLU 481.A OE1 no hydrogen 2.755 N/A ASP 449.A N THR 446.A OG1 no hydrogen 3.221 N/A ARG 450.A N THR 446.A O no hydrogen 2.925 N/A ARG 450.A NE PHE 445.A O no hydrogen 2.979 N/A ARG 450.A NH1 THR 529.A OG1 no hydrogen 2.317 N/A HIS 451.A N ARG 447.A O no hydrogen 3.013 N/A HIS 451.A ND1 SER 482.A OG no hydrogen 2.643 N/A THR 452.A N GLU 448.A O no hydrogen 2.824 N/A THR 452.A OG1 GLU 448.A O no hydrogen 3.477 N/A ASN 453.A N ASP 449.A O no hydrogen 3.056 N/A ILE 454.A N ARG 450.A O no hydrogen 2.913 N/A GLN 455.A N HIS 451.A O no hydrogen 3.010 N/A ARG 456.A N THR 452.A O no hydrogen 2.903 N/A ARG 456.A NH1 LEU 439.A O no hydrogen 3.081 N/A ILE 457.A N ASN 453.A O no hydrogen 2.991 N/A ALA 458.A N ILE 454.A O no hydrogen 3.034 N/A PHE 459.A N GLN 455.A O no hydrogen 2.824 N/A VAL 460.A N ARG 456.A O no hydrogen 3.226 N/A ALA 461.A N ILE 457.A O no hydrogen 2.822 N/A THR 462.A N ALA 458.A O no hydrogen 2.960 N/A THR 462.A OG1 ALA 458.A O no hydrogen 2.829 N/A GLU 463.A N PHE 459.A O no hydrogen 3.320 N/A LEU 464.A N VAL 460.A O no hydrogen 3.052 N/A THR 465.A N ALA 461.A O no hydrogen 2.773 N/A THR 465.A OG1 ALA 461.A O no hydrogen 2.706 N/A ARG 466.A N THR 462.A O no hydrogen 2.887 N/A ALA 467.A N GLU 463.A O no hydrogen 3.160 N/A ALA 467.A N LEU 464.A O no hydrogen 3.056 N/A GLY 468.A N THR 465.A O no hydrogen 2.916 N/A ALA 469.A N LEU 464.A O no hydrogen 2.993 N/A ALA 470.A N SER 426.A O no hydrogen 3.055 N/A VAL 471.A N PHE 396.A O no hydrogen 2.933 N/A ILE 472.A N SER 428.A O no hydrogen 2.882 N/A ALA 473.A N ILE 398.A O no hydrogen 3.076 N/A ALA 474.A N LEU 430.A O no hydrogen 2.831 N/A TYR 479.A OH ASP 533.A OD2 no hydrogen 2.855 N/A GLU 480.A N GLU 536.A OE1 no hydrogen 3.052 N/A SER 482.A OG HIS 451.A ND1 no hydrogen 2.643 N/A ARG 483.A N TYR 479.A O no hydrogen 3.285 N/A ARG 483.A NE GLU 480.A OE1 no hydrogen 2.844 N/A ARG 483.A NH1 ALA 477.A O no hydrogen 2.786 N/A ARG 483.A NH1 GLU 536.A O no hydrogen 2.993 N/A ARG 483.A NH2 GLU 480.A OE1 no hydrogen 2.809 N/A ARG 483.A NH2 GLU 536.A O no hydrogen 2.800 N/A LYS 484.A N GLU 480.A O no hydrogen 2.911 N/A LYS 484.A NZ ASP 488.A OD2 no hydrogen 2.754 N/A PHE 485.A N GLU 481.A O no hydrogen 2.993 N/A ALA 486.A N SER 482.A O no hydrogen 2.806 N/A ARG 487.A N ARG 483.A O no hydrogen 2.918 N/A ARG 487.A NH2 ASP 542.A OD2 no hydrogen 2.869 N/A ASP 488.A N LYS 484.A O no hydrogen 2.914 N/A ALA 489.A N PHE 485.A O no hydrogen 3.006 N/A VAL 490.A N ALA 486.A O no hydrogen 3.075 N/A SER 491.A N ARG 487.A O no hydrogen 3.025 N/A SER 491.A OG ARG 487.A O no hydrogen 2.542 N/A GLN 492.A N ALA 489.A O no hydrogen 3.064 N/A ALA 493.A N VAL 490.A O no hydrogen 2.674 N/A GLY 494.A N VAL 490.A O no hydrogen 2.825 N/A PHE 497.A N THR 397.A O no hydrogen 2.961 N/A LEU 498.A N ASP 542.A OD2 no hydrogen 2.652 N/A VAL 499.A N PHE 399.A O no hydrogen 2.764 N/A HIS 500.A N LEU 543.A O no hydrogen 2.848 N/A VAL 501.A N THR 401.A O no hydrogen 2.833 N/A ALA 502.A N VAL 545.A O no hydrogen 2.760 N/A THR 503.A OG1 SER 406.A O no hydrogen 2.757 N/A THR 503.A OG1 ASP 546.A OD1 no hydrogen 3.380 N/A GLU 506.A N GLU 506.A OE1 no hydrogen 2.355 N/A CYS 508.A N PRO 504.A O no hydrogen 3.187 N/A CYS 508.A SG ASN 405.A O no hydrogen 3.712 N/A CYS 508.A SG THR 503.A O no hydrogen 3.689 N/A CYS 508.A SG PRO 504.A O no hydrogen 3.514 N/A GLU 509.A N LEU 505.A O no hydrogen 2.824 N/A GLN 510.A N GLU 506.A O no hydrogen 2.713 N/A SER 511.A N HIS 507.A O no hydrogen 3.085 N/A SER 511.A N CYS 508.A O no hydrogen 3.251 N/A SER 511.A OG HIS 507.A O no hydrogen 2.827 N/A SER 511.A OG CYS 508.A O no hydrogen 3.448 N/A ASP 512.A N GLU 509.A O no hydrogen 3.417 N/A ARG 514.A N ASP 512.A OD1 no hydrogen 2.905 N/A ILE 516.A N ASP 512.A OD2 no hydrogen 2.575 N/A TYR 517.A N ASP 512.A OD2 no hydrogen 2.829 N/A TYR 517.A OH MET 404.A O no hydrogen 2.593 N/A ALA 519.A N GLY 515.A O no hydrogen 3.270 N/A ALA 520.A N ILE 516.A O no hydrogen 2.948 N/A ARG 521.A N TYR 517.A O no hydrogen 2.880 N/A ARG 521.A NH1 GLU 509.A OE2 no hydrogen 2.870 N/A ARG 522.A N ALA 518.A O no hydrogen 2.951 N/A ARG 522.A NE GLU 524.A OE1 no hydrogen 2.430 N/A GLY 523.A N ALA 520.A O no hydrogen 2.713 N/A GLU 524.A N ALA 519.A O no hydrogen 2.678 N/A GLY 530.A N ASP 533.A O no hydrogen 3.011 N/A VAL 531.A N PHE 528.A O no hydrogen 2.865 N/A ASP 532.A N PHE 528.A O no hydrogen 2.865 N/A TYR 535.A OH THR 401.A OG1 no hydrogen 2.747 N/A GLU 536.A N PRO 478.A O no hydrogen 2.685 N/A GLU 539.A N GLU 480.A OE2 no hydrogen 3.144 N/A ASP 542.A N LEU 498.A O no hydrogen 2.872 N/A LEU 543.A N LEU 498.A O no hydrogen 3.345 N/A VAL 545.A N HIS 500.A O no hydrogen 3.024 N/A ASP 546.A N GLN 550.A OE1 no hydrogen 2.784 N/A PHE 547.A N THR 503.A OG1 no hydrogen 2.762 N/A SER 548.A N ASP 546.A OD1 no hydrogen 2.994 N/A SER 548.A OG HIS 507.A ND1 no hydrogen 2.973 N/A SER 548.A OG ASP 546.A OD1 no hydrogen 3.149 N/A LYS 549.A N ASP 546.A O no hydrogen 3.040 N/A GLN 550.A N ASP 546.A O no hydrogen 2.661 N/A GLN 550.A NE2 GLU 558.A OE1 no hydrogen 3.414 N/A SER 551.A N SER 554.A OG no hydrogen 3.372 N/A SER 551.A OG SER 554.A OG no hydrogen 3.375 N/A SER 554.A N SER 551.A OG no hydrogen 3.322 N/A SER 554.A OG SER 551.A O no hydrogen 3.207 N/A SER 554.A OG SER 551.A OG no hydrogen 3.375 N/A ILE 555.A N SER 551.A O no hydrogen 2.866 N/A VAL 556.A N VAL 552.A O no hydrogen 2.828 N/A HIS 557.A N ARG 553.A O no hydrogen 3.006 N/A GLU 558.A N SER 554.A O no hydrogen 2.815 N/A ILE 559.A N ILE 555.A O no hydrogen 3.012 N/A ILE 560.A N VAL 556.A O no hydrogen 2.987 N/A LEU 561.A N HIS 557.A O no hydrogen 3.085 N/A VAL 562.A N GLU 558.A O no hydrogen 3.294 N/A VAL 562.A N ILE 559.A O no hydrogen 2.797 N/A LEU 563.A N ILE 559.A O no hydrogen 3.057 N/A GLU 564.A N ILE 560.A O no hydrogen 2.873 N/A SER 565.A N LEU 561.A O no hydrogen 2.969 N/A SER 565.A OG VAL 562.A O no hydrogen 2.728 N/A GLN 566.A N VAL 562.A O no hydrogen 3.195 N/A GLY 567.A N GLU 564.A O no hydrogen 2.934 N/A PHE 568.A N LEU 563.A O no hydrogen 3.139 N/A ARG 571.A N GLU 570.A OE1 no hydrogen 3.307 N/A ARG 571.A NH1 GLU 570.A O no hydrogen 3.299 N/A GLN 572.A NE2 GLY 424.A O no hydrogen 3.527 N/A