Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 2wmk_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LYS 3.A NZ TYR 163.A OH no hydrogen 3.008 N/A LYS 3.A NZ LYS 196.A O no hydrogen 2.884 N/A ARG 4.A N GLY 161.A O no hydrogen 2.776 N/A ARG 4.A NE ASN 160.A O no hydrogen 2.791 N/A ARG 4.A NH1 TYR 124.A O no hydrogen 3.175 N/A ARG 4.A NH1 TYR 127.A O no hydrogen 2.913 N/A ARG 4.A NH1 LEU 130.A O no hydrogen 2.990 N/A ARG 4.A NH2 TYR 124.A O no hydrogen 2.989 N/A ARG 4.A NH2 ASN 160.A O no hydrogen 3.232 N/A ARG 5.A NH1 PRO 51.A O no hydrogen 3.511 N/A ILE 7.A N GLU 6.A OE2 no hydrogen 3.010 N/A ASN 8.A N HIS 11.A O no hydrogen 3.063 N/A ASN 9.A ND2 ALA 321.A O no hydrogen 2.983 N/A GLU 10.A N ASN 8.A OD1 no hydrogen 2.990 N/A HIS 11.A N ASN 8.A O no hydrogen 2.966 N/A HIS 11.A N ASN 8.A OD1 no hydrogen 2.850 N/A HIS 11.A ND1 ASN 8.A OD1 no hydrogen 3.239 N/A LEU 13.A N VAL 284.A O no hydrogen 2.853 N/A LEU 14.A N TYR 52.A O no hydrogen 2.802 N/A MET 15.A N TYR 286.A O no hydrogen 2.887 N/A MET 16.A N VAL 54.A O no hydrogen 2.898 N/A LEU 18.A N GLN 56.A O no hydrogen 2.862 N/A ALA 20.A N HIS 58.A O no hydrogen 2.953 N/A ASN 21.A N THR 31.A O no hydrogen 2.885 N/A GLY 22.A N ASP 61.A OD1 no hydrogen 2.865 N/A GLU 24.A N ASN 21.A OD1 no hydrogen 3.002 N/A PHE 25.A N ASN 21.A O no hydrogen 3.037 N/A ASN 26.A N GLY 22.A O no hydrogen 3.051 N/A GLY 28.A N PHE 25.A O no hydrogen 2.933 N/A LYS 29.A N GLU 24.A O no hydrogen 2.944 N/A TYR 30.A OH ASP 71.A OD1 no hydrogen 2.478 N/A THR 31.A OG1 GLU 24.A OE1 no hydrogen 2.683 N/A TRP 33.A N TYR 19.A O no hydrogen 2.867 N/A TRP 33.A NE1 ASP 61.A OD1 no hydrogen 2.929 N/A GLY 35.A N PHE 32.A O no hydrogen 3.069 N/A THR 37.A N ASN 299.A OD1 no hydrogen 2.842 N/A THR 39.A N GLU 79.A OE2 no hydrogen 3.031 N/A THR 39.A OG1 GLU 79.A OE2 no hydrogen 2.638 N/A GLY 40.A N THR 37.A OG1 no hydrogen 2.999 N/A LYS 41.A N THR 37.A O no hydrogen 2.900 N/A LYS 41.A NZ ASP 36.A OD2 no hydrogen 2.599 N/A TRP 42.A N LEU 38.A O no hydrogen 3.117 N/A GLU 43.A N THR 39.A O no hydrogen 2.936 N/A ASN 44.A N GLY 40.A O no hydrogen 3.004 N/A ASN 44.A N LYS 41.A O no hydrogen 3.157 N/A ILE 45.A N TRP 42.A O no hydrogen 3.092 N/A LEU 49.A N PRO 46.A O no hydrogen 2.900 N/A LYS 50.A N PRO 46.A O no hydrogen 3.173 N/A LYS 50.A N ASP 47.A O no hydrogen 3.360 N/A LYS 50.A NZ TRP 42.A O no hydrogen 2.961 N/A LYS 50.A NZ GLU 43.A O no hydrogen 3.284 N/A LYS 50.A NZ ILE 45.A O no hydrogen 2.647 N/A TYR 52.A N LEU 49.A O no hydrogen 2.922 N/A THR 53.A N LYS 50.A O no hydrogen 3.471 N/A THR 53.A OG1 LEU 49.A O no hydrogen 3.021 N/A VAL 54.A N LEU 14.A O no hydrogen 3.163 N/A ILE 55.A N PRO 95.A O no hydrogen 3.111 N/A GLN 56.A N MET 16.A O no hydrogen 2.822 N/A GLN 56.A NE2 THR 99.A OG1 no hydrogen 3.148 N/A LEU 57.A N ILE 97.A O no hydrogen 2.910 N/A HIS 58.A N LEU 18.A O no hydrogen 2.869 N/A ASP 60.A N HIS 58.A ND1 no hydrogen 2.899 N/A LEU 62.A N PRO 59.A O no hydrogen 2.878 N/A LYS 64.A NZ TYR 108.A O no hydrogen 3.157 N/A ARG 65.A N PRO 63.A O no hydrogen 2.976 N/A ARG 70.A NH1 ASP 66.A OD1 no hydrogen 2.944 N/A ARG 70.A NH1 TRP 114.A O no hydrogen 3.049 N/A ARG 70.A NH2 ASP 66.A OD2 no hydrogen 2.828 N/A ASP 71.A N GLY 67.A O no hydrogen 2.884 N/A PHE 72.A N ALA 68.A O no hydrogen 3.035 N/A TYR 73.A N ALA 69.A O no hydrogen 2.886 N/A TYR 73.A OH LEU 57.A O no hydrogen 3.321 N/A TYR 73.A OH THR 99.A O no hydrogen 2.583 N/A GLU 74.A N ARG 70.A O no hydrogen 2.856 N/A HIS 75.A N ASP 71.A O no hydrogen 2.977 N/A MET 76.A N PHE 72.A O no hydrogen 3.019 N/A LEU 77.A N TYR 73.A O no hydrogen 2.819 N/A GLU 78.A N GLU 74.A O no hydrogen 2.995 N/A GLU 79.A N HIS 75.A O no hydrogen 3.129 N/A ALA 80.A N MET 76.A O no hydrogen 2.871 N/A ALA 81.A N LEU 77.A O no hydrogen 2.877 N/A LYS 82.A N GLU 78.A O no hydrogen 3.000 N/A LYS 82.A NZ GLU 78.A OE1 no hydrogen 3.540 N/A TYR 83.A N ALA 80.A O no hydrogen 3.466 N/A TYR 83.A OH GLU 43.A OE2 no hydrogen 3.067 N/A ASN 85.A N LYS 90.A O no hydrogen 2.796 N/A ASN 85.A ND2 GLU 92.A OE1 no hydrogen 2.756 N/A LYS 87.A NZ ASP 47.A OD2 no hydrogen 3.437 N/A GLU 92.A N TYR 83.A O no hydrogen 2.889 N/A ILE 94.A N ALA 80.A O no hydrogen 2.909 N/A VAL 96.A N ASN 129.A O no hydrogen 2.820 N/A ILE 97.A N ILE 55.A O no hydrogen 2.723 N/A LEU 98.A N GLY 132.A O no hydrogen 3.253 N/A THR 99.A N LEU 57.A O no hydrogen 2.989 N/A THR 99.A OG1 LEU 57.A O no hydrogen 2.769 N/A VAL 100.A N PHE 134.A O no hydrogen 2.799 N/A THR 102.A OG1 THR 136.A O no hydrogen 2.714 N/A GLY 104.A N ASN 138.A OD1 no hydrogen 2.929 N/A ASN 105.A N THR 102.A O no hydrogen 2.785 N/A ASN 105.A ND2 THR 102.A O no hydrogen 3.298 N/A MET 106.A N ALA 103.A O no hydrogen 3.275 N/A TYR 109.A N MET 106.A O no hydrogen 2.867 N/A THR 110.A N MET 106.A O no hydrogen 3.085 N/A ALA 112.A N THR 110.A OG1 no hydrogen 3.024 N/A HIS 113.A N THR 110.A O no hydrogen 3.266 N/A TRP 114.A N SER 111.A O no hydrogen 3.198 N/A LEU 115.A N ALA 112.A O no hydrogen 3.209 N/A TRP 119.A N SER 116.A OG no hydrogen 2.826 N/A TRP 119.A NE1 GLU 74.A OE2 no hydrogen 2.832 N/A ILE 120.A N SER 116.A O no hydrogen 2.959 N/A ASP 121.A N THR 117.A O no hydrogen 2.844 N/A LYS 122.A N SER 118.A O no hydrogen 3.060 N/A MET 123.A N TRP 119.A O no hydrogen 2.913 N/A TYR 124.A N ILE 120.A O no hydrogen 2.899 N/A TYR 124.A OH SER 157.A OG no hydrogen 2.734 N/A GLN 125.A N ASP 121.A O no hydrogen 2.984 N/A GLN 125.A NE2 ASP 121.A OD1 no hydrogen 3.113 N/A LYS 126.A N LYS 122.A O no hydrogen 2.960 N/A TYR 127.A N MET 123.A O no hydrogen 2.901 N/A TYR 127.A OH GLU 78.A OE2 no hydrogen 2.481 N/A ASN 129.A ND2 ILE 94.A O no hydrogen 2.884 N/A LEU 130.A N TYR 127.A O no hydrogen 2.995 N/A HIS 131.A N VAL 96.A O no hydrogen 2.911 N/A ILE 133.A N TYR 163.A O no hydrogen 2.889 N/A PHE 134.A N LEU 98.A O no hydrogen 2.805 N/A SER 135.A N ILE 165.A O no hydrogen 2.816 N/A SER 135.A OG TYR 101.A O no hydrogen 3.561 N/A THR 136.A N TYR 101.A O no hydrogen 2.997 N/A ALA 137.A N ALA 167.A O no hydrogen 2.997 N/A ASN 138.A N GLU 168.A OE1 no hydrogen 2.882 N/A ASN 138.A N GLU 168.A OE2 no hydrogen 3.090 N/A ASN 138.A ND2 SER 135.A OG no hydrogen 2.955 N/A ASN 138.A ND2 GLU 168.A OE1 no hydrogen 3.148 N/A TYR 139.A N GLU 168.A OE2 no hydrogen 2.815 N/A ILE 141.A N ASN 138.A O no hydrogen 2.856 N/A TRP 142.A NE1 GLU 147.A OE2 no hydrogen 2.932 N/A ILE 146.A N ALA 143.A O no hydrogen 3.071 N/A GLU 147.A N GLU 147.A OE1 no hydrogen 2.854 N/A LYS 149.A N ASP 145.A O no hydrogen 3.009 N/A ALA 150.A N ILE 146.A O no hydrogen 2.941 N/A ALA 151.A N GLU 147.A O no hydrogen 3.048 N/A ASP 152.A N ASN 148.A O no hydrogen 3.152 N/A TYR 153.A N LYS 149.A O no hydrogen 2.904 N/A LEU 154.A N ALA 150.A O no hydrogen 2.872 N/A LYS 155.A N ALA 151.A O no hydrogen 2.897 N/A VAL 156.A N ASP 152.A O no hydrogen 2.943 N/A SER 157.A N TYR 153.A O no hydrogen 3.103 N/A SER 157.A OG TYR 124.A OH no hydrogen 2.734 N/A SER 157.A OG TYR 153.A O no hydrogen 2.978 N/A ALA 158.A N LEU 154.A O no hydrogen 2.908 N/A LYS 159.A N LYS 155.A O no hydrogen 2.785 N/A LYS 159.A NZ ASP 121.A OD1 no hydrogen 3.325 N/A LYS 159.A NZ ASP 121.A OD2 no hydrogen 2.690 N/A ASN 160.A N SER 157.A O no hydrogen 2.968 N/A GLY 161.A N ALA 158.A O no hydrogen 3.240 N/A GLY 162.A N SER 157.A O no hydrogen 2.904 N/A TYR 163.A N HIS 131.A O no hydrogen 3.042 N/A TYR 163.A OH ARG 5.A O no hydrogen 2.910 N/A PHE 164.A N ASN 197.A O no hydrogen 2.894 N/A ILE 165.A N ILE 133.A O no hydrogen 2.822 N/A TRP 166.A N ILE 199.A O no hydrogen 2.985 N/A TRP 166.A NE1 GLU 168.A OE1 no hydrogen 2.991 N/A ALA 167.A N SER 135.A O no hydrogen 2.853 N/A GLU 168.A N MET 201.A O no hydrogen 2.878 N/A GLN 169.A N GLU 168.A OE2 no hydrogen 3.314 N/A ASN 170.A N THR 215.A OG1 no hydrogen 2.833 N/A ASN 170.A ND2 GLU 176.A OE2 no hydrogen 3.065 N/A ASN 171.A N GLN 169.A O no hydrogen 2.745 N/A ASN 171.A ND2 GLU 209.A OE1 no hydrogen 3.073 N/A SER 173.A OG GLU 176.A OE1 no hydrogen 3.372 N/A ALA 174.A N ASN 171.A O no hydrogen 3.117 N/A ILE 175.A N ASN 170.A OD1 no hydrogen 2.947 N/A LYS 177.A N SER 173.A O no hydrogen 2.949 N/A LYS 177.A NZ GLY 172.A O no hydrogen 2.810 N/A ALA 178.A N ALA 174.A O no hydrogen 2.945 N/A PHE 179.A N GLU 176.A O no hydrogen 3.201 N/A GLY 180.A N GLU 176.A O no hydrogen 3.247 N/A GLY 180.A N LYS 177.A O no hydrogen 2.947 N/A LYS 181.A N GLU 176.A O no hydrogen 3.124 N/A GLY 183.A N GLY 180.A O no hydrogen 2.869 N/A LYS 189.A N ILE 185.A O no hydrogen 3.064 N/A SER 190.A N ALA 186.A O no hydrogen 2.943 N/A SER 190.A OG ALA 151.A O no hydrogen 3.362 N/A VAL 191.A N PHE 187.A O no hydrogen 2.904 N/A ASP 192.A N GLN 188.A O no hydrogen 3.113 N/A LYS 193.A N SER 190.A O no hydrogen 2.963 N/A LYS 193.A NZ LYS 189.A O no hydrogen 3.290 N/A TYR 194.A N SER 190.A O no hydrogen 2.769 N/A TRP 195.A N VAL 191.A O no hydrogen 3.021 N/A ASN 197.A N TYR 194.A O no hydrogen 2.871 N/A LEU 198.A N TRP 195.A O no hydrogen 3.064 N/A ILE 199.A N PHE 164.A O no hydrogen 2.950 N/A PHE 200.A N GLN 230.A O no hydrogen 3.342 N/A MET 201.A N TRP 166.A O no hydrogen 2.827 N/A PHE 202.A N GLY 232.A O no hydrogen 3.072 N/A LYS 203.A N GLN 169.A OE1 no hydrogen 2.941 N/A LYS 203.A NZ THR 205.A OG1 no hydrogen 2.667 N/A LYS 203.A NZ GLU 289.A OE2 no hydrogen 3.049 N/A ASN 204.A N LEU 234.A O no hydrogen 3.051 N/A ASN 204.A ND2 GLU 274.A OE1 no hydrogen 3.015 N/A THR 205.A OG1 ASP 236.A OD2 no hydrogen 2.424 N/A ALA 207.A N THR 205.A O no hydrogen 2.791 N/A GLU 209.A N PRO 206.A O no hydrogen 3.171 N/A GLY 210.A N ALA 207.A O no hydrogen 3.233 N/A THR 214.A OG1 ASN 211.A O no hydrogen 3.425 N/A THR 215.A N ASN 211.A O no hydrogen 3.028 N/A THR 215.A OG1 ASN 211.A O no hydrogen 2.649 N/A GLU 216.A N ASP 212.A O no hydrogen 2.977 N/A SER 217.A N SER 213.A O no hydrogen 2.897 N/A SER 217.A OG TYR 339.A OH no hydrogen 2.697 N/A SER 217.A OG ILE 369.A O no hydrogen 2.557 N/A TYR 218.A N THR 214.A O no hydrogen 3.082 N/A TYR 218.A OH GLU 176.A OE2 no hydrogen 3.264 N/A TYR 218.A OH GLY 337.A O no hydrogen 2.858 N/A MET 219.A N THR 215.A O no hydrogen 2.909 N/A LYS 220.A N GLU 216.A O no hydrogen 2.929 N/A LYS 220.A NZ VAL 368.A O no hydrogen 2.669 N/A GLY 221.A N SER 217.A O no hydrogen 2.914 N/A LEU 222.A N TYR 218.A O no hydrogen 2.781 N/A TRP 223.A N MET 219.A O no hydrogen 3.165 N/A LEU 224.A N LYS 220.A O no hydrogen 3.004 N/A SER 225.A N GLY 221.A O no hydrogen 2.972 N/A SER 225.A OG GLY 221.A O no hydrogen 2.789 N/A SER 225.A OG LEU 222.A O no hydrogen 3.406 N/A ASN 226.A N TRP 223.A O no hydrogen 3.100 N/A HIS 227.A N LEU 222.A O no hydrogen 2.749 N/A THR 228.A OG1 LEU 198.A O no hydrogen 3.025 N/A THR 228.A OG1 GLN 230.A O no hydrogen 2.951 N/A TYR 229.A N LEU 198.A O no hydrogen 2.848 N/A TYR 229.A OH GLU 6.A OE1 no hydrogen 3.366 N/A TYR 229.A OH GLU 6.A OE2 no hydrogen 2.492 N/A GLY 232.A N PHE 200.A O no hydrogen 3.080 N/A GLY 233.A N VAL 285.A O no hydrogen 3.021 N/A LEU 234.A N PHE 202.A O no hydrogen 2.763 N/A MET 235.A N ASN 287.A O no hydrogen 3.040 N/A ASP 236.A N ASN 204.A OD1 no hydrogen 2.909 N/A THR 237.A N GLU 289.A O no hydrogen 2.846 N/A THR 237.A OG1 TRP 263.A O no hydrogen 2.675 N/A THR 237.A OG1 GLU 289.A O no hydrogen 3.568 N/A TRP 238.A N ASP 236.A OD1 no hydrogen 2.827 N/A LYS 239.A N ASP 236.A O no hydrogen 3.067 N/A LYS 239.A NZ ASN 204.A OD1 no hydrogen 3.547 N/A LYS 239.A NZ ASP 236.A O no hydrogen 2.735 N/A LYS 239.A NZ GLU 266.A OE1 no hydrogen 3.071 N/A LYS 239.A NZ GLU 274.A OE1 no hydrogen 2.851 N/A LYS 239.A NZ GLU 274.A OE2 no hydrogen 2.962 N/A TRP 240.A N THR 237.A O no hydrogen 3.225 N/A TRP 240.A NE1 TRP 246.A O no hydrogen 2.903 N/A GLU 242.A N TRP 238.A O no hydrogen 2.961 N/A THR 243.A N LYS 239.A O no hydrogen 3.031 N/A THR 243.A OG1 LYS 239.A O no hydrogen 3.050 N/A GLY 244.A N TYR 241.A O no hydrogen 3.008 N/A LYS 245.A N TRP 240.A O no hydrogen 3.034 N/A LYS 245.A NZ THR 243.A OG1 no hydrogen 3.199 N/A TRP 246.A NE1 SER 251.A O no hydrogen 3.095 N/A ALA 250.A N LYS 247.A O no hydrogen 3.121 N/A ASN 253.A ND2 THR 243.A O no hydrogen 2.977 N/A ILE 254.A N GLY 244.A O no hydrogen 2.853 N/A GLY 255.A N ASN 253.A OD1 no hydrogen 2.866 N/A LYS 256.A NZ GLU 242.A OE1 no hydrogen 2.663 N/A SER 257.A N GLY 255.A O no hydrogen 3.025 N/A SER 257.A OG ILE 254.A O no hydrogen 2.711 N/A GLN 258.A N GLN 262.A OE1 no hydrogen 2.874 N/A GLN 258.A NE2 LYS 489.A O no hydrogen 2.991 N/A GLN 258.A NE2 LEU 491.A O no hydrogen 3.064 N/A ARG 261.A NE LEU 478.A O no hydrogen 3.099 N/A ARG 261.A NH1 GLN 258.A OE1 no hydrogen 2.560 N/A ARG 261.A NH1 PRO 492.A O no hydrogen 2.348 N/A ARG 261.A NH2 PRO 492.A O no hydrogen 2.821 N/A GLN 262.A N GLN 258.A O no hydrogen 2.864 N/A GLN 262.A NE2 TRP 240.A O no hydrogen 3.679 N/A GLN 262.A NE2 LYS 245.A O no hydrogen 2.933 N/A GLN 262.A NE2 GLY 255.A O no hydrogen 3.075 N/A TRP 263.A N GLY 259.A O no hydrogen 2.960 N/A TRP 263.A NE1 ASP 260.A OD1 no hydrogen 2.797 N/A LEU 264.A N ARG 261.A O no hydrogen 3.283 N/A THR 265.A N GLN 262.A O no hydrogen 3.128 N/A THR 265.A OG1 ARG 261.A O no hydrogen 2.970 N/A GLU 268.A N GLU 268.A OE1 no hydrogen 2.801 N/A SER 269.A N PHE 471.A O no hydrogen 2.965 N/A SER 269.A OG HIS 452.A O no hydrogen 2.629 N/A SER 269.A OG PHE 471.A O no hydrogen 3.351 N/A MET 270.A N PRO 267.A O no hydrogen 3.002 N/A LEU 271.A N GLU 268.A O no hydrogen 3.174 N/A GLU 273.A N SER 269.A O no hydrogen 3.265 N/A GLU 274.A N MET 270.A O no hydrogen 2.976 N/A ALA 275.A N LEU 271.A O no hydrogen 2.876 N/A LEU 276.A N GLY 272.A O no hydrogen 3.001 N/A GLY 277.A N GLU 274.A O no hydrogen 3.133 N/A TYR 279.A N ALA 275.A O no hydrogen 3.051 N/A TYR 279.A OH HIS 319.A O no hydrogen 2.665 N/A LEU 280.A N LEU 276.A O no hydrogen 2.787 N/A ASN 281.A N VAL 278.A O no hydrogen 3.189 N/A GLY 282.A N TYR 279.A O no hydrogen 3.136 N/A GLY 283.A N VAL 278.A O no hydrogen 2.866 N/A VAL 284.A N TRP 231.A O no hydrogen 2.919 N/A TYR 286.A N LEU 13.A O no hydrogen 3.011 N/A ASN 287.A N GLY 233.A O no hydrogen 3.176 N/A ASN 287.A ND2 GLN 56.A OE1 no hydrogen 2.762 N/A PHE 288.A N ASN 287.A OD1 no hydrogen 2.814 N/A GLU 289.A N MET 235.A O no hydrogen 3.125 N/A HIS 290.A N THR 237.A OG1 no hydrogen 3.245 N/A ALA 292.A N HIS 290.A ND1 no hydrogen 3.057 N/A TYR 293.A N HIS 290.A O no hydrogen 3.234 N/A TYR 293.A OH GLU 266.A O no hydrogen 2.585 N/A THR 294.A N HIS 290.A O no hydrogen 3.043 N/A THR 294.A OG1 HIS 290.A O no hydrogen 2.916 N/A TYR 295.A N PRO 291.A O no hydrogen 2.926 N/A TYR 295.A OH MET 15.A O no hydrogen 2.672 N/A TYR 295.A OH ASN 287.A OD1 no hydrogen 3.287 N/A GLY 296.A N PRO 291.A O no hydrogen 3.158 N/A ASN 298.A N GLY 34.A O no hydrogen 2.814 N/A ASN 298.A ND2 GLU 504.A OE2 no hydrogen 2.968 N/A ASN 299.A N ASP 36.A OD1 no hydrogen 2.747 N/A ASN 299.A ND2 THR 37.A OG1 no hydrogen 2.971 N/A LYS 300.A N VAL 297.A O no hydrogen 2.943 N/A SER 302.A N TYR 295.A O no hydrogen 2.927 N/A SER 302.A OG TYR 293.A O no hydrogen 2.660 N/A PHE 305.A N SER 302.A OG no hydrogen 3.081 N/A SER 306.A N SER 302.A O no hydrogen 2.839 N/A SER 306.A OG SER 302.A O no hydrogen 3.421 N/A SER 306.A OG GLU 307.A OE2 no hydrogen 2.678 N/A GLU 307.A N LEU 303.A O no hydrogen 2.848 N/A VAL 308.A N LEU 304.A O no hydrogen 3.022 N/A ILE 309.A N LEU 304.A O no hydrogen 3.184 N/A LYS 310.A N PHE 305.A O no hydrogen 2.794 N/A LYS 310.A NZ GLU 301.A OE1 no hydrogen 2.780 N/A PHE 312.A N VAL 308.A O no hydrogen 2.846 N/A PHE 313.A N ILE 309.A O no hydrogen 2.759 N/A ARG 314.A N LYS 310.A O no hydrogen 2.890 N/A ARG 314.A NE ASP 48.A OD2 no hydrogen 2.945 N/A ARG 314.A NH2 ASP 48.A OD1 no hydrogen 2.889 N/A TYR 315.A N GLU 311.A O no hydrogen 2.970 N/A VAL 316.A N PHE 312.A O no hydrogen 3.037 N/A ILE 317.A N PHE 313.A O no hydrogen 3.126 N/A ALA 318.A N ARG 314.A O no hydrogen 3.076 N/A HIS 319.A N TYR 315.A O no hydrogen 2.768 N/A LYS 324.A NZ ASN 226.A OD1 no hydrogen 2.700 N/A LYS 326.A N SER 323.A OG no hydrogen 3.119 N/A LYS 326.A NZ ASP 330.A OD2 no hydrogen 2.744 N/A VAL 327.A N SER 323.A O no hydrogen 2.822 N/A LEU 328.A N LYS 324.A O no hydrogen 2.839 N/A GLU 329.A N GLU 325.A O no hydrogen 2.956 N/A ASP 330.A N LYS 326.A O no hydrogen 3.184 N/A THR 331.A N LEU 328.A O no hydrogen 3.339 N/A THR 331.A OG1 VAL 327.A O no hydrogen 2.658 N/A LYS 332.A N TYR 404.A OH no hydrogen 2.972 N/A LYS 332.A NZ GLU 329.A O no hydrogen 3.438 N/A VAL 333.A N TYR 404.A OH no hydrogen 3.138 N/A PHE 334.A N GLN 381.A O no hydrogen 2.931 N/A ILE 335.A N PRO 370.A O no hydrogen 2.810 N/A HIS 336.A N LYS 383.A O no hydrogen 2.836 N/A GLY 337.A N ILE 372.A O no hydrogen 3.018 N/A TYR 339.A N TYR 218.A OH no hydrogen 2.840 N/A TYR 339.A OH SER 217.A OG no hydrogen 2.697 N/A SER 340.A N GLU 176.A OE2 no hydrogen 3.106 N/A SER 340.A OG GLU 176.A OE1 no hydrogen 2.402 N/A SER 340.A OG GLU 176.A OE2 no hydrogen 3.215 N/A ASN 341.A N ASP 338.A O no hydrogen 3.109 N/A LYS 342.A N TYR 339.A O no hydrogen 2.851 N/A ASN 344.A N TYR 339.A O no hydrogen 2.814 N/A LYS 346.A N GLY 343.A O no hydrogen 3.041 N/A PHE 347.A N ASN 344.A O no hydrogen 2.893 N/A PHE 348.A N GLY 345.A O no hydrogen 3.286 N/A VAL 349.A N LYS 346.A O no hydrogen 3.193 N/A ASN 350.A N THR 353.A O no hydrogen 2.814 N/A VAL 351.A N PHE 348.A O no hydrogen 2.817 N/A ASN 352.A N PHE 348.A O no hydrogen 2.895 N/A ASN 352.A ND2 ASN 367.A O no hydrogen 3.270 N/A THR 353.A N PHE 348.A O no hydrogen 3.145 N/A ARG 355.A NE ASP 354.A OD1 no hydrogen 2.808 N/A ARG 355.A NE ASP 354.A OD2 no hydrogen 3.315 N/A ARG 355.A NH1 GLU 430.A OE1 no hydrogen 3.470 N/A ARG 355.A NH1 GLU 430.A OE2 no hydrogen 2.900 N/A ARG 355.A NH2 ASP 354.A OD2 no hydrogen 2.760 N/A ARG 355.A NH2 GLU 430.A OE1 no hydrogen 2.901 N/A LEU 360.A N THR 358.A OG1 no hydrogen 2.996 N/A TYR 361.A N TYR 424.A OH no hydrogen 2.829 N/A TYR 361.A OH GLU 216.A OE2 no hydrogen 2.615 N/A MET 362.A N ASN 352.A O no hydrogen 2.847 N/A THR 363.A OG1 TYR 408.A OH no hydrogen 3.258 N/A ARG 365.A N THR 363.A OG1 no hydrogen 3.097 N/A ARG 365.A NE TYR 404.A O no hydrogen 2.769 N/A ARG 365.A NH2 ASN 401.A O no hydrogen 3.329 N/A ARG 365.A NH2 TYR 404.A O no hydrogen 3.074 N/A TYR 366.A OH ASN 401.A OD1 no hydrogen 2.706 N/A ASN 367.A N GLY 364.A O no hydrogen 2.823 N/A ASN 367.A ND2 VAL 368.A O no hydrogen 3.143 N/A ALA 371.A N SER 217.A O no hydrogen 3.215 N/A ILE 372.A N ILE 335.A O no hydrogen 3.088 N/A GLY 374.A N ASP 338.A OD1 no hydrogen 2.943 N/A LEU 376.A N PRO 373.A O no hydrogen 3.089 N/A GLN 381.A N LYS 332.A O no hydrogen 2.991 N/A LYS 383.A N PHE 334.A O no hydrogen 2.899 N/A LYS 383.A NZ GLU 389.A OE2 no hydrogen 2.748 N/A ILE 385.A N HIS 336.A O no hydrogen 2.890 N/A SER 387.A N GLU 384.A O no hydrogen 2.902 N/A SER 387.A OG GLU 384.A O no hydrogen 2.865 N/A GLU 389.A N GLU 389.A OE1 no hydrogen 2.717 N/A PHE 390.A N SER 387.A O no hydrogen 3.082 N/A SER 391.A N PRO 388.A O no hydrogen 3.195 N/A SER 391.A OG PRO 388.A O no hydrogen 2.965 N/A ALA 395.A N SER 392.A OG no hydrogen 3.157 N/A ARG 396.A N SER 392.A O no hydrogen 3.069 N/A ARG 396.A NE PHE 390.A O no hydrogen 2.870 N/A ARG 396.A NH2 PHE 390.A O no hydrogen 2.749 N/A LYS 397.A N THR 393.A O no hydrogen 3.143 N/A LYS 397.A NZ ASN 350.A O no hydrogen 2.965 N/A LYS 397.A NZ GLN 394.A OE1 no hydrogen 3.021 N/A GLU 398.A N GLN 394.A O no hydrogen 2.969 N/A TYR 399.A N ALA 395.A O no hydrogen 3.086 N/A TYR 399.A OH GLN 381.A OE1 no hydrogen 2.657 N/A LEU 400.A N ARG 396.A O no hydrogen 2.945 N/A ASN 401.A N LYS 397.A O no hydrogen 2.672 N/A LYS 402.A N TYR 399.A O no hydrogen 3.364 N/A LEU 403.A N LEU 400.A O no hydrogen 2.973 N/A TYR 404.A N LEU 400.A O no hydrogen 2.828 N/A TYR 408.A OH THR 363.A OG1 no hydrogen 3.258 N/A TYR 408.A OH ILE 412.A O no hydrogen 2.656 N/A GLU 409.A N LYS 437.A O no hydrogen 3.107 N/A PHE 413.A N TYR 424.A O no hydrogen 3.094 N/A ALA 414.A N TYR 408.A OH no hydrogen 3.254 N/A GLN 415.A N PHE 422.A O no hydrogen 2.949 N/A GLN 415.A NE2 LEU 280.A O no hydrogen 3.541 N/A LEU 417.A N ARG 420.A O no hydrogen 2.947 N/A ASN 419.A N ASP 418.A OD2 no hydrogen 2.836 N/A ARG 420.A N LEU 417.A O no hydrogen 2.825 N/A ARG 420.A NE ASP 418.A OD2 no hydrogen 2.858 N/A ARG 420.A NH1 TYR 279.A OH no hydrogen 2.945 N/A ARG 420.A NH1 TYR 315.A OH no hydrogen 3.014 N/A ARG 420.A NH2 ASP 418.A OD1 no hydrogen 2.918 N/A TRP 421.A N PHE 457.A O no hydrogen 2.854 N/A TRP 421.A NE1 LYS 439.A O no hydrogen 2.832 N/A PHE 422.A N GLN 415.A O no hydrogen 2.857 N/A VAL 423.A N GLY 455.A O no hydrogen 2.865 N/A TYR 424.A N PHE 413.A O no hydrogen 2.955 N/A ASN 425.A N THR 453.A O no hydrogen 3.271 N/A ASN 425.A ND2 VAL 432.A O no hydrogen 2.914 N/A ASN 425.A ND2 PHE 449.A O no hydrogen 3.003 N/A TYR 426.A N GLN 434.A OE1 no hydrogen 2.901 N/A TYR 426.A OH ASP 411.A OD1 no hydrogen 2.579 N/A TYR 426.A OH ASP 411.A OD2 no hydrogen 3.426 N/A LYS 427.A N ASN 425.A OD1 no hydrogen 2.947 N/A VAL 428.A N GLU 430.A OE1 no hydrogen 3.196 N/A ASN 429.A N GLU 430.A OE1 no hydrogen 3.311 N/A ASN 429.A N GLU 430.A OE2 no hydrogen 3.061 N/A VAL 432.A N GLU 430.A O no hydrogen 2.956 N/A GLN 434.A N PHE 449.A O no hydrogen 2.904 N/A GLY 436.A N VAL 447.A O no hydrogen 3.081 N/A LYS 437.A N GLU 409.A O no hydrogen 2.810 N/A LYS 437.A NZ GLU 444.A OE2 no hydrogen 2.428 N/A LYS 437.A NZ ASN 446.A OD1 no hydrogen 3.102 N/A LEU 438.A N MET 445.A O no hydrogen 2.766 N/A PHE 440.A N LEU 443.A O no hydrogen 2.941 N/A LEU 443.A N PHE 440.A O no hydrogen 2.919 N/A MET 445.A N LEU 438.A O no hydrogen 2.802 N/A ASN 446.A N VAL 522.A O no hydrogen 2.766 N/A VAL 447.A N GLY 436.A O no hydrogen 2.965 N/A GLU 448.A N LYS 520.A O no hydrogen 2.850 N/A PHE 449.A N GLN 434.A O no hydrogen 2.855 N/A HIS 452.A NE2 VAL 428.A O no hydrogen 2.814 N/A THR 453.A OG1 GLU 450.A O no hydrogen 2.777 N/A THR 453.A OG1 PRO 451.A O no hydrogen 3.230 N/A TYR 454.A N ASN 469.A O no hydrogen 2.862 N/A GLY 455.A N VAL 423.A O no hydrogen 2.891 N/A ILE 456.A N ASN 467.A O no hydrogen 2.801 N/A PHE 457.A N TRP 421.A O no hydrogen 2.874 N/A GLU 458.A N LYS 465.A O no hydrogen 2.809 N/A ARG 459.A N ASN 419.A O no hydrogen 2.909 N/A ARG 459.A NH1 GLY 463.A O no hydrogen 2.957 N/A ILE 460.A N GLY 463.A O no hydrogen 3.025 N/A GLY 463.A N ILE 460.A O no hydrogen 3.189 N/A LEU 464.A N LEU 570.A O no hydrogen 2.935 N/A LYS 465.A N GLU 458.A O no hydrogen 2.910 N/A LYS 465.A NZ GLU 567.A OE2 no hydrogen 3.124 N/A VAL 466.A N PHE 568.A O no hydrogen 2.773 N/A ASN 467.A N ILE 456.A O no hydrogen 2.954 N/A LEU 468.A N LEU 566.A O no hydrogen 2.770 N/A ASN 469.A N TYR 454.A O no hydrogen 2.854 N/A ASN 469.A ND2 GLU 307.A O no hydrogen 2.868 N/A ASN 470.A N GLY 564.A O no hydrogen 3.071 N/A ASN 470.A ND2 SER 562.A O no hydrogen 3.162 N/A PHE 471.A N ASN 469.A OD1 no hydrogen 3.084 N/A ARG 472.A NH1 HIS 452.A ND1 no hydrogen 2.994 N/A THR 473.A N GLU 268.A OE1 no hydrogen 3.063 N/A THR 473.A OG1 GLU 268.A OE2 no hydrogen 2.681 N/A ASN 474.A N GLN 512.A O no hydrogen 2.894 N/A LYS 475.A NZ LEU 264.A O no hydrogen 2.690 N/A LYS 475.A NZ GLU 268.A OE2 no hydrogen 3.435 N/A LYS 475.A NZ TYR 293.A OH no hydrogen 2.842 N/A ASP 476.A N ASN 474.A OD1 no hydrogen 2.896 N/A LEU 478.A N LYS 475.A O no hydrogen 3.029 N/A TRP 479.A N ASP 476.A O no hydrogen 2.746 N/A TRP 479.A NE1 THR 265.A OG1 no hydrogen 2.998 N/A SER 480.A N SER 477.A O no hydrogen 3.309 N/A SER 480.A OG SER 477.A O no hydrogen 3.130 N/A GLN 483.A N GLN 487.A OE1 no hydrogen 2.562 N/A GLN 487.A N ASP 484.A OD1 no hydrogen 2.849 N/A ALA 488.A N ASP 484.A O no hydrogen 2.870 N/A LYS 489.A N ALA 485.A O no hydrogen 2.957 N/A LYS 489.A NZ ILE 254.A O no hydrogen 2.678 N/A LYS 490.A N GLN 487.A O no hydrogen 3.123 N/A LEU 491.A N ALA 488.A O no hydrogen 3.123 N/A THR 495.A OG1 LEU 494.A O no hydrogen 2.621 N/A LYS 496.A NZ ASP 60.A OD2 no hydrogen 2.969 N/A LYS 497.A NZ GLU 23.A OE1 no hydrogen 3.182 N/A GLY 498.A N THR 495.A OG1 no hydrogen 2.970 N/A ALA 499.A N THR 495.A O no hydrogen 2.827 N/A ILE 500.A N LYS 496.A O no hydrogen 3.081 N/A LYS 501.A N LYS 497.A O no hydrogen 2.951 N/A TRP 502.A N GLY 498.A O no hydrogen 2.782 N/A ILE 503.A N ALA 499.A O no hydrogen 2.975 N/A GLU 504.A N ILE 500.A O no hydrogen 3.001 N/A GLU 505.A N LYS 501.A O no hydrogen 2.959 N/A HIS 506.A N TRP 502.A O no hydrogen 2.809 N/A TYR 507.A N ILE 503.A O no hydrogen 3.171 N/A TYR 507.A OH GLU 268.A OE2 no hydrogen 2.596 N/A ILE 508.A N ILE 503.A O no hydrogen 2.731 N/A THR 511.A OG1 TYR 507.A O no hydrogen 2.772 N/A ARG 517.A N SER 562.A O no hydrogen 2.883 N/A ARG 517.A NE ASN 470.A O no hydrogen 3.440 N/A ARG 517.A NH1 GLU 450.A OE1 no hydrogen 2.938 N/A ARG 517.A NH1 PRO 451.A O no hydrogen 2.944 N/A ARG 517.A NH2 PRO 451.A O no hydrogen 3.176 N/A ARG 517.A NH2 HIS 452.A O no hydrogen 2.830 N/A ARG 517.A NH2 ASN 470.A O no hydrogen 2.943 N/A THR 519.A N ILE 560.A O no hydrogen 2.895 N/A LYS 520.A N GLU 448.A O no hydrogen 3.101 N/A LYS 520.A NZ THR 559.A OG1 no hydrogen 3.141 N/A ILE 521.A N ILE 558.A O no hydrogen 3.040 N/A VAL 522.A N ASN 446.A O no hydrogen 2.770 N/A LEU 523.A N VAL 556.A O no hydrogen 2.911 N/A ARG 524.A N GLU 444.A O no hydrogen 2.868 N/A ILE 526.A N HIS 554.A O no hydrogen 2.704 N/A THR 531.A N HIS 571.A O no hydrogen 3.023 N/A HIS 533.A N GLU 569.A O no hydrogen 2.877 N/A SER 536.A N GLU 567.A O no hydrogen 3.026 N/A THR 538.A N ASN 565.A O no hydrogen 2.943 N/A THR 538.A OG1 GLU 307.A OE1 no hydrogen 2.753 N/A SER 541.A OG THR 538.A O no hydrogen 2.671 N/A ASP 543.A N ASN 561.A O no hydrogen 3.054 N/A SER 546.A N THR 559.A O no hydrogen 3.022 N/A ASN 548.A N THR 557.A O no hydrogen 2.900 N/A ASP 550.A N MET 555.A O no hydrogen 2.819 N/A ASN 553.A N ASP 550.A O no hydrogen 3.167 N/A HIS 554.A N GLN 551.A O no hydrogen 3.335 N/A MET 555.A N ASP 550.A O no hydrogen 3.327 N/A VAL 556.A N LEU 523.A O no hydrogen 3.013 N/A THR 557.A N ASN 548.A O no hydrogen 2.859 N/A ILE 558.A N ILE 521.A O no hydrogen 2.697 N/A THR 559.A N SER 546.A O no hydrogen 2.728 N/A ILE 560.A N THR 519.A O no hydrogen 2.846 N/A SER 562.A N ARG 517.A O no hydrogen 3.049 N/A ASN 563.A N SER 541.A O no hydrogen 2.888 N/A ASN 563.A ND2 ARG 472.A O no hydrogen 3.333 N/A GLY 564.A N ASN 470.A OD1 no hydrogen 3.024 N/A ASN 565.A N THR 538.A OG1 no hydrogen 2.866 N/A LEU 566.A N LEU 468.A O no hydrogen 2.941 N/A GLU 567.A N SER 536.A O no hydrogen 2.948 N/A PHE 568.A N VAL 466.A O no hydrogen 3.083 N/A GLU 569.A N HIS 533.A O no hydrogen 2.879 N/A LEU 570.A N LEU 464.A O no hydrogen 2.794 N/A HIS 571.A N THR 531.A O no hydrogen 2.826 N/A HIS 571.A NE2 GLU 569.A OE1 no hydrogen 2.668 N/A PHE 572.A N ASN 462.A O no hydrogen 2.868 N/A