Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4mw5_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LYS 2.A NZ VAL 3.A O no hydrogen 2.897 N/A LYS 2.A NZ ARG 268.A O no hydrogen 2.806 N/A LYS 2.A NZ PRO 270.A O no hydrogen 3.425 N/A LYS 2.A NZ ASP 272.A OD2 no hydrogen 2.952 N/A VAL 3.A N GLU 267.A O no hydrogen 2.972 N/A PHE 4.A N ARG 41.A O no hydrogen 2.752 N/A PHE 5.A N ASP 272.A OD2 no hydrogen 2.916 N/A VAL 6.A N PHE 43.A O no hydrogen 3.159 N/A THR 7.A N VAL 273.A O no hydrogen 3.074 N/A THR 7.A OG1 HIS 274.A ND1 no hydrogen 2.828 N/A SER 8.A N LEU 45.A O no hydrogen 2.953 N/A SER 8.A OG PRO 9.A O no hydrogen 2.744 N/A SER 8.A OG THR 46.A OG1 no hydrogen 2.698 N/A TYR 11.A N GLY 47.A O no hydrogen 3.009 N/A TYR 11.A OH THR 25.A OG1 no hydrogen 2.606 N/A HIS 18.A N HIS 21.A ND1 no hydrogen 3.073 N/A GLY 20.A N HIS 18.A ND1 no hydrogen 3.257 N/A VAL 22.A N HIS 18.A O no hydrogen 3.134 N/A TYR 23.A N ILE 19.A O no hydrogen 2.753 N/A TYR 23.A OH SER 343.A OG no hydrogen 3.416 N/A SER 24.A N GLY 20.A O no hydrogen 3.064 N/A SER 24.A OG GLY 20.A O no hydrogen 3.457 N/A SER 24.A OG HIS 306.A NE2 no hydrogen 2.713 N/A THR 25.A N HIS 21.A O no hydrogen 3.052 N/A THR 25.A OG1 TYR 11.A OH no hydrogen 2.606 N/A THR 25.A OG1 HIS 21.A O no hydrogen 3.163 N/A THR 25.A OG1 THR 46.A OG1 no hydrogen 3.244 N/A LEU 26.A N VAL 22.A O no hydrogen 2.936 N/A ILE 27.A N TYR 23.A O no hydrogen 3.126 N/A THR 28.A N SER 24.A O no hydrogen 3.220 N/A THR 28.A OG1 THR 7.A O no hydrogen 3.096 N/A THR 28.A OG1 SER 24.A O no hydrogen 3.035 N/A ASP 29.A N THR 25.A O no hydrogen 2.752 N/A VAL 30.A N LEU 26.A O no hydrogen 2.746 N/A ILE 31.A N ILE 27.A O no hydrogen 3.002 N/A GLY 32.A N THR 28.A O no hydrogen 3.060 N/A ARG 33.A N ASP 29.A O no hydrogen 2.822 N/A ARG 33.A NE ASP 29.A OD2 no hydrogen 2.795 N/A TYR 34.A N VAL 30.A O no hydrogen 2.928 N/A TYR 34.A OH ASP 411.A OD1 no hydrogen 2.610 N/A HIS 35.A N ILE 31.A O no hydrogen 3.232 N/A HIS 35.A ND1 GLU 40.A OE1 no hydrogen 2.772 N/A ARG 36.A N GLY 32.A O no hydrogen 2.996 N/A ARG 36.A NH2 SER 87.A O no hydrogen 2.797 N/A ARG 36.A NH2 ASP 89.A OD2 no hydrogen 2.889 N/A VAL 37.A N ARG 33.A O no hydrogen 2.919 N/A LYS 38.A N TYR 34.A O no hydrogen 3.063 N/A LYS 38.A NZ ASP 411.A OD1 no hydrogen 2.789 N/A GLY 39.A N ARG 36.A O no hydrogen 2.809 N/A GLU 40.A N HIS 35.A O no hydrogen 2.957 N/A ARG 41.A NH1 GLU 267.A OE2 no hydrogen 2.783 N/A PHE 43.A N PHE 4.A O no hydrogen 2.890 N/A ALA 44.A N ASP 89.A OD2 no hydrogen 2.747 N/A LEU 45.A N VAL 6.A O no hydrogen 2.972 N/A THR 46.A N TYR 90.A O no hydrogen 3.110 N/A THR 46.A OG1 SER 8.A OG no hydrogen 2.698 N/A THR 46.A OG1 THR 25.A OG1 no hydrogen 3.244 N/A THR 48.A N ILE 92.A O no hydrogen 2.863 N/A THR 48.A OG1 GLU 50.A OE2 no hydrogen 2.739 N/A ASP 49.A N TYR 11.A O no hydrogen 2.681 N/A GLU 50.A N THR 94.A OG1 no hydrogen 2.941 N/A HIS 51.A ND1 ASP 237.A OD2 no hydrogen 2.736 N/A GLY 52.A N TRP 221.A O no hydrogen 2.927 N/A GLN 53.A NE2 GLU 57.A OE2 no hydrogen 3.019 N/A LYS 54.A N GLU 130.A OE2 no hydrogen 3.038 N/A LYS 54.A NZ SER 128.A O no hydrogen 2.786 N/A ALA 56.A N GLY 52.A O no hydrogen 2.918 N/A GLU 57.A N GLN 53.A O no hydrogen 2.746 N/A ALA 58.A N LYS 54.A O no hydrogen 2.954 N/A ALA 59.A N VAL 55.A O no hydrogen 3.026 N/A LYS 60.A N ALA 56.A O no hydrogen 3.075 N/A GLN 61.A N GLU 57.A O no hydrogen 2.974 N/A LYS 62.A N ALA 58.A O no hydrogen 3.329 N/A GLN 63.A N LYS 60.A O no hydrogen 2.796 N/A VAL 64.A N ALA 59.A O no hydrogen 3.046 N/A TYR 67.A N SER 65.A OG no hydrogen 3.349 N/A PHE 69.A N SER 65.A O no hydrogen 2.764 N/A THR 70.A N PRO 66.A O no hydrogen 2.973 N/A THR 70.A OG1 PRO 66.A O no hydrogen 2.752 N/A THR 70.A OG1 TYR 67.A O no hydrogen 3.079 N/A THR 71.A N TYR 67.A O no hydrogen 3.141 N/A THR 71.A OG1 TYR 67.A O no hydrogen 2.937 N/A ALA 72.A N ASP 68.A O no hydrogen 3.007 N/A VAL 73.A N PHE 69.A O no hydrogen 3.002 N/A ALA 74.A N THR 70.A O no hydrogen 2.808 N/A GLY 75.A N THR 71.A O no hydrogen 2.909 N/A GLU 76.A N ALA 72.A O no hydrogen 3.091 N/A PHE 77.A N VAL 73.A O no hydrogen 2.942 N/A LYS 78.A N ALA 74.A O no hydrogen 2.906 N/A LYS 79.A N GLY 75.A O no hydrogen 2.929 N/A CYS 80.A N GLU 76.A O no hydrogen 2.973 N/A PHE 81.A N PHE 77.A O no hydrogen 2.983 N/A GLU 82.A N LYS 78.A O no hydrogen 2.907 N/A GLN 83.A N LYS 79.A O no hydrogen 2.961 N/A GLN 83.A NE2 TYR 332.A OH no hydrogen 3.057 N/A MET 84.A N CYS 80.A O no hydrogen 2.870 N/A ASP 85.A N GLU 82.A O no hydrogen 2.986 N/A SER 87.A N ASP 29.A OD1 no hydrogen 2.719 N/A ASP 89.A N ALA 44.A O no hydrogen 2.877 N/A TYR 90.A N ALA 44.A O no hydrogen 3.298 N/A ILE 92.A N THR 46.A O no hydrogen 2.896 N/A ARG 93.A NE GLU 50.A OE2 no hydrogen 2.576 N/A ARG 93.A NH2 GLU 50.A OE1 no hydrogen 2.800 N/A ARG 93.A NH2 GLU 50.A OE2 no hydrogen 3.318 N/A THR 94.A N THR 48.A O no hydrogen 3.288 N/A THR 95.A OG1 GLU 50.A OE1 no hydrogen 2.715 N/A ASN 96.A N ARG 93.A O no hydrogen 2.942 N/A ASN 96.A ND2 GLU 256.A OE1 no hydrogen 3.115 N/A GLN 98.A NE2 GLU 256.A OE1 no hydrogen 2.654 N/A HIS 99.A N ASN 96.A OD1 no hydrogen 3.068 N/A HIS 99.A ND1 THR 244.A OG1 no hydrogen 2.848 N/A HIS 99.A NE2 ASP 237.A OD1 no hydrogen 2.762 N/A LYS 100.A N ASN 96.A O no hydrogen 3.140 N/A LYS 100.A NZ HIS 51.A NE2 no hydrogen 3.384 N/A ALA 101.A N GLU 97.A O no hydrogen 3.233 N/A VAL 102.A N GLN 98.A O no hydrogen 3.240 N/A VAL 103.A N HIS 99.A O no hydrogen 2.939 N/A LYS 104.A N LYS 100.A O no hydrogen 3.058 N/A GLU 105.A N ALA 101.A O no hydrogen 2.965 N/A LEU 106.A N VAL 102.A O no hydrogen 2.786 N/A TRP 107.A N VAL 103.A O no hydrogen 2.905 N/A THR 108.A N LYS 104.A O no hydrogen 3.030 N/A THR 108.A OG1 LYS 104.A O no hydrogen 2.939 N/A LYS 109.A N GLU 105.A O no hydrogen 3.132 N/A LEU 110.A N LEU 106.A O no hydrogen 2.963 N/A GLU 111.A N TRP 107.A O no hydrogen 2.863 N/A GLN 112.A N THR 108.A O no hydrogen 2.767 N/A LYS 113.A N LYS 109.A O no hydrogen 2.826 N/A GLY 114.A N GLU 111.A O no hydrogen 2.889 N/A ASP 115.A N LEU 110.A O no hydrogen 3.057 N/A TYR 117.A N MET 168.A O no hydrogen 2.875 N/A TYR 117.A OH ASP 208.A OD2 no hydrogen 2.639 N/A GLY 119.A N ASN 166.A O no hydrogen 2.815 N/A ARG 120.A NE GLU 122.A OE2 no hydrogen 2.821 N/A ARG 120.A NH2 SER 163.A OG no hydrogen 2.880 N/A TYR 121.A N GLU 164.A O no hydrogen 2.932 N/A TYR 121.A OH TRP 124.A O no hydrogen 2.741 N/A GLY 123.A N VAL 162.A O no hydrogen 2.915 N/A TYR 125.A N THR 160.A O no hydrogen 2.819 N/A TYR 125.A OH GLU 130.A OE1 no hydrogen 2.696 N/A SER 126.A N SER 131.A O no hydrogen 2.859 N/A SER 126.A OG ASP 129.A OD2 no hydrogen 2.609 N/A ASP 129.A N SER 126.A OG no hydrogen 3.171 N/A GLU 130.A N ILE 127.A O no hydrogen 3.062 N/A SER 131.A N SER 126.A O no hydrogen 2.993 N/A SER 131.A OG PHE 132.A O no hydrogen 3.388 N/A SER 131.A OG GLU 154.A OE2 no hydrogen 3.560 N/A LEU 133.A N TRP 124.A O no hydrogen 3.188 N/A THR 134.A OG1 GLN 136.A OE1 no hydrogen 3.416 N/A THR 134.A OG1 ASN 137.A OD1 no hydrogen 3.243 N/A ASN 137.A N THR 134.A O no hydrogen 2.870 N/A ILE 138.A N PRO 135.A O no hydrogen 3.453 N/A THR 139.A N VAL 151.A O no hydrogen 2.851 N/A ASP 140.A N THR 139.A OG1 no hydrogen 2.798 N/A GLY 141.A N CYS 149.A O no hydrogen 3.038 N/A ASP 143.A N ASN 147.A O no hydrogen 2.681 N/A GLY 146.A N ASP 143.A O no hydrogen 3.296 N/A CYS 149.A N GLY 141.A O no hydrogen 3.091 N/A CYS 149.A SG LYS 150.A O no hydrogen 3.549 N/A LYS 150.A NZ ASP 140.A OD1 no hydrogen 3.025 N/A VAL 151.A N THR 139.A O no hydrogen 2.733 N/A SER 152.A N HIS 157.A O no hydrogen 2.911 N/A LEU 153.A N ASN 137.A O no hydrogen 2.966 N/A SER 155.A N SER 152.A OG no hydrogen 3.012 N/A SER 155.A OG ASP 129.A OD1 no hydrogen 3.525 N/A SER 155.A OG ASP 129.A OD2 no hydrogen 2.614 N/A SER 155.A OG HIS 157.A ND1 no hydrogen 3.200 N/A GLY 156.A N SER 152.A O no hydrogen 2.736 N/A HIS 157.A N SER 155.A OG no hydrogen 3.249 N/A VAL 159.A N LYS 150.A O no hydrogen 3.054 N/A THR 160.A N TYR 125.A O no hydrogen 2.878 N/A THR 160.A OG1 TYR 125.A O no hydrogen 3.400 N/A VAL 162.A N GLY 123.A O no hydrogen 2.806 N/A GLU 164.A N TYR 121.A O no hydrogen 2.902 N/A ASN 166.A N GLY 119.A O no hydrogen 2.799 N/A ASN 166.A ND2 GLU 164.A OE1 no hydrogen 3.058 N/A ASN 166.A ND2 GLU 165.A O no hydrogen 2.892 N/A TYR 167.A N SER 212.A OG no hydrogen 2.776 N/A MET 168.A N TYR 117.A O no hydrogen 2.645 N/A PHE 169.A N LEU 209.A O no hydrogen 2.692 N/A ARG 170.A N ASP 115.A O no hydrogen 2.931 N/A ARG 170.A NE GLY 114.A O no hydrogen 2.888 N/A LEU 171.A N PHE 169.A O no hydrogen 2.844 N/A SER 172.A N ASP 208.A OD1 no hydrogen 3.051 N/A SER 172.A OG ASP 208.A OD1 no hydrogen 2.574 N/A ALA 173.A N ARG 170.A O no hydrogen 3.079 N/A PHE 174.A N LEU 171.A O no hydrogen 2.973 N/A ARG 175.A NE VAL 202.A O no hydrogen 3.080 N/A ARG 175.A NE GLU 203.A O no hydrogen 3.207 N/A ARG 175.A NH2 GLU 203.A O no hydrogen 2.628 N/A ARG 177.A NH2 ALA 173.A O no hydrogen 2.946 N/A LEU 178.A N PHE 174.A O no hydrogen 2.913 N/A LEU 179.A N ARG 175.A O no hydrogen 2.975 N/A GLU 180.A N GLU 176.A O no hydrogen 2.987 N/A TRP 181.A N ARG 177.A O no hydrogen 2.958 N/A TYR 182.A N LEU 178.A O no hydrogen 2.964 N/A TYR 182.A OH ALA 285.A O no hydrogen 2.603 N/A HIS 183.A N.A LEU 179.A O no hydrogen 3.020 N/A HIS 183.A N.B LEU 179.A O no hydrogen 2.995 N/A ALA 184.A N GLU 180.A O no hydrogen 3.009 N/A ASN 185.A N TRP 181.A O no hydrogen 2.990 N/A ASN 185.A ND2 TRP 181.A O no hydrogen 2.926 N/A CYS 188.A N ASN 185.A O no hydrogen 2.957 N/A CYS 188.A SG ASN 185.A O no hydrogen 3.090 N/A VAL 190.A N ILE 303.A O no hydrogen 2.956 N/A ARG 194.A N PRO 191.A O no hydrogen 3.006 N/A ARG 194.A NH1 ALA 305.A O no hydrogen 2.665 N/A ARG 195.A N PRO 191.A O no hydrogen 3.269 N/A ARG 195.A NH1 GLU 192.A OE1 no hydrogen 3.545 N/A ARG 195.A NH1 GLU 192.A OE2 no hydrogen 2.690 N/A ARG 195.A NH2 TYR 182.A O no hydrogen 3.483 N/A ARG 196.A N GLU 192.A O no hydrogen 2.947 N/A ARG 196.A NE.B GLU 192.A OE2 no hydrogen 2.861 N/A ARG 196.A NH2.B GLU 192.A OE2 no hydrogen 2.739 N/A GLU 197.A N PHE 193.A O no hydrogen 3.055 N/A VAL 198.A N ARG 194.A O no hydrogen 2.998 N/A ILE 199.A N ARG 195.A O no hydrogen 3.070 N/A ARG 200.A N ARG 196.A O no hydrogen 2.886 N/A ALA 201.A N GLU 197.A O no hydrogen 2.994 N/A VAL 202.A N VAL 198.A O no hydrogen 3.028 N/A GLU 203.A N ILE 199.A O no hydrogen 2.844 N/A LYS 204.A N ARG 200.A O no hydrogen 3.389 N/A GLY 205.A N VAL 202.A O no hydrogen 3.210 N/A LEU 209.A N PHE 169.A O no hydrogen 2.949 N/A SER 210.A OG ASN 166.A OD1 no hydrogen 2.624 N/A VAL 211.A N TYR 167.A O no hydrogen 2.772 N/A SER 212.A OG HIS 231.A ND1 no hydrogen 2.879 N/A ARG 213.A NE GLU 164.A OE1 no hydrogen 2.925 N/A ARG 213.A NH2 GLU 164.A OE2 no hydrogen 3.088 N/A ALA 214.A N GLU 164.A OE1 no hydrogen 3.252 N/A ARG 215.A N ASP 230.A O no hydrogen 2.885 N/A ARG 215.A NH1 ASN 220.A OD1 no hydrogen 2.910 N/A THR 217.A OG1 GLU 164.A OE2 no hydrogen 2.714 N/A THR 217.A OG1 ALA 214.A O no hydrogen 3.531 N/A LEU 218.A N ARG 215.A O no hydrogen 3.232 N/A HIS 219.A N ALA 216.A O no hydrogen 2.896 N/A HIS 219.A NE2 GLU 57.A OE2 no hydrogen 3.092 N/A ASN 220.A N ARG 215.A O no hydrogen 3.065 N/A TRP 221.A N LEU 218.A O no hydrogen 2.973 N/A TRP 221.A NE1 GLU 50.A O no hydrogen 2.779 N/A VAL 225.A N HIS 231.A O no hydrogen 2.935 N/A ASN 228.A N VAL 225.A O no hydrogen 3.038 N/A ASN 228.A ND2 TYR 167.A OH no hydrogen 2.691 N/A ASP 230.A N ASN 228.A OD1 no hydrogen 3.216 N/A HIS 231.A N ASN 228.A O no hydrogen 3.251 N/A HIS 231.A ND1 SER 212.A OG no hydrogen 2.879 N/A TYR 233.A N VAL 211.A O no hydrogen 2.786 N/A TYR 233.A OH GLU 130.A O no hydrogen 2.764 N/A TRP 235.A NE1 ASP 129.A O no hydrogen 3.351 N/A ASP 237.A N TYR 233.A O no hydrogen 3.077 N/A ALA 238.A N VAL 234.A O no hydrogen 2.691 N/A LEU 239.A N TRP 235.A O no hydrogen 2.866 N/A THR 240.A N LEU 236.A O no hydrogen 3.214 N/A THR 240.A OG1 LEU 236.A O no hydrogen 2.656 N/A ASN 241.A N ALA 238.A O no hydrogen 2.935 N/A ASN 241.A ND2 ALA 238.A O no hydrogen 2.782 N/A TYR 242.A N LEU 239.A O no hydrogen 3.229 N/A TYR 242.A OH HIS 284.A NE2 no hydrogen 2.601 N/A THR 244.A N THR 240.A O no hydrogen 2.948 N/A THR 244.A OG1 HIS 99.A ND1 no hydrogen 2.848 N/A THR 244.A OG1 THR 240.A O no hydrogen 3.345 N/A GLY 245.A N ASN 241.A O no hydrogen 2.817 N/A SER 246.A N TYR 242.A O no hydrogen 3.169 N/A SER 246.A OG LEU 243.A O no hydrogen 2.723 N/A ARG 247.A N THR 244.A O no hydrogen 2.854 N/A ARG 247.A NE VAL 260.A O no hydrogen 2.874 N/A ARG 247.A NH1 GLU 105.A OE2 no hydrogen 2.833 N/A ARG 247.A NH2 GLU 105.A OE1 no hydrogen 3.510 N/A ARG 247.A NH2 VAL 260.A O no hydrogen 2.861 N/A LEU 248.A N GLY 245.A O no hydrogen 3.486 N/A ARG 249.A N SER 258.A O no hydrogen 2.930 N/A ARG 249.A NH2 GLU 265.A OE1 no hydrogen 2.948 N/A ASP 251.A N LYS 255.A O no hydrogen 2.899 N/A SER 253.A OG ASP 251.A OD1 no hydrogen 2.882 N/A GLY 254.A N ASP 251.A O no hydrogen 2.895 N/A LYS 255.A N ASP 251.A OD1 no hydrogen 2.988 N/A VAL 257.A N ARG 249.A O no hydrogen 2.930 N/A VAL 260.A N ARG 247.A O no hydrogen 2.913 N/A ASN 264.A ND2 ASP 262.A OD2 no hydrogen 3.079 N/A GLU 265.A N ASP 262.A O no hydrogen 2.975 N/A LEU 266.A N PHE 263.A O no hydrogen 3.129 N/A GLU 267.A N PHE 263.A O no hydrogen 3.225 N/A ARG 268.A NH1 GLY 245.A O no hydrogen 2.866 N/A ARG 268.A NH1 LEU 248.A O no hydrogen 2.840 N/A ARG 268.A NH2 LEU 248.A O no hydrogen 3.401 N/A ASP 272.A N PHE 5.A O no hydrogen 2.785 N/A VAL 273.A N PHE 5.A O no hydrogen 3.324 N/A HIS 274.A N LYS 302.A O no hydrogen 2.926 N/A HIS 274.A ND1 THR 7.A OG1 no hydrogen 2.828 N/A VAL 275.A N THR 7.A O no hydrogen 2.945 N/A ILE 276.A N VAL 304.A O no hydrogen 2.941 N/A LYS 278.A NZ ASP 347.A OD1 no hydrogen 3.234 N/A LYS 278.A NZ ASP 347.A OD2 no hydrogen 2.908 N/A ILE 280.A N GLY 277.A O no hydrogen 3.186 N/A LEU 281.A N LYS 278.A O no hydrogen 3.417 N/A LYS 282.A NZ SER 131.A OG no hydrogen 2.637 N/A LYS 282.A NZ TYR 287.A OH no hydrogen 3.492 N/A HIS 284.A ND1 ILE 280.A O no hydrogen 3.039 N/A HIS 284.A NE2 TYR 242.A OH no hydrogen 2.601 N/A ALA 285.A N LEU 281.A O no hydrogen 2.878 N/A ILE 286.A N LYS 282.A O no hydrogen 2.983 N/A TYR 287.A N LYS 282.A O no hydrogen 3.159 N/A TRP 288.A N PHE 283.A O no hydrogen 2.918 N/A TRP 288.A NE1 HIS 274.A NE2 no hydrogen 3.152 N/A ALA 290.A N ILE 286.A O no hydrogen 3.268 N/A PHE 291.A N TYR 287.A O no hydrogen 2.850 N/A LEU 292.A N TRP 288.A O no hydrogen 2.976 N/A LEU 293.A N PRO 289.A O no hydrogen 2.866 N/A SER 294.A N ALA 290.A O no hydrogen 2.964 N/A SER 294.A OG ASP 115.A OD2 no hydrogen 2.414 N/A ALA 295.A N PHE 291.A O no hydrogen 2.930 N/A GLY 296.A N LEU 293.A O no hydrogen 3.246 N/A LEU 297.A N LEU 292.A O no hydrogen 2.864 N/A LYS 301.A N ALA 271.A O no hydrogen 3.053 N/A ILE 303.A N CYS 188.A O no hydrogen 2.780 N/A VAL 304.A N HIS 274.A O no hydrogen 2.930 N/A ALA 305.A N VAL 190.A O no hydrogen 2.925 N/A HIS 306.A N ILE 276.A O no hydrogen 3.046 N/A HIS 306.A ND1 GLY 307.A O no hydrogen 3.019 N/A HIS 306.A NE2 SER 24.A OG no hydrogen 2.713 N/A TRP 308.A N ASP 347.A OD1 no hydrogen 3.174 N/A LYS 311.A N LYS 314.A O no hydrogen 3.025 N/A LYS 314.A N LYS 311.A O no hydrogen 3.316 N/A ASN 319.A ND2 LYS 311.A O no hydrogen 2.755 N/A VAL 324.A N ASP 322.A OD1 no hydrogen 3.138 N/A LYS 326.A N ASP 322.A O no hydrogen 2.950 N/A LYS 326.A NZ GLU 329.A OE1 no hydrogen 3.473 N/A LYS 326.A NZ ASP 353.A OD1 no hydrogen 3.081 N/A LYS 326.A NZ ASP 353.A OD2 no hydrogen 3.316 N/A ALA 327.A N PRO 323.A O no hydrogen 2.829 N/A GLU 328.A N VAL 324.A O no hydrogen 2.842 N/A GLU 329.A N GLU 325.A O no hydrogen 3.004 N/A PHE 330.A N LYS 326.A O no hydrogen 2.758 N/A GLY 331.A N ALA 327.A O no hydrogen 2.677 N/A TYR 332.A OH GLU 328.A OE2 no hydrogen 2.745 N/A LEU 335.A N GLY 331.A O no hydrogen 2.891 N/A LYS 336.A N TYR 332.A O no hydrogen 3.023 N/A LYS 336.A NZ MET 84.A O no hydrogen 2.802 N/A LYS 336.A NZ ASP 85.A O no hydrogen 3.183 N/A TYR 337.A N ASP 333.A O no hydrogen 2.828 N/A TYR 337.A OH GLU 363.A OE2 no hydrogen 2.552 N/A PHE 338.A N ALA 334.A O no hydrogen 2.917 N/A LEU 339.A N LEU 335.A O no hydrogen 2.995 N/A LEU 340.A N LYS 336.A O no hydrogen 2.988 N/A ARG 341.A N TYR 337.A O no hydrogen 2.711 N/A ARG 341.A NH1 ARG 341.A O no hydrogen 2.848 N/A GLU 342.A N PHE 338.A O no hydrogen 2.872 N/A SER 343.A OG TYR 23.A OH no hydrogen 3.416 N/A SER 343.A OG LEU 339.A O no hydrogen 2.871 N/A SER 343.A OG TYR 351.A OH no hydrogen 2.760 N/A SER 346.A N GLY 344.A O no hydrogen 2.937 N/A SER 346.A OG ASP 348.A OD1 no hydrogen 2.674 N/A ASP 350.A N GLU 342.A OE2 no hydrogen 2.849 N/A SER 352.A N ASP 350.A OD1 no hydrogen 3.190 N/A SER 352.A OG ASP 350.A OD1 no hydrogen 2.456 N/A ASN 355.A N SER 352.A OG no hydrogen 3.096 N/A ASN 355.A ND2 ASP 350.A O no hydrogen 3.051 N/A MET 356.A N.A SER 352.A O no hydrogen 3.014 N/A MET 356.A N.B SER 352.A O no hydrogen 3.020 N/A ILE 357.A N ASP 353.A O no hydrogen 2.950 N/A ALA 358.A N LYS 354.A O no hydrogen 2.939 N/A ARG 359.A N ASN 355.A O no hydrogen 3.037 N/A ARG 359.A NE GLU 342.A OE1 no hydrogen 2.787 N/A ARG 359.A NH1 GLU 363.A OE1 no hydrogen 3.101 N/A ARG 359.A NH1 GLU 363.A OE2 no hydrogen 3.225 N/A ARG 359.A NH2 GLU 342.A OE1 no hydrogen 2.855 N/A LEU 360.A N MET 356.A O.A no hydrogen 2.940 N/A LEU 360.A N MET 356.A O.B no hydrogen 2.923 N/A ASN 361.A N ILE 357.A O no hydrogen 2.815 N/A ASN 361.A ND2 ARG 523.A O no hydrogen 3.096 N/A GLY 362.A N ALA 358.A O no hydrogen 2.788 N/A GLU 363.A N ARG 359.A O no hydrogen 2.946 N/A LEU 364.A N ARG 359.A O no hydrogen 3.298 N/A ALA 365.A N LEU 360.A O no hydrogen 2.785 N/A ASP 366.A N ASN 361.A O no hydrogen 2.773 N/A THR 367.A OG1 GLY 362.A O no hydrogen 3.208 N/A LEU 368.A N GLU 363.A O no hydrogen 3.087 N/A GLY 369.A N LEU 364.A O no hydrogen 2.860 N/A ASN 370.A N ALA 365.A O no hydrogen 2.916 N/A ASN 370.A ND2 ASN 434.A OD1 no hydrogen 3.307 N/A VAL 372.A N LEU 368.A O no hydrogen 2.983 N/A MET 373.A N GLY 369.A O no hydrogen 2.958 N/A ARG 374.A N ASN 370.A O no hydrogen 2.890 N/A CYS 375.A N LEU 371.A O no hydrogen 3.154 N/A CYS 375.A SG LEU 371.A O no hydrogen 3.511 N/A CYS 375.A SG VAL 372.A O no hydrogen 3.485 N/A THR 376.A N VAL 372.A O no hydrogen 3.307 N/A THR 376.A N MET 373.A O no hydrogen 3.311 N/A THR 376.A OG1 VAL 372.A O no hydrogen 2.685 N/A THR 376.A OG1 MET 373.A O no hydrogen 3.233 N/A SER 377.A N ARG 374.A O no hydrogen 3.305 N/A LYS 379.A N SER 377.A OG no hydrogen 2.959 N/A ILE 380.A N SER 377.A O no hydrogen 3.214 N/A ASN 381.A N SER 377.A O no hydrogen 2.679 N/A ASN 381.A ND2 CYS 375.A O no hydrogen 3.198 N/A ASN 381.A ND2 GLU 385.A O no hydrogen 2.974 N/A GLY 384.A N ASN 381.A O no hydrogen 3.044 N/A GLU 385.A N ASN 381.A OD1 no hydrogen 3.057 N/A TRP 386.A N THR 508.A O no hydrogen 2.842 N/A TRP 386.A NE1 LEU 486.A O no hydrogen 2.919 N/A ALA 390.A N THR 455.A OG1 no hydrogen 2.989 N/A THR 393.A N ASP 396.A OD2 no hydrogen 2.891 N/A ASP 396.A N THR 393.A OG1 no hydrogen 3.093 N/A GLU 397.A N THR 393.A O no hydrogen 2.930 N/A SER 398.A N GLU 394.A O no hydrogen 2.877 N/A SER 398.A OG GLU 395.A O no hydrogen 2.691 N/A LEU 399.A N GLU 395.A O no hydrogen 3.168 N/A ILE 400.A N ASP 396.A O no hydrogen 2.944 N/A GLN 401.A N GLU 397.A O no hydrogen 2.802 N/A LEU 402.A N SER 398.A O no hydrogen 3.216 N/A ILE 403.A N LEU 399.A O no hydrogen 3.069 N/A LYS 404.A N ILE 400.A O no hydrogen 2.908 N/A ASP 405.A N GLN 401.A O no hydrogen 2.939 N/A LEU 406.A N LEU 402.A O no hydrogen 3.077 N/A LEU 406.A N ILE 403.A O no hydrogen 3.358 N/A THR 409.A N ASP 405.A O no hydrogen 3.295 N/A THR 409.A OG1 ASP 405.A O no hydrogen 3.563 N/A ALA 410.A N LEU 406.A O no hydrogen 2.813 N/A ASP 411.A N PRO 407.A O no hydrogen 2.866 N/A HIS 412.A N GLY 408.A O no hydrogen 3.249 N/A TYR 413.A N THR 409.A O no hydrogen 3.130 N/A TYR 414.A N ALA 410.A O no hydrogen 2.871 N/A TYR 414.A OH LEU 470.A O no hydrogen 2.822 N/A LEU 415.A N ASP 411.A O no hydrogen 3.030 N/A LEU 415.A N HIS 412.A O no hydrogen 3.083 N/A ILE 416.A N HIS 412.A O no hydrogen 3.160 N/A ILE 416.A N TYR 413.A O no hydrogen 3.336 N/A ASP 418.A N TYR 413.A O no hydrogen 2.698 N/A GLN 420.A NE2 ARG 341.A O no hydrogen 2.944 N/A LYS 421.A N ASP 418.A OD1 no hydrogen 2.880 N/A ALA 422.A N ASP 418.A O no hydrogen 3.300 N/A ILE 423.A N ILE 419.A O no hydrogen 2.958 N/A ILE 424.A N GLN 420.A O no hydrogen 2.975 N/A ALA 425.A N LYS 421.A O no hydrogen 2.961 N/A VAL 426.A N ALA 422.A O no hydrogen 3.077 N/A PHE 427.A N ILE 423.A O no hydrogen 2.929 N/A ASP 428.A N ILE 424.A O no hydrogen 2.859 N/A VAL 429.A N ALA 425.A O no hydrogen 3.325 N/A LEU 430.A N VAL 426.A O no hydrogen 2.945 N/A ARG 431.A N PHE 427.A O no hydrogen 2.826 N/A ARG 431.A NH2 ASP 428.A OD1 no hydrogen 2.576 N/A ALA 432.A N ASP 428.A O no hydrogen 3.080 N/A ILE 433.A N VAL 429.A O no hydrogen 2.950 N/A ASN 434.A N LEU 430.A O no hydrogen 2.954 N/A ASN 434.A ND2 THR 367.A O no hydrogen 2.914 N/A ASN 434.A ND2 LEU 430.A O no hydrogen 3.045 N/A ALA 435.A N ARG 431.A O no hydrogen 2.969 N/A TYR 436.A N ALA 432.A O no hydrogen 2.973 N/A TYR 436.A OH ASP 396.A OD1 no hydrogen 2.459 N/A VAL 437.A N ILE 433.A O no hydrogen 2.903 N/A THR 438.A N ASN 434.A O no hydrogen 2.838 N/A THR 438.A OG1 ASN 434.A O no hydrogen 3.356 N/A ASP 439.A N ALA 435.A O no hydrogen 2.983 N/A MET 440.A N TYR 436.A O no hydrogen 2.853 N/A ALA 441.A N VAL 437.A O no hydrogen 2.818 N/A LYS 444.A N ALA 441.A O no hydrogen 2.938 N/A LEU 445.A N ALA 441.A O no hydrogen 3.328 N/A VAL 446.A N PRO 442.A O no hydrogen 3.121 N/A THR 448.A N LYS 444.A O no hydrogen 3.265 N/A THR 448.A N LEU 445.A O no hydrogen 3.150 N/A ASP 449.A N LEU 445.A O no hydrogen 2.917 N/A ARG 452.A N ASP 449.A OD1 no hydrogen 2.913 N/A ARG 452.A NH1 ASP 396.A OD2 no hydrogen 2.717 N/A ARG 452.A NH2 ASP 396.A OD1 no hydrogen 2.919 N/A ARG 452.A NH2 ASP 396.A OD2 no hydrogen 3.145 N/A LEU 453.A N ASP 449.A O no hydrogen 3.068 N/A ARG 454.A N PRO 450.A O no hydrogen 3.271 N/A ARG 454.A N GLU 451.A O no hydrogen 3.030 N/A ARG 454.A NH1 SER 388.A O no hydrogen 2.936 N/A VAL 456.A N ARG 452.A O no hydrogen 3.109 N/A LEU 457.A N LEU 453.A O no hydrogen 2.862 N/A TYR 458.A N ARG 454.A O no hydrogen 2.971 N/A ILE 459.A N THR 455.A O no hydrogen 2.995 N/A THR 460.A N VAL 456.A O no hydrogen 2.984 N/A THR 460.A OG1 VAL 456.A O no hydrogen 2.689 N/A LEU 461.A N LEU 457.A O no hydrogen 2.950 N/A GLU 462.A N TYR 458.A O no hydrogen 3.070 N/A GLY 463.A N ILE 459.A O no hydrogen 2.912 N/A VAL 464.A N THR 460.A O no hydrogen 2.898 N/A ARG 465.A N LEU 461.A O no hydrogen 2.857 N/A ARG 465.A NE GLU 462.A OE1 no hydrogen 2.837 N/A ARG 465.A NH1 ASN 498.A O no hydrogen 2.771 N/A ARG 465.A NH2 GLU 462.A OE2 no hydrogen 2.813 N/A ARG 465.A NH2 ASN 498.A O no hydrogen 3.214 N/A VAL 466.A N GLU 462.A O no hydrogen 3.060 N/A THR 467.A N GLY 463.A O no hydrogen 3.037 N/A THR 467.A OG1 GLY 463.A O no hydrogen 2.789 N/A THR 467.A OG1 VAL 464.A O no hydrogen 3.062 N/A THR 468.A N VAL 464.A O no hydrogen 2.964 N/A THR 468.A OG1 VAL 464.A O no hydrogen 2.574 N/A LEU 469.A N ARG 465.A O no hydrogen 2.920 N/A LEU 470.A N VAL 466.A O no hydrogen 3.070 N/A LEU 471.A N THR 467.A O no hydrogen 2.860 N/A SER 472.A N LEU 469.A O no hydrogen 3.207 N/A SER 472.A OG LEU 469.A O no hydrogen 2.560 N/A ILE 474.A N LEU 471.A O no hydrogen 2.888 N/A LEU 475.A N LEU 471.A O no hydrogen 2.874 N/A ARG 477.A NE ASP 85.A OD2 no hydrogen 2.833 N/A ARG 477.A NH2 ASP 85.A OD1 no hydrogen 2.809 N/A ARG 477.A NH2 ASP 85.A OD2 no hydrogen 3.564 N/A LYS 478.A N ASP 333.A OD2 no hydrogen 2.848 N/A LYS 478.A NZ LEU 519.A O no hydrogen 3.166 N/A SER 479.A N LEU 475.A O no hydrogen 2.866 N/A SER 479.A OG LEU 475.A O no hydrogen 2.998 N/A SER 479.A OG PRO 476.A O no hydrogen 3.009 N/A VAL 481.A N ARG 477.A O no hydrogen 3.282 N/A ILE 482.A N LYS 478.A O no hydrogen 2.859 N/A PHE 483.A N SER 479.A O no hydrogen 2.812 N/A ASP 484.A N VAL 480.A O no hydrogen 2.859 N/A MET 485.A N VAL 481.A O no hydrogen 2.923 N/A LEU 486.A N ILE 482.A O no hydrogen 2.933 N/A GLY 487.A N ASP 484.A O no hydrogen 3.202 N/A VAL 488.A N PHE 483.A O no hydrogen 2.949 N/A HIS 492.A N PRO 489.A O no hydrogen 2.928 N/A HIS 492.A ND1 ASN 498.A OD1 no hydrogen 2.656 N/A ARG 493.A N GLU 490.A O no hydrogen 2.933 N/A ARG 493.A NE VAL 488.A O no hydrogen 2.983 N/A ARG 493.A NH1 ASP 484.A OD1 no hydrogen 2.933 N/A ARG 493.A NH2 ASP 484.A OD1 no hydrogen 2.715 N/A ARG 493.A NH2 VAL 488.A O no hydrogen 2.926 N/A LYS 494.A NZ ARG 36.A O no hydrogen 3.216 N/A GLY 495.A N VAL 37.A O no hydrogen 2.660 N/A GLU 497.A N GLU 497.A OE1 no hydrogen 2.885 N/A ASN 498.A N GLY 495.A O no hydrogen 2.895 N/A ASN 498.A ND2 LYS 494.A O no hydrogen 2.839 N/A PHE 499.A N ILE 496.A O no hydrogen 3.014 N/A GLY 502.A N GLU 462.A OE2 no hydrogen 2.501 N/A GLY 507.A N TRP 386.A O no hydrogen 2.724 N/A THR 508.A N PRO 505.A O no hydrogen 3.256 N/A THR 508.A OG1 PRO 505.A O no hydrogen 2.692 N/A LEU 510.A N GLY 384.A O no hydrogen 2.931 N/A GLY 511.A N MET 485.A O no hydrogen 3.128 N/A VAL 514.A N GLU 517.A OE2 no hydrogen 3.072 N/A LYS 522.A NZ ASP 366.A OD1 no hydrogen 3.011 N/A LYS 522.A NZ ASP 366.A OD2 no hydrogen 3.129 N/A ARG 523.A N ASN 361.A OD1 no hydrogen 3.021 N/A ARG 523.A NH1 SER 521.A O no hydrogen 2.567 N/A ARG 523.A NH2 GLU 329.A O no hydrogen 3.277 N/A