Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1wcg_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): TYR 1.A OH GLU 403.A OE1 no hydrogen 2.827 N/A PHE 3.A N GLY 460.A O no hydrogen 2.842 N/A PHE 7.A N PRO 4.A O no hydrogen 3.033 N/A MET 8.A N ILE 409.A O no hydrogen 3.030 N/A GLY 10.A N TYR 411.A O no hydrogen 2.930 N/A THR 11.A OG1 VAL 413.A O.A no hydrogen 2.965 N/A THR 11.A OG1 VAL 413.A O.B no hydrogen 2.890 N/A SER 12.A N VAL 413.A O.A no hydrogen 3.019 N/A SER 12.A N VAL 413.A O.B no hydrogen 3.107 N/A SER 12.A OG THR 13.A O no hydrogen 3.165 N/A SER 12.A OG ARG 75.A O no hydrogen 3.455 N/A THR 13.A N ARG 75.A O no hydrogen 2.944 N/A THR 13.A OG1 TYR 74.A OH no hydrogen 2.695 N/A SER 15.A N SER 77.A OG no hydrogen 2.793 N/A SER 15.A OG SER 77.A OG no hydrogen 2.896 N/A SER 15.A OG ASP 122.A OD2 no hydrogen 2.723 N/A GLN 17.A NE2 PHE 420.A O no hydrogen 2.824 N/A ILE 18.A N ALA 14.A O no hydrogen 3.207 N/A ILE 18.A N SER 15.A O no hydrogen 3.344 N/A GLU 19.A N SER 15.A O no hydrogen 2.906 N/A GLU 24.A N GLY 21.A O no hydrogen 3.300 N/A LYS 27.A N GLU 24.A O no hydrogen 3.080 N/A LYS 27.A NZ TRP 22.A O no hydrogen 2.863 N/A LYS 27.A NZ GLY 28.A O no hydrogen 2.885 N/A LYS 27.A NZ ASP 33.A OD2 no hydrogen 2.766 N/A GLY 28.A N ALA 81.A O no hydrogen 2.941 N/A ASN 30.A N ASP 33.A OD2 no hydrogen 2.925 N/A ILE 31.A N LEU 123.A O no hydrogen 2.894 N/A ASP 33.A N ASN 30.A OD1 no hydrogen 2.921 N/A ARG 34.A N ASN 30.A O no hydrogen 2.993 N/A ARG 34.A NE GLU 29.A OE2 no hydrogen 2.853 N/A ARG 34.A NH2 GLU 29.A OE1 no hydrogen 2.924 N/A LEU 35.A N ILE 31.A O no hydrogen 3.006 N/A VAL 36.A N TRP 32.A O no hydrogen 2.907 N/A HIS 37.A N ASP 33.A O no hydrogen 2.994 N/A HIS 37.A NE2 ASP 50.A OD1 no hydrogen 2.677 N/A THR 38.A N ARG 34.A O no hydrogen 2.967 N/A THR 38.A OG1 ARG 34.A O no hydrogen 2.656 N/A SER 39.A N LEU 35.A O no hydrogen 2.797 N/A GLU 41.A N GLU 41.A OE1 no hydrogen 2.778 N/A VAL 42.A N SER 39.A O no hydrogen 3.075 N/A ILE 43.A N PRO 40.A O no hydrogen 3.206 N/A LYS 44.A N PHE 423.A O no hydrogen 2.759 N/A GLY 46.A N ILE 43.A O no hydrogen 2.982 N/A THR 47.A N ASP 45.A OD1 no hydrogen 3.335 N/A THR 47.A OG1 ASP 45.A OD1 no hydrogen 2.652 N/A THR 47.A OG1 ASP 45.A OD2 no hydrogen 3.391 N/A GLY 49.A N TYR 16.A OH no hydrogen 2.962 N/A ASP 50.A N ASN 48.A OD1 no hydrogen 2.852 N/A CYS 53.A N ILE 18.A O no hydrogen 3.058 N/A CYS 53.A SG ASP 418.A O no hydrogen 2.964 N/A ASP 54.A N ILE 51.A O no hydrogen 2.771 N/A SER 55.A N ILE 18.A O no hydrogen 3.103 N/A SER 55.A OG ASP 62.A OD2 no hydrogen 2.652 N/A TYR 56.A N GLU 19.A O no hydrogen 2.860 N/A TYR 56.A OH ASP 25.A OD2 no hydrogen 2.618 N/A HIS 57.A N ASP 54.A O no hydrogen 2.967 N/A HIS 57.A NE2 GLU 24.A OE1 no hydrogen 2.924 N/A LYS 58.A N ASP 54.A O no hydrogen 2.877 N/A LYS 58.A NZ GLU 61.A OE1 no hydrogen 3.273 N/A LYS 58.A NZ GLN 441.A O no hydrogen 3.105 N/A GLU 61.A N LYS 58.A O no hydrogen 2.964 N/A ASP 62.A N LYS 58.A O no hydrogen 3.285 N/A VAL 63.A N TYR 59.A O no hydrogen 2.989 N/A ALA 64.A N LYS 60.A O no hydrogen 2.977 N/A ILE 65.A N GLU 61.A O no hydrogen 3.057 N/A ILE 66.A N ASP 62.A O no hydrogen 3.039 N/A LYS 67.A N VAL 63.A O no hydrogen 2.858 N/A LYS 67.A NZ.A ASN 110.A O no hydrogen 2.965 N/A LYS 67.A NZ.B ASN 110.A O no hydrogen 2.773 N/A ASP 68.A N ALA 64.A O no hydrogen 2.963 N/A LEU 69.A N ILE 65.A O no hydrogen 2.959 N/A ASN 70.A N LYS 67.A O.A no hydrogen 3.001 N/A ASN 70.A N LYS 67.A O.B no hydrogen 2.871 N/A LEU 71.A N ILE 66.A O no hydrogen 3.378 N/A LYS 72.A N PHE 9.A O no hydrogen 2.864 N/A PHE 73.A N PHE 9.A O no hydrogen 3.459 N/A TYR 74.A N ILE 113.A O no hydrogen 2.995 N/A TYR 74.A OH THR 13.A OG1 no hydrogen 2.695 N/A ARG 75.A N THR 11.A O no hydrogen 2.865 N/A ARG 75.A NH1 SER 12.A OG no hydrogen 2.958 N/A ARG 75.A NH1 GLU 372.A OE2 no hydrogen 2.851 N/A ARG 75.A NH2 ASN 164.A OD1 no hydrogen 2.780 N/A PHE 76.A N LEU 115.A O.A no hydrogen 3.106 N/A PHE 76.A N LEU 115.A O.B no hydrogen 3.114 N/A SER 77.A OG SER 15.A OG no hydrogen 2.896 N/A ILE 78.A N THR 117.A O no hydrogen 3.036 N/A SER 79.A N TYR 100.A OH no hydrogen 2.952 N/A SER 79.A OG ASP 122.A OD2 no hydrogen 3.521 N/A TRP 80.A NE1 GLY 87.A O no hydrogen 3.088 N/A ARG 82.A N SER 79.A O no hydrogen 2.972 N/A ARG 82.A NE GLU 19.A OE1 no hydrogen 2.816 N/A ARG 82.A NH1 GLY 21.A O no hydrogen 3.081 N/A ARG 82.A NH2 GLU 19.A OE1 no hydrogen 2.964 N/A ARG 82.A NH2 GLY 20.A O no hydrogen 2.779 N/A ARG 82.A NH2 GLY 21.A O no hydrogen 3.362 N/A ILE 83.A N TRP 80.A O no hydrogen 3.044 N/A ALA 84.A N TRP 80.A O no hydrogen 2.963 N/A GLY 87.A N ALA 84.A O no hydrogen 2.836 N/A VAL 88.A N SER 86.A OG no hydrogen 3.013 N/A GLU 93.A N ILE 83.A O.A no hydrogen 2.842 N/A GLU 93.A N ILE 83.A O.B no hydrogen 2.845 N/A LYS 95.A N GLU 93.A OE2 no hydrogen 2.980 N/A GLY 96.A N GLU 93.A O no hydrogen 3.012 N/A ILE 97.A N GLU 93.A O no hydrogen 3.261 N/A ALA 98.A N PRO 94.A O no hydrogen 2.837 N/A TYR 99.A N LYS 95.A O no hydrogen 3.105 N/A TYR 99.A OH SER 55.A O no hydrogen 2.819 N/A TYR 100.A N GLY 96.A O no hydrogen 3.411 N/A TYR 100.A OH GLU 19.A OE2 no hydrogen 2.630 N/A ASN 101.A N ILE 97.A O no hydrogen 2.946 N/A ASN 102.A N ALA 98.A O no hydrogen 2.809 N/A LEU 103.A N TYR 99.A O no hydrogen 2.967 N/A ILE 104.A N TYR 100.A O no hydrogen 2.846 N/A ASN 105.A N ASN 101.A O no hydrogen 2.831 N/A GLU 106.A N ASN 102.A O no hydrogen 2.900 N/A LEU 107.A N LEU 103.A O no hydrogen 2.931 N/A ILE 108.A N ILE 104.A O no hydrogen 2.991 N/A LYS 109.A N ASN 105.A O no hydrogen 2.976 N/A ASN 110.A N GLU 106.A O no hydrogen 3.309 N/A ASN 110.A N LEU 107.A O no hydrogen 3.018 N/A ASN 110.A ND2 GLU 106.A O no hydrogen 2.861 N/A ASP 111.A N ILE 108.A O no hydrogen 2.941 N/A ILE 112.A N LEU 107.A O no hydrogen 2.943 N/A ILE 113.A N LYS 72.A O no hydrogen 2.941 N/A LEU 115.A N TYR 74.A O no hydrogen 2.938 N/A VAL 116.A N TRP 159.A O no hydrogen 3.047 N/A THR 117.A N PHE 76.A O no hydrogen 2.866 N/A MET 118.A N ILE 161.A O no hydrogen 2.797 N/A TYR 119.A N THR 162.A O no hydrogen 2.935 N/A TRP 121.A NE1 ASN 164.A O no hydrogen 2.852 N/A GLN 125.A N GLU 29.A O no hydrogen 2.884 N/A GLN 125.A NE2 ASP 129.A OD1 no hydrogen 2.955 N/A GLN 128.A N PRO 124.A O no hydrogen 3.185 N/A ASP 129.A N GLN 125.A O no hydrogen 2.906 N/A LEU 130.A N LEU 127.A O no hydrogen 3.147 N/A GLY 131.A N GLN 128.A O no hydrogen 2.770 N/A GLY 132.A N LEU 127.A O no hydrogen 3.044 N/A TRP 133.A N TYR 173.A OH no hydrogen 3.025 N/A TRP 133.A NE1 TYR 119.A OH no hydrogen 3.029 N/A ASN 135.A N GLY 132.A O no hydrogen 2.993 N/A ASN 135.A ND2 LEU 130.A O no hydrogen 2.809 N/A ILE 137.A N ASN 135.A OD1 no hydrogen 3.063 N/A MET 138.A N ASN 135.A O no hydrogen 2.939 N/A SER 139.A N PRO 136.A O.A no hydrogen 3.394 N/A SER 139.A N PRO 136.A O.B no hydrogen 3.396 N/A SER 139.A OG PRO 136.A O.A no hydrogen 3.249 N/A SER 139.A OG PRO 136.A O.B no hydrogen 3.250 N/A ASP 140.A N ILE 137.A O no hydrogen 3.132 N/A TYR 141.A N ILE 137.A O no hydrogen 3.470 N/A PHE 142.A N MET 138.A O no hydrogen 2.922 N/A LYS 143.A N SER 139.A O no hydrogen 2.978 N/A GLU 144.A N ASP 140.A O no hydrogen 3.158 N/A TYR 145.A N TYR 141.A O no hydrogen 3.071 N/A TYR 145.A OH MET 118.A O no hydrogen 2.829 N/A ALA 146.A N PHE 142.A O no hydrogen 2.854 N/A ARG 147.A N LYS 143.A O.A no hydrogen 2.960 N/A ARG 147.A N LYS 143.A O.B no hydrogen 2.963 N/A ARG 147.A NE.A GLU 144.A OE1 no hydrogen 3.071 N/A ARG 147.A NH2.A GLU 144.A OE2 no hydrogen 2.922 N/A VAL 148.A N GLU 144.A O no hydrogen 3.175 N/A LEU 149.A N TYR 145.A O no hydrogen 3.019 N/A PHE 150.A N ALA 146.A O no hydrogen 2.881 N/A THR 151.A N ARG 147.A O.A no hydrogen 2.953 N/A THR 151.A N ARG 147.A O.B no hydrogen 2.956 N/A THR 151.A OG1 ARG 147.A O.A no hydrogen 2.736 N/A THR 151.A OG1 ARG 147.A O.B no hydrogen 2.733 N/A TYR 152.A N VAL 148.A O no hydrogen 2.981 N/A PHE 153.A N LEU 149.A O no hydrogen 2.915 N/A GLY 154.A N PHE 150.A O no hydrogen 2.964 N/A ARG 156.A N PHE 153.A O no hydrogen 3.064 N/A ARG 156.A NE ASP 155.A OD1 no hydrogen 3.365 N/A ARG 156.A NE ASP 155.A OD2 no hydrogen 2.851 N/A ARG 156.A NH1 ASN 101.A OD1 no hydrogen 2.902 N/A ARG 156.A NH1 ASN 105.A OD1 no hydrogen 2.947 N/A ARG 156.A NH2 ASN 101.A OD1 no hydrogen 2.868 N/A ARG 156.A NH2 ASP 155.A OD1 no hydrogen 3.078 N/A VAL 157.A N PHE 153.A O no hydrogen 2.846 N/A LYS 158.A NZ GLY 154.A O no hydrogen 2.939 N/A LYS 158.A NZ ASP 155.A O no hydrogen 3.205 N/A LYS 158.A NZ GLN 215.A O no hydrogen 2.833 N/A TRP 160.A N LYS 218.A O no hydrogen 2.896 N/A ILE 161.A N VAL 116.A O no hydrogen 2.822 N/A THR 162.A N SER 220.A O no hydrogen 2.972 N/A THR 162.A OG1 SER 220.A O no hydrogen 3.403 N/A ASN 164.A N TYR 119.A O no hydrogen 2.976 N/A GLU 165.A N SER 222.A O no hydrogen 2.898 N/A ALA 168.A N GLU 165.A O no hydrogen 2.889 N/A VAL 169.A N GLU 165.A O no hydrogen 3.240 N/A CYS 170.A N PRO 166.A O no hydrogen 3.012 N/A CYS 170.A SG PRO 166.A O no hydrogen 3.244 N/A CYS 170.A SG HIS 189.A O no hydrogen 3.415 N/A LYS 171.A N ILE 167.A O no hydrogen 3.028 N/A GLY 172.A N ALA 168.A O no hydrogen 3.180 N/A GLY 172.A N VAL 169.A O no hydrogen 3.136 N/A TYR 173.A N CYS 170.A O no hydrogen 2.908 N/A TYR 173.A OH GLN 128.A OE1 no hydrogen 2.672 N/A SER 174.A N CYS 170.A O no hydrogen 3.010 N/A SER 174.A OG CYS 170.A O no hydrogen 3.205 N/A ILE 175.A N LYS 171.A O no hydrogen 3.098 N/A LYS 176.A N LEU 182.A O no hydrogen 2.886 N/A ALA 177.A N LYS 171.A O no hydrogen 3.409 N/A ASN 181.A N TYR 178.A O no hydrogen 2.776 N/A LEU 182.A N GLY 172.A O no hydrogen 2.974 N/A LEU 184.A N TYR 173.A O no hydrogen 2.904 N/A LYS 185.A N SER 174.A O no hydrogen 2.908 N/A LYS 185.A NZ.A ASN 183.A OD1 no hydrogen 3.402 N/A THR 187.A OG1.A LEU 184.A O no hydrogen 2.957 N/A GLY 188.A N LEU 184.A O no hydrogen 3.438 N/A HIS 189.A N LYS 185.A O no hydrogen 2.970 N/A TYR 190.A N THR 186.A O no hydrogen 3.056 N/A TYR 190.A OH ASP 325.A OD2 no hydrogen 2.624 N/A LEU 191.A N THR 187.A O.A no hydrogen 3.278 N/A LEU 191.A N THR 187.A O.B no hydrogen 3.249 N/A ALA 192.A N GLY 188.A O no hydrogen 2.968 N/A GLY 193.A N HIS 189.A O no hydrogen 3.133 N/A HIS 194.A N TYR 190.A O no hydrogen 2.941 N/A HIS 194.A ND1 TYR 262.A OH no hydrogen 2.617 N/A THR 195.A N LEU 191.A O no hydrogen 3.146 N/A THR 195.A OG1 TRP 133.A O no hydrogen 2.919 N/A THR 195.A OG1 LEU 191.A O no hydrogen 3.010 N/A GLN 196.A N ALA 192.A O no hydrogen 3.123 N/A GLN 196.A NE2 PRO 166.A O no hydrogen 3.238 N/A GLN 196.A NE2 ALA 192.A O no hydrogen 3.253 N/A LEU 197.A N GLY 193.A O no hydrogen 2.999 N/A ILE 198.A N HIS 194.A O no hydrogen 2.968 N/A ALA 199.A N THR 195.A O no hydrogen 2.871 N/A HIS 200.A N GLN 196.A O no hydrogen 2.844 N/A GLY 201.A N LEU 197.A O.A no hydrogen 2.950 N/A GLY 201.A N LEU 197.A O.B no hydrogen 2.950 N/A LYS 202.A N ILE 198.A O.A no hydrogen 2.879 N/A LYS 202.A N ILE 198.A O.B no hydrogen 2.885 N/A LYS 202.A NZ SER 139.A OG no hydrogen 2.865 N/A LYS 202.A NZ ASP 140.A OD1 no hydrogen 2.792 N/A ALA 203.A N ALA 199.A O no hydrogen 2.934 N/A TYR 204.A N HIS 200.A O no hydrogen 2.923 N/A TYR 204.A OH ASP 300.A OD1 no hydrogen 2.626 N/A ARG 205.A N GLY 201.A O no hydrogen 2.951 N/A ARG 205.A NE LEU 294.A O no hydrogen 2.827 N/A ARG 205.A NH1 GLU 208.A OE1.A no hydrogen 2.798 N/A ARG 205.A NH1 GLU 208.A OE2.B no hydrogen 3.163 N/A ARG 205.A NH2 LYS 293.A O no hydrogen 3.361 N/A ARG 205.A NH2 LEU 294.A O no hydrogen 3.170 N/A LEU 206.A N LYS 202.A O no hydrogen 2.920 N/A TYR 207.A N ALA 203.A O no hydrogen 2.926 N/A GLU 208.A N TYR 204.A O no hydrogen 2.929 N/A GLU 209.A N ARG 205.A O no hydrogen 3.049 N/A MET 210.A N LEU 206.A O.A no hydrogen 2.880 N/A MET 210.A N LEU 206.A O.B no hydrogen 2.875 N/A PHE 211.A N TYR 207.A O no hydrogen 2.930 N/A LYS 212.A N TYR 207.A O no hydrogen 2.738 N/A THR 214.A N PHE 211.A O no hydrogen 3.082 N/A THR 214.A OG1 PHE 211.A O no hydrogen 3.357 N/A GLN 215.A N PHE 211.A O no hydrogen 2.826 N/A GLN 215.A NE2 PHE 150.A O no hydrogen 2.972 N/A ASN 216.A N LYS 212.A O no hydrogen 2.917 N/A LYS 218.A N LYS 158.A O no hydrogen 2.838 N/A ILE 219.A N ASP 300.A OD2 no hydrogen 2.855 N/A SER 220.A N TRP 160.A O no hydrogen 2.937 N/A SER 220.A OG ILE 221.A O no hydrogen 3.546 N/A SER 220.A OG PHE 301.A O no hydrogen 2.664 N/A ILE 221.A N SER 220.A OG no hydrogen 2.692 N/A SER 222.A N PHE 163.A O no hydrogen 2.966 N/A SER 222.A OG THR 371.A OG1 no hydrogen 2.914 N/A ILE 223.A N ALA 303.A O no hydrogen 2.993 N/A VAL 226.A N GLU 249.A OE2 no hydrogen 2.936 N/A PHE 227.A N SER 308.A O no hydrogen 3.177 N/A MET 229.A N ARG 310.A O no hydrogen 3.017 N/A LYS 231.A N VAL 312.A O no hydrogen 2.911 N/A ASN 232.A N ASP 238.A OD2 no hydrogen 2.897 N/A GLU 234.A N ASN 232.A OD1 no hydrogen 2.958 N/A SER 235.A N ASN 232.A O no hydrogen 3.012 N/A ASP 238.A N SER 235.A OG no hydrogen 3.061 N/A ILE 239.A N SER 235.A O no hydrogen 2.949 N/A GLU 240.A N ASP 236.A O no hydrogen 2.925 N/A THR 241.A N ASP 237.A O no hydrogen 2.909 N/A THR 241.A OG1 ASP 237.A O no hydrogen 3.022 N/A ALA 242.A N ASP 238.A O no hydrogen 2.862 N/A GLU 243.A N ILE 239.A O no hydrogen 3.070 N/A ARG 244.A N GLU 240.A O no hydrogen 3.026 N/A ARG 244.A NE ALA 326.A O no hydrogen 2.763 N/A ARG 244.A NH2 ALA 326.A O no hydrogen 3.002 N/A ARG 244.A NH2 SER 327.A O no hydrogen 3.257 N/A ALA 245.A N THR 241.A O no hydrogen 2.845 N/A ASN 246.A N ALA 242.A O no hydrogen 2.863 N/A GLN 247.A N GLU 243.A O no hydrogen 2.902 N/A GLN 247.A NE2 GLU 243.A OE2 no hydrogen 3.523 N/A GLN 247.A NE2 GLU 362.A OE2 no hydrogen 3.076 N/A PHE 248.A N ARG 244.A O no hydrogen 2.894 N/A GLU 249.A N ALA 245.A O no hydrogen 2.938 N/A ARG 250.A N ASN 246.A O no hydrogen 3.016 N/A ARG 250.A NH2 GLY 225.A O no hydrogen 2.987 N/A GLY 251.A N ASN 246.A O no hydrogen 3.344 N/A TRP 252.A N GLN 247.A O no hydrogen 2.808 N/A PHE 253.A N ARG 250.A O no hydrogen 3.217 N/A GLY 254.A N ARG 250.A O no hydrogen 2.975 N/A HIS 255.A N GLY 251.A O no hydrogen 2.801 N/A TYR 258.A N GLY 254.A O no hydrogen 2.883 N/A TYR 258.A OH.B PHE 301.A O no hydrogen 3.324 N/A LYS 259.A N HIS 255.A O no hydrogen 2.796 N/A LYS 259.A NZ GLU 362.A OE2 no hydrogen 2.852 N/A GLY 260.A N HIS 255.A O no hydrogen 2.828 N/A TYR 262.A N ASP 261.A OD1 no hydrogen 2.789 N/A TYR 262.A OH HIS 194.A ND1 no hydrogen 2.617 N/A MET 266.A N PRO 263.A O no hydrogen 2.979 N/A LYS 267.A N PRO 263.A O no hydrogen 3.221 N/A LYS 267.A NZ ASP 261.A OD2 no hydrogen 2.695 N/A LYS 268.A N PRO 264.A O no hydrogen 3.033 N/A TRP 269.A N ILE 265.A O no hydrogen 3.047 N/A VAL 270.A N MET 266.A O no hydrogen 2.826 N/A ASP 271.A N LYS 267.A O no hydrogen 2.986 N/A GLN 272.A N LYS 268.A O no hydrogen 3.096 N/A GLN 272.A NE2 GLU 276.A OE2 no hydrogen 3.020 N/A LYS 273.A N TRP 269.A O no hydrogen 2.907 N/A LYS 273.A NZ SER 327.A OG no hydrogen 2.878 N/A SER 274.A N VAL 270.A O no hydrogen 2.899 N/A SER 274.A OG VAL 270.A O no hydrogen 2.731 N/A LYS 275.A N ASP 271.A O no hydrogen 3.054 N/A GLU 276.A N GLN 272.A O no hydrogen 2.931 N/A GLU 277.A N LYS 273.A O no hydrogen 2.973 N/A GLY 278.A N LYS 275.A O no hydrogen 2.938 N/A LEU 279.A N SER 274.A O no hydrogen 3.061 N/A SER 282.A OG ASP 271.A OD1 no hydrogen 2.659 N/A LYS 283.A N SER 274.A OG no hydrogen 2.937 N/A LYS 283.A NZ THR 186.A OG1 no hydrogen 2.811 N/A LYS 283.A NZ GLU 277.A OE2 no hydrogen 2.754 N/A LYS 283.A NZ ASP 325.A OD1 no hydrogen 2.810 N/A LYS 283.A NZ ASP 325.A OD2 no hydrogen 3.169 N/A LEU 284.A N SER 282.A OG no hydrogen 3.105 N/A THR 288.A N GLU 291.A OE1 no hydrogen 2.957 N/A GLU 291.A N THR 288.A OG1 no hydrogen 3.041 N/A ILE 292.A N THR 288.A O no hydrogen 2.963 N/A LYS 293.A N LYS 289.A O no hydrogen 3.152 N/A LEU 294.A N ASP 290.A O no hydrogen 2.858 N/A LEU 295.A N GLU 291.A O no hydrogen 3.003 N/A LYS 296.A N ILE 292.A O no hydrogen 3.000 N/A GLY 297.A N VAL 257.A O no hydrogen 2.780 N/A THR 298.A N LEU 295.A O no hydrogen 3.296 N/A THR 298.A OG1 LEU 295.A O no hydrogen 2.699 N/A ASP 300.A N ILE 219.A O no hydrogen 2.864 N/A TYR 302.A N GLN 367.A O no hydrogen 2.750 N/A LEU 304.A N LEU 369.A O no hydrogen 2.955 N/A ASN 305.A N ILE 223.A O no hydrogen 3.183 N/A ASN 305.A ND2 ASN 164.A OD1 no hydrogen 2.949 N/A ASN 305.A ND2 GLU 165.A OE2 no hydrogen 2.990 N/A HIS 306.A N GLU 372.A O no hydrogen 2.940 N/A TYR 307.A OH GLU 372.A OE1 no hydrogen 2.600 N/A SER 308.A OG ILE 346.A O no hydrogen 2.699 N/A SER 309.A N SER 308.A OG no hydrogen 2.829 N/A ARG 310.A N PHE 227.A O no hydrogen 2.856 N/A ARG 310.A NH1 SER 308.A OG no hydrogen 3.024 N/A ARG 310.A NH1 SER 309.A O no hydrogen 2.855 N/A LEU 311.A N SER 331.A O no hydrogen 2.910 N/A VAL 312.A N MET 229.A O no hydrogen 2.861 N/A THR 313.A N VAL 329.A O no hydrogen 3.233 N/A THR 313.A OG1 ASP 238.A OD1 no hydrogen 2.686 N/A GLY 315.A N SER 327.A O no hydrogen 3.118 N/A ASN 319.A N ASP 317.A OD1 no hydrogen 2.860 N/A ASN 321.A N ASN 319.A OD1 no hydrogen 2.912 N/A PHE 322.A N ASN 319.A O no hydrogen 3.143 N/A ASN 323.A ND2 TYR 190.A OH no hydrogen 2.914 N/A ASP 325.A N ASN 323.A OD1 no hydrogen 2.863 N/A ALA 326.A N ASN 323.A O no hydrogen 3.124 N/A SER 327.A N PRO 324.A O no hydrogen 3.150 N/A VAL 329.A N THR 313.A O no hydrogen 2.890 N/A THR 330.A N ASP 317.A OD2 no hydrogen 2.789 N/A THR 330.A OG1 ASP 317.A OD2 no hydrogen 2.628 N/A SER 331.A N LEU 311.A O no hydrogen 2.868 N/A ALA 335.A N ASP 333.A OD1 no hydrogen 2.875 N/A TRP 336.A N ASP 333.A O no hydrogen 2.873 N/A LEU 337.A N GLU 334.A O no hydrogen 3.102 N/A ASN 340.A N LYS 338.A O no hydrogen 2.769 N/A TYR 344.A OH GLU 421.A OE2 no hydrogen 2.750 N/A VAL 348.A N TYR 393.A OH no hydrogen 2.790 N/A GLY 351.A N VAL 348.A O no hydrogen 2.880 N/A LEU 352.A N PRO 349.A O no hydrogen 3.019 N/A ARG 353.A N PRO 349.A O no hydrogen 3.356 N/A ARG 353.A NE GLU 350.A OE1 no hydrogen 3.237 N/A ARG 353.A NH2 GLU 350.A OE2 no hydrogen 2.950 N/A LYS 354.A N GLU 350.A O no hydrogen 2.975 N/A LEU 355.A N GLY 351.A O no hydrogen 2.826 N/A LEU 356.A N LEU 352.A O no hydrogen 2.889 N/A ILE 357.A N ARG 353.A O no hydrogen 3.156 N/A TRP 358.A N LYS 354.A O no hydrogen 2.873 N/A TRP 358.A NE1 GLU 243.A OE1 no hydrogen 2.894 N/A LEU 359.A N LEU 355.A O no hydrogen 2.866 N/A LYS 360.A N LEU 356.A O no hydrogen 2.912 N/A LYS 360.A NZ ASP 404.A O no hydrogen 2.723 N/A ASN 361.A N ILE 357.A O no hydrogen 2.933 N/A GLU 362.A N TRP 358.A O no hydrogen 2.868 N/A TYR 363.A N LEU 359.A O no hydrogen 2.978 N/A ASN 365.A N LYS 360.A O no hydrogen 2.853 N/A ASN 365.A ND2 LYS 405.A O no hydrogen 2.888 N/A LEU 368.A N ASN 407.A O.A no hydrogen 2.887 N/A LEU 368.A N ASN 407.A O.B no hydrogen 2.888 N/A LEU 369.A N TYR 302.A O no hydrogen 2.800 N/A ILE 370.A N GLY 410.A O no hydrogen 3.078 N/A THR 371.A N LEU 304.A O no hydrogen 2.743 N/A THR 371.A OG1 SER 222.A OG no hydrogen 2.914 N/A THR 371.A OG1 LEU 304.A O no hydrogen 3.292 N/A THR 371.A OG1 ASN 305.A OD1 no hydrogen 2.698 N/A GLU 372.A N LEU 304.A O no hydrogen 3.488 N/A ASN 373.A N THR 412.A O no hydrogen 3.060 N/A ASN 373.A ND2 TYR 411.A OH no hydrogen 2.637 N/A ASP 377.A N HIS 429.A O no hydrogen 3.000 N/A GLY 379.A N ASP 377.A OD1 no hydrogen 2.822 N/A GLN 380.A N ASP 378.A OD1.B no hydrogen 2.965 N/A GLN 380.A NE2.B GLN 380.A O.B no hydrogen 3.096 N/A PHE 384.A N ASP 382.A O no hydrogen 2.976 N/A LYS 386.A NZ ASP 377.A OD2 no hydrogen 3.275 N/A LYS 386.A NZ ASP 383.A OD2 no hydrogen 2.694 N/A LYS 386.A NZ GLY 431.A O no hydrogen 3.318 N/A ILE 387.A N ASP 383.A O no hydrogen 3.048 N/A SER 388.A N PHE 384.A O no hydrogen 2.889 N/A SER 388.A OG.B PHE 384.A O no hydrogen 2.791 N/A TYR 389.A N GLU 385.A O no hydrogen 3.001 N/A TYR 389.A OH TYR 307.A O no hydrogen 2.717 N/A TYR 389.A OH ASN 373.A OD1 no hydrogen 3.022 N/A LEU 390.A N LYS 386.A O no hydrogen 2.966 N/A LYS 391.A N ILE 387.A O no hydrogen 2.839 N/A ASN 392.A N SER 388.A O.A no hydrogen 2.879 N/A ASN 392.A N SER 388.A O.B no hydrogen 2.894 N/A TYR 393.A N TYR 389.A O no hydrogen 2.906 N/A TYR 393.A OH TYR 307.A O no hydrogen 2.857 N/A LEU 394.A N LEU 390.A O no hydrogen 2.820 N/A ASN 395.A N LYS 391.A O no hydrogen 2.888 N/A ALA 396.A N ASN 392.A O no hydrogen 2.938 N/A THR 397.A N TYR 393.A O no hydrogen 2.968 N/A THR 397.A OG1 TYR 393.A O no hydrogen 2.914 N/A LEU 398.A N LEU 394.A O no hydrogen 2.985 N/A GLN 399.A N ASN 395.A O no hydrogen 2.942 N/A ALA 400.A N ALA 396.A O no hydrogen 3.018 N/A MET 401.A N THR 397.A O no hydrogen 2.933 N/A TYR 402.A N LEU 398.A O no hydrogen 2.893 N/A GLU 403.A N GLN 399.A O no hydrogen 2.784 N/A ASP 404.A N ALA 400.A O no hydrogen 3.193 N/A CYS 406.A N ALA 400.A O no hydrogen 3.015 N/A CYS 406.A SG ALA 400.A O no hydrogen 3.552 N/A ASN 407.A N ASN 365.A OD1 no hydrogen 2.937 N/A ASN 407.A ND2.B ASN 365.A O no hydrogen 2.955 N/A VAL 408.A N CYS 406.A O no hydrogen 2.893 N/A ILE 409.A N LEU 368.A O no hydrogen 2.769 N/A TYR 411.A N MET 8.A O no hydrogen 2.898 N/A THR 412.A OG1 ILE 370.A O no hydrogen 2.726 N/A VAL 413.A N GLY 10.A O no hydrogen 3.057 N/A TRP 414.A N ASN 373.A O no hydrogen 2.844 N/A SER 415.A N PHE 430.A O no hydrogen 3.206 N/A SER 415.A OG SER 12.A O no hydrogen 2.741 N/A SER 415.A OG LEU 417.A O no hydrogen 3.212 N/A ASP 418.A N VAL 433.A O no hydrogen 3.044 N/A ASN 419.A ND2 LEU 417.A O no hydrogen 2.930 N/A PHE 420.A N GLN 17.A O no hydrogen 3.051 N/A GLU 421.A N GLY 425.A O no hydrogen 2.787 N/A TYR 424.A N GLU 421.A O no hydrogen 2.886 N/A GLY 425.A N TRP 422.A O no hydrogen 2.921 N/A TYR 426.A N ASP 45.A OD2 no hydrogen 2.923 N/A TYR 426.A OH ASN 48.A O no hydrogen 2.704 N/A SER 427.A N TYR 424.A O no hydrogen 3.228 N/A SER 427.A OG TYR 424.A O no hydrogen 2.638 N/A HIS 429.A N ASP 377.A O no hydrogen 2.884 N/A HIS 429.A ND1 ASP 377.A O no hydrogen 3.155 N/A GLY 431.A N ASP 418.A OD1 no hydrogen 2.993 N/A LEU 432.A N SER 415.A O no hydrogen 2.978 N/A VAL 433.A N LEU 416.A O no hydrogen 3.032 N/A LYS 434.A N THR 445.A O no hydrogen 2.748 N/A ILE 435.A N ASP 418.A OD2 no hydrogen 3.426 N/A ASP 436.A N THR 443.A O no hydrogen 3.051 N/A ASN 438.A N ASP 436.A OD1 no hydrogen 3.004 N/A ASP 439.A N ASP 436.A O no hydrogen 3.190 N/A GLN 441.A N ASP 439.A OD1 no hydrogen 2.898 N/A ARG 442.A N ASP 439.A O no hydrogen 2.801 N/A ARG 442.A NE ALA 52.A O no hydrogen 2.787 N/A ARG 442.A NH1 ASP 439.A O no hydrogen 2.813 N/A THR 443.A OG1 ASP 439.A OD2 no hydrogen 2.589 N/A ARG 444.A NH1 CYS 53.A O no hydrogen 2.857 N/A ARG 444.A NH1 ARG 442.A O no hydrogen 2.829 N/A ARG 444.A NH2 CYS 53.A O no hydrogen 3.246 N/A ARG 444.A NH2 ASP 62.A OD1 no hydrogen 2.933 N/A THR 445.A N LYS 434.A O no hydrogen 2.881 N/A LYS 446.A NZ ASP 68.A OD2 no hydrogen 3.566 N/A ARG 447.A N LEU 432.A O no hydrogen 2.965 N/A ARG 447.A NE GLY 379.A O no hydrogen 3.113 N/A ARG 447.A NE GLN 380.A O.A no hydrogen 3.117 N/A ARG 447.A NE GLN 380.A O.B no hydrogen 3.115 N/A ARG 447.A NH1 ASP 418.A OD1 no hydrogen 2.804 N/A ARG 447.A NH1 ASP 418.A OD2 no hydrogen 3.392 N/A ARG 447.A NH1 GLY 431.A O no hydrogen 2.898 N/A ARG 447.A NH2 GLY 379.A O no hydrogen 2.929 N/A ARG 447.A NH2 ASP 418.A OD1 no hydrogen 3.480 N/A ARG 447.A NH2 ASP 418.A OD2 no hydrogen 2.778 N/A GLU 448.A N LEU 381.A O no hydrogen 2.982 N/A SER 449.A N ASP 383.A OD1 no hydrogen 2.868 N/A SER 449.A OG ASP 383.A OD1 no hydrogen 3.539 N/A SER 449.A OG ASP 383.A OD2 no hydrogen 2.580 N/A TYR 450.A N ARG 447.A O no hydrogen 3.071 N/A TYR 450.A OH ILE 65.A O no hydrogen 3.347 N/A TYR 450.A OH ASP 68.A OD2 no hydrogen 2.673 N/A TYR 452.A N GLU 448.A O no hydrogen 3.121 N/A TYR 452.A OH PRO 462.A OXT no hydrogen 2.703 N/A PHE 453.A N SER 449.A O no hydrogen 2.883 N/A LYS 454.A N TYR 450.A O no hydrogen 2.925 N/A LYS 454.A NZ ASP 68.A OD1 no hydrogen 3.290 N/A LYS 454.A NZ ASP 68.A OD2 no hydrogen 2.872 N/A ASN 455.A N THR 451.A O no hydrogen 3.044 N/A VAL 456.A N TYR 452.A O no hydrogen 3.009 N/A VAL 457.A N PHE 453.A O no hydrogen 2.893 N/A SER 458.A N LYS 454.A O no hydrogen 3.157 N/A THR 459.A N ASN 455.A O no hydrogen 2.957 N/A THR 459.A OG1 ASN 455.A O no hydrogen 2.946 N/A GLY 460.A N VAL 456.A O no hydrogen 2.682 N/A LYS 461.A N THR 459.A OG1 no hydrogen 3.121 N/A