Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4yw9_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLY 1.A N LEU 22.A O no hydrogen 3.004 N/A GLY 1.A N ASP 23.A O no hydrogen 3.248 N/A GLY 1.A N LEU 25.A O no hydrogen 2.594 N/A SER 2.A N GLN 27.A OE1 no hydrogen 2.923 N/A SER 2.A OG GLN 27.A OE1 no hydrogen 3.014 N/A LEU 11.A N GLN 6.A OE1 no hydrogen 2.795 N/A ASP 12.A N GLN 6.A OE1 no hydrogen 3.191 N/A PHE 13.A N GLU 34.A OE1 no hydrogen 2.827 N/A SER 14.A N ASP 12.A OD1 no hydrogen 2.945 N/A SER 14.A OG ASP 12.A OD1 no hydrogen 2.695 N/A LYS 16.A N PHE 13.A O no hydrogen 2.988 N/A LYS 16.A NZ.B GLU 43.A O no hydrogen 3.414 N/A VAL 17.A N SER 14.A O no hydrogen 3.126 N/A ILE 18.A N ILE 45.A O no hydrogen 2.858 N/A GLN 19.A NE2 ILE 47.A O no hydrogen 2.953 N/A GLN 19.A NE2 GLU 54.A OE1 no hydrogen 2.668 N/A SER 24.A N SER 21.A O no hydrogen 3.212 N/A SER 24.A OG SER 21.A O no hydrogen 2.919 N/A LEU 25.A N LEU 22.A O no hydrogen 3.310 N/A GLN 27.A NE2 GLN 27.A O no hydrogen 2.936 N/A ARG 30.A N PRO 26.A O no hydrogen 2.953 N/A ARG 30.A NE GLU 34.A OE2 no hydrogen 2.916 N/A ARG 30.A NH1 GLY 1.A O no hydrogen 2.919 N/A ARG 30.A NH1 ASP 23.A OD1 no hydrogen 3.024 N/A ARG 30.A NH2 GLU 34.A OE1 no hydrogen 3.015 N/A ARG 30.A NH2 GLU 34.A OE2 no hydrogen 3.453 N/A LYS 31.A N GLN 27.A O no hydrogen 3.048 N/A LYS 31.A NZ GLU 28.A OE1 no hydrogen 2.863 N/A PHE 32.A N GLU 28.A O no hydrogen 3.064 N/A VAL 33.A N VAL 29.A O no hydrogen 2.912 N/A GLU 34.A N ARG 30.A O no hydrogen 2.725 N/A GLY 35.A N LYS 31.A O no hydrogen 2.889 N/A ASN 36.A N PHE 32.A O no hydrogen 3.198 N/A ASN 36.A ND2 PHE 32.A O no hydrogen 3.074 N/A ALA 37.A N VAL 33.A O no hydrogen 2.851 N/A GLN 38.A N GLU 34.A O no hydrogen 2.872 N/A GLN 38.A NE2 LEU 11.A O no hydrogen 2.827 N/A LEU 39.A N GLY 35.A O no hydrogen 3.079 N/A CYS 40.A N ASN 36.A O no hydrogen 2.801 N/A CYS 40.A SG ASN 36.A O no hydrogen 3.428 N/A CYS 40.A SG PHE 132.A O no hydrogen 3.993 N/A GLN 41.A N ALA 37.A O no hydrogen 2.833 N/A GLN 41.A NE2.B GLN 38.A O no hydrogen 2.728 N/A GLU 43.A N ARG 139.A O no hydrogen 2.775 N/A TYR 44.A N ARG 139.A O no hydrogen 3.432 N/A ILE 45.A N LYS 16.A O no hydrogen 2.880 N/A HIS 46.A N MET 141.A O no hydrogen 2.954 N/A HIS 46.A NE2 GLU 54.A OE1 no hydrogen 2.823 N/A ILE 47.A N GLN 19.A O no hydrogen 2.948 N/A CYS 48.A N VAL 143.A O no hydrogen 2.864 N/A CYS 48.A SG VAL 143.A O no hydrogen 3.375 N/A ASP 49.A N GLU 54.A OE1 no hydrogen 2.951 N/A GLY 50.A N GLU 54.A OE2 no hydrogen 2.809 N/A SER 51.A N ASP 49.A OD1 no hydrogen 2.836 N/A SER 51.A OG ASP 49.A OD1 no hydrogen 2.762 N/A SER 51.A OG ASP 49.A OD2 no hydrogen 3.517 N/A GLU 54.A N SER 51.A OG no hydrogen 3.068 N/A TYR 55.A N SER 51.A O no hydrogen 3.083 N/A GLY 56.A N GLU 52.A O no hydrogen 2.892 N/A ARG 57.A N GLU 53.A O no hydrogen 2.968 N/A LEU 58.A N GLU 54.A O no hydrogen 3.030 N/A LEU 59.A N TYR 55.A O no hydrogen 2.855 N/A ALA 60.A N GLY 56.A O no hydrogen 2.998 N/A HIS 61.A N ARG 57.A O no hydrogen 2.864 N/A HIS 61.A ND1 GLU 64.A OE2 no hydrogen 2.969 N/A MET 62.A N LEU 58.A O no hydrogen 2.958 N/A GLN 63.A N LEU 59.A O no hydrogen 2.878 N/A GLU 64.A N ALA 60.A O no hydrogen 2.768 N/A GLU 65.A N HIS 61.A O no hydrogen 3.090 N/A GLY 66.A N GLN 63.A O no hydrogen 3.030 N/A VAL 67.A N MET 62.A O no hydrogen 2.979 N/A ILE 68.A N MET 62.A O no hydrogen 3.432 N/A ARG 69.A N LEU 79.A O no hydrogen 2.869 N/A ARG 69.A NE GLU 364.A OE1 no hydrogen 2.797 N/A ARG 69.A NH2 GLU 364.A OE2 no hydrogen 3.139 N/A LEU 71.A N CYS 77.A O no hydrogen 2.833 N/A LYS 73.A N GLY 368.A O no hydrogen 3.003 N/A LYS 73.A NZ.A ASP 367.A OD2 no hydrogen 3.039 N/A TYR 74.A N LEU 71.A O no hydrogen 3.151 N/A ASP 75.A N GLN 354.A O no hydrogen 3.274 N/A ASN 76.A ND2 ASN 356.A OD1 no hydrogen 2.951 N/A CYS 77.A SG ASP 75.A O no hydrogen 3.630 N/A CYS 77.A SG ILE 353.A O no hydrogen 3.768 N/A TRP 78.A N THR 357.A O no hydrogen 2.991 N/A TRP 78.A NE1 ASN 76.A OD1 no hydrogen 2.913 N/A LEU 79.A N ARG 69.A O no hydrogen 2.768 N/A ALA 80.A N PHE 359.A O no hydrogen 2.844 N/A THR 82.A N ASN 361.A OD1 no hydrogen 2.840 N/A THR 82.A OG1 ASP 83.A O no hydrogen 3.024 N/A THR 82.A OG1 ASP 86.A O no hydrogen 3.013 N/A ARG 85.A N ASP 83.A OD1 no hydrogen 2.985 N/A ARG 85.A NE ASP 83.A OD1 no hydrogen 3.148 N/A ARG 85.A NE ASP 83.A OD2 no hydrogen 3.384 N/A ARG 85.A NH2 ASP 83.A OD2 no hydrogen 2.745 N/A ASP 86.A N ASP 83.A O no hydrogen 2.815 N/A ARG 89.A NH1 GLU 91.A OE2.B no hydrogen 3.101 N/A LYS 93.A N ILE 90.A O no hydrogen 2.984 N/A THR 94.A N GLU 91.A O no hydrogen 3.036 N/A THR 94.A OG1 ILE 90.A O no hydrogen 2.727 N/A VAL 95.A N ILE 221.A O no hydrogen 2.861 N/A ILE 96.A N ARG 117.A O no hydrogen 2.913 N/A ILE 97.A N HIS 223.A O no hydrogen 2.896 N/A THR 98.A OG1 GLU 100.A O no hydrogen 2.786 N/A THR 98.A OG1 THR 104.A OG1 no hydrogen 2.786 N/A ASP 103.A N GLU 100.A O no hydrogen 3.086 N/A THR 104.A N GLN 101.A O no hydrogen 2.835 N/A THR 104.A OG1 THR 98.A OG1 no hydrogen 2.786 N/A VAL 105.A N GLN 101.A O no hydrogen 3.069 N/A LYS 109.A N ASP 590.A O no hydrogen 2.850 N/A SER 110.A N ASP 590.A OD1 no hydrogen 2.862 N/A SER 110.A OG ASP 590.A OD1 no hydrogen 3.070 N/A GLY 111.A N ASP 590.A OD1 no hydrogen 2.909 N/A GLN 112.A NE2.B GLN 114.A OE1.B no hydrogen 2.574 N/A GLN 114.A N GLN 591.A OE1 no hydrogen 2.791 N/A LEU 115.A N SER 113.A OG no hydrogen 3.112 N/A TRP 118.A NE1 THR 98.A O no hydrogen 2.869 N/A MET 119.A N ILE 96.A O no hydrogen 2.977 N/A SER 120.A OG GLU 122.A OE1 no hydrogen 3.442 N/A SER 120.A OG ASP 123.A OD2 no hydrogen 2.992 N/A ASP 123.A N SER 120.A OG no hydrogen 3.029 N/A PHE 124.A N SER 120.A O no hydrogen 2.878 N/A GLU 125.A N GLU 121.A O no hydrogen 2.916 N/A LYS 126.A N GLU 122.A O no hydrogen 3.165 N/A LYS 126.A NZ.B GLU 122.A O no hydrogen 2.746 N/A ALA 127.A N ASP 123.A O no hydrogen 2.980 N/A PHE 128.A N PHE 124.A O no hydrogen 2.760 N/A ASN 129.A N GLU 125.A O no hydrogen 2.947 N/A ALA 130.A N LYS 126.A O no hydrogen 3.149 N/A ALA 130.A N ALA 127.A O no hydrogen 3.216 N/A ARG 131.A N PHE 128.A O no hydrogen 3.059 N/A ARG 131.A NE LEU 218.A O no hydrogen 2.790 N/A ARG 131.A NH1 ALA 127.A O no hydrogen 2.950 N/A PHE 132.A N PHE 128.A O no hydrogen 2.991 N/A GLY 134.A N LEU 39.A O no hydrogen 2.883 N/A CYS 135.A N PHE 132.A O no hydrogen 2.876 N/A CYS 135.A SG PHE 132.A O no hydrogen 3.239 N/A CYS 135.A SG SER 197.A OG no hydrogen 3.377 N/A MET 136.A N CYS 40.A O no hydrogen 2.865 N/A LYS 137.A N GLY 134.A O no hydrogen 3.197 N/A ARG 139.A N MET 136.A O no hydrogen 2.868 N/A ARG 139.A NE CYS 200.A O no hydrogen 3.042 N/A ARG 139.A NH2 CYS 200.A O no hydrogen 2.776 N/A MET 141.A N TYR 44.A O no hydrogen 2.802 N/A TYR 142.A N THR 163.A O no hydrogen 2.731 N/A VAL 143.A N HIS 46.A O no hydrogen 2.854 N/A ILE 144.A N GLU 161.A O no hydrogen 2.807 N/A PHE 146.A N GLY 159.A O no hydrogen 2.899 N/A SER 147.A N ARG 177.A O no hydrogen 2.828 N/A SER 147.A OG GLY 149.A O no hydrogen 2.908 N/A MET 148.A N LYS 157.A O no hydrogen 2.833 N/A GLY 149.A N PRO 330.A O no hydrogen 2.935 N/A SER 153.A N PRO 150.A O no hydrogen 2.884 N/A SER 153.A OG PRO 422.A O no hydrogen 2.660 N/A LEU 155.A N SER 153.A OG no hydrogen 2.971 N/A ALA 156.A N SER 153.A O no hydrogen 3.016 N/A LYS 157.A N MET 148.A O no hydrogen 2.990 N/A LYS 157.A NZ GLU 260.A OE1 no hydrogen 2.801 N/A LYS 157.A NZ GLU 260.A OE2 no hydrogen 3.432 N/A GLY 159.A N PHE 146.A O no hydrogen 2.814 N/A ILE 160.A N ILE 192.A O no hydrogen 3.031 N/A GLU 161.A N ILE 144.A O no hydrogen 2.857 N/A LEU 162.A N CYS 194.A O no hydrogen 2.835 N/A THR 163.A N TYR 142.A O no hydrogen 3.035 N/A THR 163.A OG1 HIS 196.A ND1 no hydrogen 2.806 N/A SER 165.A N THR 163.A OG1 no hydrogen 2.978 N/A TYR 167.A OH THR 360.A OG1 no hydrogen 2.702 N/A VAL 168.A N SER 165.A OG no hydrogen 3.195 N/A VAL 169.A N SER 165.A O no hydrogen 3.147 N/A ALA 170.A N PRO 166.A O no hydrogen 2.911 N/A SER 171.A N TYR 167.A O no hydrogen 2.930 N/A SER 171.A OG TYR 167.A O no hydrogen 2.978 N/A MET 172.A N VAL 168.A O no hydrogen 2.773 N/A ARG 173.A N VAL 169.A O no hydrogen 3.027 N/A ARG 173.A NE GLY 50.A O no hydrogen 3.074 N/A ARG 173.A NH2 GLY 50.A O no hydrogen 2.911 N/A MET 175.A N SER 171.A O no hydrogen 2.945 N/A THR 176.A N MET 172.A O no hydrogen 2.956 N/A THR 176.A OG1 MET 172.A O no hydrogen 2.764 N/A ARG 177.A N SER 147.A O no hydrogen 3.356 N/A ARG 177.A NH1 GLU 331.A O no hydrogen 2.969 N/A ARG 177.A NH2 GLU 420.A OE1 no hydrogen 3.037 N/A GLY 179.A N PRO 145.A O no hydrogen 2.962 N/A THR 180.A N ASP 49.A O no hydrogen 3.042 N/A VAL 182.A N GLY 179.A O no hydrogen 3.076 N/A GLU 184.A N THR 180.A O no hydrogen 3.071 N/A ALA 185.A N SER 181.A O no hydrogen 2.925 N/A LEU 186.A N VAL 182.A O no hydrogen 2.818 N/A GLY 187.A N LEU 183.A O no hydrogen 3.140 N/A GLY 189.A N LEU 186.A O no hydrogen 2.967 N/A ILE 192.A N ILE 158.A O no hydrogen 2.965 N/A LYS 193.A N ARG 228.A O no hydrogen 2.959 N/A CYS 194.A N ILE 160.A O no hydrogen 2.887 N/A CYS 194.A SG ILE 192.A O no hydrogen 3.713 N/A LEU 195.A N ILE 230.A O no hydrogen 2.864 N/A HIS 196.A N LEU 162.A O no hydrogen 2.761 N/A HIS 196.A ND1 THR 163.A OG1 no hydrogen 2.806 N/A HIS 196.A NE2 SER 235.A O no hydrogen 2.880 N/A SER 197.A N SER 232.A O no hydrogen 3.127 N/A SER 197.A OG ASP 164.A OD2 no hydrogen 2.738 N/A VAL 198.A N ASP 164.A OD1 no hydrogen 2.959 N/A GLY 199.A N SER 197.A OG no hydrogen 2.992 N/A CYS 200.A SG VAL 198.A O no hydrogen 3.841 N/A CYS 200.A SG CYS 214.A O no hydrogen 2.993 N/A LEU 202.A N LYS 137.A O no hydrogen 2.881 N/A ASN 210.A ND2 THR 82.A O no hydrogen 3.305 N/A TRP 212.A N VAL 209.A O no hydrogen 3.099 N/A TRP 212.A NE1 ASP 86.A OD2 no hydrogen 2.722 N/A CYS 214.A SG ASP 83.A OD2 no hydrogen 3.455 N/A CYS 214.A SG TRP 212.A O no hydrogen 3.874 N/A ASN 215.A N GLY 234.A O no hydrogen 2.745 N/A ASN 215.A ND2 GLY 199.A O no hydrogen 3.076 N/A GLU 217.A N GLU 217.A OE2 no hydrogen 2.778 N/A LEU 218.A N ASN 215.A O no hydrogen 3.172 N/A LEU 218.A N ASN 215.A OD1 no hydrogen 3.315 N/A THR 219.A N PRO 216.A O no hydrogen 3.200 N/A THR 219.A OG1 ASN 215.A O no hydrogen 2.853 N/A THR 219.A OG1 PRO 216.A O no hydrogen 3.484 N/A LEU 220.A N PHE 233.A O no hydrogen 2.952 N/A ILE 221.A N LYS 93.A O no hydrogen 2.710 N/A ALA 222.A N ILE 231.A O no hydrogen 2.813 N/A HIS 223.A N VAL 95.A O no hydrogen 2.987 N/A HIS 223.A ND1 VAL 95.A O no hydrogen 2.825 N/A LEU 224.A N GLU 229.A O no hydrogen 2.779 N/A ARG 227.A N LEU 224.A O no hydrogen 2.940 N/A ARG 227.A NE.A GLU 229.A OE2 no hydrogen 3.231 N/A ARG 228.A N PRO 225.A O no hydrogen 3.115 N/A ARG 228.A NH1 PRO 225.A O no hydrogen 3.243 N/A ARG 228.A NH1 GLU 259.A OE1 no hydrogen 2.875 N/A ARG 228.A NH1 GLU 259.A OE2 no hydrogen 3.545 N/A ARG 228.A NH2 GLU 259.A OE2 no hydrogen 2.880 N/A GLU 229.A N LEU 224.A O no hydrogen 3.144 N/A ILE 230.A N LYS 193.A O no hydrogen 2.807 N/A ILE 231.A N ALA 222.A O no hydrogen 2.921 N/A SER 232.A N LEU 195.A O no hydrogen 2.818 N/A SER 232.A OG ASN 240.A O no hydrogen 2.717 N/A PHE 233.A N LEU 220.A O no hydrogen 2.869 N/A GLY 234.A N SER 197.A O no hydrogen 2.749 N/A SER 235.A OG ASP 86.A OD1 no hydrogen 2.517 N/A GLY 236.A N ASP 86.A OD2 no hydrogen 2.722 N/A TYR 237.A N SER 235.A OG no hydrogen 3.210 N/A ASN 240.A N TYR 237.A O no hydrogen 2.821 N/A ASN 240.A ND2 ALA 88.A O no hydrogen 3.274 N/A ASN 240.A ND2 SER 235.A OG no hydrogen 2.883 N/A SER 241.A N GLY 238.A O no hydrogen 3.317 N/A SER 241.A OG GLY 236.A O no hydrogen 2.702 N/A SER 241.A OG TYR 237.A O no hydrogen 3.178 N/A LEU 242.A N GLY 238.A O no hydrogen 2.878 N/A LEU 243.A N GLU 161.A OE1 no hydrogen 2.970 N/A LYS 245.A N LEU 242.A O no hydrogen 2.912 N/A LYS 245.A NZ LYS 245.A O no hydrogen 2.900 N/A LYS 245.A NZ ASP 313.A OD2 no hydrogen 2.715 N/A LYS 245.A NZ GLU 331.A OE1 no hydrogen 3.121 N/A LYS 245.A NZ GLU 331.A OE2 no hydrogen 2.726 N/A LYS 246.A NZ ASP 313.A OD1 no hydrogen 3.078 N/A LYS 246.A NZ ASP 313.A OD2 no hydrogen 2.872 N/A CYS 247.A SG HIS 223.A NE2 no hydrogen 3.352 N/A PHE 248.A N LEU 243.A O no hydrogen 2.942 N/A ALA 249.A N GLY 244.A O no hydrogen 2.956 N/A LEU 250.A N LYS 246.A O no hydrogen 2.926 N/A ARG 251.A N LYS 246.A O no hydrogen 3.081 N/A ARG 251.A NE PRO 476.A O no hydrogen 3.082 N/A ARG 251.A NH1 HIS 223.A NE2 no hydrogen 3.095 N/A ARG 251.A NH2 PRO 476.A O no hydrogen 2.996 N/A ILE 252.A N CYS 247.A O no hydrogen 2.925 N/A ALA 253.A N PHE 248.A O no hydrogen 2.869 N/A SER 254.A N LEU 250.A O no hydrogen 2.892 N/A SER 254.A OG LEU 250.A O no hydrogen 2.745 N/A SER 254.A OG ARG 251.A O no hydrogen 3.137 N/A ARG 255.A NE GLU 259.A OE1 no hydrogen 2.771 N/A ARG 255.A NH1 ASP 226.A OD1 no hydrogen 3.091 N/A ARG 255.A NH2 ASP 226.A OD1 no hydrogen 2.858 N/A ARG 255.A NH2 GLU 259.A OE1 no hydrogen 2.791 N/A LEU 256.A N ILE 252.A O no hydrogen 3.019 N/A ALA 257.A N ALA 253.A O no hydrogen 2.750 N/A LYS 258.A N SER 254.A O no hydrogen 2.973 N/A GLU 259.A N ARG 255.A O no hydrogen 3.033 N/A GLU 260.A N LEU 256.A O no hydrogen 2.868 N/A TRP 262.A N ALA 257.A O no hydrogen 2.917 N/A TRP 262.A NE1 GLU 260.A OE1 no hydrogen 2.854 N/A LEU 263.A N MET 317.A O no hydrogen 2.837 N/A GLU 265.A N ALA 315.A O no hydrogen 2.841 N/A HIS 266.A ND1 ALA 473.A O no hydrogen 2.775 N/A HIS 266.A NE2 ASP 313.A OD1 no hydrogen 3.108 N/A LEU 268.A N ALA 284.A O no hydrogen 2.971 N/A ILE 269.A N GLY 311.A O no hydrogen 2.969 N/A LEU 270.A N LEU 282.A O no hydrogen 2.916 N/A GLY 271.A N GLU 308.A O no hydrogen 2.800 N/A ILE 272.A N LYS 280.A O no hydrogen 2.811 N/A THR 273.A N LYS 306.A O no hydrogen 2.878 N/A ASN 274.A N LYS 278.A O no hydrogen 2.870 N/A GLU 276.A N ASN 274.A OD1 no hydrogen 2.889 N/A GLY 277.A N ASN 274.A O no hydrogen 3.086 N/A LYS 278.A N ASN 274.A OD1 no hydrogen 2.935 N/A LYS 278.A NZ.A GLU 276.A O no hydrogen 3.233 N/A LYS 278.A NZ.B LYS 279.A O no hydrogen 2.575 N/A LYS 279.A NZ TYR 281.A OH no hydrogen 3.105 N/A LYS 279.A NZ GLU 308.A OE1 no hydrogen 3.132 N/A LYS 279.A NZ ASP 416.A OD1 no hydrogen 2.652 N/A LYS 280.A N ILE 272.A O no hydrogen 2.881 N/A LYS 280.A NZ GLU 428.A OE1 no hydrogen 2.775 N/A TYR 281.A OH ASP 416.A OD1 no hydrogen 3.295 N/A TYR 281.A OH ASP 416.A OD2 no hydrogen 2.609 N/A LEU 282.A N LEU 270.A O no hydrogen 2.931 N/A ALA 283.A N GLY 429.A O no hydrogen 2.955 N/A ALA 284.A N LEU 268.A O no hydrogen 3.021 N/A ALA 285.A N ILE 431.A O no hydrogen 2.816 N/A CYS 290.A SG SER 288.A O no hydrogen 3.731 N/A CYS 290.A SG SER 461.A OG no hydrogen 3.344 N/A LYS 292.A NZ HIS 266.A NE2 no hydrogen 3.215 N/A LYS 292.A NZ PHE 286.A O no hydrogen 2.826 N/A THR 293.A OG1 ASP 312.A OD2 no hydrogen 2.596 N/A ASN 294.A ND2 THR 345.A O no hydrogen 3.040 N/A LEU 295.A N GLY 291.A O no hydrogen 3.146 N/A ALA 296.A N LYS 292.A O no hydrogen 2.886 N/A MET 297.A N THR 293.A O no hydrogen 3.300 N/A MET 298.A N LEU 295.A O no hydrogen 3.156 N/A THR 301.A N GLY 523.A O no hydrogen 3.199 N/A THR 301.A OG1 GLY 523.A O no hydrogen 3.251 N/A THR 301.A OG1 GLU 524.A OE1 no hydrogen 2.811 N/A THR 301.A OG1 SER 526.A OG no hydrogen 3.352 N/A TRP 305.A N LEU 302.A O no hydrogen 3.350 N/A LYS 306.A N THR 273.A O no hydrogen 3.006 N/A GLU 308.A N GLY 271.A O no hydrogen 2.829 N/A CYS 309.A N ILE 414.A O no hydrogen 2.860 N/A VAL 310.A N ILE 269.A O no hydrogen 2.949 N/A GLY 311.A N ILE 269.A O no hydrogen 3.164 N/A ALA 315.A N GLU 265.A O no hydrogen 2.889 N/A TRP 316.A N ILE 328.A O no hydrogen 2.959 N/A TRP 316.A NE1 ALA 249.A O no hydrogen 2.896 N/A MET 317.A N LEU 263.A O no hydrogen 2.783 N/A LYS 318.A N ARG 326.A O no hydrogen 2.848 N/A ASP 320.A N ASN 324.A O no hydrogen 2.917 N/A GLN 322.A N ASP 320.A OD1 no hydrogen 2.890 N/A GLY 323.A N ASP 320.A O no hydrogen 2.962 N/A ASN 324.A N ASP 320.A OD1 no hydrogen 3.043 N/A ARG 326.A N LYS 318.A O no hydrogen 3.006 N/A ARG 326.A NH1 GLY 424.A O no hydrogen 2.905 N/A ALA 327.A N VAL 425.A O no hydrogen 2.786 N/A ILE 328.A N TRP 316.A O no hydrogen 2.842 N/A ASN 329.A ND2 VAL 310.A O no hydrogen 2.844 N/A GLU 331.A N ASN 329.A OD1 no hydrogen 2.864 N/A ASN 332.A N MET 175.A O no hydrogen 2.904 N/A ASN 332.A ND2 ILE 174.A O no hydrogen 3.648 N/A ASN 332.A ND2 THR 176.A O no hydrogen 2.971 N/A PHE 334.A N THR 407.A O no hydrogen 2.847 N/A GLY 336.A N PHE 405.A O no hydrogen 2.830 N/A ALA 338.A N SER 403.A O no hydrogen 2.930 N/A GLY 340.A N GLU 373.A O no hydrogen 2.830 N/A THR 341.A N ALA 338.A O no hydrogen 2.874 N/A THR 341.A OG1 VAL 337.A O no hydrogen 3.058 N/A THR 341.A OG1 ALA 338.A O no hydrogen 2.874 N/A SER 342.A N THR 345.A OG1 no hydrogen 2.994 N/A SER 342.A OG THR 345.A OG1 no hydrogen 3.356 N/A LYS 344.A NZ ASP 376.A OD2 no hydrogen 3.349 N/A THR 345.A N SER 342.A OG no hydrogen 3.040 N/A THR 345.A OG1 GLY 340.A O no hydrogen 2.710 N/A THR 345.A OG1 SER 342.A OG no hydrogen 3.356 N/A ASN 346.A N SER 342.A O no hydrogen 2.793 N/A ASN 346.A ND2 THR 293.A O no hydrogen 3.663 N/A ASN 348.A ND2 MET 297.A O no hydrogen 2.945 N/A ALA 349.A N ASN 346.A OD1 no hydrogen 3.094 N/A ILE 350.A N ASN 346.A O no hydrogen 3.171 N/A LYS 351.A N PRO 347.A O no hydrogen 3.137 N/A THR 352.A N ASN 348.A O no hydrogen 3.182 N/A THR 352.A OG1.A ASN 348.A O no hydrogen 2.594 N/A ILE 353.A N ALA 349.A O no hydrogen 3.108 N/A GLN 354.A NE2 ILE 350.A O no hydrogen 2.903 N/A ASN 356.A N ASP 75.A O no hydrogen 2.823 N/A ASN 356.A ND2 GLN 411.A OE1 no hydrogen 2.799 N/A THR 357.A OG1 LYS 355.A O no hydrogen 2.781 N/A THR 357.A OG1 THR 407.A OG1 no hydrogen 2.767 N/A ILE 358.A N CYS 406.A O no hydrogen 2.993 N/A PHE 359.A N TRP 78.A O no hydrogen 2.794 N/A THR 360.A N ARG 404.A O no hydrogen 2.890 N/A THR 360.A OG1 TYR 167.A OH no hydrogen 2.702 N/A ASN 361.A N ALA 80.A O no hydrogen 2.869 N/A ASN 361.A ND2 THR 82.A OG1 no hydrogen 2.871 N/A ALA 363.A N TYR 371.A O no hydrogen 2.917 N/A GLU 364.A N THR 386.A O no hydrogen 2.916 N/A THR 365.A N GLY 369.A O no hydrogen 2.900 N/A THR 365.A OG1 ASP 367.A OD1 no hydrogen 2.557 N/A SER 366.A N THR 384.A O no hydrogen 2.749 N/A SER 366.A OG THR 384.A O no hydrogen 3.543 N/A GLY 368.A N THR 365.A O no hydrogen 2.756 N/A GLY 369.A N THR 365.A OG1 no hydrogen 2.846 N/A VAL 370.A N TYR 74.A OH no hydrogen 3.289 N/A TYR 371.A N ALA 363.A O no hydrogen 2.868 N/A TYR 371.A OH GLU 377.A O no hydrogen 2.780 N/A TRP 372.A NE1 THR 341.A O no hydrogen 2.819 N/A ILE 375.A N TRP 372.A O no hydrogen 3.100 N/A VAL 383.A N ALA 380.A O no hydrogen 3.205 N/A THR 384.A N SER 366.A OG no hydrogen 2.808 N/A THR 386.A N GLU 364.A O no hydrogen 2.797 N/A THR 386.A OG1 GLU 392.A OE2 no hydrogen 3.142 N/A SER 387.A N LYS 391.A O no hydrogen 2.679 N/A SER 387.A OG LYS 391.A O no hydrogen 3.380 N/A TRP 388.A N CYS 398.A O no hydrogen 2.816 N/A LYS 389.A N SER 387.A OG no hydrogen 3.074 N/A ASN 390.A N SER 387.A O no hydrogen 2.897 N/A TRP 393.A N ILE 385.A O no hydrogen 2.761 N/A TRP 393.A NE1 GLU 396.A O no hydrogen 2.873 N/A CYS 398.A N GLU 373.A OE1 no hydrogen 2.785 N/A CYS 398.A SG GLU 373.A OE1 no hydrogen 3.486 N/A CYS 398.A SG GLU 373.A OE2 no hydrogen 3.691 N/A ALA 399.A N GLU 373.A OE2 no hydrogen 3.182 N/A HIS 400.A N ASN 361.A O no hydrogen 3.009 N/A ASN 402.A N HIS 400.A ND1 no hydrogen 2.960 N/A ASN 402.A ND2 VAL 87.A O no hydrogen 3.033 N/A ASN 402.A ND2 TYR 237.A OH no hydrogen 3.141 N/A SER 403.A N HIS 400.A O no hydrogen 2.914 N/A SER 403.A OG HIS 400.A O no hydrogen 2.722 N/A ARG 404.A N THR 360.A O no hydrogen 3.120 N/A ARG 404.A NE TYR 237.A OH no hydrogen 3.236 N/A ARG 404.A NH1 PHE 335.A O no hydrogen 2.876 N/A ARG 404.A NH2 ASN 402.A OD1 no hydrogen 3.006 N/A PHE 405.A N GLY 336.A O no hydrogen 2.791 N/A CYS 406.A N ILE 358.A O no hydrogen 2.753 N/A CYS 406.A SG SER 171.A O no hydrogen 3.971 N/A THR 407.A N PHE 334.A O no hydrogen 2.956 N/A THR 407.A OG1 THR 352.A O no hydrogen 3.440 N/A THR 407.A OG1 THR 357.A OG1 no hydrogen 2.767 N/A ALA 409.A N ASN 332.A O no hydrogen 3.094 N/A GLN 411.A N PRO 408.A O no hydrogen 3.308 N/A GLN 411.A NE2 THR 352.A O no hydrogen 3.077 N/A GLN 411.A NE2 LYS 355.A O no hydrogen 2.794 N/A CYS 412.A N ALA 409.A O no hydrogen 3.047 N/A ILE 415.A N CYS 412.A O no hydrogen 3.069 N/A ASP 416.A N CYS 309.A O no hydrogen 2.813 N/A ALA 418.A N ASP 416.A OD2 no hydrogen 2.878 N/A TRP 419.A N ASP 416.A O no hydrogen 2.979 N/A SER 421.A N ALA 418.A O no hydrogen 3.022 N/A SER 421.A OG.A GLU 423.A OE1.A no hydrogen 1.572 N/A SER 421.A OG.A GLU 423.A OE2.B no hydrogen 3.022 N/A SER 421.A OG.B ALA 418.A O no hydrogen 3.533 N/A GLY 424.A N SER 421.A O no hydrogen 3.026 N/A VAL 425.A N ALA 327.A O no hydrogen 2.832 N/A ILE 427.A N LEU 325.A O no hydrogen 2.770 N/A GLU 428.A N TYR 281.A O no hydrogen 2.950 N/A ILE 430.A N LYS 502.A O no hydrogen 2.836 N/A ILE 431.A N ALA 283.A O no hydrogen 2.832 N/A PHE 432.A N PHE 504.A O no hydrogen 2.854 N/A GLY 433.A N ALA 285.A O no hydrogen 3.288 N/A ARG 435.A N SER 461.A OG no hydrogen 2.827 N/A ARG 435.A NE ALA 289.A O no hydrogen 2.938 N/A ARG 435.A NH1 ALA 289.A O no hydrogen 2.936 N/A ARG 436.A N ASN 507.A OD1 no hydrogen 3.279 N/A ARG 436.A NH1 GLU 580.A OE2 no hydrogen 2.856 N/A ARG 436.A NH2 GLU 580.A OE1 no hydrogen 2.829 N/A TYR 444.A N HIS 505.A O no hydrogen 2.936 N/A GLU 445.A N TYR 549.A O no hydrogen 2.714 N/A ALA 446.A N ILE 503.A O no hydrogen 2.804 N/A LEU 447.A N HIS 451.A ND1 no hydrogen 2.945 N/A SER 448.A OG GLN 450.A OE1 no hydrogen 3.511 N/A TRP 449.A NE1 TRP 489.A O no hydrogen 2.956 N/A HIS 451.A N SER 448.A OG no hydrogen 2.932 N/A GLY 452.A N SER 448.A O no hydrogen 2.869 N/A VAL 453.A N TRP 449.A O no hydrogen 2.838 N/A PHE 454.A N GLN 450.A O no hydrogen 3.045 N/A VAL 455.A N HIS 451.A O no hydrogen 2.798 N/A GLY 456.A N GLY 452.A O no hydrogen 3.010 N/A ALA 457.A N VAL 453.A O no hydrogen 2.922 N/A ALA 458.A N PHE 454.A O no hydrogen 2.773 N/A ALA 458.A N VAL 455.A O no hydrogen 3.250 N/A MET 459.A N GLY 456.A O no hydrogen 3.291 N/A ARG 460.A NH1 GLU 580.A OE2 no hydrogen 2.970 N/A SER 461.A N MET 468.A O no hydrogen 2.798 N/A GLU 462.A N ARG 435.A O no hydrogen 2.845 N/A ALA 463.A N VAL 466.A O no hydrogen 2.847 N/A MET 468.A N SER 461.A O no hydrogen 2.901 N/A ASP 470.A N MET 459.A O no hydrogen 2.918 N/A PHE 472.A N GLY 456.A O no hydrogen 2.948 N/A ALA 473.A N ASP 470.A O no hydrogen 2.999 N/A MET 474.A N PRO 471.A O no hydrogen 2.835 N/A ARG 475.A N ASP 470.A OD1 no hydrogen 2.943 N/A ARG 475.A NH1.A GLU 91.A OE1.B no hydrogen 2.809 N/A ARG 475.A NH1.A GLU 91.A OE2.A no hydrogen 2.449 N/A ARG 475.A NH1.B GLU 91.A OE1.A no hydrogen 2.630 N/A ARG 475.A NH1.B GLN 114.A O no hydrogen 2.775 N/A ARG 475.A NH2.B GLU 91.A OE1.A no hydrogen 3.216 N/A ARG 475.A NH2.B GLU 91.A OE1.B no hydrogen 2.997 N/A ARG 475.A NH2.B GLU 91.A OE2.A no hydrogen 2.832 N/A PHE 477.A N MET 474.A O no hydrogen 2.785 N/A GLY 479.A N SER 254.A OG no hydrogen 2.868 N/A ASN 481.A N ASP 103.A O no hydrogen 2.972 N/A ASN 481.A ND2 ARG 102.A O no hydrogen 2.808 N/A ASN 481.A ND2 ASP 595.A OD2 no hydrogen 2.834 N/A LYS 484.A N ASN 481.A OD1 no hydrogen 3.023 N/A TYR 485.A N ASN 481.A O no hydrogen 2.950 N/A TYR 485.A OH GLU 265.A OE1 no hydrogen 2.569 N/A TYR 485.A OH GLU 265.A OE2 no hydrogen 3.352 N/A LEU 486.A N PHE 482.A O no hydrogen 2.890 N/A ALA 487.A N GLY 483.A O no hydrogen 3.049 N/A HIS 488.A N LYS 484.A O no hydrogen 2.887 N/A HIS 488.A NE2 TRP 262.A O no hydrogen 2.765 N/A TRP 489.A N TYR 485.A O no hydrogen 2.965 N/A TRP 489.A NE1 GLU 265.A OE2 no hydrogen 2.928 N/A LEU 490.A N LEU 486.A O no hydrogen 2.849 N/A SER 491.A N ALA 487.A O no hydrogen 2.863 N/A SER 491.A OG HIS 488.A O no hydrogen 2.595 N/A MET 492.A N TRP 489.A O no hydrogen 3.128 N/A ALA 493.A N LEU 490.A O no hydrogen 3.115 N/A HIS 494.A N SER 491.A O no hydrogen 3.034 N/A ARG 495.A N MET 492.A O no hydrogen 3.336 N/A ARG 495.A NH2 GLY 261.A O no hydrogen 2.466 N/A ALA 498.A N ARG 495.A O no hydrogen 3.246 N/A LYS 499.A N GLY 323.A O no hydrogen 2.753 N/A LYS 499.A NZ GLN 322.A O no hydrogen 3.561 N/A LYS 502.A N GLU 428.A O no hydrogen 3.213 N/A LYS 502.A NZ GLU 445.A OE2 no hydrogen 2.883 N/A PHE 504.A N ILE 430.A O no hydrogen 2.908 N/A HIS 505.A N TYR 444.A O no hydrogen 2.836 N/A VAL 506.A N PHE 432.A O no hydrogen 2.792 N/A ASN 507.A N LEU 442.A O no hydrogen 2.859 N/A ASN 507.A ND2 ARG 436.A O no hydrogen 2.761 N/A ASN 507.A ND2 VAL 440.A O no hydrogen 2.925 N/A PHE 509.A N ASN 507.A OD1 no hydrogen 3.067 N/A ARG 510.A NH1 LEU 569.A O no hydrogen 2.938 N/A ARG 510.A NH1 GLY 571.A O no hydrogen 2.898 N/A ARG 510.A NH2 GLY 571.A O no hydrogen 3.133 N/A LYS 511.A N PRO 437.A O no hydrogen 2.831 N/A ASP 512.A N LYS 516.A O no hydrogen 2.815 N/A ASN 514.A N ASP 512.A OD1 no hydrogen 2.778 N/A GLY 515.A N ASP 512.A O no hydrogen 2.955 N/A LYS 516.A N ASP 512.A OD1 no hydrogen 3.036 N/A LYS 516.A NZ ASP 512.A OD2 no hydrogen 3.171 N/A LYS 516.A NZ PHE 517.A O no hydrogen 2.994 N/A LEU 518.A N ARG 510.A O no hydrogen 2.954 N/A TRP 519.A NE1 ASN 525.A OD1 no hydrogen 2.717 N/A GLU 524.A N GLY 521.A O no hydrogen 2.993 N/A ASN 525.A N PHE 522.A O no hydrogen 2.851 N/A SER 526.A N GLY 523.A O no hydrogen 3.187 N/A SER 526.A OG THR 301.A OG1 no hydrogen 3.352 N/A SER 526.A OG GLY 523.A O no hydrogen 2.794 N/A ARG 527.A N GLU 524.A O no hydrogen 3.045 N/A ARG 527.A NE GLU 524.A OE1 no hydrogen 2.738 N/A ARG 527.A NH1 ASN 557.A O no hydrogen 2.793 N/A ARG 527.A NH1 LYS 559.A O no hydrogen 2.995 N/A ARG 527.A NH2 GLU 524.A OE1 no hydrogen 2.951 N/A ARG 527.A NH2 LYS 559.A O no hydrogen 2.992 N/A LEU 529.A N ASN 525.A O no hydrogen 3.008 N/A GLU 530.A N SER 526.A O no hydrogen 2.918 N/A TRP 531.A N ARG 527.A O no hydrogen 3.382 N/A TRP 531.A NE1 SER 541.A O no hydrogen 2.937 N/A MET 532.A N VAL 528.A O no hydrogen 3.038 N/A PHE 533.A N LEU 529.A O no hydrogen 2.818 N/A GLY 534.A N GLU 530.A O no hydrogen 3.107 N/A ARG 535.A N TRP 531.A O no hydrogen 2.937 N/A ARG 535.A NE.A GLU 445.A OE1 no hydrogen 2.685 N/A ARG 535.A NH1.A GLU 539.A O no hydrogen 3.127 N/A ARG 535.A NH2.A GLU 445.A OE1 no hydrogen 3.410 N/A ARG 535.A NH2.A GLU 445.A OE2 no hydrogen 2.898 N/A ILE 536.A N MET 532.A O no hydrogen 2.927 N/A GLU 537.A N PHE 533.A O no hydrogen 3.061 N/A GLY 538.A N ARG 535.A O no hydrogen 3.031 N/A GLU 539.A N GLY 534.A O no hydrogen 2.902 N/A LYS 543.A N VAL 550.A O no hydrogen 2.808 N/A THR 545.A N GLY 548.A O no hydrogen 2.974 N/A THR 545.A OG1 GLY 548.A O no hydrogen 2.821 N/A ILE 547.A N THR 545.A OG1 no hydrogen 3.159 N/A GLY 548.A N THR 545.A O no hydrogen 3.215 N/A TYR 549.A N GLU 445.A O no hydrogen 2.923 N/A VAL 550.A N LYS 543.A O no hydrogen 2.939 N/A LYS 552.A N SER 541.A O no hydrogen 3.027 N/A LYS 552.A NZ ASP 540.A O no hydrogen 2.537 N/A ALA 555.A N LYS 552.A O no hydrogen 3.026 N/A LYS 559.A N ASN 557.A OD1 no hydrogen 2.770 N/A LEU 561.A N LEU 558.A O no hydrogen 2.674 N/A VAL 564.A N LEU 561.A O no hydrogen 2.654 N/A GLU 568.A N ASN 565.A OD1 no hydrogen 3.123 N/A LEU 569.A N ASN 565.A O no hydrogen 2.991 N/A PHE 570.A N VAL 566.A O no hydrogen 2.761 N/A GLY 571.A N GLU 568.A O no hydrogen 3.346 N/A SER 573.A OG GLU 575.A OE1 no hydrogen 3.462 N/A LYS 574.A NZ SER 612.A O no hydrogen 3.355 N/A LYS 574.A NZ MET 614.A O no hydrogen 2.820 N/A PHE 576.A N SER 573.A OG no hydrogen 3.073 N/A TRP 577.A N SER 573.A O no hydrogen 3.029 N/A TRP 577.A NE1 GLY 439.A O no hydrogen 3.154 N/A GLU 578.A N LYS 574.A O no hydrogen 2.791 N/A LYS 579.A N GLU 575.A O no hydrogen 3.270 N/A LYS 579.A NZ GLU 583.A OE1 no hydrogen 2.822 N/A GLU 580.A N PHE 576.A O no hydrogen 2.817 N/A VAL 581.A N TRP 577.A O no hydrogen 2.848 N/A GLU 582.A N GLU 578.A O no hydrogen 3.221 N/A GLU 583.A N LYS 579.A O no hydrogen 3.014 N/A ILE 584.A N GLU 580.A O no hydrogen 2.967 N/A ASP 585.A N VAL 581.A O no hydrogen 2.829 N/A LYS 586.A N GLU 582.A O no hydrogen 2.947 N/A LYS 586.A NZ GLU 583.A OE1 no hydrogen 2.676 N/A TYR 587.A N GLU 583.A O no hydrogen 2.976 N/A LEU 588.A N ILE 584.A O no hydrogen 2.888 N/A GLU 589.A N ASP 585.A O no hydrogen 2.913 N/A ASP 590.A N LYS 586.A O no hydrogen 3.063 N/A GLN 591.A N TYR 587.A O no hydrogen 2.778 N/A GLN 591.A NE2 GLN 112.A O no hydrogen 3.029 N/A GLN 591.A NE2 ASP 590.A OD2 no hydrogen 2.983 N/A VAL 592.A N LEU 588.A O no hydrogen 2.908 N/A ASN 593.A N LEU 588.A O no hydrogen 3.045 N/A ASN 593.A ND2 ILE 107.A O no hydrogen 3.047 N/A ASP 595.A N VAL 592.A O no hydrogen 2.974 N/A LEU 596.A N ASN 593.A O no hydrogen 3.274 N/A GLU 599.A N GLU 599.A OE1.A no hydrogen 2.689 N/A ILE 600.A N PRO 597.A O no hydrogen 2.970 N/A GLU 601.A N PRO 597.A O no hydrogen 3.204 N/A ARG 602.A N TYR 598.A O no hydrogen 2.839 N/A GLU 603.A N GLU 599.A O no hydrogen 3.045 N/A LEU 604.A N ILE 600.A O no hydrogen 2.983 N/A ARG 605.A N GLU 601.A O no hydrogen 2.974 N/A ARG 605.A NE GLU 601.A OE2 no hydrogen 2.659 N/A ALA 606.A N ARG 602.A O no hydrogen 2.827 N/A LEU 607.A N GLU 603.A O no hydrogen 2.946 N/A LYS 608.A N LEU 604.A O no hydrogen 2.976 N/A LYS 608.A NZ.A ASP 585.A OD2 no hydrogen 2.980 N/A LYS 608.A NZ.B ASP 585.A OD2 no hydrogen 2.555 N/A GLN 609.A N ARG 605.A O no hydrogen 2.959 N/A ARG 610.A N ALA 606.A O no hydrogen 2.932 N/A ARG 610.A NE PRO 546.A O no hydrogen 2.768 N/A ARG 610.A NH2 PRO 546.A O no hydrogen 3.466 N/A ILE 611.A N LEU 607.A O no hydrogen 2.889 N/A SER 612.A N LYS 608.A O no hydrogen 2.863 N/A SER 612.A OG GLN 609.A O no hydrogen 2.682 N/A GLN 613.A N GLN 609.A O no hydrogen 3.264 N/A GLN 613.A N ARG 610.A O no hydrogen 3.275 N/A GLN 613.A NE2 SER 612.A OG no hydrogen 3.320 N/A MET 614.A N ILE 611.A O no hydrogen 3.085 N/A