Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3n0g_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ASN 1.A N ASP 4.A OD2 no hydrogen 2.860 N/A LEU 8.A N ASP 4.A O no hydrogen 3.257 N/A LYS 15.A NZ GLU 201.A OE1 no hydrogen 2.490 N/A LYS 15.A NZ GLU 201.A OE2 no hydrogen 2.994 N/A ALA 16.A N TYR 12.A O no hydrogen 2.928 N/A LYS 17.A N LYS 13.A O no hydrogen 3.192 N/A LYS 17.A NZ ASP 6.A OD2 no hydrogen 2.754 N/A LYS 18.A N ASP 14.A O no hydrogen 3.208 N/A LEU 19.A N LYS 15.A O no hydrogen 3.246 N/A GLU 20.A N ALA 16.A O no hydrogen 2.773 N/A ALA 21.A N LYS 17.A O no hydrogen 2.863 N/A GLU 22.A N LYS 18.A O no hydrogen 3.110 N/A VAL 23.A N LEU 19.A O no hydrogen 3.126 N/A ARG 24.A N GLU 20.A O no hydrogen 3.069 N/A ARG 25.A N ALA 21.A O no hydrogen 3.075 N/A ARG 25.A NH1 GLU 26.A OE2 no hydrogen 3.234 N/A GLU 26.A N GLU 22.A O no hydrogen 3.261 N/A GLU 26.A N VAL 23.A O no hydrogen 2.925 N/A ILE 27.A N VAL 23.A O no hydrogen 3.039 N/A ASN 28.A N ARG 24.A O no hydrogen 2.863 N/A ASN 28.A ND2 ARG 24.A O no hydrogen 2.716 N/A ASN 28.A ND2 ASP 56.A OD1 no hydrogen 2.915 N/A ASN 29.A N GLU 26.A O no hydrogen 3.380 N/A GLU 30.A N.A GLU 30.A OE1.A no hydrogen 2.523 N/A LYS 31.A N ASN 29.A OD1 no hydrogen 2.778 N/A ALA 32.A N ASN 29.A O no hydrogen 3.320 N/A THR 36.A OG1 GLU 33.A O no hydrogen 3.497 N/A LEU 37.A N GLU 33.A O no hydrogen 2.799 N/A LEU 38.A N PHE 34.A O no hydrogen 2.798 N/A GLU 39.A N LEU 35.A O no hydrogen 3.125 N/A LEU 40.A N THR 36.A O no hydrogen 3.046 N/A ILE 41.A N LEU 37.A O no hydrogen 3.075 N/A ASP 42.A N LEU 38.A O no hydrogen 2.790 N/A ASN 43.A N GLU 39.A O no hydrogen 3.002 N/A VAL 44.A N LEU 40.A O no hydrogen 2.922 N/A GLN 45.A N ILE 41.A O no hydrogen 2.928 N/A GLN 45.A NE2 GLN 90.A OE1 no hydrogen 2.685 N/A ARG 46.A N ASP 42.A O no hydrogen 2.902 N/A ARG 46.A NE ASP 42.A OD1 no hydrogen 3.210 N/A LEU 47.A N ASN 43.A O no hydrogen 2.789 N/A GLY 48.A N GLN 45.A O no hydrogen 2.841 N/A LEU 49.A N VAL 44.A O no hydrogen 2.913 N/A TYR 51.A OH ASP 206.A OD1 no hydrogen 2.762 N/A ARG 52.A N LEU 49.A O no hydrogen 2.965 N/A ARG 52.A NE TYR 51.A OH no hydrogen 3.439 N/A ARG 52.A NH1 TRP 3.A O no hydrogen 3.151 N/A ARG 52.A NH1 GLU 20.A OE1 no hydrogen 3.246 N/A ARG 52.A NH2 TRP 3.A O no hydrogen 2.710 N/A ARG 52.A NH2 TYR 51.A OH no hydrogen 2.939 N/A PHE 53.A N GLY 50.A O no hydrogen 3.223 N/A ILE 57.A N PHE 53.A O no hydrogen 2.797 N/A ARG 58.A N GLU 54.A O no hydrogen 3.239 N/A ARG 58.A NH2 HIS 91.A O no hydrogen 3.139 N/A ARG 59.A N SER 55.A O no hydrogen 2.998 N/A ARG 59.A NH2 SER 55.A OG no hydrogen 3.145 N/A ALA 60.A N ASP 56.A O no hydrogen 2.919 N/A LEU 61.A N ILE 57.A O no hydrogen 2.918 N/A ASP 62.A N ARG 58.A O no hydrogen 2.700 N/A ARG 63.A N.A ARG 59.A O no hydrogen 3.070 N/A ARG 63.A N.B ARG 59.A O no hydrogen 3.071 N/A ARG 63.A NH2.A ILE 27.A O no hydrogen 3.221 N/A PHE 64.A N ALA 60.A O no hydrogen 3.013 N/A VAL 65.A N LEU 61.A O no hydrogen 3.034 N/A SER 66.A N ASP 62.A O no hydrogen 2.830 N/A SER 66.A OG ASP 62.A O no hydrogen 3.058 N/A SER 66.A OG ARG 63.A O.A no hydrogen 3.129 N/A SER 66.A OG ARG 63.A O.B no hydrogen 3.196 N/A SER 67.A N ARG 63.A O.A no hydrogen 3.231 N/A SER 67.A N ARG 63.A O.B no hydrogen 3.313 N/A SER 67.A OG ARG 63.A O.A no hydrogen 2.972 N/A SER 67.A OG ARG 63.A O.B no hydrogen 2.969 N/A SER 67.A OG PHE 64.A O no hydrogen 3.277 N/A GLY 68.A N VAL 65.A O no hydrogen 2.487 N/A VAL 73.A N PHE 70.A O no hydrogen 3.084 N/A THR 74.A OG1 ASP 71.A O no hydrogen 2.971 N/A THR 76.A N VAL 73.A O no hydrogen 2.885 N/A THR 76.A OG1 GLY 72.A O no hydrogen 3.091 N/A SER 77.A N VAL 73.A O no hydrogen 2.725 N/A HIS 79.A ND1 SER 123.A OG no hydrogen 2.564 N/A HIS 79.A NE2 GLU 39.A OE2 no hydrogen 3.007 N/A THR 81.A N SER 77.A O no hydrogen 3.276 N/A THR 81.A OG1 SER 77.A O no hydrogen 2.722 N/A ALA 82.A N LEU 78.A O no hydrogen 2.780 N/A LEU 83.A N HIS 79.A O no hydrogen 2.914 N/A SER 84.A N ALA 80.A O no hydrogen 2.842 N/A SER 84.A OG ALA 80.A O no hydrogen 2.880 N/A SER 84.A OG THR 81.A O no hydrogen 2.845 N/A PHE 85.A N THR 81.A O no hydrogen 2.917 N/A ARG 86.A N ALA 82.A O no hydrogen 2.835 N/A ARG 86.A NH2 ASP 42.A OD1 no hydrogen 2.796 N/A LEU 87.A N LEU 83.A O no hydrogen 2.867 N/A LEU 88.A N SER 84.A O no hydrogen 2.861 N/A ARG 89.A N PHE 85.A O no hydrogen 3.015 N/A ARG 89.A NH1 LEU 130.A O no hydrogen 2.817 N/A ARG 89.A NH1 GLU 135.A OE1 no hydrogen 2.968 N/A ARG 89.A NH1 GLU 135.A OE2 no hydrogen 3.370 N/A ARG 89.A NH2 VAL 95.A O no hydrogen 3.148 N/A ARG 89.A NH2 GLU 135.A OE2 no hydrogen 2.770 N/A GLN 90.A N ARG 86.A O no hydrogen 3.020 N/A GLN 90.A NE2 GLN 45.A OE1 no hydrogen 3.626 N/A HIS 91.A N LEU 87.A O no hydrogen 3.155 N/A HIS 91.A N LEU 88.A O no hydrogen 3.144 N/A HIS 91.A NE2 GLN 45.A OE1 no hydrogen 2.776 N/A GLY 92.A N ARG 89.A O no hydrogen 2.943 N/A PHE 93.A N LEU 88.A O no hydrogen 2.828 N/A GLN 97.A NE2 ASN 136.A OD1 no hydrogen 3.362 N/A GLU 98.A N SER 96.A OG no hydrogen 2.751 N/A ALA 99.A N SER 96.A O no hydrogen 3.093 N/A PHE 100.A N GLN 97.A O no hydrogen 3.245 N/A SER 101.A N GLU 98.A O no hydrogen 3.135 N/A SER 101.A OG GLU 98.A O no hydrogen 2.753 N/A PHE 103.A N PHE 100.A O no hydrogen 2.669 N/A LYS 104.A N SER 101.A O no hydrogen 3.229 N/A LYS 104.A NZ GLU 140.A OE1 no hydrogen 3.156 N/A ASP 105.A N ASN 109.A O no hydrogen 2.607 N/A GLN 106.A N GLN 106.A OE1 no hydrogen 2.695 N/A GLY 108.A N ASP 105.A O no hydrogen 3.036 N/A GLY 108.A N ASP 105.A OD1 no hydrogen 2.784 N/A ASN 109.A N ASP 105.A OD1 no hydrogen 3.159 N/A LEU 111.A N PHE 103.A O no hydrogen 3.215 N/A LYS 115.A N GLU 112.A O no hydrogen 2.890 N/A LYS 115.A NZ SER 147.A OG no hydrogen 3.425 N/A GLU 116.A N ASN 113.A O no hydrogen 3.027 N/A LYS 119.A NZ GLU 39.A OE2 no hydrogen 3.115 N/A ALA 120.A N ASP 117.A OD2 no hydrogen 3.209 N/A LEU 122.A N THR 118.A O no hydrogen 3.331 N/A SER 123.A N LYS 119.A O no hydrogen 3.078 N/A SER 123.A OG HIS 79.A ND1 no hydrogen 2.564 N/A SER 123.A OG LYS 119.A O no hydrogen 3.464 N/A LEU 124.A N ALA 120.A O no hydrogen 2.986 N/A TYR 125.A N ILE 121.A O no hydrogen 2.836 N/A TYR 125.A OH ALA 168.A O no hydrogen 2.773 N/A GLU 126.A N LEU 122.A O no hydrogen 2.913 N/A ALA 127.A N SER 123.A O no hydrogen 3.010 N/A SER 128.A N LEU 124.A O no hydrogen 2.933 N/A SER 128.A N TYR 125.A O no hydrogen 2.975 N/A SER 128.A OG TYR 125.A O no hydrogen 2.450 N/A LEU 130.A N ALA 127.A O no hydrogen 3.243 N/A ALA 131.A N SER 128.A O no hydrogen 3.324 N/A LEU 132.A N GLU 135.A OE1 no hydrogen 2.537 N/A ASN 136.A N GLY 134.A O no hydrogen 2.750 N/A ASP 139.A N GLU 135.A O no hydrogen 3.319 N/A GLU 140.A N ASN 136.A O no hydrogen 2.810 N/A ALA 141.A N ILE 137.A O no hydrogen 2.821 N/A ARG 142.A N LEU 138.A O no hydrogen 3.032 N/A ARG 142.A NE SER 128.A OG no hydrogen 3.398 N/A ARG 142.A NH1 ASP 460.A OD1 no hydrogen 2.461 N/A ARG 142.A NH2 SER 128.A O no hydrogen 3.445 N/A VAL 143.A N ASP 139.A O no hydrogen 3.300 N/A PHE 144.A N GLU 140.A O no hydrogen 2.833 N/A ALA 145.A N ALA 141.A O no hydrogen 2.771 N/A ILE 146.A N ARG 142.A O no hydrogen 2.891 N/A SER 147.A N VAL 143.A O no hydrogen 3.278 N/A SER 147.A OG PHE 144.A O no hydrogen 2.758 N/A HIS 148.A N ALA 145.A O no hydrogen 3.161 N/A LEU 149.A N ALA 145.A O no hydrogen 3.046 N/A LYS 150.A N ILE 146.A O no hydrogen 2.955 N/A GLU 151.A N HIS 148.A O no hydrogen 3.147 N/A LEU 152.A N HIS 148.A O no hydrogen 3.460 N/A LYS 156.A N SER 153.A OG no hydrogen 3.032 N/A ILE 157.A N SER 153.A O no hydrogen 3.413 N/A ALA 162.A N GLY 158.A O no hydrogen 2.792 N/A GLU 163.A N LYS 159.A O no hydrogen 3.100 N/A GLN 164.A N GLU 160.A O no hydrogen 3.271 N/A VAL 165.A N LEU 161.A O no hydrogen 3.187 N/A ASN 166.A N ALA 162.A O no hydrogen 2.885 N/A HIS 167.A N GLU 163.A O no hydrogen 2.980 N/A HIS 167.A NE2 GLU 181.A OE2 no hydrogen 2.510 N/A ALA 168.A N GLN 164.A O no hydrogen 3.035 N/A LEU 169.A N VAL 165.A O no hydrogen 2.814 N/A GLU 170.A N ASN 166.A O no hydrogen 2.965 N/A LEU 171.A N HIS 167.A O no hydrogen 3.196 N/A LEU 173.A N GLU 126.A OE2 no hydrogen 2.913 N/A HIS 174.A NE2 ASN 467.A OD1 no hydrogen 2.787 N/A ARG 175.A N PRO 172.A O no hydrogen 2.904 N/A ARG 175.A NH2 ASP 460.A OD1 no hydrogen 2.818 N/A ARG 176.A N PRO 172.A O no hydrogen 3.106 N/A ARG 176.A N LEU 173.A O no hydrogen 3.050 N/A ARG 176.A NH1 GLU 170.A OE2 no hydrogen 2.817 N/A ARG 176.A NH2 GLU 170.A OE2 no hydrogen 3.233 N/A ARG 176.A NH2 LEU 171.A O no hydrogen 2.818 N/A GLN 178.A NE2 GLY 48.A O no hydrogen 3.656 N/A GLU 181.A N THR 177.A O no hydrogen 2.925 N/A ALA 182.A N GLN 178.A O no hydrogen 2.974 N/A VAL 183.A N ARG 179.A O no hydrogen 3.050 N/A SER 185.A N GLU 181.A O no hydrogen 2.849 N/A SER 185.A OG GLU 181.A O no hydrogen 3.238 N/A SER 185.A OG GLU 181.A OE1 no hydrogen 2.470 N/A ILE 186.A N ALA 182.A O no hydrogen 2.912 N/A GLU 187.A N.A VAL 183.A O no hydrogen 3.386 N/A GLU 187.A N.B VAL 183.A O no hydrogen 3.387 N/A ALA 188.A N TRP 184.A O no hydrogen 2.976 N/A TYR 189.A N SER 185.A O no hydrogen 2.600 N/A ARG 190.A N ILE 186.A O no hydrogen 2.771 N/A ARG 190.A NH1 GLU 187.A OE1.B no hydrogen 2.727 N/A ARG 190.A NH1 LEU 518.A O no hydrogen 3.178 N/A ARG 190.A NH2 LEU 518.A O no hydrogen 2.775 N/A LYS 192.A N TYR 189.A O no hydrogen 3.120 N/A LYS 192.A NZ ALA 188.A O no hydrogen 3.492 N/A ASP 194.A N ASP 194.A OD2 no hydrogen 2.464 N/A ALA 195.A N LYS 192.A O no hydrogen 3.424 N/A ASN 196.A N TYR 189.A OH no hydrogen 3.178 N/A GLN 197.A NE2 ALA 195.A O no hydrogen 2.724 N/A LEU 199.A N ASN 196.A OD1 no hydrogen 2.719 N/A LEU 200.A N ASN 196.A O no hydrogen 2.805 N/A GLU 201.A N GLN 197.A O no hydrogen 3.210 N/A LEU 202.A N VAL 198.A O no hydrogen 3.058 N/A ALA 203.A N LEU 199.A O no hydrogen 2.927 N/A ILE 204.A N LEU 200.A O no hydrogen 3.012 N/A LEU 205.A N GLU 201.A O no hydrogen 2.929 N/A ASP 206.A N LEU 202.A O no hydrogen 2.727 N/A TYR 207.A N ALA 203.A O no hydrogen 2.885 N/A TYR 207.A OH SER 511.A O no hydrogen 2.605 N/A ASN 208.A N ILE 204.A O no hydrogen 3.053 N/A ASN 208.A ND2 ILE 517.A O no hydrogen 3.308 N/A MET 209.A N LEU 205.A O no hydrogen 2.874 N/A ILE 210.A N ASP 206.A O no hydrogen 3.001 N/A GLN 211.A N TYR 207.A O no hydrogen 2.830 N/A GLN 211.A NE2 SER 511.A O no hydrogen 3.372 N/A GLN 211.A NE2 GLU 515.A O no hydrogen 3.143 N/A SER 212.A N ASN 208.A O no hydrogen 3.029 N/A SER 212.A OG MET 209.A O no hydrogen 2.348 N/A TYR 214.A N ILE 210.A O no hydrogen 3.143 N/A TYR 214.A OH PHE 253.A O no hydrogen 2.702 N/A GLN 215.A N GLN 211.A O no hydrogen 3.094 N/A GLN 215.A NE2 ILE 513.A O no hydrogen 2.841 N/A ARG 216.A N SER 212.A O no hydrogen 2.993 N/A ASP 217.A N VAL 213.A O no hydrogen 2.864 N/A LEU 218.A N TYR 214.A O no hydrogen 2.638 N/A ARG 219.A N GLN 215.A O no hydrogen 2.911 N/A GLU 220.A N ARG 216.A O no hydrogen 3.357 N/A THR 221.A N ASP 217.A O no hydrogen 3.068 N/A THR 221.A OG1 ASP 217.A O no hydrogen 3.187 N/A SER 222.A N LEU 218.A O no hydrogen 2.953 N/A SER 222.A OG LEU 218.A O no hydrogen 2.784 N/A ARG 223.A N ARG 219.A O no hydrogen 3.042 N/A TRP 224.A N GLU 220.A O no hydrogen 3.042 N/A TRP 225.A N THR 221.A O no hydrogen 2.930 N/A TRP 225.A NE1 ASP 239.A OD2 no hydrogen 2.791 N/A ARG 226.A N SER 222.A O no hydrogen 2.994 N/A ARG 227.A N ARG 223.A O no hydrogen 3.119 N/A VAL 228.A N TRP 224.A O no hydrogen 2.914 N/A GLY 229.A N TRP 225.A O no hydrogen 2.600 N/A THR 232.A OG1 GLY 229.A O no hydrogen 2.970 N/A LEU 234.A N LEU 230.A O no hydrogen 3.081 N/A ALA 237.A N LEU 234.A O no hydrogen 3.181 N/A ARG 238.A NE ASP 276.A OD1 no hydrogen 3.471 N/A ARG 238.A NE ASP 276.A OD2 no hydrogen 3.325 N/A ARG 238.A NH2 ASP 276.A OD1 no hydrogen 3.561 N/A ARG 240.A NE.B THR 272.A OG1 no hydrogen 3.264 N/A ARG 240.A NH1.A ASP 239.A O no hydrogen 3.545 N/A ARG 240.A NH2.B THR 272.A OG1 no hydrogen 3.000 N/A LEU 241.A N ASP 239.A OD1 no hydrogen 3.202 N/A GLU 243.A N.B GLU 243.A OE2.B no hydrogen 2.959 N/A SER 244.A N ARG 240.A O.A no hydrogen 3.184 N/A SER 244.A N ARG 240.A O.B no hydrogen 3.166 N/A SER 244.A OG ARG 240.A O.A no hydrogen 2.951 N/A SER 244.A OG ARG 240.A O.B no hydrogen 2.961 N/A PHE 245.A N LEU 241.A O no hydrogen 3.021 N/A TYR 246.A N ILE 242.A O no hydrogen 3.085 N/A TRP 247.A N GLU 243.A O.A no hydrogen 3.123 N/A TRP 247.A N GLU 243.A O.B no hydrogen 3.100 N/A TRP 247.A NE1 GLN 381.A OE1 no hydrogen 2.818 N/A ALA 248.A N SER 244.A O no hydrogen 2.849 N/A VAL 249.A N PHE 245.A O no hydrogen 2.831 N/A GLY 250.A N TYR 246.A O no hydrogen 3.375 N/A GLY 250.A N TRP 247.A O no hydrogen 2.987 N/A VAL 251.A N TRP 247.A O no hydrogen 3.419 N/A ALA 252.A N ALA 248.A O no hydrogen 2.936 N/A GLN 256.A N GLN 256.A OE1 no hydrogen 2.618 N/A TYR 257.A N GLU 254.A O no hydrogen 3.032 N/A SER 258.A OG ASP 217.A OD1 no hydrogen 2.536 N/A SER 258.A OG ASP 217.A OD2 no hydrogen 2.909 N/A ARG 261.A N TYR 257.A O no hydrogen 3.059 N/A ARG 261.A NE ASP 217.A OD2 no hydrogen 3.383 N/A ARG 261.A NH1 ALA 252.A O no hydrogen 3.031 N/A ARG 261.A NH1 GLU 254.A O no hydrogen 2.663 N/A ARG 261.A NH2 ASP 217.A OD2 no hydrogen 2.822 N/A ARG 261.A NH2 PRO 255.A O no hydrogen 3.197 N/A ASN 262.A N SER 258.A O no hydrogen 2.894 N/A SER 263.A N ASP 259.A O no hydrogen 2.821 N/A VAL 264.A N CYS 260.A O no hydrogen 2.961 N/A ALA 265.A N ARG 261.A O no hydrogen 2.863 N/A LYS 266.A N ASN 262.A O no hydrogen 3.019 N/A MET 267.A N SER 263.A O no hydrogen 3.145 N/A PHE 268.A N VAL 264.A O no hydrogen 2.860 N/A SER 269.A N ALA 265.A O no hydrogen 3.173 N/A SER 269.A OG ALA 265.A O no hydrogen 2.956 N/A PHE 270.A N LYS 266.A O no hydrogen 3.064 N/A VAL 271.A N MET 267.A O no hydrogen 2.800 N/A THR 272.A N PHE 268.A O no hydrogen 2.961 N/A THR 272.A OG1 PHE 268.A O no hydrogen 3.120 N/A ILE 273.A N SER 269.A O no hydrogen 3.355 N/A ILE 274.A N PHE 270.A O no hydrogen 2.960 N/A ASP 275.A N VAL 271.A O no hydrogen 2.713 N/A ASP 276.A N THR 272.A O no hydrogen 3.252 N/A ILE 277.A N ILE 273.A O no hydrogen 2.976 N/A TYR 278.A N ILE 274.A O no hydrogen 3.222 N/A TYR 278.A N ASP 275.A O no hydrogen 3.161 N/A TYR 278.A OH THR 291.A OG1 no hydrogen 2.737 N/A ASP 279.A N ASP 275.A O no hydrogen 3.253 N/A VAL 280.A N ASP 276.A O no hydrogen 2.982 N/A TYR 281.A N ASP 276.A O no hydrogen 3.215 N/A GLY 282.A N ILE 277.A O no hydrogen 2.646 N/A THR 283.A N GLU 286.A OE1 no hydrogen 2.966 N/A LEU 287.A N THR 283.A O no hydrogen 2.794 N/A GLU 288.A N LEU 284.A O no hydrogen 2.721 N/A LEU 289.A N ASP 285.A O no hydrogen 3.300 N/A PHE 290.A N GLU 286.A O no hydrogen 2.898 N/A THR 291.A N LEU 287.A O no hydrogen 2.778 N/A THR 291.A OG1 TYR 278.A OH no hydrogen 2.737 N/A THR 291.A OG1 LEU 287.A O no hydrogen 2.707 N/A ASP 292.A N GLU 288.A O no hydrogen 3.048 N/A ALA 293.A N LEU 289.A O no hydrogen 2.739 N/A VAL 294.A N PHE 290.A O no hydrogen 2.985 N/A GLU 295.A N THR 291.A O no hydrogen 3.137 N/A ARG 296.A N.A ASP 292.A O no hydrogen 2.982 N/A ARG 296.A N.B ASP 292.A O no hydrogen 2.976 N/A ARG 296.A NE.B ASP 292.A OD2 no hydrogen 3.096 N/A TRP 297.A N ALA 293.A O no hydrogen 2.775 N/A TRP 297.A NE1 ASN 321.A OD1 no hydrogen 3.134 N/A ASN 300.A N ASP 298.A OD2 no hydrogen 3.320 N/A ILE 302.A N VAL 299.A O no hydrogen 3.100 N/A ASP 304.A N ALA 301.A O no hydrogen 3.167 N/A TYR 308.A OH GLU 286.A OE1 no hydrogen 2.957 N/A LYS 310.A N PRO 306.A O no hydrogen 2.849 N/A LEU 311.A N ASP 307.A O no hydrogen 3.159 N/A CYS 312.A N TYR 308.A O no hydrogen 3.127 N/A PHE 313.A N MET 309.A O no hydrogen 2.895 N/A LEU 314.A N LYS 310.A O no hydrogen 3.165 N/A ALA 315.A N LEU 311.A O no hydrogen 3.394 N/A LEU 316.A N CYS 312.A O no hydrogen 3.151 N/A TYR 317.A N PHE 313.A O no hydrogen 2.730 N/A TYR 317.A OH TRP 297.A O no hydrogen 3.306 N/A ASN 318.A N LEU 314.A O no hydrogen 2.940 N/A THR 319.A N ALA 315.A O no hydrogen 3.146 N/A THR 319.A OG1 ALA 315.A O no hydrogen 2.838 N/A ILE 320.A N LEU 316.A O no hydrogen 2.987 N/A ASN 321.A N TYR 317.A O no hydrogen 2.953 N/A GLU 322.A N ASN 318.A O no hydrogen 2.751 N/A ILE 323.A N THR 319.A O no hydrogen 3.116 N/A ALA 324.A N ILE 320.A O no hydrogen 2.860 N/A TYR 325.A N ASN 321.A O no hydrogen 2.988 N/A ASP 326.A N GLU 322.A O no hydrogen 3.059 N/A ASN 327.A N ILE 323.A O no hydrogen 3.114 N/A ASN 327.A ND2 ILE 323.A O no hydrogen 3.122 N/A LEU 328.A N ALA 324.A O no hydrogen 2.954 N/A LYS 329.A N TYR 325.A O no hydrogen 2.941 N/A ASP 330.A N ASP 326.A O no hydrogen 2.821 N/A LYS 331.A N ASN 327.A O no hydrogen 2.478 N/A LYS 331.A NZ ASN 327.A OD1 no hydrogen 3.061 N/A LYS 331.A NZ PHE 387.A O no hydrogen 3.010 N/A GLY 332.A N LEU 328.A O no hydrogen 2.781 N/A LEU 339.A N ILE 335.A O no hydrogen 3.253 N/A THR 340.A N LEU 336.A O no hydrogen 2.844 N/A THR 340.A OG1 LEU 336.A O no hydrogen 3.352 N/A THR 340.A OG1 PRO 337.A O no hydrogen 3.162 N/A LYS 341.A N PRO 337.A O no hydrogen 3.000 N/A LYS 341.A NZ ASP 345.A OD1 no hydrogen 3.010 N/A ALA 342.A N TYR 338.A O no hydrogen 2.944 N/A TRP 343.A N LEU 339.A O no hydrogen 3.368 N/A ALA 344.A N THR 340.A O no hydrogen 3.069 N/A ASP 345.A N LYS 341.A O no hydrogen 3.004 N/A LEU 346.A N ALA 342.A O no hydrogen 3.058 N/A CYS 347.A N TRP 343.A O no hydrogen 2.911 N/A CYS 347.A SG TRP 343.A O no hydrogen 3.579 N/A ASN 348.A N ALA 344.A O no hydrogen 3.023 N/A ASN 348.A ND2 GLU 295.A OE2 no hydrogen 3.319 N/A ASN 348.A ND2 ALA 344.A O no hydrogen 3.017 N/A ALA 349.A N ASP 345.A O no hydrogen 2.962 N/A PHE 350.A N LEU 346.A O no hydrogen 2.819 N/A LEU 351.A N CYS 347.A O no hydrogen 2.704 N/A GLN 352.A N ASN 348.A O no hydrogen 2.918 N/A GLU 353.A N ALA 349.A O no hydrogen 3.160 N/A ALA 354.A N PHE 350.A O no hydrogen 2.980 N/A LYS 355.A N LEU 351.A O no hydrogen 2.859 N/A TRP 356.A N GLN 352.A O no hydrogen 3.103 N/A LEU 357.A N GLU 353.A O no hydrogen 3.038 N/A TYR 358.A N ALA 354.A O no hydrogen 2.898 N/A ASN 359.A N LYS 355.A O no hydrogen 2.753 N/A LYS 360.A N LEU 357.A O no hydrogen 2.985 N/A SER 361.A N TRP 356.A O no hydrogen 2.806 N/A THR 364.A OG1 ASP 367.A OD2 no hydrogen 3.185 N/A PHE 365.A N THR 443.A OG1 no hydrogen 2.875 N/A TYR 368.A N THR 364.A O no hydrogen 2.993 N/A PHE 369.A N PHE 365.A O no hydrogen 2.889 N/A GLY 370.A N ASP 366.A O no hydrogen 3.126 N/A ASN 371.A N ASP 367.A O no hydrogen 3.271 N/A ASN 371.A N TYR 368.A O no hydrogen 3.132 N/A ASN 371.A ND2 ALA 349.A O no hydrogen 2.906 N/A ALA 372.A N TYR 368.A O no hydrogen 2.748 N/A TRP 373.A N PHE 369.A O no hydrogen 3.071 N/A LYS 374.A N ASN 371.A O no hydrogen 3.066 N/A LYS 374.A NZ GLY 370.A O no hydrogen 3.124 N/A SER 375.A N ASN 371.A O no hydrogen 2.812 N/A SER 375.A OG GLU 353.A OE1 no hydrogen 2.608 N/A SER 375.A OG ASN 371.A O no hydrogen 3.472 N/A SER 375.A OG ALA 372.A O no hydrogen 2.958 N/A SER 376.A OG TRP 373.A O no hydrogen 2.670 N/A SER 377.A N LYS 374.A O no hydrogen 3.157 N/A SER 377.A OG SER 376.A O no hydrogen 2.498 N/A GLY 378.A N SER 376.A OG no hydrogen 3.045 N/A GLN 381.A N SER 377.A O no hydrogen 2.762 N/A GLN 381.A NE2 SER 377.A OG no hydrogen 2.904 N/A LEU 382.A N GLY 378.A O no hydrogen 2.951 N/A ILE 383.A N PRO 379.A O no hydrogen 2.884 N/A PHE 384.A N LEU 380.A O no hydrogen 3.027 N/A ALA 385.A N GLN 381.A O no hydrogen 2.826 N/A TYR 386.A N LEU 382.A O no hydrogen 2.652 N/A TYR 386.A OH GLU 397.A OE1 no hydrogen 2.546 N/A ALA 388.A N ALA 385.A O no hydrogen 2.895 N/A VAL 389.A N ALA 385.A O no hydrogen 2.693 N/A VAL 389.A N TYR 386.A O no hydrogen 3.091 N/A VAL 390.A N TYR 386.A O no hydrogen 3.000 N/A ASN 392.A N GLN 391.A OE1 no hydrogen 2.649 N/A LYS 394.A N TYR 386.A OH no hydrogen 3.302 N/A LYS 395.A NZ TYR 338.A OH no hydrogen 3.283 N/A ILE 398.A N LYS 394.A O no hydrogen 3.310 N/A GLU 399.A N LYS 395.A O no hydrogen 3.237 N/A ASN 400.A N GLU 396.A O no hydrogen 3.232 N/A ASN 400.A ND2 GLU 396.A O no hydrogen 2.927 N/A LEU 401.A N GLU 397.A O no hydrogen 2.921 N/A GLN 402.A N ILE 398.A O no hydrogen 2.876 N/A LYS 403.A N GLU 399.A O no hydrogen 3.219 N/A LYS 403.A N ASN 400.A O no hydrogen 3.030 N/A TYR 404.A N LEU 401.A O no hydrogen 2.861 N/A TYR 404.A OH ASP 345.A OD2 no hydrogen 2.665 N/A HIS 405.A N ASN 400.A O no hydrogen 3.025 N/A ILE 407.A N HIS 405.A ND1 no hydrogen 2.634 N/A ILE 408.A N HIS 405.A O no hydrogen 3.071 N/A SER 409.A N HIS 405.A O no hydrogen 2.946 N/A SER 409.A OG HIS 405.A O no hydrogen 3.504 N/A SER 409.A OG ASP 406.A OD1 no hydrogen 3.479 N/A ARG 410.A N.A ASP 406.A O no hydrogen 3.013 N/A ARG 410.A N.B ASP 406.A O no hydrogen 3.026 N/A SER 412.A N ILE 408.A O no hydrogen 3.310 N/A SER 412.A OG ILE 408.A O no hydrogen 2.565 N/A HIS 413.A N SER 409.A O no hydrogen 2.827 N/A ILE 414.A N ARG 410.A O.A no hydrogen 3.415 N/A ILE 414.A N ARG 410.A O.B no hydrogen 3.379 N/A PHE 415.A N PRO 411.A O no hydrogen 3.178 N/A ARG 416.A N SER 412.A O no hydrogen 3.098 N/A ARG 416.A NE ALA 372.A O no hydrogen 2.759 N/A ARG 416.A NH1 ASP 420.A OD1 no hydrogen 3.196 N/A ARG 416.A NH2 ALA 372.A O no hydrogen 3.119 N/A LEU 417.A N HIS 413.A O no hydrogen 3.078 N/A CYS 418.A N ILE 414.A O no hydrogen 2.743 N/A CYS 418.A SG ILE 414.A O no hydrogen 3.519 N/A ASN 419.A N PHE 415.A O no hydrogen 3.154 N/A ASP 420.A N ARG 416.A O no hydrogen 2.979 N/A LEU 421.A N LEU 417.A O no hydrogen 2.887 N/A ALA 422.A N ASN 419.A O no hydrogen 2.862 N/A SER 423.A N ASN 419.A O no hydrogen 3.267 N/A SER 423.A OG ASN 419.A O no hydrogen 3.200 N/A SER 423.A OG ASP 420.A O no hydrogen 3.533 N/A SER 423.A OG GLU 427.A OE2 no hydrogen 3.266 N/A SER 425.A OG GLU 448.A OE2 no hydrogen 3.382 N/A GLU 427.A N SER 423.A O no hydrogen 3.012 N/A ILE 428.A N ALA 424.A O no hydrogen 2.840 N/A ALA 429.A N SER 425.A O no hydrogen 2.900 N/A ARG 430.A N ALA 426.A O no hydrogen 2.883 N/A ARG 430.A N GLU 427.A O no hydrogen 3.280 N/A ARG 430.A NE GLU 432.A OE2 no hydrogen 2.551 N/A ARG 430.A NH2 GLU 432.A OE2 no hydrogen 2.680 N/A GLY 431.A N ILE 428.A O no hydrogen 2.882 N/A GLU 432.A N GLU 427.A O no hydrogen 2.773 N/A ASN 435.A ND2 ASP 420.A O no hydrogen 2.799 N/A ASN 435.A ND2 GLU 427.A OE2 no hydrogen 3.504 N/A SER 436.A N ASP 420.A OD2 no hydrogen 2.832 N/A SER 436.A OG ASP 420.A OD2 no hydrogen 2.703 N/A VAL 437.A N ASN 435.A OD1 no hydrogen 2.707 N/A SER 438.A N ASN 435.A OD1 no hydrogen 3.402 N/A CYS 439.A N ASN 435.A O no hydrogen 2.959 N/A CYS 439.A SG PRO 363.A O no hydrogen 3.808 N/A CYS 439.A SG THR 433.A O no hydrogen 3.992 N/A TYR 440.A N SER 436.A O no hydrogen 2.869 N/A MET 441.A N VAL 437.A O no hydrogen 3.037 N/A ARG 442.A N SER 438.A O no hydrogen 3.037 N/A ARG 442.A NH1 THR 433.A O no hydrogen 3.135 N/A ARG 442.A NH1 SER 438.A OG no hydrogen 3.195 N/A THR 443.A N CYS 439.A O no hydrogen 2.822 N/A THR 443.A OG1 CYS 439.A O no hydrogen 2.874 N/A LYS 444.A N TYR 440.A O no hydrogen 3.133 N/A GLY 445.A N ARG 442.A O no hydrogen 3.387 N/A ILE 446.A N MET 441.A O no hydrogen 3.200 N/A LEU 450.A N SER 447.A OG no hydrogen 3.313 N/A ALA 451.A N SER 447.A O no hydrogen 2.944 N/A THR 452.A N GLU 448.A O no hydrogen 2.743 N/A THR 452.A OG1 GLU 448.A O no hydrogen 2.983 N/A GLU 453.A N GLU 449.A O no hydrogen 3.009 N/A SER 454.A N LEU 450.A O no hydrogen 3.060 N/A SER 454.A OG LEU 450.A O no hydrogen 3.032 N/A VAL 455.A N ALA 451.A O no hydrogen 3.006 N/A MET 456.A N THR 452.A O no hydrogen 2.988 N/A ASN 457.A N GLU 453.A O no hydrogen 2.934 N/A LEU 458.A N SER 454.A O no hydrogen 2.813 N/A ILE 459.A N VAL 455.A O no hydrogen 2.968 N/A ASP 460.A N MET 456.A O no hydrogen 3.025 N/A GLU 461.A N ASN 457.A O no hydrogen 2.990 N/A THR 462.A N LEU 458.A O no hydrogen 3.077 N/A THR 462.A OG1 LEU 458.A O no hydrogen 2.896 N/A TRP 463.A N ILE 459.A O no hydrogen 2.992 N/A TRP 463.A NE1 HIS 492.A NE2 no hydrogen 2.826 N/A LYS 464.A N ASP 460.A O no hydrogen 3.276 N/A LYS 464.A NZ ASP 139.A OD1 no hydrogen 2.801 N/A LYS 464.A NZ ASP 139.A OD2 no hydrogen 3.022 N/A LYS 464.A NZ GLU 461.A OE2 no hydrogen 3.075 N/A LYS 465.A N GLU 461.A O no hydrogen 3.281 N/A LYS 465.A NZ GLU 133.A OE1 no hydrogen 3.161 N/A LYS 465.A NZ GLU 133.A OE2 no hydrogen 2.889 N/A MET 466.A N THR 462.A O no hydrogen 2.928 N/A ASN 467.A N TRP 463.A O no hydrogen 2.753 N/A ASN 467.A ND2 PHE 129.A O no hydrogen 3.216 N/A ASN 467.A ND2 ALA 131.A O no hydrogen 2.931 N/A LYS 468.A N LYS 464.A O no hydrogen 3.210 N/A LYS 468.A N LYS 465.A O no hydrogen 2.913 N/A GLU 469.A N LYS 465.A O no hydrogen 3.141 N/A LYS 470.A N MET 466.A O no hydrogen 3.110 N/A LYS 470.A NZ GLU 482.A OE2 no hydrogen 3.047 N/A LEU 471.A N ASN 467.A O no hydrogen 2.957 N/A GLY 472.A N LYS 468.A O no hydrogen 3.091 N/A SER 474.A OG GLU 469.A OE1 no hydrogen 3.242 N/A SER 474.A OG PHE 476.A O no hydrogen 3.263 N/A LYS 478.A NZ LYS 470.A O no hydrogen 3.498 N/A VAL 481.A N ALA 477.A O no hydrogen 3.114 N/A GLU 482.A N LYS 478.A O no hydrogen 2.845 N/A THR 483.A N PRO 479.A O no hydrogen 2.989 N/A THR 483.A OG1 PRO 479.A O no hydrogen 2.902 N/A ALA 484.A N PHE 480.A O no hydrogen 2.702 N/A ILE 485.A N VAL 481.A O no hydrogen 2.976 N/A ASN 486.A N GLU 482.A O no hydrogen 2.829 N/A ASN 486.A ND2 VAL 251.A O no hydrogen 2.893 N/A LEU 487.A N ALA 484.A O no hydrogen 2.975 N/A ALA 488.A N ILE 485.A O no hydrogen 2.762 N/A ARG 489.A N ILE 485.A O no hydrogen 3.026 N/A ARG 489.A NE HIS 174.A O no hydrogen 2.743 N/A ARG 489.A NH1 GLU 482.A OE1 no hydrogen 2.965 N/A ARG 489.A NH1 ASN 486.A OD1 no hydrogen 3.064 N/A ARG 489.A NH2 HIS 174.A O no hydrogen 3.269 N/A GLN 490.A N ASN 486.A O no hydrogen 2.734 N/A GLN 490.A NE2 THR 494.A OG1 no hydrogen 2.645 N/A SER 491.A N LEU 487.A O no hydrogen 3.092 N/A SER 491.A OG LEU 487.A O no hydrogen 2.817 N/A HIS 492.A N ALA 488.A O no hydrogen 3.077 N/A CYS 493.A N ARG 489.A O no hydrogen 3.051 N/A CYS 493.A SG ARG 489.A O no hydrogen 3.104 N/A THR 494.A N GLN 490.A O no hydrogen 2.806 N/A THR 494.A OG1 GLN 490.A O no hydrogen 2.729 N/A TYR 495.A N SER 491.A O no hydrogen 3.200 N/A HIS 496.A ND1 THR 494.A O no hydrogen 3.256 N/A GLU 503.A N SER 500.A O no hydrogen 2.983 N/A LEU 504.A N SER 500.A O no hydrogen 2.879 N/A THR 505.A N PRO 501.A O no hydrogen 3.461 N/A THR 505.A OG1 PRO 501.A O no hydrogen 3.113 N/A ARG 506.A N ASP 502.A O no hydrogen 3.238 N/A ARG 506.A NE GLU 503.A OE2 no hydrogen 2.881 N/A ARG 506.A NH2 GLU 503.A OE2 no hydrogen 2.666 N/A LYS 507.A N GLU 503.A O no hydrogen 3.050 N/A ARG 508.A N LEU 504.A O no hydrogen 3.039 N/A VAL 509.A N THR 505.A O no hydrogen 2.884 N/A LEU 510.A N ARG 506.A O no hydrogen 3.186 N/A SER 511.A N LYS 507.A O no hydrogen 2.809 N/A SER 511.A OG LYS 507.A O no hydrogen 3.375 N/A SER 511.A OG ARG 508.A O no hydrogen 2.702 N/A VAL 512.A N ARG 508.A O no hydrogen 2.638 N/A ILE 513.A N VAL 509.A O no hydrogen 2.952 N/A GLU 515.A N LEU 510.A O no hydrogen 2.783 N/A ILE 517.A N ASN 208.A OD1 no hydrogen 2.602 N/A