Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3g4f_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLN 4.A N ALA 241.A O no hydrogen 2.950 N/A GLN 4.A NE2 PHE 234.A O no hydrogen 2.542 N/A TRP 8.A N SER 6.A OG no hydrogen 2.695 N/A TRP 8.A NE1 GLU 247.A OE2 no hydrogen 2.764 N/A GLY 9.A N SER 6.A O no hydrogen 3.439 N/A LEU 11.A N TRP 8.A O no hydrogen 3.149 N/A LEU 13.A N ASP 10.A O no hydrogen 3.164 N/A GLU 20.A N ASP 18.A OD1 no hydrogen 3.034 N/A GLU 22.A N ASP 18.A O no hydrogen 3.374 N/A LYS 23.A N ALA 19.A O no hydrogen 3.069 N/A ARG 24.A N GLU 20.A O no hydrogen 2.939 N/A HIS 25.A N THR 21.A O no hydrogen 2.883 N/A HIS 25.A NE2 ASP 210.A OD1 no hydrogen 2.899 N/A GLN 26.A N GLU 22.A O no hydrogen 3.021 N/A GLN 27.A N LYS 23.A O no hydrogen 3.054 N/A LEU 28.A N ARG 24.A O no hydrogen 2.750 N/A LYS 29.A N HIS 25.A O no hydrogen 3.001 N/A GLU 31.A N GLN 27.A O no hydrogen 3.173 N/A VAL 32.A N LEU 28.A O no hydrogen 2.809 N/A ARG 33.A N LYS 29.A O no hydrogen 2.868 N/A ARG 33.A NE GLU 30.A OE1 no hydrogen 3.314 N/A ARG 33.A NE GLU 30.A OE2 no hydrogen 3.135 N/A ARG 33.A NH1 HIS 61.A O no hydrogen 3.448 N/A ARG 33.A NH1 GLU 65.A OE1 no hydrogen 2.854 N/A LYS 34.A N GLU 30.A O no hydrogen 2.999 N/A MET 35.A N GLU 31.A O no hydrogen 2.985 N/A ILE 36.A N VAL 32.A O no hydrogen 3.269 N/A ILE 36.A N ARG 33.A O no hydrogen 3.041 N/A VAL 37.A N ARG 33.A O no hydrogen 3.301 N/A ALA 38.A N LYS 34.A O no hydrogen 2.884 N/A THR 44.A OG1 THR 86.A OG1 no hydrogen 2.390 N/A GLN 45.A N ASN 42.A O no hydrogen 3.092 N/A LYS 46.A N ASN 42.A O no hydrogen 3.215 N/A LYS 46.A NZ ILE 36.A O no hydrogen 3.092 N/A LYS 46.A NZ ALA 38.A O no hydrogen 3.295 N/A LYS 46.A NZ GLU 69.A OE1 no hydrogen 2.601 N/A LEU 47.A N SER 43.A O no hydrogen 2.866 N/A ALA 48.A N THR 44.A O no hydrogen 2.844 N/A PHE 49.A N GLN 45.A O no hydrogen 2.916 N/A ILE 50.A N LYS 46.A O no hydrogen 3.048 N/A ASP 51.A N LEU 47.A O no hydrogen 2.947 N/A SER 52.A N ALA 48.A O no hydrogen 2.972 N/A SER 52.A OG ALA 48.A O no hydrogen 3.519 N/A SER 52.A OG TYR 190.A OH no hydrogen 2.581 N/A VAL 53.A N PHE 49.A O no hydrogen 2.941 N/A GLN 54.A N ILE 50.A O no hydrogen 2.892 N/A GLN 54.A NE2 HIS 97.A NE2 no hydrogen 2.682 N/A ARG 55.A N ASP 51.A O no hydrogen 2.768 N/A ARG 55.A NE ASP 51.A OD2 no hydrogen 3.177 N/A ARG 55.A NH1 GLU 169.A OE2 no hydrogen 3.563 N/A ARG 55.A NH2 ASP 51.A OD2 no hydrogen 3.309 N/A ARG 55.A NH2 GLU 169.A OE2 no hydrogen 2.841 N/A LEU 56.A N SER 52.A O no hydrogen 2.790 N/A GLY 57.A N GLN 54.A O no hydrogen 3.247 N/A VAL 58.A N VAL 53.A O no hydrogen 3.356 N/A TYR 60.A OH ASP 210.A OD2 no hydrogen 2.837 N/A HIS 61.A N VAL 58.A O no hydrogen 3.356 N/A HIS 61.A NE2 ASP 210.A OD1 no hydrogen 2.880 N/A PHE 62.A N SER 59.A O no hydrogen 2.918 N/A LYS 64.A NZ ASP 68.A OD1 no hydrogen 3.307 N/A GLU 65.A N GLU 65.A OE2 no hydrogen 3.010 N/A ILE 66.A N PHE 62.A O no hydrogen 2.961 N/A GLU 67.A N THR 63.A O no hydrogen 3.004 N/A ASP 68.A N LYS 64.A O no hydrogen 3.057 N/A GLU 69.A N GLU 65.A O no hydrogen 3.247 N/A LEU 70.A N ILE 66.A O no hydrogen 3.044 N/A GLU 71.A N GLU 67.A O no hydrogen 2.900 N/A ASN 72.A N ASP 68.A O no hydrogen 3.152 N/A ILE 73.A N GLU 69.A O no hydrogen 3.002 N/A TYR 74.A N LEU 70.A O no hydrogen 2.963 N/A TYR 74.A N GLU 71.A O no hydrogen 2.970 N/A HIS 75.A N GLU 71.A O no hydrogen 3.056 N/A ASN 82.A N ASP 79.A O no hydrogen 3.344 N/A ASN 82.A ND2 ASN 77.A OD1 no hydrogen 3.595 N/A ASP 83.A N ASP 83.A OD2 no hydrogen 2.302 N/A THR 86.A OG1 THR 44.A OG1 no hydrogen 2.390 N/A THR 86.A OG1 ASP 83.A OD2 no hydrogen 2.925 N/A THR 87.A N ASP 83.A O no hydrogen 3.253 N/A THR 87.A OG1 ASP 83.A O no hydrogen 2.642 N/A SER 88.A N LEU 84.A O no hydrogen 3.011 N/A SER 88.A OG LEU 84.A O no hydrogen 2.438 N/A ILE 89.A N TYR 85.A O no hydrogen 3.005 N/A ARG 90.A N THR 86.A O no hydrogen 3.178 N/A PHE 91.A N THR 87.A O no hydrogen 2.874 N/A ARG 92.A N SER 88.A O no hydrogen 2.743 N/A ARG 92.A NH1 ASP 51.A OD1 no hydrogen 2.744 N/A ARG 92.A NH2 ASP 51.A OD1 no hydrogen 3.240 N/A ARG 92.A NH2 ASP 51.A OD2 no hydrogen 3.255 N/A ARG 92.A NH2 GLU 129.A OE2 no hydrogen 3.022 N/A LEU 93.A N ILE 89.A O no hydrogen 2.903 N/A LEU 94.A N ARG 90.A O no hydrogen 3.104 N/A ARG 95.A N PHE 91.A O no hydrogen 3.003 N/A ARG 95.A NH1 VAL 101.A O no hydrogen 2.675 N/A ARG 95.A NH1 GLU 141.A OE2 no hydrogen 3.164 N/A ARG 95.A NH2 LEU 136.A O no hydrogen 3.229 N/A ARG 95.A NH2 GLU 141.A OE1 no hydrogen 2.946 N/A ARG 95.A NH2 GLU 141.A OE2 no hydrogen 3.267 N/A GLU 96.A N ARG 92.A O no hydrogen 2.997 N/A HIS 97.A N LEU 93.A O no hydrogen 3.317 N/A HIS 97.A N LEU 94.A O no hydrogen 3.103 N/A HIS 97.A ND1 GLU 67.A OE2 no hydrogen 2.896 N/A GLY 98.A N ARG 95.A O no hydrogen 3.032 N/A TYR 99.A N LEU 94.A O no hydrogen 2.982 N/A TYR 99.A OH GLU 67.A OE1 no hydrogen 3.166 N/A VAL 101.A N TYR 99.A O no hydrogen 2.983 N/A VAL 105.A N SER 102.A O no hydrogen 3.464 N/A PHE 106.A N CYS 103.A O no hydrogen 3.148 N/A ASN 107.A N ASP 104.A O no hydrogen 2.784 N/A LYS 108.A NZ ASP 79.A O no hydrogen 3.362 N/A LYS 108.A NZ ASN 82.A O no hydrogen 2.952 N/A PHE 109.A N PHE 106.A O no hydrogen 3.131 N/A LYS 110.A N ASN 107.A O no hydrogen 2.880 N/A LYS 110.A NZ GLY 114.A O no hydrogen 3.337 N/A LYS 110.A NZ GLU 146.A OE1 no hydrogen 3.226 N/A LYS 110.A NZ GLU 146.A OE2 no hydrogen 3.180 N/A ASP 111.A N ASN 115.A O no hydrogen 2.971 N/A GLY 114.A N ASP 111.A O no hydrogen 2.605 N/A ASN 115.A N ASP 111.A OD2 no hydrogen 2.888 N/A LYS 117.A N PHE 109.A O no hydrogen 3.241 N/A THR 121.A N SER 118.A O no hydrogen 3.303 N/A THR 121.A OG1 SER 118.A O no hydrogen 2.994 N/A SER 122.A N SER 119.A O no hydrogen 3.155 N/A SER 122.A OG SER 119.A O no hydrogen 2.843 N/A ASP 123.A N VAL 120.A O no hydrogen 3.163 N/A GLY 126.A N ASP 123.A OD1 no hydrogen 3.240 N/A LEU 127.A N ASP 123.A O no hydrogen 2.833 N/A LEU 127.A N VAL 124.A O no hydrogen 2.790 N/A LEU 128.A N VAL 124.A O no hydrogen 2.906 N/A GLU 129.A N ARG 125.A O no hydrogen 3.271 N/A LEU 130.A N GLY 126.A O no hydrogen 3.060 N/A TYR 131.A N LEU 127.A O no hydrogen 2.589 N/A TYR 131.A OH ALA 173.A O no hydrogen 2.422 N/A GLN 132.A N LEU 128.A O no hydrogen 2.898 N/A ALA 133.A N GLU 129.A O no hydrogen 2.735 N/A SER 134.A N TYR 131.A O no hydrogen 3.115 N/A SER 134.A OG TYR 131.A O no hydrogen 2.832 N/A TYR 135.A N GLN 132.A O no hydrogen 3.107 N/A TYR 135.A OH TYR 131.A OH no hydrogen 2.882 N/A LEU 136.A N ALA 133.A O no hydrogen 3.273 N/A ARG 137.A NE SER 134.A O no hydrogen 2.616 N/A ARG 137.A NH2 SER 134.A O no hydrogen 3.439 N/A VAL 138.A N GLU 141.A OE1 no hydrogen 3.039 N/A HIS 139.A NE2 SER 459.A OG no hydrogen 2.950 N/A LEU 144.A N GLU 141.A O no hydrogen 3.029 N/A ASP 145.A N GLU 141.A O no hydrogen 3.109 N/A GLU 146.A N ASP 142.A O no hydrogen 2.736 N/A ALA 147.A N ILE 143.A O no hydrogen 2.854 N/A ILE 148.A N LEU 144.A O no hydrogen 3.242 N/A PHE 150.A N GLU 146.A O no hydrogen 2.963 N/A THR 151.A N ALA 147.A O no hydrogen 2.814 N/A THR 151.A OG1 ALA 147.A O no hydrogen 2.565 N/A THR 151.A OG1 ILE 148.A O no hydrogen 3.262 N/A THR 152.A N ILE 148.A O no hydrogen 2.988 N/A THR 152.A OG1 ILE 148.A O no hydrogen 2.378 N/A HIS 153.A N SER 149.A O no hydrogen 2.894 N/A HIS 154.A N PHE 150.A O no hydrogen 3.043 N/A LEU 155.A N THR 151.A O no hydrogen 3.087 N/A SER 156.A N THR 152.A O no hydrogen 3.367 N/A SER 156.A OG THR 152.A O no hydrogen 2.616 N/A SER 156.A OG HIS 153.A O no hydrogen 3.404 N/A LEU 157.A N HIS 153.A O no hydrogen 3.371 N/A ALA 158.A N LEU 155.A O no hydrogen 3.099 N/A SER 161.A N ALA 158.A O no hydrogen 3.319 N/A SER 161.A OG ALA 158.A O no hydrogen 3.244 N/A LEU 162.A N VAL 159.A O no hydrogen 3.275 N/A HIS 164.A NE2 ASP 196.A OD1 no hydrogen 2.788 N/A GLU 169.A N PRO 165.A O no hydrogen 3.169 N/A VAL 170.A N LEU 166.A O no hydrogen 3.078 N/A SER 171.A N SER 167.A O no hydrogen 2.973 N/A SER 171.A OG GLU 168.A O no hydrogen 3.555 N/A HIS 172.A N GLU 168.A O no hydrogen 2.940 N/A HIS 172.A NE2 GLU 186.A OE1 no hydrogen 2.682 N/A ALA 173.A N GLU 169.A O no hydrogen 3.149 N/A LEU 174.A N VAL 170.A O no hydrogen 3.207 N/A LEU 174.A N SER 171.A O no hydrogen 3.204 N/A LYS 175.A N SER 171.A O no hydrogen 3.377 N/A LYS 175.A N HIS 172.A O no hydrogen 2.969 N/A GLN 176.A N HIS 172.A O no hydrogen 2.806 N/A GLN 176.A NE2 SER 177.A O no hydrogen 3.533 N/A GLN 176.A NE2 ASP 490.A OD1 no hydrogen 2.942 N/A ILE 178.A N GLN 132.A OE1 no hydrogen 3.022 N/A ARG 179.A NH1 ASN 465.A OD1 no hydrogen 2.609 N/A ARG 180.A N SER 177.A OG no hydrogen 3.074 N/A ARG 180.A NH1 GLU 458.A OE1 no hydrogen 3.090 N/A ARG 180.A NH2 GLU 458.A OE2 no hydrogen 3.111 N/A ARG 184.A NH2 PHE 211.A O no hydrogen 2.936 N/A GLU 186.A N LEU 182.A O no hydrogen 3.028 N/A ALA 187.A N PRO 183.A O no hydrogen 2.819 N/A ARG 188.A N ARG 184.A O no hydrogen 3.103 N/A ARG 188.A NH1 ARG 188.A O no hydrogen 3.326 N/A HIS 189.A N VAL 185.A O no hydrogen 3.407 N/A TYR 190.A N GLU 186.A O no hydrogen 2.836 N/A TYR 190.A OH SER 52.A OG no hydrogen 2.581 N/A LEU 191.A N ALA 187.A O no hydrogen 2.995 N/A SER 192.A N HIS 189.A O no hydrogen 3.204 N/A VAL 193.A N HIS 189.A O no hydrogen 3.318 N/A TYR 194.A N TYR 190.A O no hydrogen 2.777 N/A GLN 195.A N LEU 191.A O no hydrogen 3.350 N/A GLN 195.A N SER 192.A O no hydrogen 3.240 N/A SER 198.A OG GLU 197.A O no hydrogen 2.576 N/A ASN 200.A N TYR 194.A OH no hydrogen 3.122 N/A LEU 203.A N ASN 200.A OD1 no hydrogen 2.784 N/A LEU 204.A N ASN 200.A O no hydrogen 3.009 N/A GLU 205.A N LYS 201.A O no hydrogen 3.093 N/A PHE 206.A N ALA 202.A O no hydrogen 3.006 N/A ALA 207.A N LEU 203.A O no hydrogen 2.858 N/A LYS 208.A N LEU 204.A O no hydrogen 3.132 N/A ILE 209.A N GLU 205.A O no hydrogen 3.024 N/A ASP 210.A N PHE 206.A O no hydrogen 2.838 N/A PHE 211.A N ALA 207.A O no hydrogen 2.942 N/A ASN 212.A N LYS 208.A O no hydrogen 3.231 N/A ASN 212.A ND2 ILE 513.A O no hydrogen 2.912 N/A MET 213.A N ILE 209.A O no hydrogen 3.004 N/A LEU 214.A N ASP 210.A O no hydrogen 2.980 N/A GLN 215.A N PHE 211.A O no hydrogen 3.062 N/A GLN 215.A NE2 LEU 508.A O no hydrogen 3.485 N/A GLN 215.A NE2 GLU 511.A O no hydrogen 2.987 N/A PHE 216.A N ASN 212.A O no hydrogen 2.857 N/A LEU 217.A N MET 213.A O no hydrogen 3.114 N/A HIS 218.A N LEU 214.A O no hydrogen 2.756 N/A HIS 218.A NE2 PHE 257.A O no hydrogen 2.861 N/A ARG 219.A N GLN 215.A O no hydrogen 2.830 N/A ARG 219.A NH1 LEU 509.A O no hydrogen 2.944 N/A LYS 220.A N PHE 216.A O no hydrogen 2.887 N/A GLU 221.A N LEU 217.A O no hydrogen 2.961 N/A LEU 222.A N HIS 218.A O no hydrogen 2.813 N/A SER 223.A N ARG 219.A O no hydrogen 3.156 N/A SER 223.A OG LEU 13.A O no hydrogen 2.985 N/A GLU 224.A N LYS 220.A O no hydrogen 3.104 N/A ILE 225.A N GLU 221.A O no hydrogen 3.172 N/A CYS 226.A N LEU 222.A O no hydrogen 3.047 N/A CYS 226.A SG LEU 222.A O no hydrogen 3.272 N/A ARG 227.A N SER 223.A O no hydrogen 3.074 N/A TRP 228.A N GLU 224.A O no hydrogen 3.158 N/A TRP 229.A N ILE 225.A O no hydrogen 2.932 N/A TRP 229.A NE1 ASP 243.A OD2 no hydrogen 2.850 N/A LYS 230.A N CYS 226.A O no hydrogen 2.747 N/A ASP 231.A N ARG 227.A O no hydrogen 3.234 N/A LEU 232.A N TRP 229.A O no hydrogen 3.115 N/A LYS 237.A N ASP 233.A O no hydrogen 3.211 N/A TYR 240.A OH THR 281.A OG1 no hydrogen 2.834 N/A ALA 241.A N LEU 238.A O no hydrogen 2.629 N/A ARG 242.A N ASP 280.A OD2 no hydrogen 3.268 N/A ARG 244.A NH1 ASP 243.A O no hydrogen 3.093 N/A VAL 245.A N ASP 243.A OD1 no hydrogen 3.369 N/A GLU 247.A N GLU 247.A OE1 no hydrogen 2.880 N/A GLY 248.A N ARG 244.A O no hydrogen 2.798 N/A TYR 249.A N VAL 245.A O no hydrogen 2.837 N/A TYR 249.A OH GLU 221.A OE1 no hydrogen 2.782 N/A PHE 250.A N VAL 246.A O no hydrogen 2.973 N/A TRP 251.A N GLU 247.A O no hydrogen 3.023 N/A ILE 252.A N GLY 248.A O no hydrogen 2.815 N/A SER 253.A N TYR 249.A O no hydrogen 2.696 N/A SER 253.A OG PHE 250.A O no hydrogen 2.932 N/A GLY 254.A N PHE 250.A O no hydrogen 3.029 N/A GLY 254.A N TRP 251.A O no hydrogen 2.926 N/A VAL 255.A N ILE 252.A O no hydrogen 2.891 N/A TYR 256.A N ILE 252.A O no hydrogen 3.274 N/A TYR 256.A OH SER 389.A O no hydrogen 2.687 N/A GLU 258.A N GLU 258.A OE1 no hydrogen 2.467 N/A TYR 261.A N GLU 258.A O no hydrogen 3.346 N/A TYR 261.A OH GLU 477.A OE1 no hydrogen 2.582 N/A SER 262.A N PRO 259.A O no hydrogen 3.212 N/A SER 262.A OG GLU 221.A OE2 no hydrogen 2.540 N/A ARG 265.A N TYR 261.A O no hydrogen 2.861 N/A ARG 265.A NE GLU 221.A OE1 no hydrogen 2.719 N/A ARG 265.A NH1 TYR 256.A O no hydrogen 2.881 N/A ARG 265.A NH1 GLU 258.A O no hydrogen 2.762 N/A ARG 265.A NH2 GLU 221.A OE1 no hydrogen 3.396 N/A ARG 265.A NH2 GLU 221.A OE2 no hydrogen 2.709 N/A ARG 265.A NH2 GLU 258.A O no hydrogen 3.017 N/A LYS 266.A N SER 262.A O no hydrogen 3.113 N/A MET 267.A N LEU 263.A O no hydrogen 2.959 N/A LEU 268.A N GLY 264.A O no hydrogen 2.808 N/A THR 269.A N ARG 265.A O no hydrogen 2.804 N/A THR 269.A OG1 ARG 265.A O no hydrogen 2.737 N/A LYS 270.A N LYS 266.A O no hydrogen 3.283 N/A LYS 270.A NZ GLU 326.A OE1 no hydrogen 3.506 N/A LYS 270.A NZ GLU 326.A OE2 no hydrogen 2.499 N/A VAL 271.A N MET 267.A O no hydrogen 3.024 N/A ILE 272.A N LEU 268.A O no hydrogen 3.063 N/A ALA 273.A N THR 269.A O no hydrogen 3.073 N/A MET 274.A N LYS 270.A O no hydrogen 3.024 N/A ALA 275.A N VAL 271.A O no hydrogen 2.790 N/A SER 276.A N ILE 272.A O no hydrogen 3.099 N/A ILE 277.A N ALA 273.A O no hydrogen 3.078 N/A VAL 278.A N MET 274.A O no hydrogen 2.838 N/A ASP 279.A N ALA 275.A O no hydrogen 2.737 N/A ASP 280.A N SER 276.A O no hydrogen 2.914 N/A THR 281.A N ILE 277.A O no hydrogen 2.981 N/A THR 281.A OG1 TYR 240.A OH no hydrogen 2.834 N/A THR 281.A OG1 ILE 277.A O no hydrogen 2.640 N/A TYR 282.A N VAL 278.A O no hydrogen 3.191 N/A TYR 282.A N ASP 279.A O no hydrogen 2.944 N/A TYR 282.A OH THR 295.A OG1 no hydrogen 2.372 N/A ASP 283.A N ASP 279.A O no hydrogen 3.069 N/A ASP 283.A N ASP 280.A O no hydrogen 2.715 N/A ALA 286.A N SER 284.A OG no hydrogen 2.982 N/A THR 287.A N GLU 290.A OE1 no hydrogen 3.247 N/A GLU 290.A N THR 287.A O no hydrogen 2.958 N/A LEU 291.A N THR 287.A O no hydrogen 3.157 N/A ILE 292.A N TYR 288.A O no hydrogen 3.204 N/A TYR 294.A N GLU 290.A O no hydrogen 3.329 N/A TYR 294.A OH SER 316.A OG no hydrogen 2.667 N/A THR 295.A N LEU 291.A O no hydrogen 2.938 N/A THR 295.A OG1 TYR 282.A OH no hydrogen 2.372 N/A THR 295.A OG1 LEU 291.A O no hydrogen 3.196 N/A ASN 296.A N ILE 292.A O no hydrogen 2.795 N/A ALA 297.A N PRO 293.A O no hydrogen 2.731 N/A ILE 298.A N TYR 294.A O no hydrogen 2.948 N/A GLU 299.A N THR 295.A O no hydrogen 2.902 N/A ARG 300.A N ASN 296.A O no hydrogen 3.282 N/A ARG 300.A NH1 ASN 296.A OD1 no hydrogen 2.945 N/A TRP 301.A N ALA 297.A O no hydrogen 2.974 N/A ASP 302.A N TYR 317.A OH no hydrogen 3.178 N/A LYS 304.A N ASP 302.A OD1 no hydrogen 2.868 N/A CYS 305.A N ASP 302.A O no hydrogen 2.942 N/A ILE 306.A N ILE 303.A O no hydrogen 3.026 N/A ASP 307.A N LYS 304.A O no hydrogen 3.493 N/A GLU 308.A N CYS 305.A O no hydrogen 2.990 N/A TYR 312.A OH GLU 290.A OE1 no hydrogen 2.848 N/A MET 313.A N PRO 310.A O no hydrogen 2.897 N/A LYS 314.A N GLU 311.A O no hydrogen 3.153 N/A SER 316.A N MET 313.A O no hydrogen 3.187 N/A SER 316.A OG TYR 294.A OH no hydrogen 2.667 N/A SER 316.A OG MET 313.A O no hydrogen 3.142 N/A TYR 317.A N MET 313.A O no hydrogen 3.109 N/A TYR 317.A OH ALA 297.A O no hydrogen 2.615 N/A TYR 317.A OH ASP 302.A O no hydrogen 3.101 N/A LYS 318.A N LYS 314.A O no hydrogen 2.897 N/A LYS 318.A NZ ASP 322.A OD1 no hydrogen 3.062 N/A ALA 319.A N PRO 315.A O no hydrogen 3.249 N/A LEU 320.A N SER 316.A O no hydrogen 2.851 N/A LEU 321.A N TYR 317.A O no hydrogen 2.928 N/A ASP 322.A N LYS 318.A O no hydrogen 2.998 N/A VAL 323.A N ALA 319.A O no hydrogen 2.952 N/A GLU 325.A N LEU 321.A O no hydrogen 3.065 N/A GLU 326.A N ASP 322.A O no hydrogen 2.924 N/A MET 327.A N VAL 323.A O no hydrogen 2.905 N/A VAL 328.A N TYR 324.A O no hydrogen 2.945 N/A GLN 329.A N GLU 325.A O no hydrogen 3.344 N/A GLN 329.A NE2 GLU 325.A OE1 no hydrogen 3.406 N/A LEU 330.A N GLU 326.A O no hydrogen 2.989 N/A ALA 332.A N VAL 328.A O no hydrogen 2.970 N/A HIS 334.A N VAL 331.A O no hydrogen 3.292 N/A GLY 335.A N ALA 332.A O no hydrogen 2.765 N/A ARG 336.A N VAL 331.A O no hydrogen 3.208 N/A GLN 337.A N GLN 337.A OE1 no hydrogen 2.499 N/A ARG 339.A N ARG 336.A O no hydrogen 3.081 N/A ARG 339.A NE TYR 338.A OH no hydrogen 3.262 N/A ARG 339.A NH1 VAL 391.A O no hydrogen 3.046 N/A ARG 339.A NH1 MET 393.A O no hydrogen 2.765 N/A ARG 339.A NH2 GLY 394.A O no hydrogen 2.973 N/A VAL 340.A N GLN 337.A O no hydrogen 2.800 N/A LYS 344.A N VAL 340.A O no hydrogen 2.796 N/A LYS 344.A NZ GLU 341.A OE1 no hydrogen 3.532 N/A ASN 345.A N GLU 341.A O no hydrogen 2.827 N/A ALA 346.A N TYR 342.A O no hydrogen 3.153 N/A MET 347.A N ALA 343.A O no hydrogen 3.025 N/A ILE 348.A N LYS 344.A O no hydrogen 2.920 N/A ARG 349.A N ASN 345.A O no hydrogen 2.991 N/A ARG 349.A NH1 ARG 349.A O no hydrogen 3.178 N/A LEU 350.A N ALA 346.A O no hydrogen 3.068 N/A ALA 351.A N MET 347.A O no hydrogen 2.938 N/A GLN 352.A N ILE 348.A O no hydrogen 2.981 N/A SER 353.A N ARG 349.A O no hydrogen 3.282 N/A SER 353.A N LEU 350.A O no hydrogen 3.185 N/A SER 353.A OG LEU 350.A O no hydrogen 2.837 N/A SER 353.A OG PRO 378.A O no hydrogen 2.827 N/A TYR 354.A N LEU 350.A O no hydrogen 3.154 N/A TYR 354.A N ALA 351.A O no hydrogen 3.241 N/A LEU 355.A N ALA 351.A O no hydrogen 3.178 N/A VAL 356.A N GLN 352.A O no hydrogen 3.375 N/A GLU 357.A N SER 353.A O no hydrogen 3.117 N/A ALA 358.A N TYR 354.A O no hydrogen 2.847 N/A LYS 359.A N LEU 355.A O no hydrogen 3.229 N/A TRP 360.A N VAL 356.A O no hydrogen 3.291 N/A THR 361.A N GLU 357.A O no hydrogen 3.250 N/A THR 361.A OG1 ALA 358.A O no hydrogen 3.238 N/A LEU 362.A N ALA 358.A O no hydrogen 2.888 N/A GLN 363.A N LYS 359.A O no hydrogen 2.902 N/A TYR 365.A N TRP 360.A O no hydrogen 3.385 N/A TYR 365.A OH GLU 371.A OE1 no hydrogen 2.601 N/A TYR 365.A OH GLU 371.A OE2 no hydrogen 2.973 N/A SER 368.A N GLU 371.A OE1 no hydrogen 3.113 N/A PHE 372.A N SER 368.A O no hydrogen 3.294 N/A LYS 373.A N PHE 369.A O no hydrogen 2.738 N/A ALA 374.A N GLU 370.A O no hydrogen 2.892 N/A ASN 375.A N PHE 372.A O no hydrogen 3.109 N/A THR 379.A N ALA 376.A O no hydrogen 3.152 N/A THR 379.A OG1 ALA 376.A O no hydrogen 2.829 N/A TYR 382.A OH LEU 485.A O no hydrogen 3.270 N/A LEU 385.A N GLY 381.A O no hydrogen 2.981 N/A ALA 386.A N TYR 382.A O no hydrogen 2.924 N/A ILE 387.A N ALA 383.A O no hydrogen 2.967 N/A THR 388.A N MET 384.A O no hydrogen 3.038 N/A THR 388.A OG1 MET 384.A O no hydrogen 2.665 N/A SER 389.A N LEU 385.A O no hydrogen 2.824 N/A SER 389.A N ALA 386.A O no hydrogen 2.802 N/A SER 389.A OG ALA 386.A O no hydrogen 2.610 N/A PHE 390.A N ALA 386.A O no hydrogen 3.287 N/A PHE 390.A N ILE 387.A O no hydrogen 3.166 N/A VAL 391.A N THR 388.A O no hydrogen 3.001 N/A MET 393.A N PHE 390.A O no hydrogen 3.197 N/A VAL 397.A N GLY 394.A O no hydrogen 3.033 N/A THR 398.A N THR 401.A OG1 no hydrogen 3.090 N/A THR 398.A OG1 GLU 400.A OE1 no hydrogen 3.526 N/A THR 401.A N THR 398.A O no hydrogen 2.604 N/A LYS 403.A N PRO 399.A O no hydrogen 3.137 N/A TRP 404.A N GLU 400.A O no hydrogen 3.052 N/A TRP 404.A N THR 401.A O no hydrogen 3.205 N/A TRP 404.A NE1 GLU 473.A OE1 no hydrogen 2.937 N/A ALA 405.A N THR 401.A O no hydrogen 2.983 N/A ALA 406.A N PHE 402.A O no hydrogen 3.200 N/A SER 407.A N TRP 404.A O no hydrogen 3.240 N/A SER 407.A OG TRP 404.A O no hydrogen 3.019 N/A ASP 408.A N ALA 405.A O no hydrogen 3.433 N/A LYS 410.A NZ GLU 473.A OE1 no hydrogen 2.645 N/A LYS 410.A NZ GLU 473.A OE2 no hydrogen 2.930 N/A GLN 413.A N PRO 409.A O no hydrogen 2.976 N/A ALA 414.A N LYS 410.A O no hydrogen 2.865 N/A SER 415.A N ILE 411.A O no hydrogen 3.259 N/A SER 415.A OG ILE 411.A O no hydrogen 3.165 N/A SER 415.A OG ILE 412.A O no hydrogen 2.802 N/A THR 416.A N ILE 412.A O no hydrogen 2.924 N/A THR 416.A OG1 ILE 412.A O no hydrogen 2.865 N/A ILE 417.A N GLN 413.A O no hydrogen 2.846 N/A ILE 418.A N ALA 414.A O no hydrogen 2.933 N/A CYS 419.A N SER 415.A O no hydrogen 2.849 N/A ARG 420.A N THR 416.A O no hydrogen 2.762 N/A ARG 420.A NE ALA 376.A O no hydrogen 3.474 N/A ARG 420.A NH1 ASP 423.A OD1 no hydrogen 2.706 N/A ARG 420.A NH1 ASP 424.A OD1 no hydrogen 3.264 N/A ARG 420.A NH2 THR 379.A OG1 no hydrogen 2.689 N/A PHE 421.A N ILE 417.A O no hydrogen 2.815 N/A MET 422.A N ILE 418.A O no hydrogen 2.999 N/A MET 422.A N CYS 419.A O no hydrogen 3.217 N/A ASP 423.A N CYS 419.A O no hydrogen 2.924 N/A ASP 424.A N ARG 420.A O no hydrogen 3.222 N/A ALA 426.A N MET 422.A O no hydrogen 3.024 N/A GLU 427.A N ASP 424.A O no hydrogen 2.879 N/A HIS 428.A N ASP 424.A O no hydrogen 3.070 N/A HIS 428.A ND1 TYR 450.A OH no hydrogen 2.976 N/A LYS 429.A N VAL 425.A O no hydrogen 2.720 N/A LYS 429.A NZ GLU 495.A OE2 no hydrogen 3.449 N/A PHE 430.A N ALA 426.A O no hydrogen 3.292 N/A GLU 436.A N SER 433.A OG no hydrogen 2.706 N/A CYS 437.A N SER 433.A O no hydrogen 3.056 N/A TYR 438.A N ALA 434.A O no hydrogen 2.894 N/A MET 439.A N ILE 435.A O no hydrogen 2.858 N/A GLU 440.A N GLU 436.A O no hydrogen 3.281 N/A GLU 441.A N CYS 437.A O no hydrogen 2.992 N/A TYR 442.A N TYR 438.A O no hydrogen 3.141 N/A VAL 444.A N MET 439.A O no hydrogen 3.290 N/A THR 445.A OG1 GLU 448.A OE1 no hydrogen 2.552 N/A GLU 448.A N THR 445.A OG1 no hydrogen 3.323 N/A ALA 449.A N THR 445.A O no hydrogen 2.786 N/A TYR 450.A N ALA 446.A O no hydrogen 2.745 N/A TYR 450.A OH HIS 428.A ND1 no hydrogen 2.976 N/A ASP 451.A N GLN 447.A O no hydrogen 2.730 N/A VAL 452.A N GLU 448.A O no hydrogen 3.337 N/A PHE 453.A N ALA 449.A O no hydrogen 2.928 N/A ASN 454.A N TYR 450.A O no hydrogen 2.977 N/A LYS 455.A N ASP 451.A O no hydrogen 2.974 N/A HIS 456.A N PHE 453.A O no hydrogen 2.808 N/A VAL 457.A N PHE 453.A O no hydrogen 2.908 N/A GLU 458.A N ASN 454.A O no hydrogen 2.963 N/A SER 459.A OG HIS 139.A NE2 no hydrogen 2.950 N/A ALA 460.A N HIS 456.A O no hydrogen 2.849 N/A TRP 461.A N VAL 457.A O no hydrogen 2.768 N/A LYS 462.A N GLU 458.A O no hydrogen 3.111 N/A LYS 462.A NZ ASP 145.A OD1 no hydrogen 3.018 N/A ASP 463.A N SER 459.A O no hydrogen 2.965 N/A LEU 464.A N ALA 460.A O no hydrogen 3.029 N/A ASN 465.A N TRP 461.A O no hydrogen 3.079 N/A ASN 465.A ND2 TYR 135.A O no hydrogen 2.783 N/A ASN 465.A ND2 ARG 137.A O no hydrogen 3.116 N/A GLN 466.A N LYS 462.A O no hydrogen 3.071 N/A GLU 467.A N ASP 463.A O no hydrogen 2.990 N/A PHE 468.A N ASN 465.A O no hydrogen 3.002 N/A LEU 469.A N GLN 466.A O no hydrogen 2.949 N/A LYS 470.A N GLY 98.A O no hydrogen 2.921 N/A THR 472.A OG1 MET 474.A O no hydrogen 2.868 N/A VAL 478.A N PRO 475.A O no hydrogen 2.859 N/A LEU 479.A N PRO 475.A O no hydrogen 3.188 N/A ASN 480.A N THR 476.A O no hydrogen 2.905 N/A ASN 480.A ND2 GLU 477.A OE2 no hydrogen 2.811 N/A ARG 481.A NE VAL 255.A O no hydrogen 3.254 N/A ARG 481.A NH1 GLU 477.A O no hydrogen 2.956 N/A ARG 481.A NH1 GLU 477.A OE1 no hydrogen 2.814 N/A ARG 481.A NH2 VAL 255.A O no hydrogen 2.688 N/A SER 482.A N LEU 479.A O no hydrogen 2.755 N/A LEU 483.A N LEU 479.A O no hydrogen 3.124 N/A ASN 484.A N ASN 480.A O no hydrogen 2.728 N/A ASN 484.A ND2 VAL 255.A O no hydrogen 2.941 N/A LEU 485.A N ARG 481.A O no hydrogen 3.155 N/A ALA 486.A N SER 482.A O no hydrogen 2.992 N/A ARG 487.A N LEU 483.A O no hydrogen 2.785 N/A ARG 487.A NE ARG 179.A O no hydrogen 2.851 N/A ARG 487.A NH1 ASN 484.A OD1 no hydrogen 2.840 N/A ARG 487.A NH2 ARG 179.A O no hydrogen 3.301 N/A VAL 488.A N ASN 484.A O no hydrogen 2.855 N/A MET 489.A N LEU 485.A O no hydrogen 3.380 N/A ASP 490.A N ALA 486.A O no hydrogen 3.252 N/A VAL 491.A N ARG 487.A O no hydrogen 3.080 N/A LEU 492.A N VAL 488.A O no hydrogen 2.816 N/A TYR 493.A N MET 489.A O no hydrogen 2.687 N/A LYS 502.A N GLY 498.A O no hydrogen 2.938 N/A GLY 503.A N LYS 499.A O no hydrogen 2.801 N/A GLY 504.A N ALA 500.A O no hydrogen 3.095 N/A ILE 505.A N ALA 501.A O no hydrogen 2.866 N/A THR 506.A N LYS 502.A O no hydrogen 3.169 N/A THR 506.A OG1 LYS 502.A O no hydrogen 3.384 N/A SER 507.A N GLY 503.A O no hydrogen 3.460 N/A SER 507.A OG GLY 504.A O no hydrogen 3.260 N/A LEU 508.A N GLY 504.A O no hydrogen 3.028 N/A LEU 509.A N ILE 505.A O no hydrogen 2.999 N/A ILE 510.A N THR 506.A O no hydrogen 2.970 N/A GLU 511.A N THR 506.A O no hydrogen 2.950 N/A ILE 513.A N ASN 212.A OD1 no hydrogen 2.876 N/A