Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4f9j_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): TRP 2.A NE1 GLY 6.A O no hydrogen 2.752 N/A GLY 6.A N PRO 3.A O no hydrogen 3.003 N/A PHE 7.A N ALA 231.A O no hydrogen 2.980 N/A VAL 8.A N ALA 62.A O no hydrogen 2.945 N/A ILE 10.A N VAL 64.A O no hydrogen 3.012 N/A SER 11.A N VAL 242.A O no hydrogen 2.830 N/A SER 11.A OG ASP 68.A OD2 no hydrogen 2.974 N/A TRP 12.A N THR 66.A O no hydrogen 2.835 N/A TRP 12.A NE1 GLN 31.A OE1 no hydrogen 2.866 N/A ASN 14.A ND2 GLU 16.A OE1 no hydrogen 2.983 N/A ASN 14.A ND2 SER 22.A OG no hydrogen 3.256 N/A VAL 15.A N SER 73.A OG no hydrogen 3.075 N/A GLU 16.A N VAL 23.A O no hydrogen 3.032 N/A SER 22.A OG PHE 21.A O no hydrogen 3.201 N/A VAL 23.A N ASN 14.A O no hydrogen 3.045 N/A ARG 24.A N ASN 247.A OD1 no hydrogen 3.213 N/A THR 25.A N GLU 16.A O no hydrogen 2.776 N/A THR 25.A OG1 ASP 17.A OD1 no hydrogen 2.782 N/A LEU 28.A N ARG 24.A O no hydrogen 2.842 N/A ARG 29.A N THR 25.A O no hydrogen 2.974 N/A GLU 30.A N SER 26.A O no hydrogen 2.900 N/A GLN 31.A N ALA 27.A O no hydrogen 2.728 N/A PHE 32.A N LEU 28.A O no hydrogen 2.841 N/A ALA 33.A N ARG 29.A O no hydrogen 2.852 N/A TRP 34.A N GLU 30.A O no hydrogen 2.789 N/A LEU 35.A N GLN 31.A O no hydrogen 2.908 N/A ARG 36.A N PHE 32.A O no hydrogen 2.953 N/A GLU 37.A N ALA 33.A O no hydrogen 2.722 N/A ASN 38.A N TRP 34.A O no hydrogen 3.032 N/A ASN 38.A N LEU 35.A O no hydrogen 3.288 N/A ASN 38.A ND2 TRP 34.A O no hydrogen 2.856 N/A GLY 39.A N ARG 36.A O no hydrogen 3.159 N/A TYR 40.A N LEU 35.A O no hydrogen 3.005 N/A GLN 41.A N LYS 61.A O no hydrogen 2.824 N/A VAL 43.A N VAL 63.A O no hydrogen 2.797 N/A SER 44.A N GLN 47.A OE1 no hydrogen 2.770 N/A SER 44.A OG GLN 47.A OE1 no hydrogen 3.439 N/A GLN 47.A N SER 44.A OG no hydrogen 3.159 N/A ILE 48.A N SER 44.A O no hydrogen 3.126 N/A ARG 49.A N ILE 45.A O no hydrogen 2.925 N/A ARG 49.A NE ASP 222.A OD2 no hydrogen 2.844 N/A ARG 49.A NH2 ASP 222.A OD1 no hydrogen 2.972 N/A GLU 50.A N ALA 46.A O no hydrogen 3.057 N/A ALA 51.A N GLN 47.A O no hydrogen 3.002 N/A HIS 52.A N ILE 48.A O no hydrogen 2.891 N/A HIS 52.A ND1 ALA 233.A O no hydrogen 2.648 N/A ARG 53.A N ARG 49.A O no hydrogen 3.137 N/A GLY 54.A N ALA 51.A O no hydrogen 3.020 N/A GLY 55.A N GLU 50.A O no hydrogen 2.813 N/A LYS 56.A N GLU 50.A OE1 no hydrogen 2.698 N/A LEU 58.A N ASN 5.A OD1 no hydrogen 2.909 N/A LYS 61.A NZ ASN 38.A O no hydrogen 3.006 N/A VAL 63.A N GLN 41.A O no hydrogen 2.877 N/A VAL 64.A N VAL 8.A O no hydrogen 2.939 N/A THR 66.A N ILE 10.A O no hydrogen 2.870 N/A THR 66.A OG1 ILE 10.A O no hydrogen 2.483 N/A PHE 67.A N VAL 90.A O no hydrogen 2.866 N/A ASP 68.A N TRP 12.A O no hydrogen 2.977 N/A ASP 69.A N ALA 92.A O no hydrogen 2.772 N/A TYR 71.A OH ASP 69.A OD2 no hydrogen 2.750 N/A GLN 72.A N TYR 117.A O no hydrogen 2.824 N/A GLN 72.A NE2 GLU 116.A O no hydrogen 2.488 N/A SER 73.A OG ASN 14.A OD1 no hydrogen 2.573 N/A PHE 74.A N TYR 71.A O no hydrogen 3.064 N/A TYR 75.A OH GLU 126.A OE1 no hydrogen 2.302 N/A TYR 75.A OH GLU 126.A OE2 no hydrogen 3.057 N/A THR 76.A N GLN 72.A O no hydrogen 2.960 N/A THR 76.A OG1 GLN 72.A O no hydrogen 3.259 N/A ARG 77.A N SER 73.A O no hydrogen 2.818 N/A ARG 77.A NE ASP 17.A OD2 no hydrogen 3.108 N/A ARG 77.A NH1 VAL 15.A O no hydrogen 2.910 N/A VAL 78.A N SER 73.A O no hydrogen 3.222 N/A PHE 79.A N PHE 74.A O no hydrogen 2.698 N/A LEU 82.A N VAL 78.A O no hydrogen 3.087 N/A GLN 83.A N PHE 79.A O no hydrogen 2.998 N/A ALA 84.A N PRO 80.A O no hydrogen 2.988 N/A PHE 85.A N ILE 81.A O no hydrogen 2.884 N/A GLN 86.A N GLN 83.A O no hydrogen 3.242 N/A GLN 86.A NE2 GLN 83.A O no hydrogen 2.697 N/A TRP 87.A N LEU 82.A O no hydrogen 2.890 N/A ALA 89.A N LEU 132.A O no hydrogen 3.182 N/A VAL 90.A N LEU 65.A O no hydrogen 2.856 N/A TRP 91.A N GLU 134.A O no hydrogen 2.961 N/A ALA 92.A N PHE 67.A O no hydrogen 2.842 N/A GLY 95.A N THR 139.A O no hydrogen 3.033 N/A SER 96.A N TRP 140.A O no hydrogen 2.799 N/A SER 96.A OG TRP 140.A O no hydrogen 2.972 N/A TRP 97.A N VAL 94.A O no hydrogen 3.171 N/A VAL 98.A N VAL 94.A O no hydrogen 3.127 N/A ASP 99.A N GLY 95.A O no hydrogen 2.800 N/A THR 100.A N TRP 97.A O no hydrogen 3.135 N/A THR 100.A OG1 SER 96.A O no hydrogen 2.980 N/A THR 100.A OG1 TRP 97.A O no hydrogen 2.945 N/A LYS 104.A N PRO 101.A O no hydrogen 3.236 N/A VAL 106.A N VAL 113.A O no hydrogen 2.784 N/A PHE 108.A N GLU 111.A O no hydrogen 2.883 N/A GLU 111.A N PHE 108.A O no hydrogen 3.172 N/A VAL 113.A N VAL 106.A O no hydrogen 2.977 N/A ARG 115.A NE THR 100.A O no hydrogen 2.664 N/A ARG 115.A NE PRO 101.A O no hydrogen 3.392 N/A ARG 115.A NH1 ARG 115.A O no hydrogen 3.043 N/A ARG 115.A NH1 PHE 118.A O no hydrogen 2.889 N/A ARG 115.A NH1 ALA 119.A O no hydrogen 3.117 N/A ARG 115.A NH2 THR 100.A O no hydrogen 2.822 N/A ARG 115.A NH2 ALA 119.A O no hydrogen 3.018 N/A TYR 117.A N ASP 114.A O no hydrogen 3.233 N/A PHE 118.A N ARG 115.A O no hydrogen 2.962 N/A ALA 119.A N GLY 70.A O no hydrogen 2.994 N/A THR 120.A N GLN 123.A OE1 no hydrogen 3.048 N/A TRP 121.A NE1 ASP 99.A OD1 no hydrogen 2.651 N/A GLN 123.A N THR 120.A OG1 no hydrogen 3.212 N/A GLN 123.A NE2 GLN 72.A OE1 no hydrogen 2.959 N/A VAL 124.A N THR 120.A O no hydrogen 3.022 N/A ARG 125.A N TRP 121.A O no hydrogen 2.826 N/A ARG 125.A NE LYS 193.A O no hydrogen 2.873 N/A ARG 125.A NH2 LYS 193.A O no hydrogen 2.921 N/A GLU 126.A N GLN 122.A O no hydrogen 3.181 N/A VAL 127.A N GLN 123.A O no hydrogen 2.978 N/A ALA 128.A N VAL 124.A O no hydrogen 2.828 N/A ARG 129.A N ARG 125.A O no hydrogen 2.927 N/A SER 130.A N VAL 127.A O no hydrogen 3.194 N/A SER 130.A OG VAL 127.A O no hydrogen 2.721 N/A ARG 131.A N ALA 128.A O no hydrogen 3.325 N/A LEU 132.A N SER 130.A OG no hydrogen 3.196 N/A GLU 134.A N ALA 89.A O no hydrogen 2.993 N/A ALA 136.A N TRP 91.A O no hydrogen 2.895 N/A SER 137.A N VAL 200.A O no hydrogen 2.955 N/A HIS 138.A N PRO 93.A O no hydrogen 3.092 N/A HIS 138.A ND1 VAL 202.A O no hydrogen 2.625 N/A THR 139.A N SER 137.A OG no hydrogen 2.959 N/A THR 139.A OG1 HIS 138.A O no hydrogen 2.669 N/A TRP 140.A N ASP 183.A OD1 no hydrogen 2.805 N/A ASN 141.A N ASP 183.A OD2 no hydrogen 2.880 N/A SER 142.A N THR 139.A OG1 no hydrogen 2.953 N/A SER 142.A OG ASP 183.A OD2 no hydrogen 2.767 N/A HIS 143.A ND1 HIS 143.A O no hydrogen 2.716 N/A ILE 146.A N LEU 155.A O no hydrogen 2.823 N/A GLN 147.A NE2 ASN 149.A O no hydrogen 2.994 N/A ALA 148.A N SER 153.A O no hydrogen 2.782 N/A ASN 149.A ND2 SER 153.A OG no hydrogen 2.814 N/A ASN 149.A ND2 SER 331.A OG no hydrogen 3.010 N/A ALA 150.A N ASP 328.A OD2 no hydrogen 3.367 N/A THR 151.A OG1 ASN 149.A OD1 no hydrogen 3.260 N/A GLY 152.A N ASN 149.A O no hydrogen 3.314 N/A GLY 152.A N ASN 149.A OD1 no hydrogen 2.903 N/A SER 153.A N ASN 149.A OD1 no hydrogen 2.932 N/A LEU 155.A N ILE 146.A O no hydrogen 2.882 N/A VAL 157.A N TYR 144.A O no hydrogen 2.898 N/A TYR 158.A OH ILE 180.A O no hydrogen 2.860 N/A VAL 159.A N PRO 156.A O no hydrogen 3.415 N/A ASN 160.A ND2 PRO 156.A O no hydrogen 3.059 N/A ARG 161.A NE.B GLU 171.A O no hydrogen 2.933 N/A ARG 161.A NH1.B GLU 171.A O no hydrogen 2.738 N/A ALA 162.A N GLU 171.A OE1 no hydrogen 2.814 N/A TYR 163.A N GLN 147.A O no hydrogen 2.891 N/A PHE 164.A N ARG 169.A O no hydrogen 2.795 N/A ARG 169.A N PHE 164.A O no hydrogen 3.326 N/A ARG 169.A NH1 TYR 170.A O no hydrogen 2.991 N/A ARG 169.A NH1 GLU 175.A OE1 no hydrogen 2.955 N/A ARG 169.A NH1 GLU 175.A OE2 no hydrogen 3.533 N/A ARG 169.A NH2 GLU 175.A OE2 no hydrogen 2.882 N/A TYR 170.A OH ASP 328.A OD1 no hydrogen 3.241 N/A TYR 170.A OH ASP 328.A OD2 no hydrogen 2.440 N/A GLU 171.A N ALA 162.A O no hydrogen 2.769 N/A THR 172.A N GLU 175.A OE1 no hydrogen 2.775 N/A GLU 175.A N THR 172.A OG1 no hydrogen 3.066 N/A TYR 176.A N THR 172.A O no hydrogen 2.993 N/A TYR 176.A OH TYR 158.A O no hydrogen 2.766 N/A ARG 177.A N ALA 173.A O no hydrogen 3.041 N/A ARG 177.A NH1 GLU 214.A OE1 no hydrogen 2.878 N/A ARG 177.A NH1 GLU 215.A OE2 no hydrogen 2.656 N/A ARG 177.A NH2 GLU 214.A OE1 no hydrogen 3.220 N/A GLU 178.A N ALA 174.A O no hydrogen 3.095 N/A ARG 179.A N GLU 175.A O no hydrogen 2.919 N/A ARG 179.A NE GLU 171.A OE2 no hydrogen 2.768 N/A ARG 179.A NH1 VAL 157.A O no hydrogen 2.812 N/A ARG 179.A NH2 VAL 157.A O no hydrogen 3.281 N/A ARG 179.A NH2 ASN 160.A O no hydrogen 3.118 N/A ARG 179.A NH2 GLU 171.A OE1 no hydrogen 2.926 N/A ARG 179.A NH2 GLU 171.A OE2 no hydrogen 3.560 N/A ILE 180.A N TYR 176.A O no hydrogen 3.018 N/A ARG 181.A N ARG 177.A O no hydrogen 2.917 N/A ARG 181.A NE GLU 178.A OE2 no hydrogen 3.427 N/A ARG 181.A NH2 GLU 178.A OE1 no hydrogen 2.531 N/A ARG 181.A NH2 GLU 178.A OE2 no hydrogen 3.234 N/A LEU 182.A N GLU 178.A O no hydrogen 2.978 N/A ASP 183.A N ARG 179.A O no hydrogen 3.296 N/A ALA 184.A N ILE 180.A O no hydrogen 3.262 N/A VAL 185.A N ARG 181.A O no hydrogen 2.849 N/A LYS 186.A N LEU 182.A O no hydrogen 3.101 N/A THR 187.A OG1 ALA 184.A O no hydrogen 2.608 N/A THR 187.A OG1 TYR 221.A OH no hydrogen 3.015 N/A GLU 188.A N VAL 185.A O no hydrogen 2.861 N/A TYR 189.A N LYS 186.A O no hydrogen 2.968 N/A ARG 191.A N THR 187.A O no hydrogen 2.969 N/A THR 192.A N GLU 188.A O no hydrogen 2.980 N/A THR 192.A OG1 GLU 188.A O no hydrogen 3.223 N/A LYS 193.A N TYR 189.A O no hydrogen 2.716 N/A VAL 194.A N LEU 190.A O no hydrogen 3.232 N/A VAL 196.A N LEU 190.A O no hydrogen 3.224 N/A HIS 199.A ND1 GLY 220.A O no hydrogen 2.836 N/A VAL 202.A N SER 137.A O no hydrogen 2.967 N/A TRP 203.A N PHE 224.A O no hydrogen 3.181 N/A GLY 206.A N TRP 203.A O no hydrogen 3.108 N/A GLU 207.A N PRO 204.A O no hydrogen 3.244 N/A ASN 209.A ND2 VAL 159.A O no hydrogen 3.201 N/A GLY 210.A N ILE 474.A O no hydrogen 2.809 N/A ALA 212.A N ASN 209.A OD1 no hydrogen 3.037 N/A ILE 213.A N ASN 209.A O no hydrogen 3.045 N/A GLU 214.A N GLY 210.A O no hydrogen 3.117 N/A GLU 215.A N ILE 211.A O no hydrogen 3.103 N/A LEU 216.A N ALA 212.A O no hydrogen 2.872 N/A LYS 217.A N ILE 213.A O no hydrogen 2.901 N/A LYS 217.A NZ ASP 237.A OD1 no hydrogen 3.265 N/A LYS 217.A NZ ASP 237.A OD2 no hydrogen 3.248 N/A LYS 218.A N GLU 214.A O no hydrogen 3.278 N/A LYS 218.A NZ GLU 215.A OE1 no hydrogen 3.514 N/A LYS 218.A NZ GLU 215.A OE2 no hydrogen 2.720 N/A LEU 219.A N LEU 216.A O no hydrogen 2.967 N/A GLY 220.A N LYS 217.A O no hydrogen 3.046 N/A TYR 221.A N LEU 216.A O no hydrogen 3.206 N/A TYR 221.A OH THR 187.A OG1 no hydrogen 3.015 N/A ASP 222.A N HIS 199.A O no hydrogen 2.826 N/A PHE 224.A N PHE 201.A O no hydrogen 2.890 N/A THR 225.A N ILE 239.A O no hydrogen 2.809 N/A THR 225.A OG1 GLU 227.A OE2 no hydrogen 2.767 N/A THR 225.A OG1 ILE 239.A O no hydrogen 3.102 N/A GLU 227.A N THR 225.A OG1 no hydrogen 2.986 N/A ALA 231.A N PHE 7.A O no hydrogen 2.884 N/A ASN 232.A ND2 HIS 4.A O no hydrogen 2.818 N/A ALA 233.A N ASN 5.A O no hydrogen 2.965 N/A SER 234.A N ASN 232.A OD1 no hydrogen 3.208 N/A SER 234.A OG ASN 232.A OD1 no hydrogen 2.947 N/A GLN 235.A N ASN 232.A O no hydrogen 3.165 N/A GLN 235.A NE2 SER 238.A O no hydrogen 3.021 N/A ASP 237.A N GLN 235.A OE1 no hydrogen 2.994 N/A SER 238.A N GLN 235.A OE1 no hydrogen 2.992 N/A SER 238.A OG GLU 227.A OE2 no hydrogen 2.701 N/A ILE 239.A N PHE 223.A O no hydrogen 2.886 N/A ARG 241.A NE THR 225.A O no hydrogen 2.904 N/A ARG 241.A NH1 THR 66.A OG1 no hydrogen 2.938 N/A ARG 241.A NH1 ASP 68.A OD1 no hydrogen 2.840 N/A ARG 241.A NH1 ASP 68.A OD2 no hydrogen 3.175 N/A ARG 241.A NH2 ASP 68.A OD2 no hydrogen 2.969 N/A VAL 242.A N ALA 9.A O no hydrogen 2.806 N/A ILE 244.A N SER 11.A O no hydrogen 3.020 N/A ASN 246.A ND2 PHE 21.A O no hydrogen 3.673 N/A ASN 247.A N SER 22.A O no hydrogen 2.947 N/A SER 249.A N GLU 252.A OE1 no hydrogen 2.667 N/A GLU 252.A N SER 249.A OG no hydrogen 2.666 N/A PHE 253.A N SER 249.A O no hydrogen 2.731 N/A ALA 254.A N LEU 250.A O no hydrogen 2.734 N/A GLN 255.A N LYS 251.A O no hydrogen 2.979 N/A GLN 256.A N GLU 252.A O no hydrogen 3.187 N/A GLN 256.A NE2 LEU 243.A O no hydrogen 2.836 N/A ILE 257.A N PHE 253.A O no hydrogen 3.192 N/A ILE 258.A N ALA 254.A O no hydrogen 2.778 N/A THR 259.A N GLN 255.A O no hydrogen 2.879 N/A THR 259.A OG1 GLN 255.A O no hydrogen 2.711 N/A VAL 260.A N ILE 257.A O no hydrogen 3.307 N/A GLU 262.A N THR 259.A O no hydrogen 3.152 N/A GLN 266.A N ASN 579.A OD1 no hydrogen 2.805 N/A GLN 266.A NE2 SER 264.A O no hydrogen 2.801 N/A ARG 267.A N SER 298.A OG no hydrogen 2.941 N/A ILE 268.A N TYR 580.A O no hydrogen 2.768 N/A HIS 269.A NE2 GLU 551.A OE2 no hydrogen 2.710 N/A ILE 270.A N TYR 301.A O no hydrogen 2.830 N/A ASP 273.A N ASP 271.A OD1 no hydrogen 2.893 N/A ASP 273.A N GLN 303.A OE1.B no hydrogen 3.329 N/A TYR 274.A N ASP 271.A O no hydrogen 3.139 N/A VAL 275.A N LEU 272.A O no hydrogen 3.158 N/A TYR 276.A N LEU 272.A O no hydrogen 2.768 N/A ASN 279.A N ASP 277.A OD1 no hydrogen 2.703 N/A GLN 282.A N ASN 279.A OD1 no hydrogen 2.890 N/A GLN 282.A NE2 ASN 285.A OD1 no hydrogen 3.061 N/A ARG 284.A N GLN 281.A O no hydrogen 2.945 N/A ARG 284.A NH1 GLN 282.A OE1 no hydrogen 2.995 N/A ASN 285.A N GLN 282.A O no hydrogen 2.952 N/A ASN 285.A ND2 VAL 275.A O no hydrogen 2.898 N/A ASP 287.A N ASP 283.A O no hydrogen 2.968 N/A VAL 288.A N ARG 284.A O no hydrogen 3.118 N/A LEU 289.A N ASN 285.A O no hydrogen 2.949 N/A ILE 290.A N ILE 286.A O no hydrogen 2.840 N/A GLN 291.A N ASP 287.A O no hydrogen 3.111 N/A GLN 291.A NE2 ASP 295.A OD1 no hydrogen 2.872 N/A ARG 292.A N VAL 288.A O no hydrogen 2.899 N/A VAL 293.A N LEU 289.A O no hydrogen 2.813 N/A LYS 294.A N ILE 290.A O no hydrogen 2.952 N/A ASP 295.A N GLN 291.A O no hydrogen 2.886 N/A ILE 297.A N VAL 293.A O no hydrogen 2.996 N/A SER 298.A N ARG 267.A O no hydrogen 2.835 N/A SER 298.A OG GLN 266.A OE1 no hydrogen 3.379 N/A SER 298.A OG ARG 267.A O no hydrogen 3.272 N/A THR 299.A N ARG 267.A O no hydrogen 3.334 N/A THR 299.A OG1 GLN 266.A OE1 no hydrogen 3.570 N/A THR 299.A OG1 ASN 344.A OD1 no hydrogen 3.457 N/A VAL 300.A N ASN 344.A O no hydrogen 2.858 N/A LEU 302.A N TYR 346.A O no hydrogen 2.776 N/A GLN 303.A N ILE 270.A O no hydrogen 2.885 N/A GLN 303.A NE2.A PHE 305.A O no hydrogen 3.259 N/A GLN 303.A NE2.B ASP 273.A OD2 no hydrogen 3.352 N/A ALA 304.A N TRP 348.A O no hydrogen 3.094 N/A ALA 306.A N GLU 316.A O no hydrogen 2.848 N/A ASP 307.A N ASP 273.A OD2 no hydrogen 2.948 N/A ASP 309.A N ASP 309.A OD1 no hydrogen 2.415 N/A GLY 310.A N ASP 307.A O no hydrogen 3.033 N/A GLY 312.A N ASP 307.A OD2 no hydrogen 3.038 N/A LEU 313.A N ASP 311.A OD1 no hydrogen 2.721 N/A VAL 314.A N SER 352.A O no hydrogen 2.840 N/A VAL 317.A N PRO 325.A O no hydrogen 3.043 N/A TRP 318.A N ALA 304.A O no hydrogen 3.038 N/A ASN 321.A ND2 PHE 319.A O no hydrogen 3.252 N/A ASN 321.A ND2 LEU 324.A O no hydrogen 2.840 N/A ARG 322.A N ASP 398.A OD2 no hydrogen 2.717 N/A ARG 322.A NE ASP 398.A OD1 no hydrogen 2.900 N/A ARG 322.A NE ASP 398.A OD2 no hydrogen 3.279 N/A ARG 322.A NH2 GLU 397.A OE1 no hydrogen 3.333 N/A LEU 323.A N ASN 321.A OD1 no hydrogen 2.834 N/A LEU 324.A N ASN 321.A OD1 no hydrogen 2.657 N/A LYS 326.A N VAL 317.A O no hydrogen 2.882 N/A ILE 329.A N TRP 318.A O no hydrogen 3.330 N/A PHE 330.A N TRP 318.A O no hydrogen 3.029 N/A ARG 332.A NE ASP 283.A OD1 no hydrogen 3.286 N/A ARG 332.A NH1 THR 151.A OG1 no hydrogen 3.047 N/A ARG 332.A NH2 ASP 283.A OD1 no hydrogen 3.181 N/A ARG 332.A NH2 ASP 283.A OD2 no hydrogen 3.024 N/A VAL 333.A N ILE 329.A O no hydrogen 3.021 N/A ALA 334.A N PHE 330.A O no hydrogen 2.884 N/A TRP 335.A N SER 331.A O no hydrogen 2.954 N/A GLN 336.A N ARG 332.A O no hydrogen 2.916 N/A GLN 336.A NE2 ASP 283.A OD1 no hydrogen 3.019 N/A LEU 337.A N VAL 333.A O no hydrogen 2.991 N/A ARG 338.A N ALA 334.A O no hydrogen 3.002 N/A ARG 338.A NH1 GLU 207.A OE1 no hydrogen 3.324 N/A THR 339.A N TRP 335.A O no hydrogen 3.047 N/A THR 339.A OG1 TRP 335.A O no hydrogen 2.917 N/A THR 339.A OG1 GLN 336.A O no hydrogen 3.457 N/A ARG 340.A N GLN 336.A O no hydrogen 2.954 N/A ARG 340.A NH1 ASP 287.A OD1 no hydrogen 3.221 N/A ARG 340.A NH2 ASP 287.A OD1 no hydrogen 2.475 N/A SER 341.A N LEU 337.A O no hydrogen 2.828 N/A SER 341.A OG LEU 337.A O no hydrogen 2.653 N/A GLY 342.A N ARG 338.A O no hydrogen 2.954 N/A ASN 344.A N SER 298.A O no hydrogen 3.083 N/A ILE 345.A N ASP 406.A OD2 no hydrogen 2.847 N/A TYR 346.A N VAL 300.A O no hydrogen 2.934 N/A ALA 347.A N GLY 407.A O no hydrogen 3.013 N/A TRP 348.A N LEU 302.A O no hydrogen 2.809 N/A TRP 348.A NE1 HIS 411.A ND1 no hydrogen 2.905 N/A VAL 350.A N ASP 413.A OD1 no hydrogen 2.863 N/A LEU 351.A N ASP 413.A OD2 no hydrogen 2.898 N/A SER 352.A N ASP 413.A OD2 no hydrogen 2.772 N/A SER 352.A OG ASP 413.A OD2 no hydrogen 2.743 N/A TRP 353.A N LEU 351.A O no hydrogen 2.939 N/A ASP 354.A N VAL 314.A O no hydrogen 2.813 N/A LEU 355.A N TRP 353.A O no hydrogen 2.889 N/A THR 358.A N ASP 356.A OD1 no hydrogen 3.087 N/A THR 358.A OG1 ASP 356.A OD1 no hydrogen 2.936 N/A THR 358.A OG1 ASP 356.A OD2 no hydrogen 3.218 N/A LEU 359.A N ASP 356.A O no hydrogen 2.921 N/A THR 360.A N ASP 386.A OD2 no hydrogen 3.106 N/A THR 360.A OG1 ASP 386.A OD2 no hydrogen 2.570 N/A ARG 361.A NH1 ASP 356.A O no hydrogen 2.802 N/A ARG 361.A NH1 LEU 359.A O no hydrogen 2.830 N/A ARG 361.A NH2 LEU 355.A O no hydrogen 2.761 N/A VAL 362.A N ARG 381.A O no hydrogen 2.896 N/A LYS 363.A N ASP 421.A OD1 no hydrogen 2.947 N/A TYR 364.A OH GLU 369.A OE2 no hydrogen 3.206 N/A LEU 365.A N TYR 419.A O no hydrogen 2.874 N/A GLY 368.A N LEU 365.A O no hydrogen 2.910 N/A GLU 369.A N PRO 366.A O no hydrogen 3.038 N/A LYS 371.A NZ ASP 418.A OD1 no hydrogen 2.721 N/A ALA 372.A N GLY 368.A O no hydrogen 3.142 N/A GLN 373.A N GLU 369.A O no hydrogen 2.840 N/A ILE 374.A N LYS 370.A O no hydrogen 3.234 N/A HIS 375.A N ALA 372.A O no hydrogen 3.349 N/A GLN 378.A N HIS 375.A O no hydrogen 3.011 N/A TYR 379.A N PRO 376.A O no hydrogen 3.207 N/A ARG 381.A N GLN 378.A O no hydrogen 3.504 N/A ARG 381.A NE GLN 378.A O no hydrogen 2.754 N/A ARG 381.A NH1 LEU 415.A O no hydrogen 2.880 N/A ARG 381.A NH1 GLU 420.A OE1 no hydrogen 2.866 N/A ARG 381.A NH2 GLN 378.A O no hydrogen 3.170 N/A ARG 381.A NH2 GLU 420.A OE1 no hydrogen 3.309 N/A ARG 381.A NH2 GLU 420.A OE2 no hydrogen 2.802 N/A LEU 382.A N LEU 351.A O no hydrogen 2.942 N/A SER 383.A N THR 360.A O no hydrogen 2.912 N/A SER 383.A OG ASP 421.A OD2 no hydrogen 2.633 N/A PHE 385.A N SER 383.A OG no hydrogen 3.261 N/A ASP 386.A N SER 383.A O no hydrogen 3.290 N/A ARG 388.A N ASP 386.A OD1 no hydrogen 2.792 N/A ARG 388.A NH1 THR 358.A OG1 no hydrogen 2.914 N/A VAL 389.A N ASP 386.A OD1 no hydrogen 3.302 N/A ARG 390.A N ASP 386.A O no hydrogen 3.053 N/A ARG 390.A NH1 PRO 384.A O no hydrogen 2.893 N/A ARG 390.A NH2 GLU 466.A OE1 no hydrogen 2.981 N/A ALA 391.A N ASP 387.A O no hydrogen 3.102 N/A GLN 392.A N ARG 388.A O no hydrogen 2.895 N/A VAL 393.A N VAL 389.A O no hydrogen 2.909 N/A GLY 394.A N ARG 390.A O no hydrogen 3.041 N/A TYR 396.A N VAL 393.A O no hydrogen 3.093 N/A TYR 396.A OH PRO 349.A O no hydrogen 2.789 N/A GLU 397.A N GLY 394.A O no hydrogen 2.889 N/A LEU 399.A N LEU 395.A O no hydrogen 3.101 N/A ALA 400.A N TYR 396.A O no hydrogen 3.014 N/A GLY 401.A N GLU 397.A O no hydrogen 2.852 N/A HIS 402.A N LEU 399.A O no hydrogen 3.206 N/A HIS 402.A ND1 ASP 398.A O no hydrogen 2.654 N/A ASP 406.A N ILE 345.A O no hydrogen 2.653 N/A GLY 407.A N ILE 345.A O no hydrogen 3.266 N/A ILE 408.A N LYS 480.A O no hydrogen 2.758 N/A LEU 409.A N ALA 347.A O no hydrogen 2.851 N/A PHE 410.A N ALA 482.A O no hydrogen 2.785 N/A ASP 412.A N ASP 412.A OD1 no hydrogen 2.523 N/A LEU 416.A N PHE 499.A O no hydrogen 3.045 N/A SER 417.A N GLU 420.A OE1 no hydrogen 3.014 N/A TYR 419.A N SER 417.A OG no hydrogen 3.116 N/A GLU 420.A N SER 417.A O no hydrogen 3.039 N/A ASP 421.A N TYR 430.A OH no hydrogen 2.994 N/A ALA 422.A N LYS 363.A O no hydrogen 2.806 N/A SER 423.A N ASP 421.A OD1 no hydrogen 2.938 N/A SER 423.A OG ASP 421.A OD1 no hydrogen 3.108 N/A SER 423.A OG ASP 421.A OD2 no hydrogen 3.076 N/A ILE 427.A N SER 423.A O no hydrogen 2.950 N/A THR 428.A N ALA 424.A O no hydrogen 3.002 N/A THR 428.A OG1 ALA 424.A O no hydrogen 3.203 N/A ALA 429.A N PRO 425.A O no hydrogen 3.139 N/A TYR 430.A N ALA 426.A O no hydrogen 2.968 N/A TYR 430.A OH ASP 421.A O no hydrogen 2.635 N/A GLN 431.A N ILE 427.A O no hydrogen 3.093 N/A GLN 432.A N THR 428.A O no hydrogen 3.005 N/A ALA 433.A N TYR 430.A O no hydrogen 3.055 N/A GLY 434.A N GLN 431.A O no hydrogen 3.020 N/A PHE 435.A N TYR 430.A O no hydrogen 2.990 N/A SER 438.A N SER 436.A OG no hydrogen 2.985 N/A GLU 441.A N SER 438.A OG no hydrogen 3.386 N/A ILE 442.A N SER 438.A O no hydrogen 3.057 N/A ARG 443.A N LEU 439.A O no hydrogen 2.943 N/A ARG 443.A NH2 ASP 418.A O no hydrogen 2.932 N/A ARG 443.A NH2 ASP 418.A OD2 no hydrogen 3.032 N/A GLN 444.A N GLU 441.A O no hydrogen 3.073 N/A ASN 445.A N ILE 442.A O no hydrogen 3.064 N/A GLN 448.A N ASN 445.A OD1 no hydrogen 2.963 N/A PHE 449.A N ASN 445.A O no hydrogen 2.684 N/A LYS 450.A N PRO 446.A O no hydrogen 3.035 N/A GLN 451.A N GLU 447.A O no hydrogen 3.168 N/A GLN 451.A NE2 GLU 447.A O no hydrogen 3.675 N/A TRP 452.A N GLN 448.A O no hydrogen 2.880 N/A ALA 453.A N PHE 449.A O no hydrogen 2.916 N/A ARG 454.A N LYS 450.A O no hydrogen 3.079 N/A PHE 455.A N GLN 451.A O no hydrogen 2.864 N/A LYS 456.A N TRP 452.A O no hydrogen 3.016 N/A LYS 456.A NZ SER 417.A O no hydrogen 3.106 N/A LYS 456.A NZ GLU 420.A O no hydrogen 2.906 N/A SER 457.A N ALA 453.A O no hydrogen 3.093 N/A SER 457.A OG ALA 453.A O no hydrogen 3.393 N/A SER 457.A OG GLU 496.A OE2 no hydrogen 2.708 N/A ARG 458.A N ARG 454.A O no hydrogen 2.968 N/A ALA 459.A N PHE 455.A O no hydrogen 2.846 N/A LEU 460.A N LYS 456.A O no hydrogen 2.986 N/A THR 461.A N SER 457.A O no hydrogen 3.051 N/A THR 461.A OG1 SER 457.A O no hydrogen 3.156 N/A THR 461.A OG1 ASP 505.A OD2 no hydrogen 2.630 N/A ASP 462.A N ARG 458.A O no hydrogen 2.727 N/A PHE 463.A N ALA 459.A O no hydrogen 2.982 N/A THR 464.A N LEU 460.A O no hydrogen 3.143 N/A THR 464.A OG1 THR 461.A O no hydrogen 2.720 N/A THR 464.A OG1 TYR 510.A OH no hydrogen 2.625 N/A LEU 465.A N THR 461.A O no hydrogen 2.994 N/A GLU 466.A N ASP 462.A O no hydrogen 2.998 N/A LEU 467.A N PHE 463.A O no hydrogen 3.118 N/A SER 468.A N THR 464.A O no hydrogen 2.799 N/A ALA 469.A N LEU 465.A O no hydrogen 2.920 N/A ARG 470.A N GLU 466.A O no hydrogen 3.126 N/A ARG 470.A NH1 GLU 397.A OE2 no hydrogen 3.004 N/A VAL 471.A N LEU 467.A O no hydrogen 3.028 N/A LYS 472.A N SER 468.A O no hydrogen 2.825 N/A ALA 473.A N ALA 469.A O no hydrogen 2.919 N/A ILE 474.A N VAL 471.A O no hydrogen 3.165 N/A ARG 475.A N VAL 471.A O no hydrogen 2.703 N/A ARG 475.A NE ARG 475.A O no hydrogen 2.937 N/A ARG 475.A NH1 VAL 159.A O no hydrogen 2.612 N/A ARG 475.A NH1 ALA 208.A O no hydrogen 2.945 N/A ARG 475.A NH2 ASN 160.A OD1 no hydrogen 2.926 N/A ARG 475.A NH2 ALA 403.A O no hydrogen 2.798 N/A GLY 476.A N LYS 472.A O no hydrogen 2.963 N/A ILE 479.A N GLY 476.A O no hydrogen 3.364 N/A LYS 480.A N ASP 406.A O no hydrogen 3.040 N/A LYS 480.A NZ HIS 478.A O no hydrogen 3.262 N/A THR 481.A N ASP 511.A OD2 no hydrogen 2.872 N/A ALA 482.A N ILE 408.A O no hydrogen 2.742 N/A ARG 483.A N TRP 512.A O no hydrogen 3.127 N/A ARG 483.A NH1 THR 461.A OG1 no hydrogen 3.159 N/A ARG 483.A NH1 TYR 510.A OH no hydrogen 2.741 N/A ARG 483.A NH2 ALA 414.A O no hydrogen 2.923 N/A ASN 484.A N PHE 410.A O no hydrogen 3.151 N/A ILE 485.A N ALA 514.A O no hydrogen 2.896 N/A PHE 486.A N GLN 501.A OE1 no hydrogen 2.937 N/A VAL 490.A N ALA 487.A O no hydrogen 3.080 N/A ILE 491.A N ALA 487.A O no hydrogen 2.991 N/A GLN 492.A N LEU 488.A O no hydrogen 2.605 N/A SER 495.A N GLN 492.A O no hydrogen 2.760 N/A SER 495.A OG GLN 492.A O no hydrogen 2.727 N/A GLU 496.A N PRO 493.A O no hydrogen 3.026 N/A ALA 497.A N GLU 494.A O no hydrogen 3.032 N/A TRP 498.A N SER 495.A O no hydrogen 2.908 N/A PHE 499.A N GLU 496.A O no hydrogen 3.266 N/A ALA 500.A N GLU 496.A O no hydrogen 2.852 N/A GLN 501.A NE2 ALA 414.A O no hydrogen 3.127 N/A ASN 502.A ND2 GLU 496.A OE1 no hydrogen 2.775 N/A TYR 503.A OH SER 548.A OG no hydrogen 2.789 N/A ASP 505.A N ASN 502.A OD1 no hydrogen 2.765 N/A PHE 506.A N ASN 502.A O no hydrogen 2.913 N/A LEU 507.A N TYR 503.A O no hydrogen 3.006 N/A LYS 508.A N ALA 504.A O no hydrogen 3.162 N/A SER 509.A N ASP 505.A O no hydrogen 2.899 N/A SER 509.A N PHE 506.A O no hydrogen 3.233 N/A SER 509.A OG ASP 505.A O no hydrogen 2.708 N/A SER 509.A OG ASP 505.A OD1 no hydrogen 3.050 N/A TYR 510.A N PHE 506.A O no hydrogen 2.981 N/A TYR 510.A OH THR 464.A OG1 no hydrogen 2.625 N/A ASP 511.A N THR 481.A OG1 no hydrogen 3.294 N/A TRP 512.A N THR 481.A O no hydrogen 2.949 N/A THR 513.A N LYS 547.A O no hydrogen 2.812 N/A ALA 514.A N ARG 483.A O no hydrogen 2.993 N/A ILE 515.A N ILE 549.A O no hydrogen 2.772 N/A TYR 518.A N ALA 516.A O no hydrogen 3.104 N/A SER 526.A N ALA 523.A O no hydrogen 2.894 N/A ASP 528.A N LYS 525.A O no hydrogen 3.197 N/A LEU 531.A N ALA 527.A O no hydrogen 2.977 N/A ILE 532.A N ASP 528.A O no hydrogen 2.841 N/A GLN 533.A N GLN 529.A O no hydrogen 3.047 N/A LEU 534.A N TRP 530.A O no hydrogen 2.960 N/A THR 535.A N LEU 531.A O no hydrogen 2.855 N/A THR 535.A OG1 LEU 531.A O no hydrogen 3.557 N/A THR 535.A OG1 ILE 532.A O no hydrogen 2.844 N/A ASN 536.A N ILE 532.A O no hydrogen 2.831 N/A GLN 537.A N GLN 533.A O no hydrogen 3.226 N/A GLN 537.A NE2 VAL 490.A O no hydrogen 3.132 N/A ILE 538.A N LEU 534.A O no hydrogen 3.275 N/A LYS 539.A N THR 535.A O no hydrogen 2.864 N/A LYS 539.A NZ ASN 575.A OD1 no hydrogen 3.560 N/A ASN 540.A N ASN 536.A O no hydrogen 3.117 N/A ASN 540.A N GLN 537.A O no hydrogen 3.300 N/A ILE 541.A N ILE 538.A O no hydrogen 3.388 N/A ALA 544.A N ILE 541.A O no hydrogen 3.051 N/A LYS 545.A NZ GLY 576.A O no hydrogen 3.313 N/A LYS 547.A N ALA 544.A O no hydrogen 3.244 N/A LYS 547.A NZ LEU 507.A O no hydrogen 2.747 N/A LYS 547.A NZ TYR 510.A O no hydrogen 2.912 N/A SER 548.A OG TYR 503.A OH no hydrogen 2.789 N/A SER 548.A OG ALA 544.A O no hydrogen 2.619 N/A ILE 549.A N THR 513.A O no hydrogen 2.887 N/A LEU 550.A N ASN 579.A O no hydrogen 2.918 N/A GLU 551.A N ILE 515.A O no hydrogen 2.872 N/A LEU 552.A N GLY 581.A O no hydrogen 2.890 N/A ALA 554.A N TYR 583.A O no hydrogen 2.768 N/A GLN 555.A NE2 GLN 559.A OE1 no hydrogen 3.400 N/A GLN 559.A NE2 GLN 555.A O no hydrogen 3.498 N/A ALA 560.A N GLY 556.A O no hydrogen 3.190 N/A ILE 561.A N GLN 557.A O no hydrogen 2.967 N/A SER 562.A N HIS 558.A O no hydrogen 3.219 N/A SER 562.A OG HIS 558.A O no hydrogen 2.763 N/A SER 563.A N GLN 559.A O no hydrogen 3.063 N/A SER 563.A OG GLN 559.A O no hydrogen 3.183 N/A GLN 564.A N ALA 560.A O no hydrogen 3.104 N/A GLN 564.A NE2 GLU 524.A OE1 no hydrogen 3.403 N/A GLN 565.A N ILE 561.A O no hydrogen 2.899 N/A LEU 566.A N SER 562.A O no hydrogen 2.962 N/A ALA 567.A N SER 563.A O no hydrogen 2.866 N/A HIS 568.A N GLN 564.A O no hydrogen 2.860 N/A HIS 568.A NE2 ASP 528.A OD1 no hydrogen 2.959 N/A HIS 568.A NE2 ASP 528.A OD2 no hydrogen 2.635 N/A TRP 569.A N GLN 565.A O no hydrogen 2.764 N/A TRP 569.A NE1 GLU 524.A O no hydrogen 2.960 N/A LEU 571.A N HIS 568.A O no hydrogen 3.025 N/A LEU 572.A N TRP 569.A O no hydrogen 2.885 N/A LEU 574.A N SER 570.A O no hydrogen 3.069 N/A ASN 575.A N LEU 572.A O no hydrogen 3.076 N/A ASN 575.A ND2 LEU 571.A O no hydrogen 2.724 N/A GLY 576.A N GLN 573.A O no hydrogen 3.495 N/A VAL 577.A N LEU 572.A O no hydrogen 2.936 N/A LYS 578.A NZ LYS 263.A O no hydrogen 2.653 N/A ASN 579.A ND2 SER 548.A O no hydrogen 3.172 N/A TYR 580.A N GLN 266.A O no hydrogen 3.049 N/A TYR 580.A OH VAL 577.A O no hydrogen 2.725 N/A GLY 581.A N LEU 550.A O no hydrogen 2.894 N/A TYR 582.A N ILE 268.A O no hydrogen 2.801 N/A TYR 583.A N LEU 552.A O no hydrogen 3.295 N/A TYR 583.A OH GLU 551.A OE1 no hydrogen 3.133 N/A PHE 587.A N ASP 585.A OD2 no hydrogen 2.702 N/A