Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1f4l_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ALA 1.A N GLY 39.A O no hydrogen 3.289 N/A LYS 3.A NZ GLU 276.A OE1 no hydrogen 2.751 N/A ILE 4.A N GLU 41.A O no hydrogen 2.828 N/A LEU 5.A N GLU 285.A O no hydrogen 2.707 N/A VAL 6.A N ASN 43.A O no hydrogen 2.905 N/A THR 7.A N TYR 287.A O no hydrogen 3.013 N/A THR 7.A OG1 TYR 287.A O no hydrogen 3.520 N/A THR 7.A OG1 HIS 288.A ND1 no hydrogen 2.721 N/A CYS 8.A SG GLU 24.A O no hydrogen 3.951 N/A ALA 9.A N GLU 24.A OE1 no hydrogen 2.844 N/A ALA 13.A N ASP 49.A O no hydrogen 2.951 N/A SER 16.A OG GLU 76.A OE1 no hydrogen 2.740 N/A HIS 18.A N HIS 21.A ND1 no hydrogen 2.983 N/A LEU 19.A N ILE 338.A O no hydrogen 3.048 N/A GLY 20.A N HIS 18.A ND1 no hydrogen 3.002 N/A MET 22.A N HIS 18.A O no hydrogen 3.059 N/A LEU 23.A N LEU 19.A O no hydrogen 2.990 N/A HIS 25.A N HIS 21.A O no hydrogen 3.098 N/A ILE 26.A N MET 22.A O no hydrogen 2.997 N/A GLN 27.A N LEU 23.A O no hydrogen 3.020 N/A ALA 28.A N GLU 24.A O no hydrogen 3.066 N/A ASP 29.A N HIS 25.A O no hydrogen 2.911 N/A VAL 30.A N ILE 26.A O no hydrogen 2.954 N/A TRP 31.A N GLN 27.A O no hydrogen 3.236 N/A TRP 31.A NE1 GLU 430.A O no hydrogen 2.929 N/A VAL 32.A N ALA 28.A O no hydrogen 2.827 N/A ARG 33.A N ASP 29.A O no hydrogen 2.842 N/A ARG 33.A NE ASP 29.A OD2 no hydrogen 2.847 N/A ARG 33.A NH1 ASN 85.A O no hydrogen 2.938 N/A TYR 34.A N VAL 30.A O no hydrogen 3.037 N/A GLN 35.A N TRP 31.A O no hydrogen 2.963 N/A GLN 35.A NE2 GLU 430.A OE2 no hydrogen 2.983 N/A ARG 36.A N VAL 32.A O no hydrogen 3.010 N/A ARG 36.A NH1 SER 87.A OG no hydrogen 2.856 N/A ARG 36.A NH2 SER 87.A O no hydrogen 2.886 N/A ARG 36.A NH2 ASP 89.A OD2 no hydrogen 3.081 N/A MET 37.A N ARG 33.A O no hydrogen 3.042 N/A ARG 38.A N TYR 34.A O no hydrogen 3.129 N/A ARG 38.A N GLN 35.A O no hydrogen 3.209 N/A ARG 38.A NH2 TYR 34.A OH no hydrogen 2.951 N/A GLY 39.A N ARG 36.A O no hydrogen 2.997 N/A HIS 40.A N GLN 35.A O no hydrogen 3.390 N/A HIS 40.A ND1 GLN 35.A OE1 no hydrogen 3.088 N/A GLU 41.A N LYS 2.A O no hydrogen 2.889 N/A ASN 43.A N ILE 4.A O no hydrogen 2.940 N/A PHE 44.A N ASP 89.A OD2 no hydrogen 2.679 N/A ILE 45.A N VAL 6.A O no hydrogen 2.889 N/A CYS 46.A N ASN 90.A O no hydrogen 3.031 N/A CYS 46.A SG CYS 8.A O no hydrogen 3.697 N/A CYS 46.A SG ALA 9.A O no hydrogen 3.483 N/A CYS 46.A SG ALA 47.A O no hydrogen 3.777 N/A ASP 48.A N HIS 92.A O no hydrogen 3.308 N/A ASP 49.A N PRO 11.A O no hydrogen 2.756 N/A ALA 50.A N THR 94.A OG1 no hydrogen 2.800 N/A HIS 51.A ND1 ASP 252.A OD1 no hydrogen 2.665 N/A HIS 51.A NE2 HIS 95.A ND1 no hydrogen 2.779 N/A GLY 52.A N PHE 235.A O no hydrogen 2.941 N/A MET 56.A N GLY 52.A O no hydrogen 3.013 N/A LEU 57.A N THR 53.A O no hydrogen 2.898 N/A LYS 58.A N PRO 54.A O no hydrogen 2.902 N/A LYS 58.A NZ ASN 14.A O no hydrogen 2.578 N/A ALA 59.A N ILE 55.A O no hydrogen 2.994 N/A GLN 60.A N MET 56.A O no hydrogen 3.029 N/A GLN 61.A N LEU 57.A O no hydrogen 2.959 N/A LEU 62.A N LYS 58.A O no hydrogen 3.046 N/A GLY 63.A N ALA 59.A O no hydrogen 2.935 N/A GLY 63.A N GLN 60.A O no hydrogen 3.154 N/A ILE 64.A N ALA 59.A O no hydrogen 3.331 N/A GLU 67.A N GLU 67.A OE2 no hydrogen 2.780 N/A GLN 68.A N THR 65.A OG1 no hydrogen 2.916 N/A GLN 68.A NE2.A GLU 72.A OE2.A no hydrogen 2.878 N/A GLN 68.A NE2.A GLU 72.A OE2.B no hydrogen 2.530 N/A MET 69.A N THR 65.A O no hydrogen 3.148 N/A ILE 70.A N PRO 66.A O no hydrogen 2.908 N/A GLY 71.A N GLU 67.A O no hydrogen 3.127 N/A GLU 72.A N GLN 68.A O no hydrogen 3.057 N/A MET 73.A N MET 69.A O no hydrogen 2.973 N/A SER 74.A N ILE 70.A O no hydrogen 2.816 N/A SER 74.A OG GLN 78.A OE1 no hydrogen 2.867 N/A GLN 75.A N GLY 71.A O no hydrogen 3.228 N/A GLN 75.A NE2 THR 79.A OG1 no hydrogen 2.653 N/A GLU 76.A N GLU 72.A O no hydrogen 3.096 N/A HIS 77.A N MET 73.A O no hydrogen 2.881 N/A HIS 77.A ND1 ASP 48.A OD1 no hydrogen 2.562 N/A HIS 77.A NE2 GLY 15.A O no hydrogen 2.784 N/A GLN 78.A N SER 74.A O no hydrogen 2.949 N/A THR 79.A N GLN 75.A O no hydrogen 2.924 N/A THR 79.A OG1 GLN 75.A O no hydrogen 2.979 N/A ASP 80.A N GLU 76.A O no hydrogen 3.071 N/A PHE 81.A N HIS 77.A O no hydrogen 2.969 N/A ALA 82.A N GLN 78.A O no hydrogen 2.876 N/A GLY 83.A N THR 79.A O no hydrogen 3.011 N/A PHE 84.A N ASP 80.A O no hydrogen 3.204 N/A PHE 84.A N PHE 81.A O no hydrogen 2.992 N/A ASN 85.A N ALA 82.A O no hydrogen 2.955 N/A ILE 86.A N PHE 81.A O no hydrogen 3.232 N/A SER 87.A N ASP 29.A OD1 no hydrogen 2.763 N/A SER 87.A OG ASP 29.A OD1 no hydrogen 2.644 N/A TYR 88.A N ILE 86.A O no hydrogen 2.994 N/A TYR 88.A OH HIS 25.A ND1 no hydrogen 2.732 N/A ASP 89.A N PHE 44.A O no hydrogen 2.743 N/A ASN 90.A N PHE 44.A O no hydrogen 3.354 N/A ASN 90.A ND2 SER 260.A O no hydrogen 2.921 N/A ASN 90.A ND2 ASN 263.A OD1 no hydrogen 2.866 N/A TYR 91.A OH ASP 48.A OD1 no hydrogen 2.621 N/A HIS 92.A N CYS 46.A O no hydrogen 2.986 N/A HIS 92.A NE2 GLU 98.A OE2 no hydrogen 2.840 N/A THR 94.A N ASP 48.A O no hydrogen 3.040 N/A THR 94.A OG1 ASP 48.A O no hydrogen 3.548 N/A HIS 95.A N SER 93.A OG no hydrogen 2.984 N/A HIS 95.A ND1 HIS 51.A NE2 no hydrogen 2.779 N/A SER 96.A OG HIS 92.A NE2 no hydrogen 3.414 N/A SER 96.A OG SER 93.A O no hydrogen 2.867 N/A GLU 98.A N GLU 98.A OE2 no hydrogen 2.873 N/A ASN 99.A N SER 96.A OG no hydrogen 3.162 N/A ASN 99.A ND2 THR 94.A O no hydrogen 3.078 N/A ASN 99.A ND2 ASP 252.A O no hydrogen 2.978 N/A ARG 100.A N SER 96.A O no hydrogen 2.911 N/A GLN 101.A N GLU 97.A O no hydrogen 2.896 N/A GLN 101.A NE2.A GLU 97.A O no hydrogen 3.046 N/A LEU 102.A N GLU 98.A O no hydrogen 2.998 N/A SER 103.A N ASN 99.A O no hydrogen 2.819 N/A SER 103.A OG ASN 99.A O no hydrogen 2.932 N/A GLU 104.A N ARG 100.A O no hydrogen 2.953 N/A LEU 105.A N GLN 101.A O no hydrogen 2.984 N/A ILE 106.A N LEU 102.A O no hydrogen 2.957 N/A TYR 107.A N SER 103.A O no hydrogen 2.958 N/A SER 108.A N GLU 104.A O no hydrogen 2.904 N/A SER 108.A OG.A GLU 104.A O no hydrogen 2.973 N/A SER 108.A OG.B GLU 104.A O no hydrogen 3.388 N/A SER 108.A OG.B LEU 105.A O no hydrogen 2.848 N/A ARG 109.A N LEU 105.A O no hydrogen 2.894 N/A ARG 109.A NH1 SER 309.A O no hydrogen 2.934 N/A LEU 110.A N ILE 106.A O no hydrogen 2.803 N/A LYS 111.A N TYR 107.A O no hydrogen 2.839 N/A GLU 112.A N SER 108.A O no hydrogen 2.775 N/A ASN 113.A N ARG 109.A O no hydrogen 2.996 N/A ASN 113.A ND2 GLY 308.A O no hydrogen 2.892 N/A GLY 114.A N LYS 111.A O no hydrogen 3.060 N/A PHE 115.A N LEU 110.A O no hydrogen 2.794 N/A LYS 117.A N PHE 188.A O no hydrogen 2.848 N/A LYS 117.A NZ GLY 114.A O no hydrogen 3.008 N/A ARG 119.A N HIS 186.A O no hydrogen 2.988 N/A ILE 121.A N SER 184.A O no hydrogen 2.971 N/A GLN 123.A N ARG 182.A O no hydrogen 3.061 N/A GLN 123.A NE2 LEU 133.A O no hydrogen 3.091 N/A TYR 125.A N VAL 180.A O no hydrogen 2.759 N/A ASP 126.A N MET 131.A O no hydrogen 2.767 N/A GLU 128.A N ASP 126.A OD2 no hydrogen 2.954 N/A LYS 129.A N ASP 126.A OD2 no hydrogen 2.953 N/A GLY 130.A N ASP 126.A O no hydrogen 2.724 N/A MET 131.A N ASP 126.A O no hydrogen 3.049 N/A LEU 133.A N LEU 124.A O no hydrogen 2.913 N/A PHE 137.A N PRO 134.A O no hydrogen 3.029 N/A VAL 138.A N ASP 135.A O no hydrogen 3.126 N/A LYS 139.A N LYS 171.A O no hydrogen 2.947 N/A GLY 140.A N GLN 150.A O no hydrogen 2.935 N/A THR 141.A N ILE 168.A O no hydrogen 2.960 N/A CYS 142.A N SER 147.A O no hydrogen 3.005 N/A CYS 145.A SG SER 147.A OG no hydrogen 3.052 N/A LYS 146.A N CYS 142.A O no hydrogen 2.889 N/A LYS 146.A NZ PRO 143.A O no hydrogen 3.021 N/A GLN 150.A N GLY 140.A O no hydrogen 2.784 N/A GLN 150.A NE2 PRO 148.A O no hydrogen 3.331 N/A GLY 152.A N VAL 138.A O no hydrogen 2.901 N/A ASN 154.A ND2 ASP 153.A OD1 no hydrogen 3.103 N/A CYS 155.A N ALA 160.A O no hydrogen 2.916 N/A GLU 156.A N GLN 150.A OE1 no hydrogen 2.697 N/A GLY 159.A N CYS 155.A O no hydrogen 2.941 N/A TYR 162.A N ASP 153.A O no hydrogen 2.834 N/A SER 163.A OG THR 165.A OG1 no hydrogen 3.181 N/A THR 165.A N SER 163.A OG no hydrogen 3.120 N/A THR 165.A OG1 SER 163.A OG no hydrogen 3.181 N/A GLU 166.A N SER 163.A O no hydrogen 2.758 N/A LEU 167.A N PRO 164.A O no hydrogen 3.226 N/A ILE 168.A N THR 141.A O no hydrogen 2.790 N/A LYS 171.A N LYS 139.A O no hydrogen 2.599 N/A SER 172.A N ALA 177.A O no hydrogen 2.769 N/A SER 172.A OG ASP 126.A OD1 no hydrogen 2.495 N/A VAL 173.A N PHE 137.A O no hydrogen 2.853 N/A VAL 174.A N SER 172.A OG no hydrogen 3.230 N/A SER 175.A N SER 172.A OG no hydrogen 3.371 N/A SER 175.A OG ASP 126.A OD1 no hydrogen 2.732 N/A SER 175.A OG ASP 126.A OD2 no hydrogen 3.347 N/A GLY 176.A N SER 172.A O no hydrogen 2.780 N/A ALA 177.A N SER 175.A OG no hydrogen 2.856 N/A VAL 180.A N TYR 125.A O no hydrogen 2.963 N/A ARG 182.A N GLN 123.A O no hydrogen 3.031 N/A SER 184.A N ILE 121.A O no hydrogen 2.873 N/A SER 184.A OG GLU 185.A O no hydrogen 3.505 N/A SER 184.A OG ASP 231.A OD1 no hydrogen 3.200 N/A SER 184.A OG ASP 231.A OD2 no hydrogen 2.667 N/A HIS 186.A N ARG 119.A O no hydrogen 2.863 N/A HIS 186.A ND1 ASP 227.A OD1 no hydrogen 2.748 N/A PHE 187.A N SER 229.A OG no hydrogen 2.966 N/A PHE 188.A N LYS 117.A O no hydrogen 2.718 N/A PHE 189.A N TRP 226.A O no hydrogen 2.693 N/A ASP 190.A N PHE 115.A O no hydrogen 2.861 N/A LEU 191.A N PHE 189.A O no hydrogen 2.935 N/A SER 193.A N ASP 190.A O no hydrogen 3.108 N/A PHE 194.A N LEU 191.A O no hydrogen 2.911 N/A SER 195.A N PRO 192.A O no hydrogen 3.220 N/A SER 195.A OG PRO 192.A O no hydrogen 3.237 N/A LEU 198.A N PHE 194.A O no hydrogen 2.938 N/A GLN 199.A N SER 195.A O no hydrogen 2.915 N/A ALA 200.A N GLU 196.A O no hydrogen 3.018 N/A TRP 201.A N MET 197.A O no hydrogen 3.103 N/A THR 202.A N LEU 198.A O no hydrogen 2.891 N/A THR 202.A OG1 LEU 198.A O no hydrogen 2.832 N/A ARG 203.A N GLN 199.A O no hydrogen 3.172 N/A ARG 203.A N ALA 200.A O no hydrogen 3.168 N/A SER 204.A N TRP 201.A O no hydrogen 3.478 N/A SER 204.A OG.A ALA 200.A O no hydrogen 3.517 N/A SER 204.A OG.A TRP 201.A O no hydrogen 3.282 N/A SER 204.A OG.B TRP 201.A O no hydrogen 3.356 N/A ALA 206.A N SER 204.A OG.B no hydrogen 2.719 N/A GLN 208.A NE2 VAL 319.A O no hydrogen 3.023 N/A GLN 208.A NE2 SER 362.A O no hydrogen 2.931 N/A GLN 210.A NE2 ILE 364.A O no hydrogen 3.032 N/A ALA 212.A N GLN 208.A O no hydrogen 2.958 N/A ASN 213.A N GLU 209.A O no hydrogen 2.966 N/A LYS 214.A N GLN 210.A O no hydrogen 3.121 N/A LYS 214.A NZ.A GLN 210.A O no hydrogen 2.816 N/A LYS 214.A NZ.B GLU 217.A OE1 no hydrogen 2.713 N/A MET 215.A N VAL 211.A O no hydrogen 2.808 N/A GLN 216.A N ALA 212.A O no hydrogen 3.044 N/A GLU 217.A N ASN 213.A O no hydrogen 3.366 N/A TRP 218.A N LYS 214.A O no hydrogen 3.180 N/A PHE 219.A N MET 215.A O no hydrogen 2.942 N/A GLU 220.A N GLN 216.A O no hydrogen 2.931 N/A SER 221.A N GLU 217.A O no hydrogen 2.952 N/A SER 221.A OG.A TRP 218.A O no hydrogen 3.111 N/A SER 221.A OG.B GLU 217.A O no hydrogen 3.318 N/A GLY 222.A N TRP 218.A O no hydrogen 3.093 N/A TRP 226.A N PHE 189.A O no hydrogen 2.967 N/A ILE 228.A N PHE 187.A O no hydrogen 2.813 N/A SER 229.A N ASP 227.A OD1 no hydrogen 3.350 N/A SER 229.A OG HIS 186.A ND1 no hydrogen 3.223 N/A ARG 230.A N TYR 246.A O no hydrogen 2.879 N/A ARG 230.A NH2 ASP 227.A O no hydrogen 3.304 N/A ARG 230.A NH2 SER 229.A O no hydrogen 2.884 N/A ALA 232.A N GLY 244.A O no hydrogen 2.941 N/A ILE 239.A N LYS 245.A O no hydrogen 2.835 N/A ALA 242.A N ILE 239.A O no hydrogen 3.012 N/A LYS 245.A N ALA 242.A O no hydrogen 2.882 N/A LYS 245.A NZ GLU 185.A O no hydrogen 2.726 N/A LYS 245.A NZ ASP 231.A OD1 no hydrogen 2.676 N/A TYR 246.A N ARG 230.A O no hydrogen 2.884 N/A PHE 247.A N PHE 237.A O no hydrogen 2.909 N/A TYR 248.A N ILE 228.A O no hydrogen 2.905 N/A VAL 249.A N TYR 234.A OH no hydrogen 3.002 N/A LEU 251.A N TYR 248.A O no hydrogen 2.915 N/A GLY 256.A N ASP 252.A O no hydrogen 3.087 N/A GLY 256.A N ALA 253.A O no hydrogen 2.867 N/A TYR 257.A N PRO 254.A O no hydrogen 2.898 N/A TYR 257.A OH HIS 298.A NE2 no hydrogen 2.619 N/A GLY 259.A N ILE 255.A O no hydrogen 2.892 N/A SER 260.A N GLY 256.A O no hydrogen 2.948 N/A SER 260.A OG CYS 46.A O no hydrogen 2.908 N/A PHE 261.A N TYR 257.A O no hydrogen 3.150 N/A LYS 262.A N MET 258.A O no hydrogen 2.783 N/A LYS 262.A NZ ASP 266.A OD2 no hydrogen 2.551 N/A ASN 263.A N GLY 259.A O no hydrogen 2.893 N/A ASN 263.A ND2 GLU 98.A OE1 no hydrogen 2.926 N/A LEU 264.A N SER 260.A O no hydrogen 3.078 N/A CYS 265.A N PHE 261.A O no hydrogen 2.948 N/A CYS 265.A SG PHE 261.A O no hydrogen 3.480 N/A ASP 266.A N LYS 262.A O no hydrogen 2.884 N/A LYS 267.A N ASN 263.A O no hydrogen 2.902 N/A LYS 267.A NZ ASN 90.A OD1 no hydrogen 2.815 N/A LYS 267.A NZ ASN 263.A OD1 no hydrogen 3.171 N/A ARG 268.A N LEU 264.A O no hydrogen 3.042 N/A GLY 269.A N ASP 266.A O no hydrogen 3.128 N/A ASP 270.A N CYS 265.A O no hydrogen 2.900 N/A VAL 272.A N ASP 270.A OD2 no hydrogen 2.965 N/A SER 273.A N ASP 270.A OD2 no hydrogen 2.909 N/A SER 273.A OG ASP 270.A OD1 no hydrogen 2.563 N/A SER 273.A OG ASP 270.A OD2 no hydrogen 3.335 N/A GLU 276.A N VAL 272.A O no hydrogen 3.278 N/A TYR 277.A N SER 273.A O no hydrogen 3.054 N/A TYR 277.A N PHE 274.A O no hydrogen 3.169 N/A TYR 277.A OH GLU 41.A OE2 no hydrogen 2.596 N/A TRP 278.A N PHE 274.A O no hydrogen 3.058 N/A LYS 279.A N ASP 275.A O no hydrogen 2.859 N/A LYS 279.A NZ.B ASP 281.A OD2 no hydrogen 3.009 N/A ASP 281.A N ASP 281.A OD1 no hydrogen 2.559 N/A SER 282.A N LYS 279.A O no hydrogen 3.041 N/A SER 282.A OG GLU 276.A O no hydrogen 2.654 N/A SER 282.A OG TYR 277.A O no hydrogen 3.502 N/A ALA 284.A N SER 282.A OG no hydrogen 2.859 N/A GLU 285.A N LYS 3.A O no hydrogen 2.839 N/A LEU 286.A N SER 315.A OG no hydrogen 2.990 N/A TYR 287.A N LEU 5.A O no hydrogen 2.849 N/A HIS 288.A N ASN 316.A O no hydrogen 3.382 N/A HIS 288.A ND1 THR 7.A OG1 no hydrogen 2.721 N/A PHE 289.A N THR 7.A O no hydrogen 2.896 N/A ILE 290.A N PHE 318.A O no hydrogen 3.091 N/A LYS 292.A NZ.A ASP 366.A OD1 no hydrogen 2.736 N/A LYS 292.A NZ.B ASP 366.A OD1 no hydrogen 3.226 N/A ILE 294.A N GLY 291.A O no hydrogen 3.222 N/A VAL 295.A N LYS 292.A O no hydrogen 3.462 N/A TYR 296.A OH GLN 224.A OE1 no hydrogen 2.774 N/A HIS 298.A N ILE 294.A O no hydrogen 3.357 N/A HIS 298.A ND1 ILE 294.A O no hydrogen 2.992 N/A HIS 298.A NE2 TYR 257.A OH no hydrogen 2.619 N/A SER 299.A N VAL 295.A O no hydrogen 2.822 N/A SER 299.A OG VAL 295.A O no hydrogen 2.880 N/A LEU 300.A N TYR 296.A O no hydrogen 3.095 N/A TRP 302.A N PHE 297.A O no hydrogen 2.898 N/A TRP 302.A NE1 HIS 288.A NE2 no hydrogen 2.954 N/A ALA 304.A N LEU 300.A O no hydrogen 3.446 N/A MET 305.A N PHE 301.A O no hydrogen 2.909 N/A LEU 306.A N TRP 302.A O no hydrogen 2.953 N/A GLU 307.A N PRO 303.A O no hydrogen 2.863 N/A GLY 308.A N ALA 304.A O no hydrogen 2.907 N/A SER 309.A N LEU 306.A O no hydrogen 3.152 N/A SER 309.A OG MET 305.A O no hydrogen 2.699 N/A SER 309.A OG LEU 306.A O no hydrogen 3.399 N/A ASN 310.A N GLU 307.A O no hydrogen 3.254 N/A ASN 310.A ND2.A ASN 310.A O no hydrogen 2.965 N/A PHE 311.A N LEU 306.A O no hydrogen 2.929 N/A ARG 312.A N TRP 278.A O no hydrogen 3.032 N/A ARG 312.A NE LYS 313.A O no hydrogen 2.821 N/A ARG 312.A NH1 TYR 277.A O no hydrogen 2.951 N/A ARG 312.A NH1 ALA 284.A O no hydrogen 2.950 N/A ARG 312.A NH2 ALA 284.A O no hydrogen 3.076 N/A LYS 313.A NZ GLU 307.A OE2 no hydrogen 2.566 N/A SER 315.A N LEU 286.A O no hydrogen 2.741 N/A ASN 316.A N LEU 286.A O no hydrogen 3.396 N/A ASN 316.A ND2 ALA 206.A O no hydrogen 3.102 N/A LEU 317.A N ASN 316.A OD1 no hydrogen 2.889 N/A PHE 318.A N HIS 288.A O no hydrogen 2.866 N/A VAL 319.A N GLN 208.A OE1 no hydrogen 2.798 N/A HIS 320.A N ILE 290.A O no hydrogen 3.059 N/A HIS 320.A ND1 GLY 321.A O no hydrogen 2.658 N/A HIS 320.A NE2 GLU 24.A OE2 no hydrogen 2.628 N/A TYR 322.A N ASP 366.A OD1 no hydrogen 2.891 N/A TYR 322.A OH ASP 293.A OD2 no hydrogen 2.630 N/A THR 324.A N ILE 367.A O no hydrogen 3.022 N/A THR 324.A OG1 ASP 368.A OD2 no hydrogen 2.673 N/A VAL 325.A N ALA 328.A O no hydrogen 2.892 N/A ASN 326.A N LEU 369.A O no hydrogen 2.816 N/A GLY 327.A N ASP 368.A OD2 no hydrogen 2.696 N/A ALA 328.A N VAL 325.A O no hydrogen 3.119 N/A SER 331.A N THR 336.A OG1 no hydrogen 2.713 N/A SER 333.A OG SER 331.A OG no hydrogen 3.231 N/A ARG 334.A N SER 331.A O no hydrogen 3.146 N/A ARG 334.A N SER 331.A OG no hydrogen 3.124 N/A ARG 334.A NH1 SER 331.A OG no hydrogen 3.375 N/A GLY 335.A N LYS 332.A O no hydrogen 3.175 N/A THR 336.A N SER 331.A O no hydrogen 2.953 N/A THR 336.A OG1 SER 331.A O no hydrogen 3.420 N/A ALA 340.A N ILE 17.A O no hydrogen 2.892 N/A TRP 343.A N LYS 339.A O no hydrogen 2.992 N/A TRP 343.A NE1 ASP 348.A O no hydrogen 3.237 N/A LEU 344.A N ALA 340.A O no hydrogen 3.322 N/A ASN 345.A N THR 342.A O no hydrogen 2.978 N/A HIS 346.A N TRP 343.A O no hydrogen 2.912 N/A PHE 347.A N TRP 343.A O no hydrogen 2.891 N/A SER 351.A N ASP 348.A OD1 no hydrogen 2.896 N/A SER 351.A OG ASP 348.A O no hydrogen 2.981 N/A SER 351.A OG ASP 348.A OD1 no hydrogen 3.234 N/A ARG 353.A N ALA 349.A O no hydrogen 2.973 N/A ARG 353.A NE VAL 491.A O no hydrogen 2.834 N/A ARG 353.A NH1 ASP 29.A OD2 no hydrogen 2.947 N/A ARG 353.A NH1 PHE 84.A O no hydrogen 2.953 N/A ARG 353.A NH2 ASP 29.A OD2 no hydrogen 2.632 N/A ARG 353.A NH2 PRO 490.A O no hydrogen 3.045 N/A TYR 354.A N ASP 350.A O no hydrogen 2.839 N/A TYR 354.A OH ASP 381.A OD2 no hydrogen 2.553 N/A TYR 355.A N SER 351.A O no hydrogen 3.028 N/A TYR 355.A OH ASP 373.A OD1 no hydrogen 2.665 N/A TYR 356.A N LEU 352.A O no hydrogen 2.978 N/A TYR 356.A OH LEU 19.A O no hydrogen 3.089 N/A THR 357.A N ARG 353.A O no hydrogen 3.041 N/A THR 357.A OG1 ARG 353.A O no hydrogen 2.728 N/A ALA 358.A N TYR 354.A O no hydrogen 2.867 N/A LYS 359.A N TYR 356.A O no hydrogen 3.041 N/A LYS 359.A NZ TYR 355.A OH no hydrogen 2.895 N/A LYS 359.A NZ ASP 368.A O no hydrogen 2.692 N/A LEU 360.A N TYR 356.A O no hydrogen 2.920 N/A SER 362.A N GLU 433.A OE1 no hydrogen 3.214 N/A SER 362.A OG GLU 433.A OE2 no hydrogen 2.475 N/A ARG 363.A N SER 361.A OG no hydrogen 3.195 N/A ILE 364.A N GLN 210.A OE1 no hydrogen 2.828 N/A ILE 367.A N TYR 322.A O no hydrogen 2.837 N/A LEU 369.A N THR 324.A O no hydrogen 2.867 N/A LEU 371.A N ASN 326.A OD1 no hydrogen 3.010 N/A ASP 373.A N ASN 370.A OD1 no hydrogen 2.874 N/A PHE 374.A N ASN 370.A O no hydrogen 2.800 N/A VAL 375.A N LEU 371.A O no hydrogen 3.302 N/A GLN 376.A N GLU 372.A O no hydrogen 3.289 N/A ARG 377.A N ASP 373.A O no hydrogen 2.712 N/A VAL 378.A N PHE 374.A O no hydrogen 3.051 N/A ASN 379.A N VAL 375.A O no hydrogen 3.073 N/A ASN 379.A ND2 ILE 531.A O no hydrogen 2.878 N/A ALA 380.A N GLN 376.A O no hydrogen 2.978 N/A ASP 381.A N ARG 377.A O no hydrogen 2.886 N/A ILE 382.A N VAL 378.A O no hydrogen 2.976 N/A VAL 383.A N VAL 378.A O no hydrogen 3.281 N/A ASN 384.A N ASN 379.A O no hydrogen 2.956 N/A ASN 384.A ND2 ASN 379.A O no hydrogen 3.095 N/A LYS 385.A NZ ASP 446.A OD2 no hydrogen 2.926 N/A VAL 386.A N ASP 381.A O no hydrogen 3.052 N/A VAL 387.A N ILE 382.A O no hydrogen 2.832 N/A LEU 389.A N VAL 386.A O no hydrogen 3.187 N/A ALA 390.A N VAL 387.A O no hydrogen 2.906 N/A SER 391.A N VAL 387.A O no hydrogen 2.833 N/A SER 391.A OG VAL 387.A O no hydrogen 3.335 N/A SER 391.A OG ASN 388.A O no hydrogen 3.519 N/A ARG 392.A N ASN 388.A O no hydrogen 2.893 N/A ARG 392.A NH1 ASN 449.A OD1 no hydrogen 2.980 N/A ARG 392.A NH1 ASP 453.A OD1 no hydrogen 3.415 N/A ARG 392.A NH2 ASP 453.A OD1 no hydrogen 2.788 N/A ASN 393.A N ALA 390.A O no hydrogen 3.233 N/A ASN 393.A ND2 LEU 389.A O no hydrogen 2.758 N/A ALA 394.A N ALA 390.A O no hydrogen 2.990 N/A ILE 397.A N ASN 393.A O no hydrogen 3.431 N/A ASN 398.A N ALA 394.A O no hydrogen 2.898 N/A ASN 398.A ND2 ALA 394.A O no hydrogen 2.686 N/A LYS 399.A N GLY 395.A O no hydrogen 2.808 N/A ARG 400.A N PHE 396.A O no hydrogen 2.871 N/A ARG 400.A NH1 ALA 461.A O no hydrogen 2.861 N/A ARG 400.A NH2 ASP 467.A OD2 no hydrogen 2.401 N/A PHE 401.A N ILE 397.A O no hydrogen 2.980 N/A GLY 403.A N ILE 397.A O no hydrogen 2.912 N/A VAL 404.A N PHE 401.A O no hydrogen 2.933 N/A LEU 405.A N HIS 519.A O no hydrogen 2.982 N/A ALA 406.A N SER 475.A OG no hydrogen 2.871 N/A LEU 414.A N ASP 411.A OD2 no hydrogen 2.970 N/A TYR 415.A N ASP 411.A O no hydrogen 3.098 N/A TYR 415.A OH ILE 512.A O no hydrogen 2.634 N/A LYS 416.A N PRO 412.A O no hydrogen 2.994 N/A LYS 416.A NZ ASP 420.A OD2 no hydrogen 3.556 N/A THR 417.A N GLN 413.A O no hydrogen 3.161 N/A THR 417.A OG1 GLN 413.A O no hydrogen 3.299 N/A PHE 418.A N LEU 414.A O no hydrogen 3.304 N/A THR 419.A N TYR 415.A O no hydrogen 2.981 N/A THR 419.A OG1 TYR 415.A O no hydrogen 3.492 N/A THR 419.A OG1 LYS 416.A O no hydrogen 3.296 N/A ASP 420.A N LYS 416.A O no hydrogen 2.767 N/A ALA 421.A N PHE 418.A O no hydrogen 3.319 N/A ALA 422.A N THR 419.A O no hydrogen 3.153 N/A ILE 425.A N ALA 421.A O no hydrogen 3.103 N/A GLY 426.A N ALA 422.A O no hydrogen 2.848 N/A GLU 427.A N GLU 423.A O no hydrogen 2.937 N/A ALA 428.A N VAL 424.A O no hydrogen 3.059 N/A TRP 429.A N ILE 425.A O no hydrogen 2.943 N/A TRP 429.A NE1 TYR 487.A O no hydrogen 3.012 N/A GLU 430.A N GLY 426.A O no hydrogen 2.858 N/A SER 431.A N GLU 427.A O no hydrogen 2.894 N/A SER 431.A OG GLU 427.A O no hydrogen 2.986 N/A SER 431.A OG ALA 428.A O no hydrogen 3.377 N/A ARG 432.A N TRP 429.A O no hydrogen 3.098 N/A GLU 433.A N ALA 428.A O no hydrogen 2.887 N/A GLY 435.A N LEU 360.A O no hydrogen 2.799 N/A LYS 436.A NZ LYS 436.A O no hydrogen 3.181 N/A LYS 436.A NZ GLU 440.A OE1 no hydrogen 3.083 N/A ALA 437.A N GLU 433.A O no hydrogen 3.108 N/A VAL 438.A N PHE 434.A O no hydrogen 2.988 N/A ARG 439.A N GLY 435.A O no hydrogen 3.004 N/A GLU 440.A N LYS 436.A O no hydrogen 3.006 N/A ILE 441.A N ALA 437.A O no hydrogen 2.935 N/A MET 442.A N VAL 438.A O no hydrogen 2.817 N/A ALA 443.A N ARG 439.A O no hydrogen 2.953 N/A LEU 444.A N GLU 440.A O no hydrogen 3.115 N/A ALA 445.A N ILE 441.A O no hydrogen 2.884 N/A ASP 446.A N MET 442.A O no hydrogen 2.906 N/A LEU 447.A N ALA 443.A O no hydrogen 3.071 N/A ALA 448.A N LEU 444.A O no hydrogen 2.927 N/A ASN 449.A N ALA 445.A O no hydrogen 2.952 N/A ASN 449.A ND2 LYS 385.A O no hydrogen 2.824 N/A ASN 449.A ND2 ALA 445.A O no hydrogen 3.033 N/A ARG 450.A N ASP 446.A O no hydrogen 2.894 N/A TYR 451.A N LEU 447.A O no hydrogen 2.888 N/A VAL 452.A N ALA 448.A O no hydrogen 3.028 N/A ASP 453.A N ASN 449.A O no hydrogen 2.916 N/A GLU 454.A N ARG 450.A O no hydrogen 2.747 N/A GLN 455.A N TYR 451.A O no hydrogen 3.054 N/A GLN 455.A N VAL 452.A O no hydrogen 3.147 N/A ALA 456.A N VAL 452.A O no hydrogen 2.923 N/A ALA 456.A N ASP 453.A O no hydrogen 3.205 N/A VAL 459.A N ALA 456.A O no hydrogen 2.721 N/A VAL 460.A N ALA 456.A O no hydrogen 3.044 N/A ALA 461.A N PRO 457.A O no hydrogen 2.902 N/A LYS 462.A N VAL 459.A O no hydrogen 3.141 N/A GLN 463.A N VAL 460.A O no hydrogen 3.180 N/A ARG 466.A N GLN 463.A O no hydrogen 3.436 N/A ARG 466.A NE ASP 469.A OD1 no hydrogen 2.928 N/A ARG 466.A NH1 GLN 463.A OE1 no hydrogen 2.891 N/A ARG 466.A NH2 ASP 469.A OD1 no hydrogen 3.120 N/A LEU 470.A N ARG 466.A O no hydrogen 2.895 N/A GLN 471.A N ASP 467.A O no hydrogen 2.944 N/A GLN 471.A NE2 VAL 404.A O no hydrogen 2.863 N/A ALA 472.A N ALA 468.A O no hydrogen 2.962 N/A ILE 473.A N ASP 469.A O no hydrogen 2.947 N/A CYS 474.A N LEU 470.A O no hydrogen 2.995 N/A CYS 474.A SG ASN 393.A OD1 no hydrogen 3.692 N/A CYS 474.A SG LEU 470.A O no hydrogen 3.431 N/A SER 475.A N GLN 471.A O no hydrogen 2.948 N/A SER 475.A OG GLN 471.A O no hydrogen 2.748 N/A MET 476.A N ALA 472.A O no hydrogen 3.008 N/A GLY 477.A N ILE 473.A O no hydrogen 3.014 N/A ILE 478.A N CYS 474.A O no hydrogen 3.066 N/A ASN 479.A N SER 475.A O no hydrogen 2.903 N/A ASN 479.A ND2 SER 475.A O no hydrogen 3.337 N/A ASN 479.A ND2 LEU 516.A O no hydrogen 3.048 N/A LEU 480.A N MET 476.A O no hydrogen 3.047 N/A PHE 481.A N GLY 477.A O no hydrogen 2.970 N/A ARG 482.A N ILE 478.A O no hydrogen 2.952 N/A ARG 482.A NH1 GLN 514.A O no hydrogen 3.105 N/A VAL 483.A N ASN 479.A O no hydrogen 3.184 N/A LEU 484.A N LEU 480.A O no hydrogen 2.992 N/A MET 485.A N PHE 481.A O no hydrogen 2.859 N/A THR 486.A N ARG 482.A O no hydrogen 3.159 N/A THR 486.A N VAL 483.A O no hydrogen 3.002 N/A THR 486.A OG1 ARG 482.A O no hydrogen 2.837 N/A TYR 487.A N VAL 483.A O no hydrogen 3.142 N/A TYR 487.A OH PHE 418.A O no hydrogen 2.629 N/A LEU 488.A N LEU 484.A O no hydrogen 3.041 N/A LYS 489.A N THR 486.A O no hydrogen 3.260 N/A LYS 489.A NZ GLU 500.A OE2 no hydrogen 2.753 N/A LYS 489.A NZ LEU 507.A O no hydrogen 2.943 N/A VAL 491.A N LEU 488.A O no hydrogen 2.940 N/A LEU 492.A N LEU 488.A O no hydrogen 3.006 N/A LEU 495.A N ASP 350.A OD2 no hydrogen 2.867 N/A THR 496.A N LEU 492.A O no hydrogen 2.795 N/A THR 496.A OG1 LEU 492.A O no hydrogen 2.742 N/A GLU 497.A N PRO 493.A O no hydrogen 3.036 N/A ARG 498.A N LYS 494.A O no hydrogen 3.018 N/A ARG 498.A NE LEU 527.A O no hydrogen 2.936 N/A ARG 498.A NH2 LEU 527.A O no hydrogen 2.887 N/A ALA 499.A N LEU 495.A O no hydrogen 2.850 N/A GLU 500.A N THR 496.A O no hydrogen 2.873 N/A ALA 501.A N GLU 497.A O no hydrogen 3.099 N/A PHE 502.A N ARG 498.A O no hydrogen 3.088 N/A LEU 503.A N ALA 499.A O no hydrogen 2.889 N/A ASN 504.A ND2 LYS 520.A O no hydrogen 3.129 N/A THR 505.A N GLU 500.A O no hydrogen 3.177 N/A THR 505.A OG1 GLU 506.A O no hydrogen 3.142 N/A LEU 507.A N GLU 500.A OE2 no hydrogen 2.711 N/A GLY 511.A N THR 508.A OG1 no hydrogen 2.963 N/A GLN 513.A N ASP 510.A O no hydrogen 3.097 N/A GLN 514.A N GLY 511.A O no hydrogen 3.080 N/A LEU 516.A N ASN 479.A OD1 no hydrogen 2.805 N/A GLY 518.A N ALA 406.A O no hydrogen 3.004 N/A HIS 519.A NE2 LEU 503.A O no hydrogen 2.695 N/A LYS 520.A NZ VAL 521.A O no hydrogen 2.773 N/A VAL 521.A N GLY 403.A O no hydrogen 2.836 N/A ASN 522.A N PHE 502.A O no hydrogen 2.774 N/A ASN 522.A ND2 ALA 501.A O no hydrogen 2.848 N/A TYR 528.A OH ASP 348.A OD2 no hydrogen 3.232 N/A ILE 531.A N ASN 379.A OD1 no hydrogen 2.866 N/A ASP 532.A N GLN 535.A OE1 no hydrogen 2.726 N/A GLN 535.A N ASP 532.A O no hydrogen 3.021 N/A GLN 535.A N ASP 532.A OD2 no hydrogen 3.243 N/A GLU 537.A N MET 533.A O no hydrogen 2.918 N/A ALA 538.A N ARG 534.A O no hydrogen 3.056 N/A LEU 539.A N GLN 535.A O no hydrogen 3.030 N/A VAL 540.A N VAL 536.A O no hydrogen 2.952 N/A GLU 541.A N GLU 537.A O no hydrogen 2.857 N/A ALA 542.A N ALA 538.A O no hydrogen 2.850 N/A SER 543.A N LEU 539.A O no hydrogen 3.000 N/A SER 543.A OG LEU 539.A O no hydrogen 2.987 N/A LYS 544.A N VAL 540.A O no hydrogen 2.935 N/A LYS 544.A NZ GLU 541.A OE1 no hydrogen 3.197 N/A GLU 545.A N GLU 541.A O no hydrogen 2.993 N/A