Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 7nuf_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ASP 5.A N THR 1.A O no hydrogen 2.861 N/A LYS 6.A N VAL 2.A O no hydrogen 3.157 N/A GLN 7.A N MET 3.A O no hydrogen 2.957 N/A LYS 8.A N LEU 4.A O no hydrogen 2.848 N/A GLU 9.A N ASP 5.A O no hydrogen 3.003 N/A LEU 10.A N LYS 6.A O no hydrogen 3.041 N/A ASP 11.A N GLN 7.A O no hydrogen 2.892 N/A SER 12.A N LYS 8.A O no hydrogen 3.065 N/A LYS 13.A N GLU 9.A O no hydrogen 3.059 N/A VAL 14.A N LEU 10.A O no hydrogen 2.900 N/A ARG 15.A N ASP 11.A O no hydrogen 2.992 N/A ASN 16.A N SER 12.A O no hydrogen 2.941 N/A VAL 17.A N LYS 13.A O no hydrogen 2.992 N/A LYS 18.A N VAL 14.A O no hydrogen 2.998 N/A ASP 19.A N ARG 15.A O no hydrogen 2.900 N/A LYS 20.A N ASN 16.A O no hydrogen 2.905 N/A LYS 20.A NZ ASN 16.A OD1 no hydrogen 3.014 N/A VAL 21.A N VAL 17.A O no hydrogen 3.188 N/A MET 22.A N LYS 18.A O no hydrogen 3.197 N/A CYS 23.A N ASP 19.A O no hydrogen 2.946 N/A ILE 24.A N LYS 20.A O no hydrogen 3.183 N/A GLU 25.A N VAL 21.A O no hydrogen 3.065 N/A HIS 26.A N MET 22.A O no hydrogen 3.122 N/A GLU 27.A N CYS 23.A O no hydrogen 2.901 N/A ILE 28.A N ILE 24.A O no hydrogen 2.771 N/A LYS 29.A N GLU 25.A O no hydrogen 3.109 N/A SER 30.A N HIS 26.A O no hydrogen 3.194 N/A SER 30.A OG HIS 26.A O no hydrogen 3.290 N/A LEU 31.A N GLU 27.A O no hydrogen 2.902 N/A GLU 32.A N ILE 28.A O no hydrogen 2.949 N/A ASP 33.A N LYS 29.A O no hydrogen 3.111 N/A LEU 34.A N SER 30.A O no hydrogen 2.917 N/A GLN 35.A N LEU 31.A O no hydrogen 2.972 N/A GLN 35.A NE2 LEU 142.A O no hydrogen 3.073 N/A ASP 36.A N GLU 32.A O no hydrogen 2.913 N/A GLU 37.A N ASP 33.A O no hydrogen 3.063 N/A TYR 38.A N LEU 34.A O no hydrogen 2.803 N/A TYR 38.A OH TYR 146.A OH no hydrogen 3.315 N/A ASP 39.A N GLN 35.A O no hydrogen 2.754 N/A PHE 40.A N ASP 36.A O no hydrogen 2.945 N/A LYS 41.A N GLU 37.A O no hydrogen 2.843 N/A LYS 41.A NZ GLU 54.A OE1 no hydrogen 3.173 N/A LYS 41.A NZ GLU 54.A OE2 no hydrogen 3.345 N/A CYS 42.A N TYR 38.A O no hydrogen 3.054 N/A CYS 42.A N ASP 39.A O no hydrogen 3.176 N/A CYS 42.A SG TYR 38.A O no hydrogen 3.259 N/A LYS 43.A N ASP 39.A O no hydrogen 3.101 N/A LYS 43.A NZ ASP 39.A OD1 no hydrogen 3.093 N/A THR 44.A OG1 PHE 40.A O no hydrogen 2.724 N/A GLN 46.A NE2 LYS 43.A O no hydrogen 3.339 N/A ARG 48.A N LEU 45.A O no hydrogen 3.286 N/A ARG 48.A NE ASP 50.A OD2 no hydrogen 2.985 N/A ARG 48.A NH2 ASP 50.A OD2 no hydrogen 3.103 N/A GLN 55.A N GLN 51.A O no hydrogen 2.973 N/A LEU 56.A N LYS 52.A O no hydrogen 3.008 N/A LEU 57.A N GLN 53.A O no hydrogen 2.859 N/A LEU 58.A N GLU 54.A O no hydrogen 3.052 N/A LYS 59.A N GLN 55.A O no hydrogen 3.402 N/A LYS 59.A NZ GLN 55.A O no hydrogen 3.076 N/A LYS 60.A N LEU 56.A O no hydrogen 3.162 N/A MET 61.A N LEU 57.A O no hydrogen 2.842 N/A TYR 62.A N LEU 58.A O no hydrogen 3.046 N/A LEU 63.A N LYS 59.A O no hydrogen 3.132 N/A MET 64.A N LYS 60.A O no hydrogen 2.922 N/A LEU 65.A N MET 61.A O no hydrogen 2.860 N/A ASP 66.A N TYR 62.A O no hydrogen 2.842 N/A ASN 67.A N LEU 63.A O no hydrogen 2.925 N/A LYS 68.A N MET 64.A O no hydrogen 2.895 N/A LYS 68.A NZ GLU 27.A O no hydrogen 2.869 N/A LYS 68.A NZ GLU 27.A OE2 no hydrogen 2.966 N/A ARG 69.A N LEU 65.A O no hydrogen 2.867 N/A ARG 69.A NH1 TYR 146.A O no hydrogen 3.106 N/A ARG 69.A NH1 ASP 151.A OD1 no hydrogen 2.834 N/A ARG 69.A NH2 GLN 35.A OE1 no hydrogen 2.901 N/A ARG 69.A NH2 TYR 146.A O no hydrogen 2.980 N/A LYS 70.A N ASP 66.A O no hydrogen 2.986 N/A LYS 70.A NZ ASP 66.A OD2 no hydrogen 3.350 N/A GLU 71.A N ASN 67.A O no hydrogen 2.911 N/A VAL 72.A N LYS 68.A O no hydrogen 2.990 N/A VAL 73.A N ARG 69.A O no hydrogen 3.130 N/A HIS 74.A N LYS 70.A O no hydrogen 2.987 N/A LYS 75.A N GLU 71.A O no hydrogen 2.984 N/A LYS 75.A NZ GLU 27.A OE1 no hydrogen 2.920 N/A ILE 76.A N VAL 72.A O no hydrogen 2.975 N/A ILE 77.A N VAL 73.A O no hydrogen 3.017 N/A GLU 78.A N HIS 74.A O no hydrogen 3.015 N/A LEU 79.A N LYS 75.A O no hydrogen 2.885 N/A LEU 80.A N ILE 76.A O no hydrogen 2.917 N/A ASN 81.A N ILE 77.A O no hydrogen 3.017 N/A VAL 82.A N GLU 78.A O no hydrogen 2.924 N/A THR 83.A N LEU 79.A O no hydrogen 2.776 N/A THR 83.A OG1 LEU 79.A O no hydrogen 2.891 N/A GLU 84.A N LEU 80.A O no hydrogen 3.070 N/A LEU 85.A N ASN 81.A O no hydrogen 3.353 N/A THR 86.A N VAL 82.A O no hydrogen 2.915 N/A THR 86.A OG1 VAL 82.A O no hydrogen 2.950 N/A GLN 87.A N THR 83.A O no hydrogen 2.831 N/A GLN 87.A NE2 LEU 167.A O no hydrogen 3.199 N/A ASN 88.A N GLU 84.A O no hydrogen 2.917 N/A ALA 89.A N LEU 85.A O no hydrogen 3.082 N/A LEU 90.A N THR 86.A O no hydrogen 3.013 N/A ILE 91.A N GLN 87.A O no hydrogen 2.817 N/A ASN 92.A N ASN 88.A O no hydrogen 2.774 N/A ASP 93.A N ALA 89.A O no hydrogen 3.103 N/A GLU 94.A N ALA 89.A O no hydrogen 3.039 N/A LEU 95.A N LEU 90.A O no hydrogen 2.973 N/A GLU 97.A N ASP 93.A O no hydrogen 2.947 N/A TRP 98.A N GLU 94.A O no hydrogen 2.913 N/A TRP 98.A NE1 ALA 113.A O no hydrogen 2.906 N/A LYS 99.A N LEU 95.A O no hydrogen 2.975 N/A ARG 100.A N VAL 96.A O no hydrogen 3.130 N/A ARG 100.A NH1 GLN 103.A OE1 no hydrogen 2.865 N/A ARG 100.A NH1 ASN 321.A O no hydrogen 2.928 N/A ARG 100.A NH1 VAL 324.A O no hydrogen 3.015 N/A ARG 100.A NH2 MET 322.A O no hydrogen 3.208 N/A ARG 101.A N GLU 97.A O no hydrogen 3.129 N/A GLN 102.A N LYS 99.A O no hydrogen 3.224 N/A GLN 102.A NE2 VAL 178.A O no hydrogen 3.085 N/A GLN 103.A N LYS 99.A O no hydrogen 3.107 N/A GLN 103.A NE2 ASN 321.A OD1 no hydrogen 3.027 N/A GLN 103.A NE2 VAL 324.A O no hydrogen 3.009 N/A SER 104.A N ARG 100.A O no hydrogen 3.187 N/A SER 104.A OG ARG 100.A O no hydrogen 3.418 N/A ALA 105.A N ARG 101.A O no hydrogen 3.108 N/A CYS 106.A N GLN 102.A O no hydrogen 2.974 N/A CYS 106.A SG GLN 102.A O no hydrogen 3.295 N/A ILE 107.A N GLN 103.A O no hydrogen 3.325 N/A ILE 107.A N SER 104.A O no hydrogen 3.020 N/A GLY 108.A N ALA 105.A O no hydrogen 3.163 N/A GLY 109.A N SER 104.A O no hydrogen 2.771 N/A GLN 119.A N LEU 115.A O no hydrogen 2.909 N/A ASN 120.A N ASP 116.A O no hydrogen 2.990 N/A TRP 121.A N GLN 117.A O no hydrogen 3.244 N/A TRP 121.A NE1 ASP 11.A OD1 no hydrogen 2.795 N/A PHE 122.A N LEU 118.A O no hydrogen 2.923 N/A THR 123.A N GLN 119.A O no hydrogen 2.936 N/A THR 123.A OG1 GLN 119.A O no hydrogen 2.805 N/A THR 123.A OG1 LEU 207.A O no hydrogen 3.117 N/A ILE 124.A N ASN 120.A O no hydrogen 3.052 N/A VAL 125.A N TRP 121.A O no hydrogen 3.290 N/A ALA 126.A N PHE 122.A O no hydrogen 3.138 N/A GLU 127.A N THR 123.A O no hydrogen 2.886 N/A SER 128.A N ILE 124.A O no hydrogen 2.968 N/A SER 128.A OG ILE 124.A O no hydrogen 2.910 N/A LEU 129.A N VAL 125.A O no hydrogen 3.008 N/A GLN 130.A N ALA 126.A O no hydrogen 2.957 N/A GLN 130.A NE2 GLU 212.A OE2 no hydrogen 3.043 N/A GLN 131.A N GLU 127.A O no hydrogen 3.037 N/A GLN 131.A NE2 GLU 25.A OE2 no hydrogen 3.151 N/A VAL 132.A N SER 128.A O no hydrogen 3.002 N/A ARG 133.A N LEU 129.A O no hydrogen 3.123 N/A ARG 133.A NH2 GLY 289.A O no hydrogen 2.987 N/A GLN 134.A N GLN 130.A O no hydrogen 3.225 N/A GLN 135.A N GLN 131.A O no hydrogen 2.847 N/A GLN 135.A NE2 VAL 21.A O no hydrogen 3.178 N/A GLN 135.A NE2 GLU 25.A OE2 no hydrogen 2.933 N/A LEU 136.A N VAL 132.A O no hydrogen 2.890 N/A LYS 137.A N ARG 133.A O no hydrogen 3.303 N/A LYS 137.A N GLN 134.A O no hydrogen 3.219 N/A LYS 137.A NZ GLN 134.A OE1 no hydrogen 3.068 N/A LYS 138.A N GLN 134.A O no hydrogen 3.070 N/A LEU 139.A N GLN 135.A O no hydrogen 3.032 N/A GLU 140.A N LEU 136.A O no hydrogen 3.004 N/A GLU 141.A N LYS 137.A O no hydrogen 3.064 N/A LEU 142.A N LYS 138.A O no hydrogen 3.104 N/A GLU 143.A N LEU 139.A O no hydrogen 2.983 N/A GLN 144.A N GLU 140.A O no hydrogen 2.934 N/A LYS 145.A N GLU 141.A O no hydrogen 3.087 N/A TYR 146.A N LEU 142.A O no hydrogen 2.897 N/A THR 147.A OG1 TYR 148.A O no hydrogen 3.549 N/A THR 147.A OG1 ASP 151.A OD2 no hydrogen 3.294 N/A TYR 148.A OH ASP 66.A OD1 no hydrogen 2.801 N/A THR 154.A OG1 GLU 143.A OE1 no hydrogen 2.754 N/A THR 154.A OG1 ASP 151.A OD2 no hydrogen 3.095 N/A LYS 155.A N ASP 151.A O no hydrogen 3.163 N/A ASN 156.A N PRO 152.A O no hydrogen 3.075 N/A ASN 156.A ND2 PRO 152.A O no hydrogen 2.909 N/A LYS 157.A N ILE 153.A O no hydrogen 2.887 N/A LYS 157.A NZ GLU 143.A OE1 no hydrogen 3.113 N/A LYS 157.A NZ GLU 143.A OE2 no hydrogen 3.243 N/A GLN 158.A NE2 ASP 162.A OD1 no hydrogen 3.172 N/A GLN 158.A NE2 ASP 162.A OD2 no hydrogen 3.108 N/A LEU 160.A N ASN 156.A O no hydrogen 2.975 N/A TRP 161.A N LYS 157.A O no hydrogen 3.134 N/A ASP 162.A N GLN 158.A O no hydrogen 3.025 N/A ARG 163.A N VAL 159.A O no hydrogen 2.826 N/A ARG 163.A NH1 ASN 81.A OD1 no hydrogen 2.997 N/A ARG 163.A NH2 ASN 81.A OD1 no hydrogen 2.896 N/A ARG 163.A NH2 GLU 84.A OE1 no hydrogen 3.288 N/A THR 164.A N LEU 160.A O no hydrogen 3.081 N/A THR 164.A OG1 LEU 160.A O no hydrogen 2.842 N/A PHE 165.A N TRP 161.A O no hydrogen 3.147 N/A SER 166.A N ASP 162.A O no hydrogen 3.023 N/A LEU 167.A N ARG 163.A O no hydrogen 2.960 N/A PHE 168.A N THR 164.A O no hydrogen 2.994 N/A GLN 169.A N PHE 165.A O no hydrogen 2.835 N/A GLN 170.A N SER 166.A O no hydrogen 3.013 N/A LEU 171.A N LEU 167.A O no hydrogen 2.994 N/A ILE 172.A N PHE 168.A O no hydrogen 3.016 N/A GLN 173.A N GLN 169.A O no hydrogen 2.949 N/A GLN 173.A NE2 ASP 293.A O no hydrogen 2.843 N/A SER 174.A N GLN 170.A O no hydrogen 2.915 N/A SER 174.A OG GLN 170.A O no hydrogen 3.014 N/A SER 175.A N LEU 171.A O no hydrogen 3.065 N/A SER 175.A N ILE 172.A O no hydrogen 3.248 N/A SER 175.A OG ILE 172.A O no hydrogen 2.742 N/A PHE 176.A N GLN 173.A O no hydrogen 3.307 N/A VAL 177.A N ARG 205.A O no hydrogen 2.995 N/A GLU 179.A N LYS 203.A O no hydrogen 2.876 N/A ARG 180.A N LYS 203.A O no hydrogen 3.264 N/A ARG 180.A NH2 GLU 257.A OE2 no hydrogen 3.096 N/A GLN 181.A NE2 GLN 102.A OE1 no hydrogen 3.128 N/A CYS 183.A N THR 201.A O no hydrogen 3.108 N/A CYS 183.A SG MET 184.A O no hydrogen 3.511 N/A CYS 183.A SG HIS 187.A O no hydrogen 3.301 N/A CYS 183.A SG PRO 188.A O no hydrogen 3.602 N/A THR 186.A OG1 HIS 187.A ND1 no hydrogen 3.143 N/A HIS 187.A N MET 184.A O no hydrogen 2.973 N/A ARG 190.A N HIS 187.A O no hydrogen 3.211 N/A ARG 190.A NH1 GLN 189.A O no hydrogen 3.119 N/A LEU 192.A N PRO 182.A O no hydrogen 2.940 N/A LEU 194.A N VAL 302.A O no hydrogen 2.774 N/A LYS 195.A NZ THR 196.A O no hydrogen 2.922 N/A LYS 195.A NZ SER 305.A O no hydrogen 3.025 N/A THR 196.A N ILE 304.A O no hydrogen 2.949 N/A GLY 197.A N LEU 263.A O no hydrogen 3.237 N/A VAL 198.A N LYS 195.A O no hydrogen 3.234 N/A PHE 200.A N LEU 261.A O no hydrogen 3.018 N/A THR 201.A N CYS 183.A O no hydrogen 2.940 N/A THR 201.A OG1 CYS 183.A O no hydrogen 3.242 N/A VAL 202.A N PHE 258.A O no hydrogen 3.054 N/A LYS 203.A N ARG 180.A O no hydrogen 3.069 N/A LEU 204.A N ALA 256.A O no hydrogen 2.858 N/A ARG 205.A N VAL 177.A O no hydrogen 2.813 N/A ARG 205.A NH1 GLU 179.A OE2 no hydrogen 3.146 N/A ARG 205.A NH2 ASP 116.A OD1 no hydrogen 2.746 N/A ARG 205.A NH2 GLN 119.A OE1 no hydrogen 2.875 N/A LEU 206.A N LEU 254.A O no hydrogen 3.084 N/A LEU 207.A N SER 175.A O no hydrogen 2.829 N/A LYS 209.A N THR 123.A OG1 no hydrogen 2.979 N/A LYS 209.A NZ GLY 252.A O no hydrogen 3.188 N/A LEU 213.A N LEU 210.A O no hydrogen 2.831 N/A ASN 214.A N GLN 211.A O no hydrogen 3.111 N/A TYR 215.A N MET 249.A O no hydrogen 3.075 N/A ASN 216.A N LEU 213.A O no hydrogen 3.157 N/A VAL 219.A N LYS 247.A O no hydrogen 2.917 N/A LYS 220.A N GLU 282.A O no hydrogen 2.835 N/A VAL 221.A N HIS 245.A O no hydrogen 2.997 N/A LEU 222.A N SER 280.A O no hydrogen 2.839 N/A ASP 224.A N SER 278.A O no hydrogen 2.933 N/A LYS 225.A NZ GLU 282.A OE1 no hydrogen 3.176 N/A GLU 229.A N GLU 229.A OE2 no hydrogen 2.809 N/A ARG 230.A N VAL 227.A O no hydrogen 3.278 N/A ARG 230.A NE VAL 227.A O no hydrogen 2.810 N/A ARG 230.A NH2 VAL 227.A O no hydrogen 3.481 N/A ASN 231.A N ASN 228.A O no hydrogen 2.936 N/A THR 232.A N ASN 228.A O no hydrogen 2.828 N/A THR 232.A OG1 ASN 228.A O no hydrogen 3.149 N/A VAL 233.A N GLU 229.A O no hydrogen 2.865 N/A PHE 236.A N VAL 233.A O no hydrogen 3.269 N/A ARG 237.A N GLU 275.A OE1 no hydrogen 3.100 N/A ARG 237.A NE GLU 275.A OE2 no hydrogen 2.824 N/A ARG 237.A NH2 GLU 275.A OE2 no hydrogen 3.288 N/A ARG 237.A NH2 VAL 303.A O no hydrogen 2.875 N/A ASN 240.A N LYS 264.A O no hydrogen 2.871 N/A LEU 242.A N GLN 262.A O no hydrogen 2.686 N/A LYS 247.A N VAL 219.A O no hydrogen 3.040 N/A LYS 247.A NZ ASN 250.A OD1 no hydrogen 3.250 N/A MET 249.A N LEU 217.A O no hydrogen 2.942 N/A ASN 250.A N ALA 255.A O no hydrogen 3.044 N/A ASN 250.A ND2 MET 251.A O no hydrogen 3.482 N/A MET 251.A N ASN 214.A OD1 no hydrogen 2.911 N/A ALA 255.A N ASN 250.A O no hydrogen 2.938 N/A ALA 256.A N LEU 204.A O no hydrogen 2.870 N/A PHE 258.A N VAL 202.A O no hydrogen 2.758 N/A LEU 261.A N PHE 200.A O no hydrogen 3.259 N/A GLN 262.A N LEU 242.A O no hydrogen 3.144 N/A LYS 264.A N ASN 240.A O no hydrogen 3.056 N/A GLN 266.A N LYS 238.A O no hydrogen 2.864 N/A GLN 266.A NE2 ASN 240.A OD1 no hydrogen 2.829 N/A GLU 274.A N ILE 271.A O no hydrogen 3.018 N/A GLU 275.A N ILE 271.A O no hydrogen 2.952 N/A GLU 275.A N VAL 272.A O no hydrogen 3.202 N/A HIS 277.A N VAL 301.A O no hydrogen 2.879 N/A HIS 277.A ND1 ASP 224.A OD2 no hydrogen 2.849 N/A HIS 277.A NE2 GLU 275.A OE2 no hydrogen 2.902 N/A SER 278.A N ASP 224.A OD1 no hydrogen 2.937 N/A LEU 279.A N SER 298.A OG no hydrogen 3.143 N/A SER 280.A N LEU 222.A O no hydrogen 2.852 N/A PHE 281.A N THR 296.A O no hydrogen 2.730 N/A GLU 282.A N LYS 220.A O no hydrogen 2.769 N/A THR 283.A N LEU 294.A O no hydrogen 2.932 N/A THR 283.A OG1 LYS 218.A O no hydrogen 2.978 N/A GLN 284.A NE2 ASP 293.A OD1 no hydrogen 3.016 N/A LEU 285.A N ILE 292.A O no hydrogen 2.828 N/A GLN 287.A N LEU 290.A O no hydrogen 2.737 N/A LEU 290.A N GLN 287.A O no hydrogen 2.945 N/A ILE 292.A N LEU 285.A O no hydrogen 2.958 N/A LEU 294.A N THR 283.A O no hydrogen 2.777 N/A THR 296.A N PHE 281.A O no hydrogen 3.043 N/A THR 296.A OG1 PHE 176.A O no hydrogen 3.511 N/A THR 297.A OG1 SER 298.A O no hydrogen 3.266 N/A SER 298.A N LEU 279.A O no hydrogen 2.893 N/A SER 298.A OG LEU 279.A O no hydrogen 3.515 N/A SER 298.A OG LEU 299.A O no hydrogen 2.918 N/A LEU 299.A N GLN 181.A OE1 no hydrogen 2.841 N/A VAL 301.A N HIS 277.A O no hydrogen 2.901 N/A VAL 302.A N LEU 192.A O no hydrogen 2.843 N/A ILE 304.A N LEU 194.A O no hydrogen 2.754 N/A GLN 309.A N ASN 306.A O no hydrogen 3.021 N/A GLN 309.A NE2 ASN 306.A O no hydrogen 3.630 N/A LEU 310.A N VAL 307.A O no hydrogen 3.080 N/A GLY 313.A N GLN 309.A O no hydrogen 2.933 N/A TRP 314.A N LEU 310.A O no hydrogen 2.891 N/A TRP 314.A NE1 GLN 351.A OE1 no hydrogen 2.838 N/A ALA 315.A N PRO 311.A O no hydrogen 3.091 N/A SER 316.A N SER 312.A O no hydrogen 3.314 N/A SER 316.A N GLY 313.A O no hydrogen 3.076 N/A SER 316.A OG THR 273.A O no hydrogen 3.054 N/A SER 316.A OG SER 312.A O no hydrogen 3.426 N/A ILE 317.A N GLY 313.A O no hydrogen 3.162 N/A LEU 318.A N TRP 314.A O no hydrogen 2.909 N/A TRP 319.A N ALA 315.A O no hydrogen 3.083 N/A TRP 319.A NE1 PRO 337.A O no hydrogen 2.925 N/A TYR 320.A N SER 316.A O no hydrogen 3.138 N/A TYR 320.A OH GLU 326.A O no hydrogen 2.611 N/A ASN 321.A N ILE 317.A O no hydrogen 3.020 N/A MET 322.A N LEU 318.A O no hydrogen 2.999 N/A LEU 323.A N TRP 319.A O no hydrogen 3.056 N/A LEU 323.A N TYR 320.A O no hydrogen 3.130 N/A VAL 324.A N TYR 320.A O no hydrogen 2.686 N/A ARG 328.A NH1 LYS 225.A O no hydrogen 2.805 N/A ARG 328.A NH1 ASP 226.A O no hydrogen 3.319 N/A ARG 328.A NH2 LYS 225.A O no hydrogen 2.750 N/A ASN 329.A N TYR 320.A OH no hydrogen 2.896 N/A SER 331.A OG GLU 229.A OE1 no hydrogen 2.751 N/A LEU 334.A N SER 331.A O no hydrogen 3.306 N/A ALA 339.A N ILE 383.A O no hydrogen 3.064 N/A ARG 340.A N GLN 343.A OE1 no hydrogen 3.138 N/A TRP 341.A N GLY 381.A O no hydrogen 2.932 N/A ALA 342.A N PRO 379.A O no hydrogen 3.069 N/A LEU 344.A N ARG 340.A O no hydrogen 3.218 N/A SER 345.A N TRP 341.A O no hydrogen 2.766 N/A SER 345.A OG TRP 341.A O no hydrogen 2.988 N/A SER 345.A OG ALA 342.A O no hydrogen 2.717 N/A GLU 346.A N ALA 342.A O no hydrogen 3.406 N/A VAL 347.A N GLN 343.A O no hydrogen 3.176 N/A LEU 348.A N LEU 344.A O no hydrogen 2.792 N/A SER 349.A N SER 345.A O no hydrogen 2.988 N/A SER 349.A OG LEU 360.A O no hydrogen 3.451 N/A TRP 350.A N GLU 346.A O no hydrogen 2.944 N/A GLN 351.A N VAL 347.A O no hydrogen 3.028 N/A GLN 351.A NE2 ILE 107.A O no hydrogen 2.930 N/A GLN 351.A NE2 VAL 347.A O no hydrogen 3.035 N/A PHE 352.A N LEU 348.A O no hydrogen 3.409 N/A SER 353.A N SER 349.A O no hydrogen 2.936 N/A SER 353.A OG SER 349.A O no hydrogen 2.950 N/A SER 353.A OG TRP 350.A O no hydrogen 3.128 N/A SER 354.A N TRP 350.A O no hydrogen 2.891 N/A SER 354.A OG TRP 350.A O no hydrogen 3.109 N/A SER 354.A OG GLN 351.A O no hydrogen 2.910 N/A VAL 355.A N GLN 351.A O no hydrogen 3.187 N/A THR 356.A N PHE 352.A O no hydrogen 2.756 N/A THR 356.A OG1 PHE 352.A O no hydrogen 2.861 N/A LYS 357.A N ASN 418.A OD1 no hydrogen 3.169 N/A ARG 358.A N THR 356.A OG1 no hydrogen 2.818 N/A ARG 358.A NH1 ASN 418.A O no hydrogen 2.842 N/A LEU 360.A N SER 349.A OG no hydrogen 2.980 N/A ASN 361.A N GLN 364.A OE1 no hydrogen 3.070 N/A GLN 364.A N ASN 361.A OD1 no hydrogen 2.807 N/A GLN 364.A NE2 MET 423.A O no hydrogen 2.875 N/A LEU 365.A N ASN 361.A O no hydrogen 2.988 N/A ASN 366.A N VAL 362.A O no hydrogen 2.741 N/A MET 367.A N ASP 363.A O no hydrogen 3.147 N/A LEU 368.A N GLN 364.A O no hydrogen 3.167 N/A GLY 369.A N LEU 365.A O no hydrogen 2.692 N/A GLU 370.A N ASN 366.A O no hydrogen 3.071 N/A LYS 371.A N MET 367.A O no hydrogen 3.259 N/A LYS 371.A NZ GLU 449.A OE1 no hydrogen 2.990 N/A LEU 372.A N LEU 368.A O no hydrogen 3.154 N/A LEU 373.A N GLY 369.A O no hydrogen 2.754 N/A GLY 374.A N GLU 370.A O no hydrogen 2.890 N/A ALA 377.A N GLY 374.A O no hydrogen 3.007 N/A GLY 381.A N SER 378.A O no hydrogen 3.150 N/A ILE 383.A N ALA 339.A O no hydrogen 2.699 N/A TRP 385.A NE1 GLU 274.A OE2 no hydrogen 2.813 N/A ARG 387.A N PRO 384.A O no hydrogen 2.921 N/A PHE 388.A N PRO 384.A O no hydrogen 3.085 N/A CYS 389.A N TRP 385.A O no hydrogen 3.031 N/A LYS 390.A NZ GLU 274.A OE2 no hydrogen 3.271 N/A GLU 391.A N THR 386.A O no hydrogen 2.747 N/A ASN 392.A ND2 ASN 395.A OD1 no hydrogen 3.666 N/A TRP 399.A N PHE 388.A O no hydrogen 3.008 N/A TRP 399.A NE1 PRO 311.A O no hydrogen 2.772 N/A TRP 401.A N PRO 397.A O no hydrogen 3.293 N/A TRP 401.A NE1 SER 448.A O no hydrogen 2.782 N/A ILE 402.A N PHE 398.A O no hydrogen 3.003 N/A GLU 403.A N TRP 399.A O no hydrogen 2.870 N/A SER 404.A N LEU 400.A O no hydrogen 3.140 N/A SER 404.A OG LEU 400.A O no hydrogen 3.183 N/A SER 404.A OG TRP 401.A O no hydrogen 2.821 N/A SER 404.A OG ARG 452.A O no hydrogen 3.125 N/A ILE 405.A N ILE 402.A O no hydrogen 3.153 N/A LEU 406.A N ILE 402.A O no hydrogen 3.097 N/A GLU 407.A N GLU 403.A O no hydrogen 2.914 N/A LEU 408.A N SER 404.A O no hydrogen 3.243 N/A ILE 409.A N ILE 405.A O no hydrogen 2.913 N/A LYS 410.A N LEU 406.A O no hydrogen 2.966 N/A LYS 411.A N GLU 407.A O no hydrogen 3.066 N/A HIS 412.A N LEU 408.A O no hydrogen 2.795 N/A LEU 413.A N ILE 409.A O no hydrogen 2.943 N/A TRP 417.A N LEU 413.A O no hydrogen 3.046 N/A TRP 417.A NE1 ARG 358.A O no hydrogen 3.103 N/A ASN 418.A N LEU 414.A O no hydrogen 2.950 N/A ASP 419.A N PRO 415.A O no hydrogen 3.111 N/A GLY 420.A N TRP 417.A O no hydrogen 3.200 N/A CYS 421.A N LEU 416.A O no hydrogen 2.983 N/A CYS 421.A SG TYR 519.A OH no hydrogen 3.669 N/A GLY 424.A N LEU 445.A O no hydrogen 2.950 N/A PHE 425.A N MET 423.A O no hydrogen 2.813 N/A ARG 430.A N SER 427.A OG no hydrogen 3.066 N/A GLU 431.A N SER 427.A O no hydrogen 2.834 N/A ARG 432.A N LYS 428.A O no hydrogen 2.989 N/A ALA 433.A N GLU 429.A O no hydrogen 3.035 N/A LEU 434.A N ARG 430.A O no hydrogen 3.004 N/A LEU 435.A N GLU 431.A O no hydrogen 2.887 N/A LYS 436.A N ARG 432.A O no hydrogen 3.068 N/A GLN 438.A N LEU 435.A O no hydrogen 3.210 N/A THR 442.A N GLN 439.A O no hydrogen 3.063 N/A THR 442.A OG1 GLN 439.A O no hydrogen 2.879 N/A PHE 443.A N TYR 505.A O no hydrogen 2.816 N/A LEU 444.A N THR 459.A O no hydrogen 3.072 N/A ARG 446.A N THR 457.A O no hydrogen 2.896 N/A PHE 447.A N GLY 424.A O no hydrogen 2.876 N/A SER 448.A N ALA 455.A O no hydrogen 3.283 N/A SER 450.A N SER 448.A OG no hydrogen 3.042 N/A ARG 452.A NH2 ASN 395.A O no hydrogen 2.923 N/A ILE 456.A N TYR 473.A O no hydrogen 3.049 N/A THR 457.A N ARG 446.A O no hydrogen 2.902 N/A THR 457.A OG1 VAL 470.A O no hydrogen 2.953 N/A THR 459.A N LEU 444.A O no hydrogen 3.099 N/A THR 459.A OG1 GLU 431.A OE2 no hydrogen 3.340 N/A TRP 460.A N HIS 468.A O no hydrogen 2.744 N/A TRP 460.A NE1 GLU 462.A OE2 no hydrogen 3.195 N/A VAL 461.A N THR 442.A O no hydrogen 2.998 N/A GLU 462.A N ASP 466.A O no hydrogen 2.757 N/A SER 464.A OG ASP 466.A OD1 no hydrogen 3.386 N/A HIS 468.A N TRP 460.A O no hydrogen 2.783 N/A VAL 470.A N PHE 458.A O no hydrogen 3.293 N/A TYR 473.A N ILE 456.A O no hydrogen 2.758 N/A THR 474.A N GLU 477.A OE2 no hydrogen 2.829 N/A THR 474.A OG1 GLU 477.A OE2 no hydrogen 2.760 N/A LYS 476.A N THR 474.A OG1 no hydrogen 3.361 N/A LEU 478.A N THR 474.A O no hydrogen 3.051 N/A SER 479.A N LYS 475.A O no hydrogen 2.769 N/A SER 479.A OG LYS 475.A O no hydrogen 2.891 N/A ALA 480.A N LYS 476.A O no hydrogen 3.446 N/A VAL 481.A N GLU 477.A O no hydrogen 3.117 N/A ILE 486.A N THR 482.A O no hydrogen 3.085 N/A ILE 487.A N PHE 483.A O no hydrogen 2.991 N/A ARG 488.A N PRO 484.A O no hydrogen 2.897 N/A ASN 489.A N ASP 485.A O no hydrogen 2.927 N/A LYS 491.A NZ TYR 490.A O no hydrogen 3.116 N/A VAL 492.A N GLU 500.A O no hydrogen 2.820 N/A ALA 494.A N ILE 498.A O no hydrogen 2.962 N/A ASN 497.A N ALA 494.A O no hydrogen 2.941 N/A GLU 500.A N VAL 492.A O no hydrogen 2.893 N/A ASN 501.A ND2 ILE 487.A O no hydrogen 3.105 N/A LEU 503.A N ASN 501.A OD1 no hydrogen 3.236 N/A LYS 504.A N GLY 441.A O no hydrogen 2.926 N/A LYS 504.A NZ ASN 501.A O no hydrogen 3.159 N/A TYR 505.A N GLY 441.A O no hydrogen 2.859 N/A LEU 506.A N ILE 510.A O no hydrogen 2.779 N/A TYR 507.A N PHE 443.A O no hydrogen 3.079 N/A ILE 510.A N LEU 506.A O no hydrogen 2.903 N/A LYS 512.A N LYS 504.A O no hydrogen 3.115 N/A LYS 512.A NZ ARG 488.A O no hydrogen 3.240 N/A ALA 515.A N ASP 511.A O no hydrogen 2.936 N/A PHE 516.A N LYS 512.A O no hydrogen 2.818 N/A LYS 518.A NZ ALA 515.A O no hydrogen 2.988 N/A TYR 519.A N PHE 516.A O no hydrogen 3.163 N/A TYR 519.A OH ASP 419.A OD2 no hydrogen 2.792 N/A TYR 520.A N GLY 517.A O no hydrogen 3.325 N/A TYR 520.A OH ASP 513.A OD1 no hydrogen 3.039 N/A SER 521.A N ASP 485.A OD1 no hydrogen 3.245 N/A SER 521.A OG ASP 485.A OD2 no hydrogen 2.747 N/A