Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4n5s_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLU 6.A N GLY 41.A O no hydrogen 2.860 N/A ALA 8.A N VAL 43.A O no hydrogen 2.837 N/A TRP 10.A NE1 ASP 55.A OD2 no hydrogen 2.697 N/A ALA 16.A N PRO 13.A O no hydrogen 3.374 N/A PHE 17.A N ALA 38.A O no hydrogen 2.957 N/A VAL 18.A N ARG 60.A O no hydrogen 2.734 N/A GLY 19.A N ALA 36.A O no hydrogen 2.912 N/A VAL 21.A N ALA 34.A O no hydrogen 2.967 N/A SER 23.A N ASP 31.A O no hydrogen 2.896 N/A ARG 24.A NE GLU 26.A OE1 no hydrogen 2.830 N/A ARG 24.A NH2 GLU 26.A OE1 no hydrogen 3.492 N/A ARG 24.A NH2 GLU 26.A OE2 no hydrogen 3.063 N/A GLU 26.A N GLU 26.A OE1 no hydrogen 2.884 N/A TRP 29.A N GLU 26.A O no hydrogen 3.014 N/A ASP 31.A N SER 23.A OG no hydrogen 2.856 N/A LEU 32.A N TYR 50.A OH no hydrogen 2.872 N/A LEU 33.A N VAL 21.A O no hydrogen 2.791 N/A ALA 34.A N VAL 21.A O no hydrogen 3.400 N/A ALA 36.A N GLY 19.A O no hydrogen 2.879 N/A ALA 37.A N HIS 44.A O no hydrogen 2.748 N/A ALA 38.A N PHE 17.A O no hydrogen 2.733 N/A ARG 39.A N ARG 42.A O no hydrogen 3.033 N/A GLY 40.A N GLU 121.A OE2 no hydrogen 2.884 N/A ARG 42.A N ARG 39.A O no hydrogen 3.121 N/A VAL 43.A N GLU 6.A O no hydrogen 2.704 N/A HIS 44.A N ALA 37.A O no hydrogen 2.741 N/A HIS 44.A ND1 PRO 9.A O no hydrogen 2.908 N/A ARG 45.A NE GLU 112.A OE1 no hydrogen 2.817 N/A ARG 45.A NH2 GLU 112.A OE1 no hydrogen 3.520 N/A ARG 45.A NH2 GLU 112.A OE2 no hydrogen 2.718 N/A ALA 46.A N LEU 35.A O no hydrogen 2.886 N/A TYR 50.A N GLU 48.A OE2 no hydrogen 2.969 N/A TYR 50.A OH ASP 31.A OD1 no hydrogen 2.662 N/A LYS 51.A N GLU 48.A OE1 no hydrogen 2.927 N/A ALA 52.A N GLU 48.A O no hydrogen 3.104 N/A LEU 53.A N PRO 49.A O no hydrogen 3.098 N/A LEU 53.A N TYR 50.A O no hydrogen 3.259 N/A ARG 54.A N LYS 51.A O no hydrogen 3.082 N/A ASP 55.A N ALA 52.A O no hydrogen 2.831 N/A LEU 56.A N LEU 53.A O no hydrogen 3.268 N/A ALA 59.A N PRO 79.A O no hydrogen 2.970 N/A ARG 60.A NH1 GLY 15.A O no hydrogen 2.802 N/A ARG 60.A NH2 ASP 82.A OD2 no hydrogen 2.757 N/A GLY 61.A N ASP 82.A O no hydrogen 2.811 N/A LEU 62.A N SER 120.A OG no hydrogen 2.997 N/A ALA 64.A N ASP 83.A OD2 no hydrogen 3.256 N/A LYS 65.A NZ ASP 66.A OD1 no hydrogen 3.158 N/A LYS 65.A NZ GLU 156.A OE2 no hydrogen 2.818 N/A LYS 65.A NZ PHE 275.A O no hydrogen 3.004 N/A ASP 66.A N LEU 63.A O no hydrogen 3.009 N/A LEU 67.A N LEU 63.A O no hydrogen 3.372 N/A SER 68.A N ALA 64.A O no hydrogen 2.960 N/A SER 68.A OG LEU 78.A O no hydrogen 2.616 N/A VAL 69.A N LYS 65.A O no hydrogen 2.855 N/A LEU 70.A N ASP 66.A O no hydrogen 3.187 N/A ALA 71.A N LEU 67.A O no hydrogen 2.882 N/A LEU 72.A N SER 68.A O no hydrogen 2.854 N/A ARG 73.A N VAL 69.A O no hydrogen 2.929 N/A ARG 73.A NE GLU 74.A OE1 no hydrogen 2.804 N/A ARG 73.A NH1 ALA 30.A O no hydrogen 2.838 N/A ARG 73.A NH2 ALA 30.A O no hydrogen 3.192 N/A ARG 73.A NH2 GLU 74.A OE1 no hydrogen 3.049 N/A GLU 74.A N LEU 70.A O no hydrogen 3.137 N/A GLY 75.A N LEU 72.A O no hydrogen 2.930 N/A LEU 76.A N ALA 71.A O no hydrogen 2.937 N/A GLY 81.A N ALA 59.A O no hydrogen 2.798 N/A ASP 83.A N TYR 141.A OH no hydrogen 3.235 N/A MET 85.A N ASP 83.A OD1 no hydrogen 2.829 N/A LEU 86.A N ASP 83.A O no hydrogen 2.995 N/A ALA 88.A N PRO 84.A O no hydrogen 2.891 N/A TYR 89.A N MET 85.A O no hydrogen 2.896 N/A TYR 89.A OH THR 280.A O no hydrogen 2.678 N/A LEU 90.A N LEU 86.A O no hydrogen 3.052 N/A LEU 91.A N LEU 87.A O no hydrogen 3.059 N/A ASP 92.A N ALA 88.A O no hydrogen 2.977 N/A SER 94.A N ASP 92.A OD1 no hydrogen 2.957 N/A SER 94.A OG ASP 92.A OD1 no hydrogen 2.872 N/A SER 94.A OG ASP 92.A OD2 no hydrogen 3.092 N/A ASN 95.A N ASP 92.A O no hydrogen 2.859 N/A ASN 95.A ND2 ALA 88.A O no hydrogen 2.925 N/A ASN 95.A ND2 TYR 105.A OH no hydrogen 3.021 N/A GLU 99.A N GLU 99.A OE1 no hydrogen 2.788 N/A GLY 100.A N THR 97.A OG1 no hydrogen 3.034 N/A VAL 101.A N THR 97.A O no hydrogen 2.968 N/A ALA 102.A N PRO 98.A O no hydrogen 2.853 N/A ARG 103.A N GLU 99.A O no hydrogen 3.168 N/A ARG 104.A N GLY 100.A O no hydrogen 2.929 N/A ARG 104.A NH1 ASP 92.A OD2 no hydrogen 3.568 N/A ARG 104.A NH2 ASP 92.A OD2 no hydrogen 2.822 N/A ARG 104.A NH2 ASN 95.A OD1 no hydrogen 2.980 N/A TYR 105.A N VAL 101.A O no hydrogen 2.925 N/A GLY 106.A N ALA 102.A O no hydrogen 2.875 N/A THR 110.A OG1 GLU 115.A OE1 no hydrogen 2.635 N/A GLY 114.A N GLU 112.A OE1 no hydrogen 3.001 N/A GLU 115.A N GLU 112.A OE2 no hydrogen 3.016 N/A ARG 116.A N GLU 112.A O no hydrogen 2.932 N/A ARG 116.A NE THR 110.A O no hydrogen 2.811 N/A ARG 116.A NH1 PHE 20.A O no hydrogen 2.893 N/A ARG 116.A NH2 THR 110.A O no hydrogen 2.978 N/A ARG 116.A NH2 GLU 111.A OE2 no hydrogen 3.398 N/A ALA 117.A N ALA 113.A O no hydrogen 2.857 N/A ALA 118.A N GLY 114.A O no hydrogen 3.016 N/A LEU 119.A N GLU 115.A O no hydrogen 2.862 N/A SER 120.A N ARG 116.A O no hydrogen 2.898 N/A SER 120.A OG VAL 18.A O no hydrogen 3.404 N/A SER 120.A OG ARG 116.A O no hydrogen 2.968 N/A GLU 121.A N ALA 117.A O no hydrogen 3.076 N/A ARG 122.A N ALA 118.A O no hydrogen 3.042 N/A ARG 122.A NH1 GLY 106.A O no hydrogen 2.989 N/A LEU 123.A N LEU 119.A O no hydrogen 2.873 N/A PHE 124.A N SER 120.A O no hydrogen 2.948 N/A ALA 125.A N GLU 121.A O no hydrogen 3.133 N/A ASN 126.A N ARG 122.A O no hydrogen 2.966 N/A ASN 126.A ND2 TYR 105.A O no hydrogen 2.815 N/A LEU 127.A N LEU 123.A O no hydrogen 2.808 N/A TRP 128.A N PHE 124.A O no hydrogen 2.854 N/A GLY 129.A N ALA 125.A O no hydrogen 3.117 N/A ARG 130.A N ASN 126.A O no hydrogen 3.058 N/A LEU 131.A N LEU 127.A O no hydrogen 3.124 N/A LEU 131.A N TRP 128.A O no hydrogen 3.144 N/A GLU 132.A N GLY 129.A O no hydrogen 3.109 N/A GLU 134.A N LEU 131.A O no hydrogen 2.902 N/A ARG 136.A NH2 GLU 432.A OE2 no hydrogen 2.967 N/A LEU 138.A N GLU 134.A O no hydrogen 2.942 N/A TRP 139.A N GLU 135.A O no hydrogen 2.999 N/A LEU 140.A N ARG 136.A O no hydrogen 2.929 N/A TYR 141.A N LEU 137.A O no hydrogen 2.938 N/A TYR 141.A OH ASP 82.A OD1 no hydrogen 2.645 N/A ARG 142.A N LEU 138.A O no hydrogen 2.907 N/A GLU 143.A N TRP 139.A O no hydrogen 2.805 N/A VAL 144.A N LEU 140.A O no hydrogen 2.990 N/A GLU 145.A N LEU 140.A O no hydrogen 2.818 N/A ARG 146.A N TYR 141.A O no hydrogen 2.875 N/A ARG 146.A NH1 ASP 82.A OD1 no hydrogen 2.808 N/A LEU 148.A N VAL 144.A O no hydrogen 2.831 N/A SER 149.A N GLU 145.A O no hydrogen 3.059 N/A SER 149.A OG ARG 146.A O no hydrogen 2.711 N/A ALA 150.A N PRO 147.A O no hydrogen 3.114 N/A VAL 151.A N PRO 147.A O no hydrogen 3.393 N/A LEU 152.A N LEU 148.A O no hydrogen 2.803 N/A ALA 153.A N SER 149.A O no hydrogen 3.035 N/A HIS 154.A N ALA 150.A O no hydrogen 3.165 N/A MET 155.A N VAL 151.A O no hydrogen 2.946 N/A GLU 156.A N LEU 152.A O no hydrogen 2.896 N/A ALA 157.A N ALA 153.A O no hydrogen 3.033 N/A THR 158.A N HIS 154.A O no hydrogen 3.007 N/A THR 158.A N MET 155.A O no hydrogen 3.176 N/A THR 158.A OG1 HIS 154.A O no hydrogen 2.795 N/A GLY 159.A N MET 155.A O no hydrogen 3.168 N/A VAL 160.A N LEU 271.A O no hydrogen 2.964 N/A ARG 161.A NH1 ALA 311.A O no hydrogen 2.967 N/A ASP 163.A N ALA 308.A O no hydrogen 2.716 N/A TYR 166.A N ASP 163.A OD1 no hydrogen 3.326 N/A TYR 166.A OH ARG 304.A O no hydrogen 2.771 N/A LEU 167.A N ASP 163.A O no hydrogen 3.123 N/A ARG 168.A N VAL 164.A O no hydrogen 2.932 N/A ARG 168.A NH1 ASP 262.A OD1 no hydrogen 3.362 N/A ARG 168.A NH2 ASP 262.A OD1 no hydrogen 2.844 N/A ALA 169.A N ALA 165.A O no hydrogen 3.050 N/A LEU 170.A N TYR 166.A O no hydrogen 2.987 N/A SER 171.A N LEU 167.A O no hydrogen 2.901 N/A SER 171.A OG ASP 258.A OD1 no hydrogen 2.531 N/A GLU 173.A N ALA 169.A O no hydrogen 3.265 N/A VAL 174.A N LEU 170.A O no hydrogen 2.885 N/A ALA 175.A N SER 171.A O no hydrogen 2.925 N/A GLU 176.A N LEU 172.A O no hydrogen 3.457 N/A GLU 177.A N GLU 173.A O no hydrogen 3.330 N/A ILE 178.A N VAL 174.A O no hydrogen 2.870 N/A ALA 179.A N ALA 175.A O no hydrogen 3.044 N/A ARG 180.A N GLU 176.A O no hydrogen 3.194 N/A LEU 181.A N GLU 177.A O no hydrogen 3.149 N/A GLU 182.A N ILE 178.A O no hydrogen 2.863 N/A ALA 183.A N ALA 179.A O no hydrogen 2.957 N/A GLU 184.A N ARG 180.A O no hydrogen 3.078 N/A VAL 185.A N LEU 181.A O no hydrogen 2.921 N/A PHE 186.A N GLU 182.A O no hydrogen 2.899 N/A ARG 187.A N ALA 183.A O no hydrogen 2.842 N/A ARG 187.A NE GLU 184.A OE1 no hydrogen 2.718 N/A LEU 188.A N GLU 184.A O no hydrogen 2.879 N/A ALA 189.A N VAL 185.A O no hydrogen 2.901 N/A GLY 190.A N PHE 186.A O no hydrogen 2.928 N/A GLY 190.A N ARG 187.A O no hydrogen 3.322 N/A HIS 191.A ND1 PRO 192.A O no hydrogen 2.865 N/A HIS 191.A NE2 GLU 208.A OE1 no hydrogen 2.672 N/A ASN 194.A N GLN 200.A OE1 no hydrogen 2.901 N/A ASN 196.A N ASN 194.A OD1 no hydrogen 2.873 N/A SER 197.A N ASN 194.A O no hydrogen 2.959 N/A ARG 198.A NH1 ASP 199.A OD1 no hydrogen 2.900 N/A ARG 198.A NH1 GLU 202.A OE1 no hydrogen 2.713 N/A ARG 198.A NH2 ARG 223.A O no hydrogen 2.776 N/A GLN 200.A N SER 197.A OG no hydrogen 3.199 N/A LEU 201.A N SER 197.A O no hydrogen 2.942 N/A GLU 202.A N ARG 198.A O no hydrogen 2.948 N/A ARG 203.A N ASP 199.A O no hydrogen 3.382 N/A VAL 204.A N GLN 200.A O no hydrogen 3.122 N/A LEU 205.A N LEU 201.A O no hydrogen 2.803 N/A PHE 206.A N GLU 202.A O no hydrogen 2.964 N/A ASP 207.A N ARG 203.A O no hydrogen 2.878 N/A GLU 208.A N ARG 203.A O no hydrogen 2.961 N/A LEU 209.A N VAL 204.A O no hydrogen 2.907 N/A LEU 211.A N LEU 205.A O no hydrogen 2.974 N/A LYS 216.A NZ GLY 221.A O no hydrogen 3.205 N/A THR 217.A N LYS 222.A O no hydrogen 2.818 N/A THR 217.A OG1 THR 220.A OG1 no hydrogen 3.361 N/A THR 220.A OG1 THR 217.A OG1 no hydrogen 3.361 N/A GLY 221.A N THR 217.A O no hydrogen 3.161 N/A LYS 222.A N THR 217.A OG1 no hydrogen 3.092 N/A LYS 222.A NZ ASP 199.A OD1 no hydrogen 2.906 N/A LYS 222.A NZ ASP 199.A OD2 no hydrogen 3.261 N/A ARG 223.A N GLU 202.A OE2 no hydrogen 2.903 N/A ARG 223.A NE GLU 202.A OE2 no hydrogen 2.872 N/A ARG 223.A NH1 ASP 207.A OD1 no hydrogen 2.747 N/A ARG 223.A NH2 GLU 202.A OE2 no hydrogen 3.519 N/A ARG 223.A NH2 ASP 207.A OD1 no hydrogen 3.429 N/A ARG 223.A NH2 ASP 207.A OD2 no hydrogen 2.784 N/A SER 224.A N GLY 215.A O no hydrogen 2.882 N/A SER 226.A N SER 224.A OG no hydrogen 3.081 N/A SER 226.A OG SER 224.A OG no hydrogen 3.328 N/A VAL 229.A N SER 226.A OG no hydrogen 3.385 N/A LEU 230.A N SER 226.A O no hydrogen 2.878 N/A GLU 231.A N ALA 227.A O no hydrogen 2.791 N/A ALA 232.A N ALA 228.A O no hydrogen 3.173 N/A LEU 233.A N VAL 229.A O no hydrogen 3.147 N/A LEU 233.A N LEU 230.A O no hydrogen 2.924 N/A ARG 234.A N GLU 231.A O no hydrogen 3.277 N/A ALA 236.A N LEU 233.A O no hydrogen 2.966 N/A ILE 239.A N HIS 237.A ND1 no hydrogen 3.175 N/A VAL 240.A N HIS 237.A O no hydrogen 3.201 N/A LYS 242.A NZ GLU 241.A OE1 no hydrogen 3.283 N/A ILE 243.A N ILE 239.A O no hydrogen 3.031 N/A LEU 244.A N VAL 240.A O no hydrogen 2.986 N/A GLN 245.A N GLU 241.A O no hydrogen 2.970 N/A TYR 246.A N LYS 242.A O no hydrogen 2.838 N/A TYR 246.A OH ASN 196.A OD1 no hydrogen 2.689 N/A ARG 247.A N ILE 243.A O no hydrogen 2.819 N/A ARG 247.A NH1 THR 225.A O no hydrogen 2.840 N/A ARG 247.A NH2 THR 225.A O no hydrogen 3.482 N/A ARG 247.A NH2 THR 225.A OG1 no hydrogen 2.949 N/A GLU 248.A N LEU 244.A O no hydrogen 2.967 N/A LEU 249.A N GLN 245.A O no hydrogen 3.109 N/A THR 250.A N TYR 246.A O no hydrogen 2.863 N/A THR 250.A OG1 TYR 246.A O no hydrogen 2.896 N/A THR 250.A OG1 ARG 247.A O no hydrogen 3.378 N/A LYS 251.A N ARG 247.A O no hydrogen 3.007 N/A LEU 252.A N GLU 248.A O no hydrogen 3.263 N/A LYS 253.A N LEU 249.A O no hydrogen 2.869 N/A LYS 253.A NZ ASP 258.A OD2 no hydrogen 2.804 N/A SER 254.A N THR 250.A O no hydrogen 2.861 N/A SER 254.A OG THR 250.A O no hydrogen 2.853 N/A SER 254.A OG LYS 251.A O no hydrogen 3.524 N/A THR 255.A N LYS 251.A O no hydrogen 3.132 N/A THR 255.A OG1 LYS 251.A O no hydrogen 3.167 N/A TYR 256.A N LEU 252.A O no hydrogen 3.019 N/A TYR 256.A OH ASN 294.A O no hydrogen 2.723 N/A ILE 257.A N LEU 252.A O no hydrogen 3.086 N/A ASP 258.A N LYS 253.A O no hydrogen 2.984 N/A LEU 260.A N TYR 256.A O no hydrogen 3.185 N/A ASP 262.A N PRO 259.A O no hydrogen 3.125 N/A LEU 263.A N LEU 260.A O no hydrogen 2.996 N/A HIS 265.A N ARG 270.A O no hydrogen 2.946 N/A HIS 265.A NE2 MET 28.A O no hydrogen 2.922 N/A ARG 267.A N HIS 265.A ND1 no hydrogen 3.095 N/A THR 268.A OG1 HIS 272.A NE2 no hydrogen 2.690 N/A GLY 269.A N HIS 265.A O no hydrogen 2.832 N/A ARG 270.A N THR 268.A OG1 no hydrogen 2.947 N/A ARG 270.A NE THR 158.A O no hydrogen 3.021 N/A ARG 270.A NH1 GLU 312.A OE1 no hydrogen 2.934 N/A ARG 270.A NH1 GLU 501.A OE1 no hydrogen 3.237 N/A ARG 270.A NH1 GLU 501.A OE2 no hydrogen 3.309 N/A ARG 270.A NH2 GLY 159.A O no hydrogen 2.737 N/A ARG 270.A NH2 GLU 501.A OE1 no hydrogen 2.896 N/A LEU 271.A N VAL 160.A O no hydrogen 2.828 N/A HIS 272.A ND1 GLU 156.A O no hydrogen 2.731 N/A HIS 272.A NE2 THR 268.A OG1 no hydrogen 2.690 N/A THR 273.A OG1 ARG 274.A O no hydrogen 3.359 N/A THR 273.A OG1 SER 287.A OG no hydrogen 2.623 N/A THR 273.A OG1 SER 288.A O no hydrogen 3.132 N/A THR 273.A OG1 PRO 290.A O no hydrogen 2.697 N/A ARG 274.A N SER 288.A O no hydrogen 2.882 N/A PHE 275.A N GLU 156.A OE2 no hydrogen 2.839 N/A ASN 276.A N SER 286.A O no hydrogen 2.859 N/A ASN 276.A ND2 SER 286.A OG no hydrogen 3.024 N/A ASN 276.A ND2 SER 288.A OG no hydrogen 3.028 N/A GLN 277.A NE2 GLU 145.A O no hydrogen 2.895 N/A GLN 277.A NE2 GLU 145.A OE1 no hydrogen 2.787 N/A THR 278.A OG1 THR 96.A O no hydrogen 3.418 N/A THR 280.A OG1 TYR 89.A OH no hydrogen 3.247 N/A THR 280.A OG1 ARG 284.A O no hydrogen 2.745 N/A THR 282.A OG1 GLN 465.A OE1 no hydrogen 2.687 N/A GLY 283.A N THR 280.A OG1 no hydrogen 3.227 N/A SER 286.A N ASN 276.A O no hydrogen 3.109 N/A SER 287.A OG THR 273.A OG1 no hydrogen 2.623 N/A SER 288.A N ARG 274.A O no hydrogen 2.991 N/A SER 288.A OG ASP 289.A OD2 no hydrogen 2.665 N/A LEU 292.A N SER 287.A OG no hydrogen 2.854 N/A GLN 293.A N ASN 291.A OD1 no hydrogen 2.681 N/A GLN 293.A NE2 GLN 493.A O no hydrogen 2.923 N/A THR 299.A OG1 GLU 248.A OE2 no hydrogen 3.052 N/A GLY 302.A N THR 299.A OG1 no hydrogen 3.141 N/A GLN 303.A N THR 299.A O no hydrogen 2.830 N/A GLN 303.A NE2 VAL 297.A O no hydrogen 3.188 N/A ARG 304.A N PRO 300.A O no hydrogen 3.101 N/A ARG 304.A NH1 GLU 173.A OE1 no hydrogen 3.462 N/A ARG 304.A NH1 GLU 173.A OE2 no hydrogen 2.803 N/A ARG 304.A NH2 GLU 173.A OE1 no hydrogen 2.797 N/A ILE 305.A N LEU 301.A O no hydrogen 3.118 N/A ILE 305.A N GLY 302.A O no hydrogen 3.034 N/A ARG 306.A N GLY 302.A O no hydrogen 3.222 N/A ARG 306.A NE PRO 296.A O no hydrogen 2.834 N/A ARG 306.A NH2 ILE 295.A O no hydrogen 2.792 N/A ARG 307.A N GLN 303.A O no hydrogen 3.089 N/A ALA 308.A N ILE 305.A O no hydrogen 2.922 N/A PHE 309.A N ARG 306.A O no hydrogen 3.199 N/A ILE 310.A N ARG 161.A O no hydrogen 3.145 N/A ALA 311.A N GLU 536.A O no hydrogen 3.003 N/A GLU 312.A N GLU 501.A OE2 no hydrogen 2.785 N/A GLU 313.A N GLU 313.A OE1 no hydrogen 2.792 N/A TRP 315.A N GLU 312.A O no hydrogen 2.915 N/A LEU 316.A N ALA 502.A O no hydrogen 2.807 N/A LEU 317.A N GLY 535.A O no hydrogen 2.751 N/A VAL 318.A N LEU 500.A O no hydrogen 2.834 N/A ALA 319.A N GLY 533.A O no hydrogen 2.864 N/A LEU 320.A N LEU 498.A O no hydrogen 2.886 N/A ASP 321.A N GLU 531.A O no hydrogen 2.893 N/A TYR 322.A N ASP 496.A O no hydrogen 2.962 N/A TYR 322.A OH MET 518.A O no hydrogen 2.740 N/A SER 323.A N GLU 529.A O no hydrogen 2.829 N/A GLN 324.A NE2 ARG 347.A O no hydrogen 3.122 N/A ARG 328.A N GLN 324.A O no hydrogen 3.092 N/A ARG 328.A NE SER 323.A O no hydrogen 2.824 N/A ARG 328.A NH1 PRO 527.A O no hydrogen 2.857 N/A ARG 328.A NH2 SER 323.A OG no hydrogen 3.012 N/A ARG 328.A NH2 GLU 529.A OE1 no hydrogen 3.277 N/A VAL 329.A N ILE 325.A O no hydrogen 2.989 N/A LEU 330.A N GLU 326.A O no hydrogen 2.937 N/A ALA 331.A N LEU 327.A O no hydrogen 2.968 N/A HIS 332.A N ARG 328.A O no hydrogen 3.139 N/A LEU 333.A N VAL 329.A O no hydrogen 2.871 N/A SER 334.A N LEU 330.A O no hydrogen 2.848 N/A SER 334.A OG LEU 330.A O no hydrogen 2.803 N/A GLY 335.A N ALA 331.A O no hydrogen 2.880 N/A ASP 336.A N SER 334.A OG no hydrogen 3.082 N/A GLU 337.A N GLU 337.A OE1 no hydrogen 2.901 N/A ASN 338.A ND2 SER 410.A O no hydrogen 2.803 N/A LEU 339.A N ASP 336.A OD2 no hydrogen 2.790 N/A ILE 340.A N ASP 336.A O no hydrogen 2.891 N/A ARG 341.A N GLU 337.A O no hydrogen 2.926 N/A ARG 341.A NH1 ASN 338.A OD1 no hydrogen 2.682 N/A VAL 342.A N ASN 338.A O no hydrogen 3.034 N/A PHE 343.A N LEU 339.A O no hydrogen 3.436 N/A GLN 344.A N ILE 340.A O no hydrogen 2.926 N/A GLU 345.A N ARG 341.A O no hydrogen 2.820 N/A GLY 346.A N PHE 343.A O no hydrogen 3.215 N/A ARG 347.A N VAL 342.A O no hydrogen 2.986 N/A ARG 347.A NE GLU 352.A OE2 no hydrogen 2.784 N/A ARG 347.A NH2 GLU 352.A OE1 no hydrogen 2.802 N/A ARG 347.A NH2 GLU 352.A OE2 no hydrogen 3.501 N/A ILE 349.A N GLN 324.A OE1 no hydrogen 2.927 N/A THR 351.A N ASP 348.A OD1 no hydrogen 3.001 N/A GLU 352.A N ASP 348.A O no hydrogen 2.961 N/A THR 353.A N ILE 349.A O no hydrogen 2.955 N/A THR 353.A OG1 ILE 349.A O no hydrogen 3.292 N/A THR 353.A OG1 ASN 377.A OD1 no hydrogen 2.581 N/A ALA 354.A N HIS 350.A O no hydrogen 2.923 N/A SER 355.A N THR 351.A O no hydrogen 2.968 N/A SER 355.A OG VAL 360.A O no hydrogen 2.389 N/A TRP 356.A N GLU 352.A O no hydrogen 3.285 N/A MET 357.A N THR 353.A O no hydrogen 2.835 N/A PHE 358.A N ALA 354.A O no hydrogen 2.886 N/A VAL 360.A N SER 355.A O no hydrogen 3.136 N/A ALA 364.A N PRO 361.A O no hydrogen 2.875 N/A VAL 365.A N ARG 362.A O no hydrogen 3.100 N/A MET 369.A N ASP 366.A OD1 no hydrogen 2.956 N/A ARG 370.A N ASP 366.A O no hydrogen 2.970 N/A ARG 370.A NE ASP 348.A OD1 no hydrogen 3.381 N/A ARG 370.A NE ASP 348.A OD2 no hydrogen 3.101 N/A ARG 370.A NH2 ASP 348.A OD1 no hydrogen 3.514 N/A ARG 370.A NH2 ASP 348.A OD2 no hydrogen 2.856 N/A ARG 371.A N PRO 367.A O no hydrogen 2.856 N/A ALA 372.A N LEU 368.A O no hydrogen 3.034 N/A ALA 373.A N MET 369.A O no hydrogen 3.249 N/A LYS 374.A N ARG 371.A O no hydrogen 2.910 N/A ASN 377.A N ALA 373.A O no hydrogen 2.795 N/A ASN 377.A ND2 ILE 349.A O no hydrogen 3.158 N/A ASN 377.A ND2 HIS 350.A ND1 no hydrogen 2.989 N/A PHE 378.A N LYS 374.A O no hydrogen 2.874 N/A GLY 379.A N THR 375.A O no hydrogen 2.823 N/A VAL 380.A N ILE 376.A O no hydrogen 2.882 N/A LEU 381.A N ASN 377.A O no hydrogen 3.094 N/A TYR 382.A N PHE 378.A O no hydrogen 2.950 N/A TYR 382.A OH GLU 326.A OE1 no hydrogen 2.651 N/A GLY 383.A N VAL 380.A O no hydrogen 3.188 N/A MET 384.A N GLY 379.A O no hydrogen 2.787 N/A ARG 388.A N SER 385.A OG no hydrogen 3.134 N/A ARG 388.A NE GLU 392.A OE1 no hydrogen 2.517 N/A ARG 388.A NH2 GLU 392.A OE1 no hydrogen 3.021 N/A LEU 389.A N SER 385.A O no hydrogen 2.865 N/A SER 390.A N ALA 386.A O no hydrogen 2.832 N/A SER 390.A OG ALA 386.A O no hydrogen 3.420 N/A SER 390.A OG HIS 387.A O no hydrogen 2.719 N/A GLN 391.A N HIS 387.A O no hydrogen 3.099 N/A GLU 392.A N ARG 388.A O no hydrogen 2.832 N/A LEU 393.A N LEU 389.A O no hydrogen 2.985 N/A ALA 394.A N GLN 391.A O no hydrogen 3.295 N/A ILE 395.A N SER 390.A O no hydrogen 3.130 N/A ALA 400.A N PRO 396.A O no hydrogen 3.031 N/A GLN 401.A N TYR 397.A O no hydrogen 2.872 N/A ALA 402.A N GLU 398.A O no hydrogen 2.974 N/A PHE 403.A N GLU 399.A O no hydrogen 3.026 N/A ILE 404.A N ALA 400.A O no hydrogen 3.068 N/A GLU 405.A N GLN 401.A O no hydrogen 2.951 N/A ARG 406.A N ALA 402.A O no hydrogen 2.878 N/A TYR 407.A N PHE 403.A O no hydrogen 2.830 N/A PHE 408.A N ILE 404.A O no hydrogen 3.304 N/A GLN 409.A N GLU 405.A O no hydrogen 2.921 N/A SER 410.A N ARG 406.A O no hydrogen 2.929 N/A SER 410.A OG ARG 406.A O no hydrogen 2.675 N/A PHE 411.A N PHE 408.A O no hydrogen 3.154 N/A LYS 413.A N ASP 336.A OD1 no hydrogen 2.827 N/A LYS 413.A NZ GLU 337.A OE1 no hydrogen 3.426 N/A LYS 413.A NZ GLU 337.A OE2 no hydrogen 3.532 N/A VAL 414.A N PHE 411.A O no hydrogen 2.945 N/A TRP 417.A N LYS 413.A O no hydrogen 3.059 N/A LEU 418.A N VAL 414.A O no hydrogen 2.853 N/A GLU 419.A N ARG 415.A O no hydrogen 3.066 N/A LYS 420.A N ALA 416.A O no hydrogen 3.003 N/A THR 421.A N TRP 417.A O no hydrogen 2.861 N/A THR 421.A OG1 TRP 417.A O no hydrogen 2.728 N/A LEU 422.A N LEU 418.A O no hydrogen 2.925 N/A GLU 423.A N GLU 419.A O no hydrogen 3.007 N/A GLU 424.A N LYS 420.A O no hydrogen 3.075 N/A GLY 425.A N THR 421.A O no hydrogen 2.999 N/A ARG 426.A N LEU 422.A O no hydrogen 2.854 N/A ARG 427.A N GLU 423.A O no hydrogen 2.980 N/A ARG 427.A NE GLU 423.A OE2 no hydrogen 3.015 N/A ARG 427.A NH2 GLU 423.A OE1 no hydrogen 3.274 N/A ARG 428.A N GLU 424.A O no hydrogen 2.830 N/A GLY 429.A N GLY 425.A O no hydrogen 2.846 N/A VAL 431.A N ARG 439.A O no hydrogen 2.977 N/A THR 433.A N ARG 437.A O no hydrogen 2.823 N/A THR 433.A OG1 ASP 470.A OD2 no hydrogen 2.647 N/A LEU 434.A N THR 467.A OG1 no hydrogen 2.926 N/A PHE 435.A N THR 433.A OG1 no hydrogen 3.282 N/A GLY 436.A N THR 433.A O no hydrogen 2.913 N/A ARG 437.A N THR 433.A OG1 no hydrogen 3.046 N/A ARG 437.A NE ASP 470.A OD1 no hydrogen 2.730 N/A ARG 437.A NH1 GLU 145.A OE2 no hydrogen 2.898 N/A ARG 437.A NH2 GLU 145.A OE2 no hydrogen 2.804 N/A ARG 437.A NH2 ASP 470.A OD1 no hydrogen 2.755 N/A ARG 438.A NH1 GLU 134.A OE2 no hydrogen 2.957 N/A ARG 438.A NH2 GLU 134.A OE1 no hydrogen 2.876 N/A ARG 439.A N VAL 431.A O no hydrogen 2.970 N/A VAL 441.A N GLY 429.A O no hydrogen 2.980 N/A LEU 444.A N VAL 441.A O no hydrogen 3.261 N/A GLU 445.A N PRO 442.A O no hydrogen 3.216 N/A ALA 446.A N ASP 443.A O no hydrogen 2.933 N/A ARG 452.A N VAL 448.A O no hydrogen 2.959 N/A ARG 452.A NH1 ALA 446.A O no hydrogen 2.940 N/A GLU 453.A N LYS 449.A O no hydrogen 2.831 N/A ALA 454.A N SER 450.A O no hydrogen 3.058 N/A ALA 455.A N VAL 451.A O no hydrogen 2.994 N/A GLU 456.A N ARG 452.A O no hydrogen 2.803 N/A ARG 457.A N GLU 453.A O no hydrogen 2.967 N/A MET 458.A N ALA 454.A O no hydrogen 2.991 N/A ALA 459.A N ALA 455.A O no hydrogen 2.805 N/A PHE 460.A N GLU 456.A O no hydrogen 2.938 N/A ASN 461.A N ARG 457.A O no hydrogen 3.260 N/A MET 462.A N MET 458.A O no hydrogen 3.143 N/A VAL 464.A N ASN 461.A O no hydrogen 3.010 N/A GLN 465.A N ASN 461.A O no hydrogen 2.940 N/A GLY 466.A N MET 462.A O no hydrogen 2.740 N/A THR 467.A N PRO 463.A O no hydrogen 2.954 N/A THR 467.A OG1 PRO 463.A O no hydrogen 2.643 N/A ALA 468.A N VAL 464.A O no hydrogen 3.040 N/A ALA 469.A N GLN 465.A O no hydrogen 2.947 N/A ASP 470.A N GLY 466.A O no hydrogen 2.884 N/A LEU 471.A N THR 467.A O no hydrogen 2.948 N/A MET 472.A N ALA 468.A O no hydrogen 3.038 N/A LYS 473.A N ALA 469.A O no hydrogen 2.941 N/A LYS 473.A NZ GLU 145.A OE1 no hydrogen 3.335 N/A LYS 473.A NZ GLU 145.A OE2 no hydrogen 2.786 N/A LYS 473.A NZ GLY 283.A O no hydrogen 2.800 N/A LEU 474.A N ASP 470.A O no hydrogen 2.990 N/A ALA 475.A N LEU 471.A O no hydrogen 2.918 N/A MET 476.A N MET 472.A O no hydrogen 2.987 N/A VAL 477.A N LYS 473.A O no hydrogen 3.098 N/A LYS 478.A N LEU 474.A O no hydrogen 3.036 N/A LYS 478.A NZ VAL 521.A O no hydrogen 2.811 N/A LEU 479.A N ALA 475.A O no hydrogen 2.843 N/A PHE 480.A N MET 476.A O no hydrogen 3.015 N/A LEU 483.A N LEU 479.A O no hydrogen 3.038 N/A GLU 484.A N PHE 480.A O no hydrogen 2.964 N/A GLU 485.A N PRO 481.A O no hydrogen 3.105 N/A MET 486.A N ARG 482.A O no hydrogen 3.231 N/A MET 486.A N LEU 483.A O no hydrogen 3.040 N/A GLY 487.A N GLU 484.A O no hydrogen 3.139 N/A ALA 488.A N LEU 483.A O no hydrogen 2.958 N/A ARG 489.A N GLU 501.A O no hydrogen 2.865 N/A ARG 489.A NH1 GLU 501.A OE1 no hydrogen 2.877 N/A LEU 491.A N VAL 499.A O no hydrogen 2.899 N/A LEU 492.A N VAL 499.A O no hydrogen 3.069 N/A VAL 494.A N GLU 497.A O no hydrogen 2.737 N/A HIS 495.A N GLN 493.A OE1 no hydrogen 2.857 N/A ASP 496.A N VAL 494.A O no hydrogen 2.878 N/A LEU 498.A N LEU 320.A O no hydrogen 2.904 N/A VAL 499.A N LEU 492.A O no hydrogen 2.920 N/A LEU 500.A N VAL 318.A O no hydrogen 2.806 N/A GLU 501.A N ARG 489.A O no hydrogen 2.927 N/A ALA 502.A N LEU 316.A O no hydrogen 2.892 N/A LYS 504.A N GLY 314.A O no hydrogen 3.004 N/A LYS 504.A NZ TRP 315.A O no hydrogen 3.041 N/A LYS 504.A NZ GLU 536.A OE2 no hydrogen 2.744 N/A GLU 505.A N GLU 505.A OE1 no hydrogen 2.984 N/A ARG 506.A N PRO 503.A O no hydrogen 2.866 N/A ARG 506.A NH1 MET 486.A O no hydrogen 3.051 N/A ALA 507.A N LYS 504.A O no hydrogen 3.454 N/A VAL 510.A N ARG 506.A O no hydrogen 2.877 N/A ALA 511.A N ALA 507.A O no hydrogen 2.870 N/A ARG 512.A N GLU 508.A O no hydrogen 3.054 N/A LEU 513.A N ALA 509.A O no hydrogen 3.006 N/A ALA 514.A N VAL 510.A O no hydrogen 2.883 N/A LYS 515.A N ALA 511.A O no hydrogen 2.983 N/A LYS 515.A NZ GLU 519.A OE2 no hydrogen 2.694 N/A GLU 516.A N ARG 512.A O no hydrogen 3.123 N/A VAL 517.A N LEU 513.A O no hydrogen 2.867 N/A MET 518.A N ALA 514.A O no hydrogen 3.011 N/A GLU 519.A N LYS 515.A O no hydrogen 2.865 N/A GLY 520.A N GLU 516.A O no hydrogen 2.982 N/A ALA 525.A N HIS 332.A ND1 no hydrogen 2.984 N/A VAL 530.A N GLU 519.A OE2 no hydrogen 2.846 N/A GLU 531.A N ASP 321.A O no hydrogen 2.904 N/A GLY 533.A N ALA 319.A O no hydrogen 2.924 N/A GLY 535.A N LEU 317.A O no hydrogen 2.926 N/A TRP 538.A N PHE 309.A O no hydrogen 2.883 N/A TRP 538.A NE1 GLU 497.A OE2 no hydrogen 2.882 N/A SER 540.A N ASP 537.A OD1 no hydrogen 2.863 N/A SER 540.A OG ASP 537.A OD1 no hydrogen 3.302 N/A SER 540.A OG ASP 537.A OD2 no hydrogen 3.001 N/A ALA 541.A N ASP 537.A O no hydrogen 3.008 N/A LYS 542.A N LEU 539.A O no hydrogen 3.157 N/A LYS 542.A NZ ASP 321.A OD2 no hydrogen 2.758 N/A LYS 542.A NZ GLU 497.A OE1 no hydrogen 3.257 N/A