Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 2epk_X.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ALA 1.A N GLY 24.A O no hydrogen 2.688 N/A THR 2.A N ILE 26.A O no hydrogen 2.948 N/A LEU 4.A N VAL 28.A O no hydrogen 2.988 N/A SER 7.A N GLN 10.A OE1 no hydrogen 2.982 N/A LYS 9.A NZ ALA 150.A O no hydrogen 2.817 N/A LYS 9.A NZ ASP 153.A OD1 no hydrogen 2.814 N/A GLN 10.A N SER 7.A OG no hydrogen 3.063 N/A GLN 10.A NE2 TYR 51.A OH no hydrogen 2.911 N/A GLU 11.A N SER 7.A O no hydrogen 2.951 N/A LYS 12.A N SER 8.A O no hydrogen 3.076 N/A ALA 13.A N LYS 9.A O no hydrogen 3.303 N/A LEU 14.A N GLN 10.A O no hydrogen 2.969 N/A VAL 15.A N GLU 11.A O no hydrogen 3.105 N/A ARG 16.A N LYS 12.A O no hydrogen 3.158 N/A ARG 16.A NH1 ASP 151.A OD2 no hydrogen 2.544 N/A LEU 17.A N ALA 13.A O no hydrogen 2.903 N/A ASP 18.A N VAL 15.A O no hydrogen 3.370 N/A TYR 20.A N LEU 17.A O no hydrogen 2.871 N/A TYR 20.A OH GLU 106.A OE1 no hydrogen 2.621 N/A LEU 21.A N LEU 17.A O no hydrogen 3.146 N/A ASN 22.A N SER 65.A OG no hydrogen 2.999 N/A ALA 27.A N GLY 45.A O no hydrogen 2.786 N/A VAL 28.A N THR 2.A O no hydrogen 2.910 N/A SER 29.A N TYR 47.A O no hydrogen 2.847 N/A LEU 30.A N LEU 4.A O no hydrogen 3.017 N/A VAL 31.A N VAL 49.A O no hydrogen 2.859 N/A ASP 33.A N TYR 51.A O no hydrogen 3.096 N/A ALA 35.A N ASP 33.A OD2 no hydrogen 2.729 N/A ILE 38.A N GLU 79.A O no hydrogen 3.029 N/A LYS 39.A N SER 50.A O no hydrogen 2.925 N/A VAL 40.A N ILE 77.A O no hydrogen 2.862 N/A GLU 41.A N GLN 48.A O no hydrogen 2.964 N/A GLY 42.A N VAL 75.A O no hydrogen 3.032 N/A ARG 43.A N TYR 46.A O no hydrogen 3.093 N/A GLN 44.A N ASP 73.A OD1 no hydrogen 3.202 N/A GLN 44.A N ASP 73.A OD2 no hydrogen 2.674 N/A TYR 46.A N ARG 43.A O no hydrogen 3.177 N/A TYR 47.A N ALA 27.A O no hydrogen 2.913 N/A TYR 47.A OH ASP 73.A O no hydrogen 2.819 N/A GLN 48.A N GLU 41.A O no hydrogen 2.719 N/A VAL 49.A N SER 29.A O no hydrogen 2.797 N/A SER 50.A N LYS 39.A O no hydrogen 2.796 N/A TYR 51.A N VAL 31.A O no hydrogen 3.149 N/A LYS 52.A N SER 37.A O no hydrogen 2.916 N/A GLN 53.A N GLN 56.A OE1 no hydrogen 2.780 N/A GLN 56.A N GLN 53.A O no hydrogen 2.878 N/A GLN 56.A NE2 TYR 373.A OH no hydrogen 3.471 N/A LEU 57.A N PRO 54.A O no hydrogen 3.168 N/A TYR 58.A N HIS 55.A O no hydrogen 3.175 N/A ARG 59.A NE GLU 79.A OE1 no hydrogen 2.865 N/A ARG 59.A NH1 GLU 370.A OE2 no hydrogen 3.024 N/A ARG 59.A NH2 GLU 79.A OE1 no hydrogen 3.533 N/A ARG 59.A NH2 GLU 79.A OE2 no hydrogen 2.948 N/A ARG 59.A NH2 GLU 370.A OE1 no hydrogen 3.345 N/A ARG 59.A NH2 GLU 370.A OE2 no hydrogen 3.356 N/A ALA 60.A N GLN 56.A O no hydrogen 2.923 N/A LEU 61.A N LEU 57.A O no hydrogen 3.001 N/A ALA 62.A N TYR 58.A O no hydrogen 3.143 N/A LEU 63.A N ARG 59.A O no hydrogen 2.857 N/A LEU 64.A N ALA 60.A O no hydrogen 2.980 N/A SER 65.A N LEU 61.A O no hydrogen 2.783 N/A ALA 66.A N ALA 62.A O no hydrogen 2.864 N/A ALA 67.A N LEU 63.A O no hydrogen 2.998 N/A LEU 68.A N LEU 64.A O no hydrogen 3.032 N/A ARG 69.A N SER 65.A O no hydrogen 3.058 N/A SER 70.A N ALA 66.A O no hydrogen 2.971 N/A SER 70.A OG ALA 66.A O no hydrogen 2.840 N/A GLY 71.A N LEU 68.A O no hydrogen 2.882 N/A GLN 72.A N ALA 67.A O no hydrogen 3.078 N/A GLN 72.A NE2 GLU 74.A O no hydrogen 3.486 N/A VAL 75.A N GLY 42.A O no hydrogen 2.763 N/A GLN 76.A NE2 GLU 74.A OE1 no hydrogen 2.762 N/A ILE 77.A N VAL 40.A O no hydrogen 2.772 N/A GLU 79.A N ILE 38.A O no hydrogen 2.854 N/A ALA 81.A N SER 37.A OG no hydrogen 2.899 N/A ALA 82.A N ALA 372.A O no hydrogen 2.906 N/A TYR 83.A OH ASN 333.A OD1 no hydrogen 2.801 N/A ASP 85.A N LYS 342.A O no hydrogen 3.070 N/A LEU 86.A N SER 113.A OG no hydrogen 3.107 N/A ALA 87.A N VAL 344.A O no hydrogen 2.988 N/A TYR 88.A N THR 114.A O no hydrogen 3.172 N/A ASP 90.A N GLY 348.A O no hydrogen 3.382 N/A CYS 91.A N TYR 118.A O no hydrogen 2.878 N/A CYS 91.A SG TYR 137.A OH no hydrogen 3.543 N/A SER 92.A N ASP 90.A OD2 no hydrogen 2.820 N/A SER 92.A OG TYR 118.A O no hydrogen 2.890 N/A ARG 93.A NE ASP 90.A OD1 no hydrogen 2.969 N/A ARG 93.A NH2 ASP 90.A OD1 no hydrogen 2.955 N/A ASN 98.A N GLU 523.A O no hydrogen 2.932 N/A ASN 98.A ND2 GLN 522.A O no hydrogen 3.092 N/A ASN 98.A ND2 ASN 524.A O no hydrogen 3.400 N/A SER 101.A N ASN 98.A OD1 no hydrogen 2.893 N/A SER 101.A OG ASN 98.A OD1 no hydrogen 2.873 N/A SER 101.A OG GLU 523.A O no hydrogen 3.323 N/A ALA 102.A N ASN 98.A O no hydrogen 2.899 N/A LYS 103.A N LEU 99.A O no hydrogen 2.937 N/A LYS 103.A NZ GLU 144.A OE2 no hydrogen 2.803 N/A LYS 104.A N SER 100.A O no hydrogen 3.110 N/A GLU 106.A N LYS 103.A O no hydrogen 3.111 N/A VAL 107.A N LYS 104.A O no hydrogen 2.950 N/A ALA 109.A N ILE 105.A O no hydrogen 2.829 N/A LEU 110.A N GLU 106.A O no hydrogen 3.103 N/A TYR 112.A N LEU 108.A O no hydrogen 3.141 N/A TYR 112.A OH LEU 365.A O no hydrogen 2.672 N/A SER 113.A N LEU 86.A O no hydrogen 2.889 N/A SER 113.A OG ASP 85.A OD1 no hydrogen 3.481 N/A SER 113.A OG LEU 86.A O no hydrogen 3.126 N/A SER 113.A OG THR 114.A OG1 no hydrogen 2.940 N/A THR 114.A N LEU 86.A O no hydrogen 3.275 N/A THR 114.A OG1 SER 113.A OG no hydrogen 2.940 N/A PHE 115.A N SER 154.A O no hydrogen 2.972 N/A GLU 116.A N TYR 88.A O no hydrogen 2.876 N/A TYR 118.A N ALA 89.A O no hydrogen 2.783 N/A TYR 118.A OH GLU 119.A OE2 no hydrogen 2.603 N/A THR 121.A OG1 CYS 91.A O no hydrogen 2.992 N/A GLU 123.A N TYR 137.A O no hydrogen 3.011 N/A ASN 126.A ND2 GLU 125.A OE1 no hydrogen 2.698 N/A GLN 127.A N ILE 124.A O no hydrogen 3.162 N/A PHE 130.A N GLN 127.A O no hydrogen 3.008 N/A TYR 132.A N TYR 129.A O no hydrogen 3.240 N/A ARG 134.A N GLY 131.A O no hydrogen 3.088 N/A ARG 134.A NE ASP 120.A OD2 no hydrogen 2.882 N/A ARG 134.A NH2 SER 92.A O no hydrogen 2.832 N/A ARG 134.A NH2 ASP 120.A OD1 no hydrogen 2.882 N/A ARG 136.A NE GLU 123.A OE2 no hydrogen 3.308 N/A ARG 136.A NH1 PRO 128.A O no hydrogen 3.129 N/A ARG 136.A NH1 PHE 130.A O no hydrogen 2.960 N/A TYR 137.A N THR 121.A O no hydrogen 2.754 N/A TYR 137.A OH LEU 97.A O no hydrogen 2.523 N/A THR 138.A N GLU 141.A OE1 no hydrogen 3.200 N/A GLU 141.A N THR 138.A OG1 no hydrogen 2.961 N/A LEU 142.A N THR 138.A O no hydrogen 3.038 N/A GLN 143.A N VAL 139.A O no hydrogen 2.930 N/A GLU 144.A N ALA 140.A O no hydrogen 2.928 N/A ILE 145.A N GLU 141.A O no hydrogen 3.056 N/A GLU 146.A N LEU 142.A O no hydrogen 2.830 N/A ASP 147.A N GLN 143.A O no hydrogen 2.756 N/A TYR 148.A N GLU 144.A O no hydrogen 3.051 N/A TYR 148.A OH GLU 106.A OE2 no hydrogen 2.501 N/A ALA 149.A N ILE 145.A O no hydrogen 3.135 N/A ALA 150.A N GLU 146.A O no hydrogen 2.981 N/A ASP 151.A N ASP 147.A O no hydrogen 3.096 N/A PHE 152.A N ALA 149.A O no hydrogen 2.859 N/A ASP 153.A N ALA 150.A O no hydrogen 2.845 N/A SER 154.A N SER 113.A O no hydrogen 2.823 N/A VAL 156.A N PHE 115.A O no hydrogen 3.059 N/A CYS 158.A N LEU 117.A O no hydrogen 2.874 N/A CYS 158.A SG GLU 116.A OE1 no hydrogen 3.211 N/A CYS 158.A SG VAL 156.A O no hydrogen 3.933 N/A ILE 159.A N ASN 211.A O no hydrogen 2.835 N/A GLN 160.A NE2 TYR 118.A OH no hydrogen 2.743 N/A THR 161.A OG1 ILE 212.A O no hydrogen 2.846 N/A HIS 164.A N ASP 184.A OD2 no hydrogen 2.886 N/A HIS 164.A NE2 ASP 214.A OD1 no hydrogen 2.675 N/A HIS 164.A NE2 ASP 214.A OD2 no hydrogen 3.062 N/A LEU 165.A N ASP 184.A O no hydrogen 3.369 N/A PHE 168.A N LEU 165.A O no hydrogen 3.070 N/A VAL 169.A N LEU 165.A O no hydrogen 3.173 N/A LYS 170.A NZ ALA 167.A O no hydrogen 2.693 N/A TRP 171.A N PHE 168.A O no hydrogen 3.391 N/A LYS 174.A NZ GLU 175.A OE2 no hydrogen 2.502 N/A VAL 176.A N ILE 173.A O no hydrogen 2.897 N/A GLN 177.A N ILE 173.A O no hydrogen 2.853 N/A GLN 177.A NE2 VAL 169.A O no hydrogen 2.768 N/A GLN 177.A NE2 TRP 171.A O no hydrogen 2.697 N/A GLU 178.A N LYS 174.A O no hydrogen 2.872 N/A LEU 179.A N VAL 176.A O no hydrogen 3.022 N/A ARG 180.A N GLN 177.A O no hydrogen 3.258 N/A ARG 180.A NH1 GLN 177.A OE1 no hydrogen 2.910 N/A ARG 180.A NH2 GLU 183.A O no hydrogen 2.935 N/A ASP 181.A N ILE 185.A O no hydrogen 2.790 N/A ILE 185.A N VAL 182.A O no hydrogen 2.928 N/A LEU 186.A N LEU 162.A O no hydrogen 2.732 N/A LEU 187.A N LEU 179.A O no hydrogen 2.842 N/A GLY 189.A N TYR 194.A OH no hydrogen 3.098 N/A GLU 190.A N LEU 187.A O no hydrogen 3.425 N/A LYS 192.A N GLU 190.A OE2 no hydrogen 3.166 N/A VAL 193.A N GLU 190.A O no hydrogen 2.893 N/A TYR 194.A N GLU 190.A O no hydrogen 3.206 N/A TYR 194.A OH HIS 239.A ND1 no hydrogen 2.722 N/A ASP 195.A N GLU 191.A O no hydrogen 2.904 N/A LEU 196.A N LYS 192.A O no hydrogen 3.017 N/A ILE 197.A N VAL 193.A O no hydrogen 2.958 N/A GLU 198.A N TYR 194.A O no hydrogen 3.009 N/A GLY 199.A N ASP 195.A O no hydrogen 3.001 N/A GLN 201.A N GLU 198.A O no hydrogen 2.938 N/A THR 202.A N GLY 199.A O no hydrogen 3.087 N/A THR 202.A OG1 GLU 123.A O no hydrogen 2.594 N/A THR 202.A OG1 GLY 199.A O no hydrogen 3.407 N/A HIS 204.A N THR 202.A O no hydrogen 3.220 N/A HIS 206.A N GLU 146.A OE1 no hydrogen 2.710 N/A THR 207.A N GLU 146.A OE2 no hydrogen 2.699 N/A THR 207.A OG1 PHE 155.A O no hydrogen 2.801 N/A THR 207.A OG1 LYS 209.A O no hydrogen 3.368 N/A ARG 208.A NE TYR 250.A O no hydrogen 3.032 N/A ARG 208.A NH1 LEU 205.A O no hydrogen 2.917 N/A ARG 208.A NH1 THR 207.A O no hydrogen 2.854 N/A ARG 208.A NH2 ALA 203.A O no hydrogen 2.887 N/A LYS 209.A N THR 207.A OG1 no hydrogen 3.157 N/A LYS 209.A NZ GLU 343.A OE1 no hydrogen 2.909 N/A LYS 209.A NZ GLU 343.A OE2 no hydrogen 3.277 N/A ILE 210.A N ASN 253.A O no hydrogen 3.162 N/A ASN 211.A N PRO 157.A O no hydrogen 2.925 N/A ILE 212.A N GLN 255.A O no hydrogen 2.983 N/A GLY 213.A N ASN 211.A OD1 no hydrogen 2.893 N/A VAL 219.A N ALA 216.A O no hydrogen 3.306 N/A GLY 220.A N ASP 181.A OD1 no hydrogen 2.764 N/A LEU 221.A N LEU 218.A O no hydrogen 2.833 N/A GLY 222.A N ASP 181.A OD2 no hydrogen 2.990 N/A ARG 223.A N ASP 181.A O no hydrogen 2.909 N/A ARG 223.A NH1 GLU 178.A O no hydrogen 3.265 N/A ARG 223.A NH1 ARG 180.A O no hydrogen 2.815 N/A TYR 224.A N ASP 181.A OD2 no hydrogen 3.091 N/A ILE 226.A N GLY 222.A O no hydrogen 3.266 N/A LYS 227.A N ARG 223.A O no hydrogen 2.982 N/A HIS 228.A N TYR 224.A O no hydrogen 2.818 N/A GLY 229.A N LEU 225.A O no hydrogen 2.817 N/A LEU 236.A N ASN 232.A O no hydrogen 3.256 N/A CYS 237.A SG SER 234.A O no hydrogen 3.263 N/A GLN 238.A N LEU 235.A O no hydrogen 2.947 N/A HIS 239.A N LEU 236.A O no hydrogen 2.898 N/A HIS 239.A ND1 TYR 194.A OH no hydrogen 2.722 N/A HIS 239.A NE2 THR 161.A O no hydrogen 2.595 N/A GLU 241.A N CYS 237.A O no hydrogen 2.984 N/A ARG 242.A N GLN 238.A O no hydrogen 3.227 N/A ARG 242.A NH1 GLU 191.A OE2 no hydrogen 3.142 N/A ARG 242.A NH2 GLU 191.A OE1 no hydrogen 2.945 N/A VAL 243.A N HIS 239.A O no hydrogen 2.987 N/A LEU 244.A N LEU 240.A O no hydrogen 2.840 N/A ASP 245.A N GLU 241.A O no hydrogen 2.937 N/A ILE 246.A N ARG 242.A O no hydrogen 3.127 N/A ALA 247.A N VAL 243.A O no hydrogen 2.869 N/A ASP 248.A N LEU 244.A O no hydrogen 2.807 N/A LYS 249.A N ASP 245.A O no hydrogen 3.058 N/A LYS 249.A NZ GLU 198.A OE2 no hydrogen 2.708 N/A TYR 250.A N ILE 246.A O no hydrogen 3.309 N/A TYR 250.A N ALA 247.A O no hydrogen 3.151 N/A TYR 250.A OH GLU 198.A OE2 no hydrogen 2.567 N/A GLY 251.A N ASP 248.A O no hydrogen 3.017 N/A PHE 252.A N ALA 247.A O no hydrogen 2.958 N/A ASN 253.A N ARG 208.A O no hydrogen 2.801 N/A GLN 255.A N ILE 210.A O no hydrogen 2.862 N/A GLN 255.A NE2 GLU 343.A OE1 no hydrogen 2.786 N/A TRP 256.A N GLY 213.A O no hydrogen 3.198 N/A SER 257.A N VAL 280.A O no hydrogen 3.070 N/A SER 257.A OG VAL 280.A O no hydrogen 3.517 N/A SER 257.A OG HIS 299.A NE2 no hydrogen 2.696 N/A PHE 260.A N ASP 258.A O no hydrogen 3.059 N/A LEU 262.A N PHE 259.A O no hydrogen 2.887 N/A THR 266.A N PRO 263.A O no hydrogen 3.008 N/A ARG 267.A N PRO 263.A O no hydrogen 3.105 N/A VAL 268.A N GLU 264.A O no hydrogen 3.302 N/A TYR 269.A N GLU 265.A O no hydrogen 3.194 N/A TYR 269.A OH GLU 241.A OE1 no hydrogen 2.403 N/A LEU 270.A N THR 266.A O no hydrogen 2.942 N/A ASP 271.A N ARG 267.A O no hydrogen 3.015 N/A ARG 272.A N VAL 268.A O no hydrogen 3.161 N/A ARG 272.A N TYR 269.A O no hydrogen 3.125 N/A LEU 273.A N TYR 269.A O no hydrogen 3.051 N/A LYS 274.A N LEU 270.A O no hydrogen 2.893 N/A LYS 274.A NZ ASP 271.A OD2 no hydrogen 3.192 N/A LYS 274.A NZ ILE 302.A O no hydrogen 2.881 N/A ARG 276.A N LEU 273.A O no hydrogen 2.949 N/A ARG 276.A NH2 ASP 245.A OD1 no hydrogen 3.172 N/A ARG 276.A NH2 ASP 248.A OD2 no hydrogen 3.013 N/A THR 278.A N CYS 254.A O no hydrogen 3.041 N/A THR 278.A OG1 ASP 305.A OD1 no hydrogen 3.470 N/A THR 278.A OG1 ASP 305.A OD2 no hydrogen 2.765 N/A LEU 279.A N ASP 305.A O no hydrogen 3.278 N/A TYR 281.A N ALA 307.A O no hydrogen 2.865 N/A TYR 281.A OH ASP 283.A OD2 no hydrogen 2.680 N/A TRP 282.A NE1 ASP 258.A OD1 no hydrogen 2.865 N/A ASP 283.A N ALA 309.A O no hydrogen 3.059 N/A TYR 285.A N ASP 283.A OD1 no hydrogen 3.171 N/A GLN 286.A NE2 ASP 283.A OD2 no hydrogen 2.757 N/A GLU 289.A N GLU 331.A OE2 no hydrogen 3.072 N/A LYS 291.A N SER 288.A O no hydrogen 3.086 N/A LYS 291.A NZ ASP 287.A OD2 no hydrogen 3.052 N/A TYR 292.A OH GLN 286.A O no hydrogen 2.787 N/A ASN 293.A N GLU 289.A O no hydrogen 2.857 N/A ARG 294.A N GLU 290.A O no hydrogen 2.990 N/A ASN 295.A N LYS 291.A O no hydrogen 3.414 N/A ASN 295.A ND2 TYR 281.A OH no hydrogen 2.782 N/A PHE 296.A N TYR 292.A O no hydrogen 2.894 N/A GLN 297.A N ASN 293.A O no hydrogen 2.874 N/A ASN 298.A N ARG 294.A O no hydrogen 3.126 N/A HIS 299.A N ASN 295.A O no hydrogen 2.943 N/A HIS 299.A ND1 ASN 295.A O no hydrogen 2.734 N/A HIS 299.A NE2 SER 257.A OG no hydrogen 2.696 N/A HIS 300.A N PHE 296.A O no hydrogen 2.839 N/A HIS 300.A ND1 SER 303.A O no hydrogen 3.139 N/A HIS 300.A NE2 ASN 339.A O no hydrogen 3.316 N/A LYS 301.A N GLN 297.A O no hydrogen 3.258 N/A LYS 301.A N ASN 298.A O no hydrogen 3.322 N/A ILE 302.A N HIS 299.A O no hydrogen 3.024 N/A SER 303.A N HIS 299.A O no hydrogen 3.110 N/A ASP 305.A N SER 303.A OG no hydrogen 2.958 N/A ALA 307.A N LEU 279.A O no hydrogen 2.910 N/A PHE 308.A N GLU 343.A O no hydrogen 3.019 N/A ALA 309.A N TYR 281.A O no hydrogen 2.888 N/A GLY 310.A N ILE 345.A O no hydrogen 2.820 N/A ALA 312.A N THR 347.A O no hydrogen 2.916 N/A TRP 313.A N SER 325.A OG no hydrogen 2.989 N/A TRP 313.A NE1 TYR 284.A O no hydrogen 3.012 N/A LYS 314.A NZ GLY 348.A O no hydrogen 3.248 N/A LYS 314.A NZ TRP 349.A O no hydrogen 3.094 N/A PHE 318.A N ASN 416.A OD1 no hydrogen 2.748 N/A HIS 321.A N TRP 313.A O no hydrogen 2.857 N/A ASN 322.A N ASP 398.A OD1 no hydrogen 3.038 N/A ASN 322.A ND2 SER 360.A O no hydrogen 2.965 N/A ASN 322.A ND2 ASP 398.A OD1 no hydrogen 2.997 N/A HIS 323.A N ASP 398.A OD2 no hydrogen 2.802 N/A HIS 323.A ND1 ASP 398.A OD2 no hydrogen 2.710 N/A PHE 324.A N HIS 321.A ND1 no hydrogen 3.035 N/A SER 325.A N HIS 321.A O no hydrogen 2.920 N/A SER 325.A OG HIS 321.A O no hydrogen 2.752 N/A ARG 326.A N ASN 322.A O no hydrogen 2.760 N/A LEU 327.A N HIS 323.A O no hydrogen 3.207 N/A VAL 328.A N PHE 324.A O no hydrogen 3.240 N/A ALA 329.A N SER 325.A O no hydrogen 3.051 N/A ILE 330.A N ARG 326.A O no hydrogen 3.042 N/A ALA 332.A N VAL 328.A O no hydrogen 2.765 N/A ASN 333.A N ALA 329.A O no hydrogen 2.802 N/A ASN 333.A ND2 ASN 375.A OD1 no hydrogen 2.873 N/A LYS 334.A N ILE 330.A O no hydrogen 3.463 N/A LYS 334.A NZ GLU 331.A OE1 no hydrogen 3.220 N/A ALA 335.A N GLU 331.A O no hydrogen 3.287 N/A CYS 336.A N ALA 332.A O no hydrogen 2.823 N/A CYS 336.A SG ALA 332.A O no hydrogen 3.445 N/A ARG 337.A N ASN 333.A O no hydrogen 3.023 N/A ARG 337.A NE ASN 333.A OD1 no hydrogen 3.060 N/A ARG 337.A NH2 LEU 371.A O no hydrogen 2.810 N/A LYS 338.A N LYS 334.A O no hydrogen 3.040 N/A ASN 339.A N ALA 335.A O no hydrogen 3.058 N/A ASN 339.A ND2 ALA 335.A O no hydrogen 2.724 N/A GLN 340.A N ARG 337.A O no hydrogen 3.265 N/A VAL 341.A N CYS 336.A O no hydrogen 3.040 N/A VAL 344.A N ASP 85.A O no hydrogen 3.065 N/A ILE 345.A N PHE 308.A O no hydrogen 2.767 N/A VAL 346.A N ALA 87.A O no hydrogen 2.794 N/A THR 347.A N GLY 310.A O no hydrogen 2.976 N/A THR 347.A OG1 GLY 310.A O no hydrogen 2.786 N/A TRP 349.A NE1 TYR 284.A OH no hydrogen 3.025 N/A GLY 350.A N ASP 90.A OD1 no hydrogen 2.740 N/A GLY 354.A N GLY 350.A O no hydrogen 3.122 N/A THR 356.A OG1 LYS 314.A O no hydrogen 3.368 N/A THR 356.A OG1 GLY 317.A O no hydrogen 2.518 N/A SER 357.A OG GLU 523.A OE1 no hydrogen 3.428 N/A SER 357.A OG GLU 523.A OE2 no hydrogen 2.610 N/A GLN 358.A N GLU 523.A OE1 no hydrogen 2.945 N/A GLN 358.A NE2 ALA 95.A O no hydrogen 3.517 N/A GLN 358.A NE2 ASN 524.A OD1 no hydrogen 2.927 N/A PHE 359.A N SER 357.A OG no hydrogen 2.993 N/A SER 360.A N SER 357.A O no hydrogen 3.109 N/A SER 360.A OG SER 357.A O no hydrogen 2.703 N/A ALA 364.A N ASN 322.A OD1 no hydrogen 3.134 N/A LEU 365.A N VAL 361.A O no hydrogen 2.980 N/A GLN 366.A N LEU 362.A O no hydrogen 2.930 N/A GLN 366.A NE2 SER 387.A OG no hydrogen 2.719 N/A ILE 367.A N PRO 363.A O no hydrogen 2.881 N/A TRP 368.A N ALA 364.A O no hydrogen 3.087 N/A ALA 369.A N LEU 365.A O no hydrogen 3.195 N/A GLU 370.A N GLN 366.A O no hydrogen 2.849 N/A LEU 371.A N ILE 367.A O no hydrogen 2.987 N/A ALA 372.A N TRP 368.A O no hydrogen 2.841 N/A TYR 373.A N ALA 369.A O no hydrogen 2.966 N/A TYR 373.A OH GLY 111.A O no hydrogen 2.688 N/A ARG 374.A N GLU 370.A O no hydrogen 2.725 N/A ARG 374.A NE ASP 376.A OD1 no hydrogen 3.123 N/A ARG 374.A NH2 ASP 376.A OD1 no hydrogen 3.243 N/A ASN 375.A N GLU 370.A O no hydrogen 3.224 N/A ASN 375.A N LEU 371.A O no hydrogen 3.109 N/A LYS 378.A N ASP 376.A OD1 no hydrogen 2.940 N/A VAL 380.A N LEU 377.A O no hydrogen 3.167 N/A GLU 382.A N GLU 382.A OE1 no hydrogen 2.639 N/A HIS 383.A N LYS 379.A O no hydrogen 3.160 N/A HIS 383.A ND1 GLU 370.A OE1 no hydrogen 2.978 N/A HIS 383.A ND1 GLU 370.A OE2 no hydrogen 3.027 N/A PHE 384.A N VAL 380.A O no hydrogen 3.000 N/A LEU 385.A N SER 381.A O no hydrogen 3.161 N/A VAL 386.A N HIS 383.A O no hydrogen 2.895 N/A SER 387.A N HIS 383.A O no hydrogen 3.096 N/A SER 387.A OG HIS 383.A O no hydrogen 3.439 N/A THR 388.A N PHE 384.A O no hydrogen 2.890 N/A THR 388.A OG1 PHE 384.A O no hydrogen 2.896 N/A GLY 389.A N LEU 385.A O no hydrogen 2.906 N/A LEU 390.A N THR 388.A OG1 no hydrogen 3.110 N/A ASP 394.A N ASP 391.A OD2 no hydrogen 2.915 N/A PHE 395.A N ASP 391.A O no hydrogen 2.949 N/A LYS 396.A NZ GLN 448.A OE1 no hydrogen 2.903 N/A ILE 397.A N PHE 395.A O no hydrogen 2.962 N/A LEU 399.A N LYS 396.A O no hydrogen 2.876 N/A ASN 401.A N ASP 398.A O no hydrogen 2.949 N/A ASN 401.A ND2 THR 319.A O no hydrogen 2.894 N/A ASN 401.A ND2 PRO 320.A O no hydrogen 2.987 N/A LEU 402.A N LEU 399.A O no hydrogen 2.815 N/A LEU 406.A N LEU 403.A O no hydrogen 3.352 N/A ASN 409.A ND2 ASP 287.A OD1 no hydrogen 2.804 N/A ASN 414.A ND2 ILE 316.A O no hydrogen 3.266 N/A ASN 414.A ND2 ALA 585.A O no hydrogen 2.901 N/A ASN 416.A ND2 ILE 316.A O no hydrogen 3.157 N/A ASN 416.A ND2 ASN 401.A OD1 no hydrogen 2.780 N/A ARG 417.A N ASN 414.A O no hydrogen 2.971 N/A ARG 417.A NE GLU 355.A OE1 no hydrogen 2.757 N/A ARG 417.A NH1 ASN 352.A OD1 no hydrogen 2.850 N/A ARG 417.A NH2 ASN 352.A OD1 no hydrogen 2.671 N/A ARG 417.A NH2 GLU 355.A OE2 no hydrogen 3.524 N/A TYR 418.A N ASN 414.A O no hydrogen 3.480 N/A VAL 419.A N PRO 415.A O no hydrogen 3.033 N/A TYR 421.A N ARG 417.A O no hydrogen 2.963 N/A TYR 421.A OH GLU 355.A OE2 no hydrogen 2.640 N/A GLN 422.A N TYR 418.A O no hydrogen 3.123 N/A GLN 422.A NE2 GLU 430.A OE1 no hydrogen 3.535 N/A CYS 426.A N ASP 423.A OD2 no hydrogen 2.925 N/A LEU 429.A N GLN 422.A OE1 no hydrogen 3.060 N/A GLU 430.A N PRO 427.A O no hydrogen 3.120 N/A HIS 432.A N LEU 429.A O no hydrogen 2.861 N/A HIS 432.A ND1 THR 581.A O no hydrogen 2.787 N/A ILE 433.A N GLU 430.A O no hydrogen 3.239 N/A ARG 434.A N ASP 438.A OD2 no hydrogen 2.910 N/A LYS 437.A NZ ASP 405.A OD2 no hydrogen 2.651 N/A ASP 438.A N ARG 434.A O no hydrogen 2.929 N/A LYS 439.A NZ GLU 436.A OE1 no hydrogen 3.289 N/A GLN 440.A N GLU 436.A O no hydrogen 3.051 N/A HIS 441.A N LYS 437.A O no hydrogen 3.136 N/A HIS 441.A NE2 LEU 399.A O no hydrogen 2.715 N/A PHE 442.A N ASP 438.A O no hydrogen 2.976 N/A ALA 443.A N LYS 439.A O no hydrogen 2.874 N/A SER 444.A N GLN 440.A O no hydrogen 3.008 N/A SER 445.A N HIS 441.A O no hydrogen 2.842 N/A SER 445.A OG HIS 441.A O no hydrogen 2.871 N/A ALA 446.A N PHE 442.A O no hydrogen 2.945 N/A GLN 447.A N ALA 443.A O no hydrogen 3.371 N/A GLN 448.A N SER 444.A O no hydrogen 3.105 N/A GLN 448.A NE2 SER 444.A O no hydrogen 3.539 N/A GLN 448.A NE2 SER 444.A OG no hydrogen 3.053 N/A LEU 449.A N SER 445.A O no hydrogen 2.926 N/A GLY 450.A N ALA 446.A O no hydrogen 2.998 N/A GLU 451.A N GLN 447.A O no hydrogen 3.270 N/A ILE 452.A N GLN 448.A O no hydrogen 3.164 N/A SER 453.A N LEU 449.A O no hydrogen 2.851 N/A SER 453.A OG GLY 450.A O no hydrogen 2.810 N/A LYS 454.A N GLU 451.A O no hydrogen 3.090 N/A LYS 454.A NZ GLU 451.A OE1 no hydrogen 3.479 N/A LYS 454.A NZ GLU 451.A OE2 no hydrogen 3.561 N/A ARG 455.A N ILE 452.A O no hydrogen 3.047 N/A ARG 455.A NE ASP 394.A OD2 no hydrogen 2.908 N/A ARG 455.A NH2 ASP 394.A OD1 no hydrogen 3.260 N/A ARG 455.A NH2 ASP 394.A OD2 no hydrogen 3.506 N/A ALA 456.A N SER 453.A O no hydrogen 3.350 N/A TYR 459.A N ALA 456.A O no hydrogen 3.078 N/A ALA 460.A N GLY 457.A O no hydrogen 3.120 N/A TYR 461.A OH GLU 523.A OE2 no hydrogen 2.752 N/A ILE 462.A N TYR 459.A O no hydrogen 3.064 N/A GLU 464.A N ALA 460.A O no hydrogen 2.887 N/A THR 465.A N TYR 461.A O no hydrogen 3.101 N/A THR 465.A OG1 TYR 461.A O no hydrogen 2.994 N/A GLN 466.A N ILE 462.A O no hydrogen 3.242 N/A GLN 466.A NE2 THR 319.A OG1 no hydrogen 2.745 N/A ALA 467.A N PHE 463.A O no hydrogen 2.813 N/A GLN 468.A N GLU 464.A O no hydrogen 3.032 N/A GLN 468.A NE2 GLU 464.A OE1 no hydrogen 3.021 N/A LEU 469.A N THR 465.A O no hydrogen 3.054 N/A ASN 470.A N GLN 466.A O no hydrogen 3.054 N/A ASN 470.A ND2 GLN 466.A O no hydrogen 2.826 N/A ALA 471.A N ALA 467.A O no hydrogen 3.166 N/A LEU 472.A N GLN 468.A O no hydrogen 2.929 N/A LEU 473.A N LEU 469.A O no hydrogen 2.795 N/A ALA 474.A N ASN 470.A O no hydrogen 3.104 N/A LEU 475.A N ALA 471.A O no hydrogen 3.295 N/A LYS 476.A N LEU 472.A O no hydrogen 2.904 N/A LYS 476.A NZ VAL 419.A O no hydrogen 2.825 N/A LYS 476.A NZ LEU 420.A O no hydrogen 3.135 N/A LYS 476.A NZ GLN 422.A O no hydrogen 2.630 N/A ILE 477.A N LEU 473.A O no hydrogen 2.987 N/A SER 478.A N ALA 474.A O no hydrogen 3.042 N/A ILE 479.A N LEU 475.A O no hydrogen 2.880 N/A THR 480.A N LYS 476.A O no hydrogen 2.851 N/A THR 480.A OG1 LYS 476.A O no hydrogen 2.815 N/A SER 481.A N ILE 477.A O no hydrogen 2.931 N/A SER 481.A OG GLU 430.A OE2 no hydrogen 2.719 N/A SER 481.A OG ILE 477.A O no hydrogen 3.446 N/A GLY 482.A N SER 478.A O no hydrogen 2.915 N/A ILE 483.A N ILE 479.A O no hydrogen 2.908 N/A GLN 484.A N THR 480.A O no hydrogen 3.445 N/A LYS 485.A N SER 481.A O no hydrogen 3.117 N/A ALA 486.A N GLY 482.A O no hydrogen 2.921 N/A TYR 487.A N ILE 483.A O no hydrogen 2.907 N/A TYR 487.A OH GLU 565.A OE2 no hydrogen 2.465 N/A ARG 488.A N GLN 484.A O no hydrogen 2.876 N/A ASN 489.A N LYS 485.A O no hydrogen 3.044 N/A GLY 490.A N TYR 487.A O no hydrogen 3.083 N/A ASP 491.A N ALA 486.A O no hydrogen 2.827 N/A LYS 492.A N GLY 490.A O no hydrogen 2.949 N/A HIS 494.A N ASP 491.A OD1 no hydrogen 3.036 N/A LEU 495.A N ASP 491.A O no hydrogen 3.126 N/A SER 496.A N LYS 492.A O no hydrogen 2.812 N/A SER 496.A OG LYS 492.A O no hydrogen 2.740 N/A ALA 497.A N GLU 493.A O no hydrogen 3.054 N/A LEU 498.A N HIS 494.A O no hydrogen 2.999 N/A ALA 499.A N LEU 495.A O no hydrogen 2.940 N/A GLU 500.A N SER 496.A O no hydrogen 2.877 N/A LYS 501.A N ALA 497.A O no hydrogen 2.981 N/A PHE 503.A N LEU 498.A O no hydrogen 2.963 N/A GLN 505.A N LYS 501.A O no hydrogen 3.231 N/A LEU 506.A N ASP 502.A O no hydrogen 2.865 N/A TYR 507.A N PHE 503.A O no hydrogen 2.848 N/A GLN 508.A N PRO 504.A O no hydrogen 3.094 N/A GLN 508.A NE2 ASP 511.A OD1 no hydrogen 2.902 N/A GLN 508.A NE2 ASP 511.A OD2 no hydrogen 3.442 N/A GLU 510.A N TYR 507.A O no hydrogen 2.952 N/A ASP 511.A N GLN 508.A O no hydrogen 2.895 N/A SER 513.A N VAL 509.A O no hydrogen 2.907 N/A ASP 514.A N GLU 510.A O no hydrogen 3.041 N/A GLN 515.A N ASP 511.A O no hydrogen 2.942 N/A GLN 515.A NE2 TYR 461.A O no hydrogen 3.064 N/A PHE 516.A N PHE 512.A O no hydrogen 2.642 N/A SER 517.A N SER 513.A O no hydrogen 2.970 N/A SER 517.A OG SER 513.A O no hydrogen 2.900 N/A ARG 518.A N ASP 514.A O no hydrogen 3.269 N/A ARG 518.A NH1 GLN 515.A OE1 no hydrogen 2.943 N/A GLN 519.A N GLN 515.A O no hydrogen 3.138 N/A TRP 520.A N PHE 516.A O no hydrogen 2.845 N/A TRP 520.A NE1 LYS 525.A O no hydrogen 2.868 N/A GLN 521.A N SER 517.A O no hydrogen 2.980 N/A GLN 522.A N ARG 518.A O no hydrogen 3.001 N/A GLN 522.A N GLN 519.A O no hydrogen 3.136 N/A GLU 523.A N GLN 519.A O no hydrogen 3.269 N/A GLU 523.A N TRP 520.A O no hydrogen 3.072 N/A ASN 524.A N TRP 520.A O no hydrogen 2.749 N/A LYS 525.A N VAL 96.A O no hydrogen 2.668 N/A LYS 525.A NZ GLY 135.A O no hydrogen 2.968 N/A LYS 525.A NZ GLU 141.A OE1 no hydrogen 2.819 N/A LEU 529.A N ILE 526.A O no hydrogen 3.182 N/A THR 531.A N GLY 528.A O no hydrogen 3.276 N/A THR 531.A N ASP 530.A OD2 no hydrogen 3.034 N/A ASP 533.A N LEU 529.A O no hydrogen 2.932 N/A ILE 534.A N ASP 530.A O no hydrogen 2.947 N/A ARG 535.A N THR 531.A O no hydrogen 3.055 N/A ARG 535.A NH1 ASN 352.A O no hydrogen 2.794 N/A ARG 535.A NH1 GLU 355.A OE2 no hydrogen 2.897 N/A ARG 535.A NH2 ASN 352.A O no hydrogen 3.494 N/A PHE 536.A N ILE 532.A O no hydrogen 2.836 N/A GLY 537.A N ASP 533.A O no hydrogen 2.907 N/A GLY 538.A N ILE 534.A O no hydrogen 2.900 N/A LEU 539.A N ARG 535.A O no hydrogen 3.005 N/A LEU 540.A N PHE 536.A O no hydrogen 2.903 N/A LYS 541.A N GLY 537.A O no hydrogen 3.130 N/A ARG 542.A N GLY 538.A O no hydrogen 2.984 N/A ARG 542.A NE ASP 423.A OD1 no hydrogen 2.864 N/A ARG 542.A NH2 ASP 423.A OD1 no hydrogen 3.467 N/A ARG 542.A NH2 ASP 423.A OD2 no hydrogen 2.839 N/A ILE 543.A N LEU 539.A O no hydrogen 2.905 N/A LYS 544.A N LEU 540.A O no hydrogen 2.939 N/A ARG 545.A N LYS 541.A O no hydrogen 2.855 N/A ALA 546.A N ARG 542.A O no hydrogen 3.003 N/A GLN 547.A N ILE 543.A O no hydrogen 3.098 N/A GLU 548.A N LYS 544.A O no hydrogen 2.987 N/A ARG 549.A N ARG 545.A O no hydrogen 2.864 N/A ARG 549.A NE GLU 563.A OE1 no hydrogen 2.927 N/A ARG 549.A NE GLU 563.A OE2 no hydrogen 3.373 N/A ARG 549.A NH2 GLU 562.A OE1 no hydrogen 2.959 N/A ARG 549.A NH2 GLU 563.A OE2 no hydrogen 2.666 N/A LEU 550.A N ALA 546.A O no hydrogen 3.106 N/A GLU 551.A N GLN 547.A O no hydrogen 2.913 N/A GLN 552.A N GLU 548.A O no hydrogen 3.083 N/A PHE 553.A N ARG 549.A O no hydrogen 3.178 N/A ILE 554.A N LEU 550.A O no hydrogen 2.801 N/A SER 555.A N GLU 551.A O no hydrogen 2.828 N/A SER 555.A OG GLU 551.A O no hydrogen 3.380 N/A SER 555.A OG GLN 552.A O no hydrogen 3.123 N/A GLY 556.A N PHE 553.A O no hydrogen 3.228 N/A GLN 557.A N SER 555.A OG no hydrogen 3.239 N/A GLN 557.A NE2 SER 555.A OG no hydrogen 3.016 N/A ILE 558.A N GLN 552.A O no hydrogen 3.237 N/A CYS 560.A SG GLU 562.A OE1 no hydrogen 3.634 N/A VAL 561.A N TYR 487.A OH no hydrogen 2.987 N/A GLU 562.A N GLU 562.A OE1 no hydrogen 2.731 N/A GLU 563.A N GLU 563.A OE2 no hydrogen 2.786 N/A LEU 564.A N VAL 561.A O no hydrogen 2.899 N/A GLU 565.A N GLU 562.A O no hydrogen 2.979 N/A GLN 566.A N GLU 563.A O no hydrogen 3.485 N/A GLN 566.A NE2 GLU 562.A O no hydrogen 2.834 N/A PHE 571.A N HIS 432.A NE2 no hydrogen 3.004 N/A ASN 572.A ND2 THR 584.A O no hydrogen 2.858 N/A PHE 574.A N ASN 572.A OD1 no hydrogen 3.418 N/A TYR 575.A OH SER 411.A O no hydrogen 2.546 N/A LYS 576.A N ASP 573.A O no hydrogen 3.078 N/A GLN 578.A N TYR 575.A O no hydrogen 3.219 N/A GLY 579.A N LYS 576.A O no hydrogen 3.080 N/A LEU 580.A N TYR 575.A O no hydrogen 3.348 N/A THR 583.A N TYR 418.A OH no hydrogen 3.193 N/A THR 583.A OG1 ASN 572.A OD1 no hydrogen 2.620 N/A THR 584.A OG1 GLY 412.A O no hydrogen 2.653 N/A ALA 585.A N ASN 414.A OD1 no hydrogen 2.969 N/A TRP 588.A N ASN 352.A OD1 no hydrogen 2.976 N/A LEU 590.A N GLN 587.A O no hydrogen 3.075 N/A ILE 591.A N GLN 587.A O no hydrogen 3.232 N/A ILE 591.A N TRP 588.A O no hydrogen 3.011 N/A ALA 592.A N TRP 588.A O no hydrogen 2.991 N/A SER 595.A N THR 593.A OG1 no hydrogen 2.737 N/A SER 595.A OG THR 593.A OG1 no hydrogen 3.140 N/A