Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3vsn_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLN 5.A N ILE 1.A O no hydrogen 3.260 N/A ASN 6.A N GLN 2.A O no hydrogen 2.835 N/A PHE 7.A N GLU 3.A O no hydrogen 2.966 N/A GLU 8.A N LEU 4.A O no hydrogen 2.960 N/A ARG 9.A N GLN 5.A O no hydrogen 2.996 N/A TRP 10.A N ASN 6.A O no hydrogen 2.971 N/A PHE 11.A N PHE 7.A O no hydrogen 2.800 N/A LYS 12.A N GLU 8.A O no hydrogen 3.105 N/A LYS 12.A NZ ASN 129.A OD1 no hydrogen 2.813 N/A ASN 13.A N ARG 9.A O no hydrogen 2.894 N/A ASN 14.A N TRP 10.A O no hydrogen 3.016 N/A ASN 14.A N PHE 11.A O no hydrogen 3.329 N/A SER 18.A N ASN 14.A O no hydrogen 2.763 N/A SER 18.A OG TYR 237.A OH no hydrogen 2.865 N/A PHE 19.A N LEU 15.A O no hydrogen 2.787 N/A SER 20.A N SER 16.A O no hydrogen 3.049 N/A SER 20.A OG TYR 17.A O no hydrogen 2.587 N/A GLN 21.A N SER 18.A O no hydrogen 2.973 N/A GLN 21.A NE2 ASN 284.A O no hydrogen 3.122 N/A LYS 22.A N PHE 19.A O no hydrogen 3.133 N/A LYS 22.A NZ GLU 119.A OE1 no hydrogen 2.926 N/A LYS 25.A NZ PHE 19.A O no hydrogen 3.216 N/A LYS 25.A NZ LYS 22.A O no hydrogen 2.701 N/A ARG 31.A NH1 ASP 40.A O no hydrogen 3.058 N/A ASN 34.A N VAL 38.A O no hydrogen 2.867 N/A ASN 34.A ND2 ASP 40.A OD1 no hydrogen 2.983 N/A ASN 36.A N ASN 34.A OD1 no hydrogen 2.726 N/A THR 37.A N ASN 34.A OD1 no hydrogen 2.903 N/A THR 37.A OG1 PHE 39.A O no hydrogen 2.695 N/A PHE 39.A N THR 37.A O no hydrogen 2.749 N/A ASP 40.A N ASN 32.A O no hydrogen 2.971 N/A SER 43.A N ASP 50.A OD2 no hydrogen 2.763 N/A TRP 45.A NE1 ASN 36.A O no hydrogen 2.848 N/A THR 46.A N SER 43.A O no hydrogen 3.375 N/A THR 46.A OG1 SER 43.A O no hydrogen 3.542 N/A SER 47.A N SER 43.A O no hydrogen 2.828 N/A ASP 50.A N SER 47.A OG no hydrogen 3.340 N/A PHE 51.A N SER 47.A O no hydrogen 3.141 N/A GLY 52.A N VAL 48.A O no hydrogen 2.987 N/A THR 53.A N PRO 49.A O no hydrogen 3.036 N/A THR 53.A OG1 PRO 49.A O no hydrogen 3.158 N/A VAL 54.A N ASP 50.A O no hydrogen 2.923 N/A CYS 55.A N PHE 51.A O no hydrogen 2.895 N/A CYS 55.A SG PHE 51.A O no hydrogen 3.388 N/A HIS 56.A N GLY 52.A O no hydrogen 2.909 N/A THR 57.A N THR 53.A O no hydrogen 2.883 N/A THR 57.A OG1 THR 53.A O no hydrogen 2.610 N/A LEU 58.A N VAL 54.A O no hydrogen 2.939 N/A ILE 59.A N CYS 55.A O no hydrogen 3.132 N/A GLY 60.A N HIS 56.A O no hydrogen 2.870 N/A TYR 61.A N THR 57.A O no hydrogen 2.948 N/A TYR 61.A OH ARG 31.A O no hydrogen 2.784 N/A CYS 62.A N LEU 58.A O no hydrogen 2.971 N/A CYS 62.A SG LEU 58.A O no hydrogen 3.419 N/A VAL 63.A N ILE 59.A O no hydrogen 3.116 N/A ARG 64.A N GLY 60.A O no hydrogen 3.149 N/A ARG 64.A NE ASP 70.A OD1 no hydrogen 3.183 N/A ARG 64.A NE ASP 70.A OD2 no hydrogen 2.846 N/A ARG 64.A NH1 PRO 29.A O no hydrogen 2.723 N/A ARG 64.A NH2 ASP 70.A OD1 no hydrogen 3.026 N/A TYR 65.A N TYR 61.A O no hydrogen 2.839 N/A ASN 66.A N CYS 62.A O no hydrogen 3.004 N/A ASN 67.A N ARG 64.A O no hydrogen 3.289 N/A ASP 70.A N ASN 67.A O no hydrogen 2.932 N/A LEU 72.A N ASP 70.A OD1 no hydrogen 2.789 N/A TYR 73.A N ASP 70.A O no hydrogen 3.140 N/A GLN 74.A N TYR 65.A O no hydrogen 2.949 N/A ASN 75.A N LEU 72.A O no hydrogen 3.106 N/A LEU 78.A N ASN 75.A OD1 no hydrogen 3.143 N/A ALA 79.A N ASN 75.A O no hydrogen 3.003 N/A TYR 80.A N PRO 76.A O no hydrogen 2.991 N/A ASN 81.A N GLU 77.A O no hydrogen 2.979 N/A LEU 82.A N LEU 78.A O no hydrogen 2.855 N/A ILE 83.A N ALA 79.A O no hydrogen 3.088 N/A ASN 84.A N TYR 80.A O no hydrogen 2.853 N/A ASN 84.A ND2 ASP 35.A OD1 no hydrogen 2.942 N/A GLY 85.A N ASN 81.A O no hydrogen 2.864 N/A LEU 86.A N LEU 82.A O no hydrogen 3.046 N/A ARG 87.A N ILE 83.A O no hydrogen 2.929 N/A ARG 87.A NE GLU 136.A OE1 no hydrogen 3.374 N/A ARG 87.A NE GLU 136.A OE2 no hydrogen 2.817 N/A ARG 87.A NH2 GLU 136.A OE1 no hydrogen 2.744 N/A ILE 88.A N ASN 84.A O no hydrogen 2.949 N/A ILE 89.A N GLY 85.A O no hydrogen 3.155 N/A CYS 90.A N LEU 86.A O no hydrogen 2.971 N/A CYS 90.A SG LEU 86.A O no hydrogen 3.360 N/A SER 91.A N ARG 87.A O no hydrogen 3.047 N/A SER 91.A OG ILE 88.A O no hydrogen 2.758 N/A LYS 92.A N ILE 89.A O no hydrogen 3.011 N/A LEU 93.A N ILE 89.A O no hydrogen 3.265 N/A GLN 100.A N MET 156.A O no hydrogen 2.768 N/A ALA 102.A N VAL 107.A O no hydrogen 3.243 N/A TRP 104.A NE1 PRO 44.A O no hydrogen 2.727 N/A ASP 109.A N PRO 106.A O no hydrogen 3.017 N/A TYR 111.A OH GLU 24.A OE1 no hydrogen 2.908 N/A TYR 111.A OH GLU 24.A OE2 no hydrogen 3.299 N/A PHE 113.A N TRP 110.A O no hydrogen 3.067 N/A THR 114.A N TRP 110.A O no hydrogen 3.270 N/A THR 114.A N TYR 111.A O no hydrogen 3.211 N/A THR 114.A OG1 SER 155.A OG no hydrogen 2.734 N/A ILE 115.A N TYR 111.A O no hydrogen 2.806 N/A MET 117.A N HIS 112.A O no hydrogen 2.836 N/A VAL 120.A N THR 116.A O no hydrogen 3.207 N/A PHE 121.A N MET 117.A O no hydrogen 3.228 N/A MET 122.A N PRO 118.A O no hydrogen 3.120 N/A ASN 123.A N GLU 119.A O no hydrogen 2.902 N/A ILE 124.A N VAL 120.A O no hydrogen 2.975 N/A THR 125.A N PHE 121.A O no hydrogen 3.059 N/A THR 125.A OG1 PHE 121.A O no hydrogen 2.805 N/A THR 125.A OG1 THR 141.A OG1 no hydrogen 2.870 N/A ILE 126.A N MET 122.A O no hydrogen 3.086 N/A VAL 127.A N ASN 123.A O no hydrogen 3.073 N/A LEU 128.A N ILE 124.A O no hydrogen 3.177 N/A ASN 129.A N ILE 126.A O no hydrogen 2.976 N/A ASN 129.A ND2 GLU 8.A OE1 no hydrogen 3.121 N/A THR 131.A N LEU 128.A O no hydrogen 2.953 N/A THR 131.A OG1 LEU 128.A O no hydrogen 2.690 N/A HIS 133.A N THR 131.A OG1 no hydrogen 3.108 N/A TYR 134.A N THR 131.A O no hydrogen 3.458 N/A TYR 134.A OH GLU 8.A OE2 no hydrogen 2.637 N/A ALA 137.A N HIS 133.A O no hydrogen 2.957 N/A ALA 138.A N TYR 134.A O no hydrogen 2.801 N/A SER 139.A N ASP 135.A O no hydrogen 3.030 N/A SER 139.A OG ASP 135.A O no hydrogen 2.916 N/A LEU 140.A N GLU 136.A O no hydrogen 2.904 N/A THR 141.A N ALA 137.A O no hydrogen 2.923 N/A THR 141.A OG1 THR 125.A OG1 no hydrogen 2.870 N/A THR 141.A OG1 ALA 137.A O no hydrogen 2.946 N/A ARG 142.A N ALA 138.A O no hydrogen 2.874 N/A ARG 142.A NH1 SER 139.A OG no hydrogen 3.167 N/A ARG 142.A NH2 LEU 178.A O no hydrogen 3.058 N/A TYR 143.A N SER 139.A O no hydrogen 2.992 N/A TYR 143.A OH ASP 95.A OD1 no hydrogen 2.460 N/A TRP 144.A N LEU 140.A O no hydrogen 2.836 N/A LEU 145.A N THR 141.A O no hydrogen 2.985 N/A GLY 146.A N ARG 142.A O no hydrogen 3.211 N/A LEU 147.A N TYR 143.A O no hydrogen 3.194 N/A TYR 148.A N TRP 144.A O no hydrogen 2.878 N/A TYR 148.A OH PRO 94.A O no hydrogen 2.781 N/A LEU 149.A N LEU 145.A O no hydrogen 2.698 N/A VAL 153.A N THR 151.A OG1 no hydrogen 3.202 N/A ASN 154.A ND2 THR 151.A OG1 no hydrogen 2.612 N/A SER 155.A N TRP 158.A O no hydrogen 3.031 N/A SER 155.A OG THR 114.A OG1 no hydrogen 2.734 N/A SER 155.A OG TYR 148.A O no hydrogen 2.708 N/A TRP 158.A N SER 155.A O no hydrogen 3.036 N/A ARG 160.A N VAL 153.A O no hydrogen 2.697 N/A SER 165.A N THR 161.A O no hydrogen 3.124 N/A SER 165.A OG ALA 162.A O no hydrogen 2.924 N/A MET 166.A N ALA 162.A O no hydrogen 3.109 N/A ARG 167.A N GLY 163.A O no hydrogen 3.263 N/A ARG 167.A NE GLU 119.A OE2 no hydrogen 2.705 N/A ARG 167.A NH1 GLU 24.A OE1 no hydrogen 2.876 N/A ARG 167.A NH2 GLU 119.A OE1 no hydrogen 2.827 N/A ARG 167.A NH2 GLU 119.A OE2 no hydrogen 3.266 N/A MET 168.A N ASN 164.A O no hydrogen 3.075 N/A GLY 169.A N SER 165.A O no hydrogen 3.029 N/A VAL 170.A N ARG 167.A O no hydrogen 3.441 N/A TYR 172.A N MET 168.A O no hydrogen 3.110 N/A TYR 172.A OH GLU 189.A OE1 no hydrogen 2.477 N/A THR 173.A N GLY 169.A O no hydrogen 2.934 N/A THR 173.A OG1 GLY 169.A O no hydrogen 2.801 N/A TYR 174.A N VAL 170.A O no hydrogen 3.250 N/A TYR 174.A OH GLU 8.A OE2 no hydrogen 2.639 N/A SER 175.A N PRO 171.A O no hydrogen 2.880 N/A SER 175.A OG TYR 172.A O no hydrogen 2.604 N/A GLN 176.A N TYR 172.A O no hydrogen 3.013 N/A GLN 176.A NE2 GLU 189.A OE2 no hydrogen 2.822 N/A MET 177.A N THR 173.A O no hydrogen 2.997 N/A LEU 178.A N TYR 174.A O no hydrogen 2.940 N/A ARG 179.A N SER 175.A O no hydrogen 3.179 N/A ARG 179.A NH1 SER 175.A OG no hydrogen 3.007 N/A ARG 179.A NH1 GLN 176.A OE1 no hydrogen 2.829 N/A ARG 179.A NH2 ARG 142.A O no hydrogen 2.957 N/A GLY 180.A N MET 177.A O no hydrogen 3.000 N/A TYR 181.A N GLN 176.A O no hydrogen 3.117 N/A LEU 183.A N GLU 3.A OE1 no hydrogen 2.713 N/A GLN 185.A N SER 182.A OG no hydrogen 3.323 N/A ILE 186.A N SER 182.A O no hydrogen 3.064 N/A ARG 187.A N LEU 183.A O no hydrogen 2.931 N/A ARG 187.A NH2 GLU 245.A OE2.B no hydrogen 3.169 N/A GLN 188.A N GLN 185.A O no hydrogen 3.107 N/A GLU 189.A N ILE 186.A O no hydrogen 3.083 N/A GLN 193.A N GLU 189.A O no hydrogen 2.999 N/A GLU 194.A N GLN 190.A O no hydrogen 3.078 N/A ILE 195.A N GLY 191.A O no hydrogen 3.185 N/A LEU 196.A N ILE 192.A O no hydrogen 2.822 N/A ASN 197.A N GLN 193.A O no hydrogen 3.198 N/A THR 198.A N GLU 194.A O no hydrogen 3.038 N/A THR 198.A OG1 GLU 194.A O no hydrogen 3.106 N/A ILE 199.A N ILE 195.A O no hydrogen 2.838 N/A ALA 200.A N ASN 197.A O no hydrogen 3.317 N/A VAL 204.A N LEU 210.A O no hydrogen 2.794 N/A THR 205.A OG1 GLN 206.A OE1 no hydrogen 2.891 N/A GLY 209.A N ILE 217.A O no hydrogen 2.823 N/A HIS 211.A N ILE 215.A O no hydrogen 3.061 N/A SER 214.A N HIS 211.A O no hydrogen 2.824 N/A SER 214.A OG GLY 251.A O no hydrogen 3.021 N/A ILE 217.A N GLY 209.A O no hydrogen 2.947 N/A ASP 218.A N VAL 222.A O no hydrogen 2.831 N/A HIS 219.A N ASP 218.A OD1 no hydrogen 2.892 N/A HIS 219.A ND1 GLU 323.A OE2 no hydrogen 2.538 N/A ILE 220.A N ASN 208.A OD1 no hydrogen 2.653 N/A ASP 221.A N HIS 219.A O no hydrogen 2.875 N/A VAL 222.A N ASP 218.A O no hydrogen 2.899 N/A ARG 223.A NE SER 298.A O no hydrogen 2.818 N/A ARG 223.A NH2 SER 298.A O no hydrogen 2.919 N/A ALA 224.A N TYR 216.A O no hydrogen 3.113 N/A TYR 225.A N VAL 270.A O no hydrogen 3.054 N/A TYR 225.A OH ALA 255.A O no hydrogen 2.704 N/A ILE 229.A N TYR 225.A O no hydrogen 2.834 N/A ASN 230.A N GLY 226.A O no hydrogen 3.006 N/A ASN 230.A ND2 GLY 226.A O no hydrogen 3.050 N/A SER 231.A OG.A GLY 163.A O no hydrogen 3.524 N/A SER 231.A OG.B TYR 227.A O no hydrogen 2.940 N/A TYR 232.A OH PHE 285.A O no hydrogen 3.313 N/A THR 234.A N SER 231.A O no hydrogen 3.006 N/A THR 234.A OG1 SER 231.A O no hydrogen 2.723 N/A PHE 235.A N TYR 232.A O no hydrogen 3.009 N/A TYR 237.A N THR 234.A O no hydrogen 3.004 N/A TYR 237.A OH SER 18.A OG no hydrogen 2.865 N/A TYR 238.A N THR 234.A O no hydrogen 3.239 N/A TYR 238.A OH MET 166.A O no hydrogen 2.630 N/A THR 239.A N PHE 235.A O no hydrogen 2.987 N/A THR 239.A OG1 PHE 235.A O no hydrogen 3.199 N/A TYR 240.A N ALA 236.A O no hydrogen 3.036 N/A TYR 241.A N TYR 237.A O no hydrogen 2.751 N/A TYR 241.A OH VAL 170.A O no hydrogen 2.833 N/A PHE 242.A N TYR 238.A O no hydrogen 2.820 N/A GLY 243.A N THR 239.A O no hydrogen 2.969 N/A GLU 245.A N GLU 245.A OE1.B no hydrogen 2.739 N/A ASN 248.A N ALA 200.A O no hydrogen 2.992 N/A ASN 248.A ND2 PHE 201.A O no hydrogen 2.972 N/A THR 249.A N ILE 247.A O no hydrogen 2.749 N/A THR 249.A OG1 ILE 247.A O no hydrogen 3.480 N/A GLY 251.A N ASN 248.A OD1 no hydrogen 3.142 N/A LEU 252.A N ASN 248.A O no hydrogen 3.012 N/A THR 253.A N THR 249.A O no hydrogen 2.881 N/A THR 253.A OG1 THR 249.A O no hydrogen 2.845 N/A ARG 254.A N VAL 250.A O no hydrogen 2.995 N/A ARG 254.A NH1 ASN 258.A OD1 no hydrogen 2.920 N/A ARG 254.A NH2 GLU 257.A OE1 no hydrogen 2.957 N/A ARG 254.A NH2 ASN 258.A OD1 no hydrogen 3.077 N/A ALA 255.A N GLY 251.A O no hydrogen 2.973 N/A ILE 256.A N LEU 252.A O no hydrogen 3.009 N/A GLU 257.A N THR 253.A O no hydrogen 2.893 N/A ASN 258.A N ARG 254.A O no hydrogen 2.855 N/A ASN 258.A ND2 SER 214.A O no hydrogen 2.974 N/A VAL 259.A N ILE 256.A O no hydrogen 3.211 N/A GLY 260.A N ILE 256.A O no hydrogen 2.811 N/A SER 261.A OG VAL 265.A O no hydrogen 2.775 N/A GLY 264.A N SER 261.A O no hydrogen 2.925 N/A VAL 266.A N LEU 277.A O no hydrogen 2.796 N/A VAL 267.A N TYR 309.A OH no hydrogen 2.920 N/A VAL 270.A N VAL 267.A O no hydrogen 3.368 N/A MET 271.A N PRO 268.A O no hydrogen 2.955 N/A SER 272.A OG ASN 274.A OD1 no hydrogen 2.655 N/A ARG 273.A NE ASP 325.A OD2 no hydrogen 2.732 N/A ARG 273.A NH1 GLU 323.A OE1 no hydrogen 2.923 N/A GLY 275.A N SER 272.A O no hydrogen 3.143 N/A THR 276.A OG1 TYR 278.A O no hydrogen 3.256 N/A LEU 277.A N ASN 350.A OD1 no hydrogen 2.968 N/A TYR 278.A N THR 276.A OG1 no hydrogen 3.262 N/A SER 279.A N GLY 264.A O no hydrogen 2.917 N/A VAL 281.A N SER 279.A OG no hydrogen 3.321 N/A ILE 282.A N SER 279.A OG no hydrogen 3.216 N/A ASN 284.A N VAL 281.A O no hydrogen 2.793 N/A ASN 284.A ND2 SER 20.A O no hydrogen 2.862 N/A PHE 285.A N ILE 282.A O no hydrogen 3.206 N/A TYR 288.A OH ILE 282.A O no hydrogen 2.687 N/A ALA 291.A N LEU 304.A O no hydrogen 2.979 N/A HIS 293.A N THR 302.A O no hydrogen 2.720 N/A SER 294.A OG ASP 296.A OD1 no hydrogen 3.053 N/A ALA 295.A N VAL 300.A O no hydrogen 2.791 N/A TYR 297.A N ASP 213.A OD2 no hydrogen 2.755 N/A TYR 297.A OH SER 621.A O no hydrogen 2.527 N/A SER 298.A N ASP 213.A OD2 no hydrogen 2.599 N/A SER 298.A OG ASP 213.A OD1 no hydrogen 2.650 N/A SER 298.A OG ASP 213.A OD2 no hydrogen 3.362 N/A LYS 299.A N ALA 295.A O no hydrogen 2.829 N/A LYS 299.A NZ ASP 296.A O no hydrogen 2.745 N/A LYS 299.A NZ THR 390.A O no hydrogen 2.880 N/A LYS 299.A NZ GLU 581.A OE2 no hydrogen 2.711 N/A VAL 300.A N ALA 295.A O no hydrogen 3.193 N/A LEU 301.A N VAL 312.A O no hydrogen 3.050 N/A THR 302.A N HIS 293.A O no hydrogen 2.958 N/A THR 302.A OG1 ASN 258.A O no hydrogen 2.651 N/A THR 302.A OG1 SER 311.A OG no hydrogen 2.763 N/A LYS 303.A N GLY 310.A O no hydrogen 2.807 N/A LYS 303.A NZ THR 397.A O no hydrogen 2.747 N/A LYS 303.A NZ ASP 423.A OD1 no hydrogen 2.695 N/A LEU 304.A N ALA 291.A O no hydrogen 2.966 N/A SER 305.A N TYR 308.A O no hydrogen 2.915 N/A SER 305.A OG THR 307.A OG1 no hydrogen 3.278 N/A SER 305.A OG TYR 308.A O no hydrogen 3.527 N/A THR 307.A N SER 305.A OG no hydrogen 3.077 N/A THR 307.A OG1 SER 305.A OG no hydrogen 3.278 N/A THR 307.A OG1 HIS 424.A ND1 no hydrogen 2.825 N/A TYR 308.A N SER 305.A OG no hydrogen 3.020 N/A TYR 308.A OH TYR 422.A O no hydrogen 2.734 N/A TYR 309.A N TRP 342.A O no hydrogen 3.030 N/A TYR 309.A OH VAL 259.A O no hydrogen 2.509 N/A GLY 310.A N LYS 303.A O no hydrogen 2.929 N/A SER 311.A OG LEU 301.A O no hydrogen 3.139 N/A SER 311.A OG THR 302.A OG1 no hydrogen 2.763 N/A VAL 312.A N LEU 301.A O no hydrogen 2.875 N/A GLY 314.A N LYS 299.A O no hydrogen 2.709 N/A VAL 315.A N THR 390.A OG1 no hydrogen 2.984 N/A ASN 317.A N GLY 388.A O no hydrogen 3.247 N/A ARG 318.A N THR 316.A OG1 no hydrogen 3.211 N/A ARG 318.A NH1 GLU 581.A OE1 no hydrogen 2.828 N/A ARG 318.A NH1 GLU 581.A OE2 no hydrogen 3.340 N/A ARG 318.A NH2 TYR 297.A O no hydrogen 2.940 N/A ARG 318.A NH2 GLU 581.A OE2 no hydrogen 2.676 N/A LEU 319.A N THR 316.A O no hydrogen 3.145 N/A ALA 320.A N ASP 221.A O no hydrogen 2.823 N/A TYR 321.A N PHE 383.A O no hydrogen 2.836 N/A TYR 321.A OH GLU 409.A OE1 no hydrogen 2.562 N/A TYR 322.A OH GLN 331.A OE1 no hydrogen 3.156 N/A SER 324.A N GLN 381.A O no hydrogen 2.917 N/A SER 324.A OG ILE 373.A O no hydrogen 2.968 N/A ASP 325.A N ASN 328.A O no hydrogen 2.918 N/A THR 327.A N ASP 325.A OD1 no hydrogen 2.837 N/A ASN 328.A N ASP 325.A OD1 no hydrogen 2.665 N/A ILE 330.A N GLN 331.A OE1 no hydrogen 2.967 N/A GLN 331.A N TYR 322.A OH no hydrogen 3.073 N/A GLN 331.A NE2 ASN 274.A O no hydrogen 2.961 N/A TRP 335.A N GLN 331.A O no hydrogen 3.132 N/A THR 336.A N ALA 332.A O no hydrogen 3.024 N/A THR 336.A N PRO 333.A O no hydrogen 3.298 N/A THR 336.A OG1 ALA 332.A O no hydrogen 2.800 N/A THR 336.A OG1 PRO 333.A O no hydrogen 3.366 N/A MET 337.A N PRO 333.A O no hydrogen 2.825 N/A ARG 339.A N SER 360.A O no hydrogen 2.755 N/A ARG 339.A NE SER 417.A OG no hydrogen 3.218 N/A ARG 339.A NH1 THR 336.A O no hydrogen 3.317 N/A ARG 339.A NH1 ALA 338.A O no hydrogen 3.074 N/A ARG 339.A NH2 THR 336.A O no hydrogen 3.542 N/A ARG 339.A NH2 SER 417.A OG no hydrogen 3.244 N/A ARG 340.A NE ILE 341.A O no hydrogen 2.689 N/A ARG 340.A NH1 GLU 359.A OE2 no hydrogen 2.911 N/A TRP 342.A N TYR 309.A O no hydrogen 2.886 N/A ASN 343.A ND2 GLY 481.A O no hydrogen 2.928 N/A ARG 344.A N THR 307.A O no hydrogen 2.924 N/A ARG 344.A NE GLU 263.A OE1 no hydrogen 3.037 N/A ARG 344.A NE GLU 263.A OE2 no hydrogen 3.291 N/A ARG 344.A NH1 SER 305.A O no hydrogen 2.886 N/A ARG 344.A NH2 GLU 263.A OE2 no hydrogen 3.005 N/A ARG 345.A N ASN 343.A OD1 no hydrogen 2.882 N/A GLY 346.A N ASN 343.A O no hydrogen 2.840 N/A ARG 347.A N ASN 480.A OD1 no hydrogen 2.778 N/A ASN 350.A ND2 THR 276.A OG1 no hydrogen 2.866 N/A TYR 351.A N ASN 350.A OD1 no hydrogen 2.947 N/A TYR 351.A OH GLU 359.A OE1 no hydrogen 2.619 N/A ASN 352.A N THR 355.A OG1 no hydrogen 2.923 N/A ASN 354.A N ASN 352.A OD1 no hydrogen 2.889 N/A THR 355.A N ASN 352.A O no hydrogen 3.034 N/A THR 355.A OG1 ASN 352.A O no hydrogen 3.529 N/A VAL 356.A N ASN 352.A O no hydrogen 2.884 N/A PHE 358.A N THR 355.A O no hydrogen 3.039 N/A SER 360.A N GLU 359.A OE2 no hydrogen 2.883 N/A SER 360.A OG.A VAL 449.A O no hydrogen 2.787 N/A SER 360.A OG.B ARG 339.A O no hydrogen 3.137 N/A SER 360.A OG.B VAL 449.A O no hydrogen 2.695 N/A SER 360.A OG.B TYR 527.A OH no hydrogen 2.955 N/A GLY 361.A N ILE 448.A O no hydrogen 2.764 N/A ILE 362.A N GLU 359.A O no hydrogen 3.025 N/A LEU 364.A N ARG 446.A O no hydrogen 2.713 N/A GLN 365.A NE2 MET 410.A O no hydrogen 2.957 N/A SER 366.A OG ASN 368.A OD1 no hydrogen 3.207 N/A GLY 369.A N SER 366.A OG no hydrogen 3.280 N/A ILE 370.A N ASN 368.A OD1 no hydrogen 3.067 N/A ARG 372.A NH1 ASN 329.A OD1 no hydrogen 2.921 N/A ILE 373.A N ASN 329.A O no hydrogen 2.787 N/A SER 375.A OG THR 377.A O no hydrogen 3.331 N/A SER 375.A OG SER 379.A O no hydrogen 2.616 N/A GLY 376.A N GLN 381.A OE1 no hydrogen 2.601 N/A THR 377.A N SER 375.A OG no hydrogen 3.398 N/A THR 377.A OG1 SER 375.A OG no hydrogen 3.174 N/A THR 377.A OG1 THR 380.A O no hydrogen 2.799 N/A SER 379.A N THR 377.A OG1 no hydrogen 3.246 N/A GLN 381.A N SER 324.A O no hydrogen 3.056 N/A SER 382.A OG ASP 221.A OD1 no hydrogen 2.923 N/A PHE 383.A N TYR 322.A O no hydrogen 2.893 N/A ARG 384.A NE ASP 221.A OD2 no hydrogen 2.724 N/A ARG 384.A NH1 ASN 317.A O no hydrogen 2.892 N/A ARG 384.A NH2 ASP 221.A OD2 no hydrogen 3.531 N/A ILE 387.A N LYS 406.A O no hydrogen 3.316 N/A GLN 389.A N TYR 404.A O no hydrogen 2.948 N/A THR 390.A OG1 VAL 315.A O no hydrogen 2.721 N/A ALA 391.A N LEU 402.A O no hydrogen 2.834 N/A ALA 393.A N ALA 400.A O no hydrogen 2.994 N/A LYS 394.A N GLN 626.A OE1 no hydrogen 3.063 N/A LYS 394.A NZ SER 294.A OG no hydrogen 2.759 N/A THR 395.A N ALA 398.A O no hydrogen 2.794 N/A THR 395.A OG1 ALA 398.A O no hydrogen 3.530 N/A THR 395.A OG1 GLU 570.A OE1 no hydrogen 2.611 N/A THR 397.A N GLU 570.A OE1 no hydrogen 2.879 N/A THR 397.A OG1 GLU 570.A OE1 no hydrogen 3.267 N/A THR 397.A OG1 GLU 570.A OE2 no hydrogen 2.474 N/A GLY 399.A N PHE 421.A O no hydrogen 3.062 N/A ALA 400.A N ALA 393.A O no hydrogen 2.763 N/A ILE 401.A N THR 419.A O no hydrogen 2.884 N/A LEU 402.A N ALA 391.A O no hydrogen 2.796 N/A VAL 403.A N SER 417.A O no hydrogen 2.845 N/A TYR 404.A N GLN 389.A O no hydrogen 2.826 N/A ALA 405.A N PHE 415.A O no hydrogen 3.175 N/A LYS 406.A N ILE 387.A O no hydrogen 3.014 N/A PHE 407.A N LEU 413.A O no hydrogen 2.794 N/A GLU 409.A N GLU 409.A OE1 no hydrogen 2.814 N/A MET 410.A N PHE 407.A O no hydrogen 3.183 N/A ASN 411.A ND2 GLN 365.A OE1 no hydrogen 2.914 N/A ASN 411.A ND2 SER 439.A OG no hydrogen 2.816 N/A ASN 412.A N ALA 408.A O no hydrogen 3.484 N/A LEU 413.A N MET 410.A O no hydrogen 3.151 N/A GLN 414.A N GLY 434.A O no hydrogen 2.850 N/A PHE 415.A N ALA 405.A O no hydrogen 3.065 N/A LYS 416.A N TYR 431.A O no hydrogen 2.912 N/A LYS 416.A NZ GLU 547.A OE2 no hydrogen 2.808 N/A SER 417.A N VAL 403.A O no hydrogen 2.727 N/A CYS 418.A N LEU 429.A O no hydrogen 2.787 N/A THR 419.A N ILE 401.A O no hydrogen 2.960 N/A THR 419.A OG1 GLN 428.A OE1 no hydrogen 2.584 N/A LEU 420.A N PHE 427.A O no hydrogen 2.897 N/A PHE 421.A N GLY 399.A O no hydrogen 2.828 N/A TYR 422.A N GLY 425.A O no hydrogen 2.995 N/A TYR 422.A OH ASP 536.A OD2 no hydrogen 2.694 N/A HIS 424.A ND1 THR 307.A OG1 no hydrogen 2.825 N/A GLY 425.A N TYR 422.A O no hydrogen 2.863 N/A MET 426.A N LEU 529.A O no hydrogen 2.894 N/A PHE 427.A N LEU 420.A O no hydrogen 2.838 N/A GLN 428.A N TYR 527.A O no hydrogen 2.913 N/A GLN 428.A NE2 SER 417.A OG no hydrogen 2.995 N/A LEU 429.A N CYS 418.A O no hydrogen 2.857 N/A TYR 430.A N ALA 525.A O no hydrogen 2.877 N/A TYR 430.A OH GLY 361.A O no hydrogen 2.642 N/A TYR 431.A N LYS 416.A O no hydrogen 2.980 N/A TYR 431.A OH GLU 547.A OE2 no hydrogen 2.623 N/A ILE 433.A N ALA 523.A O no hydrogen 2.923 N/A GLY 434.A N GLN 414.A O no hydrogen 2.954 N/A VAL 435.A N MET 518.A O no hydrogen 3.020 N/A GLU 436.A N ASN 411.A O no hydrogen 3.018 N/A SER 439.A OG GLU 436.A O no hydrogen 2.557 N/A LEU 440.A N TYR 519.A OH no hydrogen 2.818 N/A THR 443.A N LEU 440.A O no hydrogen 3.087 N/A THR 443.A OG1 LEU 440.A O no hydrogen 3.117 N/A THR 443.A OG1 ASN 441.A O no hydrogen 3.194 N/A ARG 446.A N LEU 364.A O no hydrogen 3.064 N/A ARG 446.A NE GLU 510.A OE1 no hydrogen 3.515 N/A ARG 446.A NE GLU 510.A OE2 no hydrogen 2.988 N/A ARG 446.A NH1 ASN 444.A O no hydrogen 2.907 N/A ARG 446.A NH2 GLU 510.A OE2 no hydrogen 3.084 N/A VAL 447.A N GLN 511.A O no hydrogen 2.842 N/A ILE 448.A N ILE 362.A O no hydrogen 2.901 N/A VAL 449.A N VAL 509.A O no hydrogen 2.772 N/A LEU 450.A N VAL 509.A O no hydrogen 3.106 N/A ARG 452.A N GLU 507.A O no hydrogen 2.974 N/A ARG 452.A NE GLU 507.A OE1 no hydrogen 2.786 N/A ARG 452.A NH2 GLU 507.A OE1 no hydrogen 3.032 N/A THR 454.A N SER 505.A O no hydrogen 2.820 N/A THR 454.A OG1 SER 504.A O no hydrogen 3.318 N/A SER 455.A N ASP 453.A OD1 no hydrogen 2.922 N/A SER 455.A OG ASP 453.A OD1 no hydrogen 2.679 N/A VAL 456.A N ASP 453.A O no hydrogen 3.138 N/A THR 458.A OG1 ASP 460.A OD2 no hydrogen 2.745 N/A ASP 460.A N THR 458.A OG1 no hydrogen 3.261 N/A PHE 463.A N GLU 507.A OE1 no hydrogen 2.907 N/A GLU 464.A N GLU 507.A OE2 no hydrogen 3.235 N/A ALA 465.A N SER 462.A OG no hydrogen 3.063 N/A GLN 466.A N SER 462.A O no hydrogen 2.909 N/A GLN 466.A NE2 LEU 461.A O no hydrogen 2.944 N/A GLN 466.A NE2 THR 478.A O no hydrogen 2.834 N/A ARG 467.A N PHE 463.A O no hydrogen 2.957 N/A ARG 467.A NE ASN 472.A OD1 no hydrogen 2.956 N/A ARG 467.A NH1 SER 474.A OG no hydrogen 2.822 N/A ARG 467.A NH1 LEU 497.A O no hydrogen 2.802 N/A ILE 468.A N GLU 464.A O no hydrogen 2.995 N/A ASN 469.A N ALA 465.A O no hydrogen 2.950 N/A ASN 470.A N GLN 466.A O no hydrogen 3.013 N/A ASN 470.A N ARG 467.A O no hydrogen 2.972 N/A ASN 470.A ND2 SER 473.A O no hydrogen 3.246 N/A SER 473.A N ARG 467.A O no hydrogen 3.116 N/A SER 473.A N ASN 470.A O no hydrogen 3.144 N/A GLU 475.A N SER 473.A OG no hydrogen 3.274 N/A GLY 476.A N CYS 484.A O no hydrogen 2.830 N/A THR 477.A N SER 474.A O no hydrogen 3.207 N/A THR 477.A OG1 SER 474.A O no hydrogen 2.598 N/A THR 478.A N GLN 466.A OE1 no hydrogen 2.774 N/A THR 478.A OG1 GLY 476.A O no hydrogen 3.346 N/A PHE 479.A N VAL 482.A O no hydrogen 2.886 N/A ASN 480.A N ASP 460.A OD2 no hydrogen 3.102 N/A ASN 480.A ND2 ARG 347.A O no hydrogen 2.799 N/A VAL 482.A N PHE 479.A O no hydrogen 2.984 N/A VAL 483.A N ASN 530.A O no hydrogen 2.823 N/A CYS 484.A N THR 477.A O no hydrogen 2.965 N/A CYS 484.A SG THR 477.A O no hydrogen 3.760 N/A HIS 485.A N LYS 528.A O no hydrogen 2.964 N/A ARG 486.A N GLU 475.A OE1 no hydrogen 2.863 N/A ARG 486.A NE VAL 494.A O no hydrogen 2.995 N/A ARG 486.A NE PRO 495.A O no hydrogen 3.213 N/A ARG 486.A NH1 VAL 494.A O no hydrogen 2.925 N/A VAL 487.A N CYS 526.A O no hydrogen 3.256 N/A ILE 492.A N ILE 489.A O no hydrogen 2.981 N/A THR 498.A N GLU 510.A O no hydrogen 2.995 N/A THR 498.A OG1 GLU 510.A O no hydrogen 3.404 N/A ARG 500.A N LEU 508.A O no hydrogen 3.095 N/A ARG 500.A NE GLU 510.A OE1 no hydrogen 3.380 N/A ARG 500.A NE GLU 510.A OE2 no hydrogen 2.765 N/A ARG 500.A NH1 LEU 367.A O no hydrogen 2.806 N/A ARG 500.A NH2 LEU 367.A O no hydrogen 3.478 N/A ARG 500.A NH2 GLU 510.A OE1 no hydrogen 3.040 N/A SER 501.A OG VAL 506.A O no hydrogen 3.516 N/A ASN 503.A ND2 ASN 354.A O no hydrogen 3.159 N/A SER 505.A N ASN 503.A OD1 no hydrogen 2.808 N/A VAL 506.A N ASN 503.A O no hydrogen 3.532 N/A GLU 507.A N ARG 452.A O no hydrogen 3.088 N/A LEU 508.A N ARG 500.A O no hydrogen 2.796 N/A VAL 509.A N LEU 450.A O no hydrogen 2.787 N/A GLU 510.A N THR 498.A O no hydrogen 2.822 N/A GLN 511.A N VAL 447.A O no hydrogen 2.823 N/A GLN 511.A NE2 CYS 526.A O no hydrogen 2.812 N/A ILE 513.A N GLY 445.A O no hydrogen 2.944 N/A SER 514.A OG THR 517.A OG1 no hydrogen 2.821 N/A GLN 516.A N GLN 516.A OE1 no hydrogen 2.778 N/A THR 517.A N SER 514.A OG no hydrogen 3.165 N/A THR 517.A OG1 SER 514.A O no hydrogen 2.980 N/A THR 517.A OG1 SER 514.A OG no hydrogen 2.821 N/A MET 518.A N SER 514.A O no hydrogen 3.120 N/A TYR 519.A N PHE 515.A O no hydrogen 2.902 N/A THR 520.A N GLN 516.A O no hydrogen 3.363 N/A THR 520.A OG1 GLN 516.A O no hydrogen 3.431 N/A THR 520.A OG1 THR 517.A O no hydrogen 3.095 N/A THR 520.A OG1 THR 522.A OG1 no hydrogen 2.719 N/A ALA 521.A N MET 518.A O no hydrogen 3.154 N/A THR 522.A N THR 517.A O no hydrogen 2.850 N/A THR 522.A OG1 THR 517.A O no hydrogen 3.265 N/A THR 522.A OG1 THR 520.A OG1 no hydrogen 2.719 N/A ALA 523.A N ILE 433.A O no hydrogen 3.267 N/A SER 524.A OG ASN 493.A O no hydrogen 2.558 N/A ALA 525.A N TYR 430.A O no hydrogen 2.947 N/A CYS 526.A N GLN 511.A OE1 no hydrogen 2.963 N/A CYS 526.A SG GLN 428.A O no hydrogen 3.539 N/A CYS 526.A SG VAL 487.A O no hydrogen 3.434 N/A TYR 527.A N GLN 428.A O no hydrogen 3.006 N/A TYR 527.A OH ARG 339.A O no hydrogen 3.116 N/A TYR 527.A OH SER 360.A OG.B no hydrogen 2.955 N/A LYS 528.A N HIS 485.A O no hydrogen 2.805 N/A LYS 528.A NZ ASP 536.A OD1 no hydrogen 2.614 N/A LEU 529.A N MET 426.A O no hydrogen 2.886 N/A ASN 530.A N VAL 483.A O no hydrogen 2.800 N/A VAL 531.A N HIS 424.A O no hydrogen 3.044 N/A GLU 532.A N GLY 481.A O no hydrogen 2.945 N/A HIS 534.A N VAL 531.A O no hydrogen 2.917 N/A LEU 538.A N ASP 536.A OD1 no hydrogen 2.973 N/A ARG 539.A N ASN 552.A O no hydrogen 2.991 N/A ARG 539.A NH1 LEU 538.A O no hydrogen 2.895 N/A PHE 541.A N TYR 550.A O no hydrogen 2.749 N/A ARG 542.A NH2 ASN 544.A O no hydrogen 3.489 N/A ARG 542.A NH2 ASP 546.A OD1 no hydrogen 3.055 N/A VAL 543.A N ASN 548.A O no hydrogen 2.876 N/A SER 545.A N VAL 543.A O no hydrogen 2.751 N/A ASN 548.A N SER 545.A O no hydrogen 3.344 N/A ASN 548.A ND2 VAL 543.A O no hydrogen 2.955 N/A ASN 548.A ND2 SER 596.A OG no hydrogen 2.892 N/A ILE 549.A N PHE 561.A O no hydrogen 2.733 N/A TYR 550.A N PHE 541.A O no hydrogen 2.858 N/A VAL 551.A N ALA 559.A O no hydrogen 2.872 N/A ASN 552.A N ARG 539.A O no hydrogen 2.923 N/A VAL 553.A N VAL 557.A O no hydrogen 3.057 N/A GLY 554.A N ASN 552.A OD1 no hydrogen 2.989 N/A ASN 555.A ND2 ASP 423.A O no hydrogen 3.332 N/A VAL 557.A N ASN 555.A OD1 no hydrogen 3.051 N/A LYS 558.A N LYS 569.A O no hydrogen 2.993 N/A LYS 558.A NZ ILE 597.A O no hydrogen 2.876 N/A LYS 558.A NZ GLU 599.A OE2 no hydrogen 2.845 N/A ALA 559.A N VAL 551.A O no hydrogen 2.846 N/A LEU 560.A N MET 567.A O no hydrogen 2.818 N/A PHE 561.A N ILE 549.A O no hydrogen 2.816 N/A ASN 562.A N TRP 565.A O no hydrogen 2.877 N/A TRP 565.A N ASN 562.A O no hydrogen 2.922 N/A VAL 566.A N MET 577.A O no hydrogen 2.965 N/A MET 567.A N LEU 560.A O no hydrogen 2.888 N/A VAL 568.A N SER 575.A O no hydrogen 3.014 N/A LYS 569.A N LYS 558.A O no hydrogen 2.803 N/A LYS 569.A NZ GLU 599.A OE1 no hydrogen 3.360 N/A LYS 569.A NZ GLU 599.A OE2 no hydrogen 2.856 N/A GLU 570.A N LYS 573.A O no hydrogen 2.966 N/A LYS 573.A N GLU 570.A O no hydrogen 3.036 N/A LYS 573.A NZ LYS 394.A O no hydrogen 3.191 N/A VAL 574.A N PHE 629.A O no hydrogen 3.014 N/A SER 575.A N VAL 568.A O no hydrogen 2.963 N/A SER 575.A OG GLN 626.A OE1 no hydrogen 2.695 N/A PHE 576.A N PHE 627.A O no hydrogen 2.907 N/A MET 577.A N VAL 566.A O no hydrogen 3.034 N/A ALA 579.A N PRO 564.A O no hydrogen 2.781 N/A ASN 580.A N SER 578.A OG no hydrogen 3.022 N/A GLU 581.A N SER 578.A O no hydrogen 2.872 N/A ILE 585.A N PHE 616.A O no hydrogen 2.863 N/A PHE 587.A N ASN 614.A O no hydrogen 2.949 N/A VAL 589.A N PRO 586.A O no hydrogen 3.158 N/A ILE 590.A N PRO 586.A O no hydrogen 3.414 N/A MET 591.A N PHE 587.A O no hydrogen 2.947 N/A ASN 592.A N SER 588.A O no hydrogen 2.858 N/A SER 593.A N VAL 589.A O no hydrogen 2.965 N/A SER 593.A OG VAL 589.A O no hydrogen 2.714 N/A PHE 594.A N ILE 590.A O no hydrogen 2.987 N/A THR 595.A N MET 591.A O no hydrogen 2.975 N/A THR 595.A OG1 MET 591.A O no hydrogen 2.801 N/A SER 596.A N ASN 592.A O no hydrogen 2.904 N/A SER 596.A OG ASN 592.A O no hydrogen 3.076 N/A ILE 597.A N SER 593.A O no hydrogen 3.120 N/A GLY 598.A N THR 595.A O no hydrogen 3.055 N/A GLU 599.A N PHE 594.A O no hydrogen 2.803 N/A LEU 602.A N GLU 599.A O no hydrogen 3.305 N/A SER 605.A N GLU 630.A O no hydrogen 2.843 N/A SER 607.A N ILE 628.A O no hydrogen 2.820 N/A ASN 608.A ND2 GLN 626.A O no hydrogen 2.818 N/A CYS 609.A SG ASN 608.A OD1 no hydrogen 3.863 N/A PHE 610.A N LYS 617.A O no hydrogen 2.878 N/A TYR 612.A N GLY 615.A O no hydrogen 2.853 N/A PHE 616.A N ILE 585.A O no hydrogen 2.880 N/A LYS 617.A N PHE 610.A O no hydrogen 2.790 N/A LEU 618.A N THR 583.A O no hydrogen 2.986 N/A ASN 619.A N ASN 608.A O no hydrogen 2.877 N/A THR 622.A N ASN 620.A OD1 no hydrogen 2.926 N/A THR 622.A OG1 ASN 620.A OD1 no hydrogen 2.677 N/A LEU 625.A N ASP 296.A OD2 no hydrogen 2.828 N/A GLN 626.A NE2 ASP 296.A OD1 no hydrogen 3.036 N/A GLN 626.A NE2 ASP 296.A OD2 no hydrogen 3.544 N/A PHE 627.A N PHE 576.A O no hydrogen 2.795 N/A ILE 628.A N ASN 608.A OD1 no hydrogen 2.782 N/A PHE 629.A N VAL 574.A O no hydrogen 2.923 N/A GLU 630.A N SER 605.A O no hydrogen 2.762 N/A ILE 631.A N ASN 572.A O no hydrogen 2.808 N/A VAL 632.A N GLN 603.A O no hydrogen 3.043 N/A