Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 2xpk_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): VAL 2.A N ASP 19.A O no hydrogen 2.786 N/A ASN 8.A N GLN 122.A OE1 no hydrogen 2.841 N/A ASN 8.A ND2 ASN 169.A OD1 no hydrogen 2.911 N/A ASN 8.A ND2 HIS 403.A O no hydrogen 3.261 N/A THR 10.A N ASP 407.A OD1 no hydrogen 3.007 N/A THR 10.A OG1 ASP 407.A OD1 no hydrogen 2.982 N/A GLU 12.A N ASP 136.A OD1 no hydrogen 2.698 N/A ASN 13.A N THR 135.A O no hydrogen 3.097 N/A ASN 13.A ND2 THR 135.A O no hydrogen 3.510 N/A ASN 13.A ND2 THR 135.A OG1 no hydrogen 3.429 N/A GLU 15.A N ASN 133.A O no hydrogen 2.887 N/A VAL 17.A N GLU 131.A O no hydrogen 2.916 N/A GLY 20.A N GLU 131.A OE2 no hydrogen 2.725 N/A PHE 21.A N ILE 129.A O no hydrogen 3.140 N/A LYS 22.A NZ ILE 23.A O no hydrogen 3.469 N/A ILE 23.A N SER 127.A O no hydrogen 2.836 N/A THR 24.A N THR 63.A OG1 no hydrogen 3.095 N/A THR 24.A OG1 SER 26.A O no hydrogen 3.011 N/A THR 24.A OG1 THR 63.A OG1 no hydrogen 3.121 N/A SER 26.A OG ASN 55.A OD1 no hydrogen 2.822 N/A ILE 27.A N GLU 53.A O no hydrogen 2.813 N/A ASN 28.A N THR 63.A O no hydrogen 2.974 N/A ASN 28.A ND2 ASP 59.A O no hydrogen 3.428 N/A ASN 28.A ND2 THR 64.A OG1 no hydrogen 3.310 N/A VAL 30.A N LEU 65.A O no hydrogen 2.879 N/A GLU 32.A N GLU 32.A OE2 no hydrogen 2.801 N/A GLU 34.A N GLY 31.A O no hydrogen 3.145 N/A ALA 35.A N GLY 31.A O no hydrogen 3.078 N/A ASP 36.A N GLU 69.A OE2 no hydrogen 3.163 N/A ALA 39.A N ASP 36.A OD1 no hydrogen 2.677 N/A VAL 40.A N ASP 36.A O no hydrogen 3.031 N/A ASN 41.A N GLU 37.A O no hydrogen 2.941 N/A ALA 42.A N ASN 38.A O no hydrogen 3.006 N/A LEU 43.A N ALA 39.A O no hydrogen 3.052 N/A ARG 44.A N VAL 40.A O no hydrogen 2.871 N/A GLU 45.A N ASN 41.A O no hydrogen 2.938 N/A PHE 46.A N ALA 42.A O no hydrogen 3.187 N/A LEU 47.A N LEU 43.A O no hydrogen 2.868 N/A THR 48.A N ARG 44.A O no hydrogen 2.845 N/A THR 48.A OG1 ARG 44.A O no hydrogen 3.098 N/A ALA 49.A N GLU 45.A O no hydrogen 3.128 N/A ASN 50.A N PHE 46.A O no hydrogen 2.976 N/A ASN 50.A ND2 PHE 46.A O no hydrogen 2.707 N/A ASN 51.A N THR 48.A O no hydrogen 3.246 N/A ILE 52.A N LEU 47.A O no hydrogen 2.806 N/A GLU 53.A N SER 25.A O no hydrogen 3.278 N/A ASN 55.A N ILE 27.A O no hydrogen 2.813 N/A ASN 55.A ND2 ASN 28.A OD1 no hydrogen 2.760 N/A ASP 59.A N ASN 28.A OD1 no hydrogen 3.084 N/A ASN 61.A N ASP 59.A OD1 no hydrogen 2.756 N/A SER 62.A N ASP 59.A OD2 no hydrogen 2.300 N/A SER 62.A OG SER 26.A O no hydrogen 3.201 N/A THR 63.A N THR 24.A OG1 no hydrogen 2.768 N/A THR 63.A OG1 THR 24.A OG1 no hydrogen 3.121 N/A THR 64.A N GLY 101.A O no hydrogen 2.673 N/A LEU 65.A N ASN 28.A O no hydrogen 2.840 N/A ILE 66.A N ILE 103.A O no hydrogen 2.880 N/A ILE 67.A N VAL 30.A O no hydrogen 3.086 N/A GLY 68.A N ILE 105.A O no hydrogen 3.058 N/A GLU 69.A N ASP 72.A OD1 no hydrogen 3.291 N/A VAL 70.A N GLY 107.A O no hydrogen 3.203 N/A ASP 72.A N GLU 69.A O no hydrogen 3.171 N/A GLU 76.A N GLU 76.A OE2 no hydrogen 2.947 N/A LEU 77.A N ILE 74.A O no hydrogen 3.177 N/A GLU 79.A N PRO 75.A O no hydrogen 3.220 N/A ALA 80.A N GLU 76.A O no hydrogen 3.040 N/A LEU 81.A N LEU 77.A O no hydrogen 3.172 N/A THR 85.A OG1 GLU 106.A OE1 no hydrogen 3.270 N/A ALA 86.A N GLU 106.A OE1 no hydrogen 3.114 N/A GLU 87.A N THR 85.A OG1 no hydrogen 3.011 N/A LEU 89.A N ALA 86.A O no hydrogen 3.397 N/A LYS 90.A NZ PRO 138.A O no hydrogen 2.886 N/A GLU 91.A N GLU 91.A OE2 no hydrogen 3.334 N/A GLU 92.A N ASP 109.A OD1 no hydrogen 3.184 N/A GLU 92.A N ASP 109.A OD2 no hydrogen 3.031 N/A GLY 93.A N LYS 90.A O no hydrogen 2.918 N/A TYR 94.A N ASP 136.A O no hydrogen 2.971 N/A TYR 94.A OH ASP 136.A OD2 no hydrogen 2.888 N/A ALA 95.A N GLU 106.A O no hydrogen 2.737 N/A LEU 96.A N ILE 134.A O no hydrogen 2.922 N/A VAL 97.A N ALA 104.A O no hydrogen 2.860 N/A SER 98.A N VAL 132.A O no hydrogen 2.853 N/A SER 98.A OG PRO 130.A O no hydrogen 2.738 N/A SER 98.A OG VAL 132.A O no hydrogen 3.529 N/A ASN 99.A N LYS 102.A O no hydrogen 2.940 N/A ASP 100.A N GLU 131.A OE1 no hydrogen 2.878 N/A LYS 102.A N ASN 99.A O no hydrogen 3.048 N/A ILE 103.A N THR 64.A O no hydrogen 2.969 N/A ALA 104.A N VAL 97.A O no hydrogen 2.759 N/A ILE 105.A N ILE 66.A O no hydrogen 2.907 N/A GLU 106.A N ALA 95.A O no hydrogen 2.909 N/A GLY 107.A N GLY 68.A O no hydrogen 3.068 N/A LYS 108.A N GLY 93.A O no hydrogen 3.001 N/A LYS 108.A NZ GLU 87.A O no hydrogen 3.226 N/A GLY 112.A N ASP 109.A OD1 no hydrogen 2.748 N/A THR 113.A N ASP 109.A O no hydrogen 3.168 N/A THR 113.A OG1 GLY 68.A O no hydrogen 3.385 N/A THR 113.A OG1 GLU 69.A OE2 no hydrogen 2.813 N/A THR 113.A OG1 ASP 109.A O no hydrogen 3.225 N/A PHE 114.A N GLY 110.A O no hydrogen 3.133 N/A TYR 115.A N ASP 111.A O no hydrogen 2.888 N/A GLY 116.A N GLY 112.A O no hydrogen 2.862 N/A VAL 117.A N THR 113.A O no hydrogen 2.978 N/A GLN 118.A N PHE 114.A O no hydrogen 3.118 N/A THR 119.A N TYR 115.A O no hydrogen 3.092 N/A THR 119.A OG1 TYR 94.A OH no hydrogen 2.577 N/A THR 119.A OG1 TYR 115.A O no hydrogen 3.367 N/A PHE 120.A N GLY 116.A O no hydrogen 3.000 N/A LYS 121.A N VAL 117.A O no hydrogen 2.874 N/A LYS 121.A NZ GLN 118.A OE1 no hydrogen 2.759 N/A GLN 122.A N GLN 118.A O no hydrogen 3.142 N/A GLN 122.A NE2 ASN 8.A O no hydrogen 2.996 N/A LEU 123.A N THR 119.A O no hydrogen 2.806 N/A VAL 124.A N PHE 120.A O no hydrogen 3.063 N/A LYS 125.A N ASN 128.A O no hydrogen 2.997 N/A ASN 128.A N LYS 125.A O no hydrogen 2.919 N/A ILE 129.A N PHE 21.A O no hydrogen 3.076 N/A VAL 132.A N SER 98.A OG no hydrogen 2.792 N/A ASN 133.A N GLU 15.A O no hydrogen 2.871 N/A ILE 134.A N LEU 96.A O no hydrogen 2.856 N/A THR 135.A N ASN 13.A O no hydrogen 3.186 N/A ASP 136.A N TYR 94.A O no hydrogen 3.044 N/A TYR 137.A N ASP 136.A OD1 no hydrogen 3.044 N/A THR 139.A N TRP 410.A O no hydrogen 2.754 N/A THR 139.A OG1 TRP 410.A O no hydrogen 2.831 N/A VAL 140.A N SER 409.A O no hydrogen 3.082 N/A ALA 142.A N ASP 385.A O no hydrogen 3.353 N/A ARG 143.A N ASN 172.A OD1 no hydrogen 2.634 N/A ARG 143.A NE LYS 170.A O no hydrogen 3.091 N/A ARG 143.A NH1 GLU 92.A OE1 no hydrogen 3.191 N/A ARG 143.A NH1 VAL 140.A O no hydrogen 2.730 N/A ARG 143.A NH2 GLU 92.A OE2 no hydrogen 2.916 N/A ARG 143.A NH2 LYS 170.A O no hydrogen 2.857 N/A GLY 144.A N PHE 387.A O no hydrogen 3.096 N/A ILE 145.A N THR 173.A O no hydrogen 2.937 N/A VAL 146.A N VAL 389.A O no hydrogen 2.997 N/A GLU 147.A N ILE 175.A O no hydrogen 2.803 N/A GLY 148.A N ASN 390.A OD1 no hydrogen 3.216 N/A TYR 150.A N ASP 362.A OD2 no hydrogen 3.033 N/A TYR 150.A OH ASP 259.A OD1 no hydrogen 2.524 N/A GLY 151.A N ASP 180.A OD1 no hydrogen 2.806 N/A TRP 154.A N GLU 147.A OE1 no hydrogen 3.054 N/A TRP 154.A NE1 MET 392.A O no hydrogen 3.004 N/A THR 155.A N ASP 158.A OD2 no hydrogen 3.256 N/A HIS 156.A NE2 GLU 202.A OE1 no hydrogen 3.046 N/A ASP 158.A N THR 155.A OG1 no hydrogen 3.078 N/A ARG 159.A N THR 155.A O no hydrogen 3.097 N/A ARG 159.A NE GLU 147.A OE2 no hydrogen 2.665 N/A ARG 159.A NH2 GLU 147.A OE1 no hydrogen 2.866 N/A ARG 159.A NH2 GLU 147.A OE2 no hydrogen 3.376 N/A LEU 160.A N HIS 156.A O no hydrogen 3.161 N/A ASP 161.A N GLN 157.A O no hydrogen 3.073 N/A GLN 162.A N ASP 158.A O no hydrogen 2.834 N/A GLN 162.A NE2 TYR 166.A OH no hydrogen 2.636 N/A ILE 163.A N ARG 159.A O no hydrogen 2.819 N/A LYS 164.A N LEU 160.A O no hydrogen 3.210 N/A PHE 165.A N ASP 161.A O no hydrogen 3.037 N/A TYR 166.A N GLN 162.A O no hydrogen 2.781 N/A GLY 167.A N ILE 163.A O no hydrogen 3.160 N/A GLU 168.A N LYS 164.A O no hydrogen 3.127 N/A ASN 169.A N PHE 165.A O no hydrogen 3.308 N/A ASN 169.A N TYR 166.A O no hydrogen 3.280 N/A ASN 169.A ND2 PHE 165.A O no hydrogen 2.775 N/A LYS 170.A N GLY 167.A O no hydrogen 3.104 N/A LYS 170.A NZ THR 119.A OG1 no hydrogen 2.769 N/A LEU 171.A N TYR 166.A O no hydrogen 2.712 N/A ASN 172.A N ARG 143.A O no hydrogen 2.849 N/A ASN 172.A ND2 GLU 92.A OE2 no hydrogen 3.209 N/A ASN 172.A ND2 SER 141.A O no hydrogen 2.752 N/A THR 173.A N ARG 143.A O no hydrogen 2.884 N/A THR 173.A OG1 ASN 172.A OD1 no hydrogen 2.909 N/A TYR 174.A N ASP 213.A O no hydrogen 2.967 N/A TYR 174.A OH GLU 147.A OE2 no hydrogen 2.711 N/A ILE 175.A N ILE 145.A O no hydrogen 2.720 N/A TYR 176.A N VAL 215.A O no hydrogen 2.833 N/A TYR 176.A OH ASP 181.A OD2 no hydrogen 2.487 N/A ALA 177.A N GLU 147.A O no hydrogen 2.936 N/A LYS 179.A N PHE 149.A O no hydrogen 3.138 N/A LYS 179.A NZ ASP 258.A OD2 no hydrogen 2.770 N/A ASP 181.A N PRO 178.A O no hydrogen 2.997 N/A TYR 183.A N ASP 181.A OD1 no hydrogen 2.928 N/A HIS 184.A N ASP 181.A O no hydrogen 2.781 N/A ARG 185.A N PRO 182.A O no hydrogen 3.443 N/A LYS 187.A N PRO 182.A O no hydrogen 2.568 N/A TRP 188.A N ARG 185.A O no hydrogen 3.397 N/A TRP 188.A NE1 ASP 223.A OD1 no hydrogen 2.994 N/A ARG 189.A NE ASP 234.A OD1 no hydrogen 2.913 N/A ARG 189.A NH1 ASP 223.A O no hydrogen 3.065 N/A ARG 189.A NH1 ASP 234.A OD1 no hydrogen 3.550 N/A ARG 189.A NH1 ASP 234.A OD2 no hydrogen 2.894 N/A ARG 189.A NH2 ASP 223.A OD1 no hydrogen 3.327 N/A ARG 189.A NH2 ASP 223.A OD2 no hydrogen 3.211 N/A GLU 190.A N LYS 187.A O no hydrogen 2.964 N/A TYR 192.A OH ASP 181.A OD2 no hydrogen 2.449 N/A GLU 196.A N PRO 193.A O no hydrogen 3.036 N/A MET 197.A N PRO 193.A O no hydrogen 3.105 N/A GLN 198.A N GLU 194.A O no hydrogen 3.133 N/A ARG 199.A N SER 195.A O no hydrogen 3.439 N/A MET 200.A N GLU 196.A O no hydrogen 2.936 N/A GLN 201.A N MET 197.A O no hydrogen 3.107 N/A GLN 201.A NE2 GLN 201.A O no hydrogen 3.314 N/A GLN 201.A NE2 ASN 205.A OD1 no hydrogen 3.232 N/A GLN 201.A NE2 MET 248.A O no hydrogen 2.939 N/A GLU 202.A N GLN 198.A O no hydrogen 3.314 N/A LEU 203.A N ARG 199.A O no hydrogen 3.279 N/A ILE 204.A N MET 200.A O no hydrogen 3.135 N/A ASN 205.A N GLN 201.A O no hydrogen 2.875 N/A ALA 206.A N GLU 202.A O no hydrogen 2.782 N/A SER 207.A N LEU 203.A O no hydrogen 2.753 N/A SER 207.A OG LEU 203.A O no hydrogen 2.727 N/A ALA 208.A N ILE 204.A O no hydrogen 3.002 N/A GLU 209.A N ASN 205.A O no hydrogen 3.073 N/A ASN 210.A N SER 207.A O no hydrogen 3.234 N/A ASN 210.A ND2 ALA 206.A O no hydrogen 2.880 N/A LYS 211.A N ALA 208.A O no hydrogen 3.261 N/A LYS 211.A NZ ASP 36.A OD2 no hydrogen 2.687 N/A LYS 211.A NZ ASN 38.A OD1 no hydrogen 3.059 N/A VAL 212.A N SER 207.A O no hydrogen 2.928 N/A ASP 213.A N ASN 172.A O no hydrogen 2.444 N/A VAL 215.A N TYR 174.A O no hydrogen 2.869 N/A PHE 216.A N SER 252.A O no hydrogen 2.946 N/A GLY 217.A N TYR 176.A O no hydrogen 2.883 N/A ILE 218.A N ALA 254.A O no hydrogen 2.906 N/A SER 219.A N HIS 184.A O no hydrogen 2.865 N/A ILE 224.A N PRO 220.A O no hydrogen 3.008 N/A ARG 225.A N ASP 234.A OD2 no hydrogen 2.701 N/A ARG 225.A NE ASP 234.A OD2 no hydrogen 3.159 N/A ARG 225.A NH2 ASP 234.A OD1 no hydrogen 2.862 N/A GLY 231.A N ASP 227.A O no hydrogen 3.275 N/A GLU 232.A N GLY 228.A O no hydrogen 2.943 N/A GLU 233.A N ASP 229.A O no hydrogen 2.606 N/A ASP 234.A N ALA 230.A O no hydrogen 2.849 N/A PHE 235.A N GLY 231.A O no hydrogen 2.930 N/A ASN 236.A N GLU 232.A O no hydrogen 3.089 N/A HIS 237.A N GLU 233.A O no hydrogen 3.269 N/A HIS 237.A N ASP 234.A O no hydrogen 3.127 N/A LEU 238.A N ASP 234.A O no hydrogen 3.315 N/A ILE 239.A N PHE 235.A O no hydrogen 3.224 N/A THR 240.A N ASN 236.A O no hydrogen 2.955 N/A THR 240.A OG1 ASN 236.A O no hydrogen 2.533 N/A LYS 241.A N HIS 237.A O no hydrogen 2.885 N/A LYS 241.A NZ TYR 183.A O no hydrogen 2.795 N/A LYS 241.A NZ TRP 188.A O no hydrogen 2.423 N/A LYS 241.A NZ GLU 190.A O no hydrogen 2.749 N/A ALA 242.A N LEU 238.A O no hydrogen 2.892 N/A GLU 243.A N ILE 239.A O no hydrogen 2.774 N/A SER 244.A N THR 240.A O no hydrogen 3.057 N/A SER 244.A OG LYS 241.A O no hydrogen 3.136 N/A LEU 245.A N ALA 242.A O no hydrogen 3.112 N/A TYR 246.A N ALA 242.A O no hydrogen 2.839 N/A TYR 246.A OH ASP 285.A OD1 no hydrogen 2.960 N/A ASP 247.A N GLU 243.A O no hydrogen 2.778 N/A MET 248.A N LEU 245.A O no hydrogen 3.171 N/A GLY 249.A N TYR 246.A O no hydrogen 2.982 N/A VAL 250.A N LEU 245.A O no hydrogen 3.025 N/A ARG 251.A NE ASP 285.A OD2 no hydrogen 2.896 N/A ARG 251.A NH1 TYR 246.A O no hydrogen 2.779 N/A ARG 251.A NH1 VAL 250.A O no hydrogen 2.814 N/A ALA 254.A N PHE 216.A O no hydrogen 3.060 N/A ILE 255.A N ILE 290.A O no hydrogen 3.029 N/A TYR 256.A N ILE 218.A O no hydrogen 3.044 N/A TRP 257.A N CYS 292.A O no hydrogen 3.186 N/A LYS 263.A NZ GLU 295.A OE2 no hydrogen 3.050 N/A SER 264.A OG ASP 262.A OD1 no hydrogen 3.182 N/A SER 264.A OG ASP 262.A OD2 no hydrogen 3.012 N/A LYS 267.A N SER 264.A O no hydrogen 2.955 N/A LYS 267.A NZ ASP 227.A OD1 no hydrogen 3.228 N/A LYS 267.A NZ ASP 227.A OD2 no hydrogen 2.713 N/A HIS 268.A N SER 264.A O no hydrogen 2.966 N/A HIS 268.A ND1 TYR 310.A OH no hydrogen 2.656 N/A ALA 269.A N ALA 265.A O no hydrogen 2.909 N/A GLN 270.A N ALA 266.A O no hydrogen 2.937 N/A VAL 271.A N LYS 267.A O no hydrogen 2.993 N/A LEU 272.A N HIS 268.A O no hydrogen 3.135 N/A ASN 273.A N ALA 269.A O no hydrogen 2.878 N/A ASN 273.A ND2 THR 317.A O no hydrogen 2.882 N/A ARG 274.A N GLN 270.A O no hydrogen 3.054 N/A ARG 274.A NH1 GLU 278.A OE2 no hydrogen 3.344 N/A ARG 274.A NH2 GLU 232.A OE1 no hydrogen 2.707 N/A PHE 275.A N VAL 271.A O no hydrogen 3.013 N/A ASN 276.A N LEU 272.A O no hydrogen 2.881 N/A ASN 276.A ND2 ASP 319.A OD2 no hydrogen 3.327 N/A GLU 277.A N ASN 273.A O no hydrogen 2.996 N/A GLU 278.A N ARG 274.A O no hydrogen 2.775 N/A PHE 279.A N PHE 275.A O no hydrogen 2.955 N/A VAL 280.A N PHE 275.A O no hydrogen 3.169 N/A LYS 281.A N ASN 276.A O no hydrogen 3.068 N/A LYS 281.A NZ GLU 277.A OE2 no hydrogen 3.463 N/A LYS 283.A N PHE 279.A O no hydrogen 3.034 N/A GLY 284.A N VAL 280.A O no hydrogen 3.217 N/A LYS 287.A N ARG 251.A O no hydrogen 2.820 N/A LYS 287.A NZ ASP 213.A OD2 no hydrogen 2.663 N/A ILE 290.A N PHE 253.A O no hydrogen 3.015 N/A THR 291.A N GLU 323.A O no hydrogen 2.856 N/A THR 291.A OG1 ILE 255.A O no hydrogen 2.842 N/A THR 291.A OG1 CYS 292.A O no hydrogen 3.472 N/A CYS 292.A SG ASP 258.A OD1 no hydrogen 3.462 N/A CYS 292.A SG PRO 293.A O no hydrogen 3.896 N/A THR 294.A N TYR 310.A OH no hydrogen 2.931 N/A THR 294.A OG1 TRP 257.A O no hydrogen 2.949 N/A THR 294.A OG1 TYR 310.A OH no hydrogen 3.037 N/A TYR 296.A OH ASP 259.A OD2 no hydrogen 3.069 N/A THR 298.A N GLY 328.A O no hydrogen 2.810 N/A THR 298.A OG1 GLY 328.A O no hydrogen 3.040 N/A THR 298.A OG1 ASP 340.A OD1 no hydrogen 2.760 N/A THR 298.A OG1 ASP 340.A OD2 no hydrogen 3.126 N/A GLY 299.A N PRO 329.A O no hydrogen 3.042 N/A ALA 300.A N ASP 297.A O no hydrogen 2.832 N/A MET 301.A N ASP 297.A O no hydrogen 2.911 N/A MET 301.A N THR 298.A O no hydrogen 3.158 N/A VAL 302.A N THR 298.A O no hydrogen 2.974 N/A SER 303.A N GLN 306.A O no hydrogen 2.836 N/A GLN 306.A N SER 303.A O no hydrogen 3.136 N/A ARG 308.A N MET 301.A O no hydrogen 2.749 N/A ARG 308.A NH2 GLY 299.A O no hydrogen 2.793 N/A TYR 310.A OH HIS 268.A ND1 no hydrogen 2.656 N/A THR 311.A N GLU 295.A OE1 no hydrogen 3.193 N/A THR 311.A OG1 GLU 295.A OE1 no hydrogen 2.525 N/A ARG 312.A N ARG 308.A O no hydrogen 2.819 N/A ILE 313.A N ALA 309.A O no hydrogen 3.021 N/A PHE 314.A N TYR 310.A O no hydrogen 2.819 N/A ALA 315.A N THR 311.A O no hydrogen 2.756 N/A GLU 316.A N ARG 312.A O no hydrogen 3.150 N/A THR 317.A N ILE 313.A O no hydrogen 3.044 N/A THR 317.A N PHE 314.A O no hydrogen 3.069 N/A THR 317.A OG1 ILE 313.A O no hydrogen 2.792 N/A THR 317.A OG1 GLU 316.A OE2 no hydrogen 3.351 N/A VAL 318.A N PHE 314.A O no hydrogen 2.929 N/A ASP 319.A N ASN 273.A OD1 no hydrogen 2.824 N/A ILE 322.A N ASP 319.A O no hydrogen 3.375 N/A GLU 323.A N LEU 289.A O no hydrogen 2.642 N/A MET 325.A N THR 291.A O no hydrogen 2.841 N/A TRP 326.A N ALA 353.A O no hydrogen 2.884 N/A TRP 326.A NE1 THR 298.A OG1 no hydrogen 3.312 N/A THR 327.A N TYR 296.A O no hydrogen 2.987 N/A THR 327.A OG1 TYR 296.A O no hydrogen 3.403 N/A THR 327.A OG1 GLY 330.A O no hydrogen 2.857 N/A ILE 336.A N GLY 375.A O no hydrogen 3.016 N/A ASP 340.A N PRO 337.A O no hydrogen 3.162 N/A GLN 342.A N LEU 338.A O no hydrogen 2.865 N/A LEU 343.A N SER 339.A O no hydrogen 3.101 N/A ILE 344.A N ASP 340.A O no hydrogen 3.159 N/A SER 345.A N ALA 341.A O no hydrogen 2.849 N/A SER 345.A OG ARG 350.A O no hydrogen 2.665 N/A GLY 346.A N GLN 342.A O no hydrogen 3.103 N/A ILE 347.A N LEU 343.A O no hydrogen 3.118 N/A TYR 348.A N ILE 344.A O no hydrogen 3.032 N/A ARG 350.A N SER 345.A O no hydrogen 3.294 N/A ARG 350.A NE ILE 322.A O no hydrogen 3.130 N/A ARG 350.A NH1 TYR 348.A O no hydrogen 3.143 N/A ARG 350.A NH2 ASP 319.A O no hydrogen 2.345 N/A ARG 350.A NH2 ILE 322.A O no hydrogen 3.101 N/A ASN 351.A ND2 GLN 382.A O no hydrogen 3.324 N/A MET 352.A N TYR 383.A O no hydrogen 2.764 N/A ALA 353.A N VAL 324.A O no hydrogen 2.820 N/A VAL 354.A N PHE 386.A O no hydrogen 2.854 N/A TRP 355.A N TRP 326.A O no hydrogen 2.970 N/A TRP 355.A NE1 ASN 357.A OD1 no hydrogen 2.711 N/A TRP 356.A N THR 388.A O no hydrogen 2.902 N/A ASN 357.A ND2 VAL 331.A O no hydrogen 3.147 N/A TYR 358.A N TRP 356.A O no hydrogen 2.830 N/A TYR 358.A OH THR 444.A O no hydrogen 2.643 N/A VAL 360.A N ASN 390.A O no hydrogen 2.991 N/A PHE 364.A N THR 361.A O no hydrogen 2.847 N/A LYS 367.A N PHE 364.A O no hydrogen 3.242 N/A LYS 367.A NZ ARG 445.A O no hydrogen 2.903 N/A LYS 367.A NZ ASP 458.A OD1 no hydrogen 3.364 N/A LYS 367.A NZ ASP 458.A OD2 no hydrogen 2.659 N/A LYS 367.A NZ GLU 567.A OE1 no hydrogen 2.684 N/A LEU 370.A N SER 443.A O no hydrogen 2.889 N/A GLY 371.A N TYR 358.A OH no hydrogen 3.004 N/A MET 373.A N THR 404.A OG1 no hydrogen 2.865 N/A ASP 377.A N ILE 336.A O no hydrogen 3.117 N/A LYS 378.A NZ TYR 415.A O no hydrogen 2.644 N/A GLY 379.A N ASP 377.A OD1 no hydrogen 2.782 N/A LEU 380.A N ASP 377.A O no hydrogen 3.340 N/A GLN 382.A N GLY 379.A O no hydrogen 3.061 N/A TYR 383.A N LEU 380.A O no hydrogen 3.029 N/A ASP 385.A N MET 352.A O no hydrogen 3.045 N/A PHE 387.A N ALA 142.A O no hydrogen 2.807 N/A THR 388.A N VAL 354.A O no hydrogen 3.062 N/A THR 388.A OG1 VAL 354.A O no hydrogen 3.104 N/A VAL 389.A N GLY 144.A O no hydrogen 3.007 N/A ASN 390.A N TRP 356.A O no hydrogen 2.947 N/A ASN 390.A ND2 GLY 148.A O no hydrogen 3.617 N/A ASN 390.A ND2 ASN 357.A OD1 no hydrogen 3.010 N/A MET 392.A N SER 398.A OG no hydrogen 3.087 N/A GLU 396.A N GLU 511.A OE2 no hydrogen 2.943 N/A LEU 397.A N GLU 511.A OE1 no hydrogen 2.739 N/A SER 398.A N HIS 394.A O no hydrogen 3.212 N/A SER 398.A OG MET 392.A O no hydrogen 3.492 N/A SER 398.A OG HIS 394.A O no hydrogen 2.663 N/A LYS 399.A N GLU 396.A O no hydrogen 3.274 N/A LYS 399.A NZ ASP 161.A OD2 no hydrogen 2.918 N/A LYS 399.A NZ GLU 396.A OE1 no hydrogen 3.073 N/A LYS 399.A NZ GLU 396.A OE2 no hydrogen 3.294 N/A SER 401.A OG GLY 371.A O no hydrogen 2.909 N/A ILE 402.A N SER 398.A O no hydrogen 3.000 N/A HIS 403.A N LYS 399.A O no hydrogen 2.792 N/A THR 404.A N ILE 400.A O no hydrogen 3.400 N/A THR 404.A OG1 SER 401.A O no hydrogen 2.807 N/A ALA 405.A N SER 401.A O no hydrogen 2.972 N/A ALA 406.A N ILE 402.A O no hydrogen 2.949 N/A ASP 407.A N HIS 403.A O no hydrogen 3.318 N/A TYR 408.A N THR 404.A O no hydrogen 2.829 N/A TYR 408.A OH ASP 377.A O no hydrogen 2.695 N/A SER 409.A N ALA 405.A O no hydrogen 2.933 N/A SER 409.A OG ALA 405.A O no hydrogen 2.738 N/A TRP 410.A N ALA 406.A O no hydrogen 3.260 N/A TRP 410.A NE1 ASP 136.A OD1 no hydrogen 2.769 N/A ASN 411.A N ASP 407.A O no hydrogen 2.982 N/A ASN 411.A ND2 THR 10.A O no hydrogen 2.889 N/A MET 412.A N THR 139.A OG1 no hydrogen 3.178 N/A ASN 414.A N ASN 411.A O no hydrogen 3.410 N/A TYR 415.A N MET 412.A O no hydrogen 3.335 N/A TYR 415.A OH MET 373.A O no hydrogen 2.682 N/A LYS 419.A N ASP 416.A OD2 no hydrogen 3.297 N/A ALA 420.A N ASP 416.A O no hydrogen 2.881 N/A TRP 421.A N TYR 417.A O no hydrogen 2.859 N/A TRP 421.A NE1 LEU 370.A O no hydrogen 2.879 N/A ASN 422.A N ASP 418.A O no hydrogen 3.204 N/A ASN 422.A ND2 ASP 418.A O no hydrogen 2.750 N/A ARG 423.A N LYS 419.A O no hydrogen 2.928 N/A ALA 424.A N ALA 420.A O no hydrogen 2.906 N/A ILE 425.A N TRP 421.A O no hydrogen 3.180 N/A ASP 426.A N ASN 422.A O no hydrogen 2.931 N/A MET 427.A N ARG 423.A O no hydrogen 2.868 N/A LEU 428.A N ALA 424.A O no hydrogen 2.994 N/A TYR 429.A N ILE 425.A O no hydrogen 2.733 N/A GLY 430.A N ASP 426.A O no hydrogen 3.398 N/A LEU 432.A N TYR 429.A O no hydrogen 3.037 N/A ALA 433.A N GLY 430.A O no hydrogen 3.071 N/A MET 436.A N LEU 432.A O no hydrogen 2.905 N/A LYS 437.A N ALA 433.A O no hydrogen 2.766 N/A LYS 437.A NZ ASN 422.A OD1 no hydrogen 3.207 N/A LYS 437.A NZ ASP 426.A OD1 no hydrogen 2.844 N/A LYS 437.A NZ ASP 426.A OD2 no hydrogen 3.568 N/A LYS 437.A NZ GLU 434.A OE2 no hydrogen 3.333 N/A VAL 438.A N GLU 434.A O no hydrogen 3.270 N/A PHE 439.A N ASP 435.A O no hydrogen 3.243 N/A ALA 440.A N MET 436.A O no hydrogen 2.867 N/A ASN 441.A N LYS 437.A O no hydrogen 2.989 N/A HIS 442.A N PHE 439.A O no hydrogen 3.005 N/A HIS 442.A ND1 SER 566.A OG no hydrogen 2.829 N/A SER 443.A N ALA 440.A O no hydrogen 2.935 N/A SER 443.A OG LEU 368.A O no hydrogen 2.655 N/A THR 444.A N ASP 458.A OD1 no hydrogen 2.755 N/A THR 444.A OG1 ARG 456.A O no hydrogen 2.765 N/A THR 444.A OG1 ASP 458.A OD1 no hydrogen 3.566 N/A ARG 445.A N ASP 458.A OD1 no hydrogen 2.943 N/A ARG 445.A NH1 ASN 334.A OD1 no hydrogen 2.801 N/A ARG 445.A NH1 GLY 455.A O no hydrogen 2.877 N/A ARG 445.A NH2 ASN 334.A OD1 no hydrogen 2.864 N/A MET 446.A N SER 454.A O no hydrogen 2.708 N/A ASN 448.A N ALA 452.A O no hydrogen 2.964 N/A LYS 449.A N ASP 447.A OD1 no hydrogen 2.862 N/A THR 450.A N ASN 448.A OD1 no hydrogen 3.085 N/A ALA 452.A N ASN 448.A OD1 no hydrogen 2.824 N/A LYS 453.A N VAL 332.A O no hydrogen 3.133 N/A LYS 453.A NZ THR 450.A O no hydrogen 2.880 N/A SER 454.A N MET 446.A O no hydrogen 2.930 N/A SER 454.A OG THR 333.A O no hydrogen 2.716 N/A ARG 456.A NE GLU 457.A O no hydrogen 2.778 N/A ARG 456.A NH1 ASN 441.A OD1 no hydrogen 3.184 N/A ARG 456.A NH2 ASN 441.A OD1 no hydrogen 2.618 N/A ARG 456.A NH2 GLU 457.A O no hydrogen 3.165 N/A ALA 459.A N ASN 441.A O no hydrogen 2.770 N/A ARG 463.A N ALA 459.A O no hydrogen 2.994 N/A ARG 463.A NE LYS 568.A O no hydrogen 3.220 N/A ARG 463.A NH1 ASP 467.A OD1 no hydrogen 2.694 N/A ARG 463.A NH1 GLU 576.A OE1 no hydrogen 3.084 N/A ARG 463.A NH2 LYS 568.A O no hydrogen 2.894 N/A ARG 463.A NH2 GLU 576.A OE1 no hydrogen 3.048 N/A ARG 463.A NH2 GLU 576.A OE2 no hydrogen 2.619 N/A ALA 464.A N PRO 460.A O no hydrogen 2.951 N/A LYS 465.A N GLU 461.A O no hydrogen 3.120 N/A LYS 465.A NZ GLU 485.A OE1 no hydrogen 2.583 N/A LYS 465.A NZ GLU 489.A OE1 no hydrogen 2.985 N/A MET 466.A N LEU 462.A O no hydrogen 2.973 N/A ASP 467.A N ARG 463.A O no hydrogen 3.052 N/A GLU 468.A N ALA 464.A O no hydrogen 3.135 N/A LEU 469.A N LYS 465.A O no hydrogen 3.060 N/A TRP 470.A N MET 466.A O no hydrogen 3.122 N/A TRP 470.A NE1 GLU 576.A OE1 no hydrogen 2.911 N/A ASN 471.A N ASP 467.A O no hydrogen 2.916 N/A LYS 472.A N GLU 468.A O no hydrogen 2.863 N/A LYS 472.A NZ GLU 468.A OE1 no hydrogen 3.186 N/A LEU 473.A N LEU 469.A O no hydrogen 2.897 N/A SER 474.A N TRP 470.A O no hydrogen 2.877 N/A SER 474.A OG TRP 470.A O no hydrogen 2.803 N/A SER 474.A OG ASN 471.A O no hydrogen 3.195 N/A SER 475.A N ASN 471.A O no hydrogen 3.169 N/A SER 475.A N LYS 472.A O no hydrogen 3.229 N/A SER 475.A OG ASN 471.A O no hydrogen 2.892 N/A LYS 476.A N LEU 473.A O no hydrogen 3.065 N/A GLU 477.A N LYS 472.A O no hydrogen 2.938 N/A SER 480.A N ASP 478.A OD2 no hydrogen 2.796 N/A SER 480.A OG ASP 478.A OD2 no hydrogen 2.747 N/A ILE 483.A N ALA 479.A O no hydrogen 2.887 N/A GLU 484.A N SER 480.A O no hydrogen 2.970 N/A GLU 485.A N ALA 481.A O no hydrogen 3.057 N/A LEU 486.A N LEU 482.A O no hydrogen 2.946 N/A TYR 487.A N ILE 483.A O no hydrogen 3.085 N/A TYR 487.A OH ASP 531.A OD1 no hydrogen 2.542 N/A GLY 488.A N GLU 484.A O no hydrogen 3.316 N/A GLU 489.A N GLU 485.A O no hydrogen 3.191 N/A PHE 490.A N LEU 486.A O no hydrogen 2.902 N/A ALA 491.A N TYR 487.A O no hydrogen 2.957 N/A ARG 492.A N GLY 488.A O no hydrogen 2.909 N/A ARG 492.A NH1 ASP 435.A OD1 no hydrogen 2.730 N/A ARG 492.A NH1 GLU 495.A OE1 no hydrogen 3.254 N/A ARG 492.A NH2 ASP 435.A OD1 no hydrogen 2.530 N/A MET 493.A N GLU 489.A O no hydrogen 2.925 N/A GLU 494.A N PHE 490.A O no hydrogen 3.241 N/A GLU 495.A N ALA 491.A O no hydrogen 3.072 N/A ALA 496.A N ARG 492.A O no hydrogen 2.984 N/A CYS 497.A N MET 493.A O no hydrogen 3.115 N/A CYS 497.A SG MET 493.A O no hydrogen 3.417 N/A CYS 497.A SG LEU 516.A O no hydrogen 4.003 N/A ASN 498.A N GLU 494.A O no hydrogen 3.103 N/A ASN 499.A N GLU 495.A O no hydrogen 2.919 N/A ASN 499.A ND2 ASP 435.A OD2 no hydrogen 2.413 N/A LEU 500.A N ALA 496.A O no hydrogen 2.905 N/A LYS 501.A N CYS 497.A O no hydrogen 2.825 N/A LYS 501.A NZ ASP 517.A OD1 no hydrogen 3.268 N/A ALA 502.A N ASN 498.A O no hydrogen 2.998 N/A ASN 503.A N ASN 499.A O no hydrogen 2.852 N/A ASN 503.A ND2 ASN 499.A O no hydrogen 3.242 N/A ASN 503.A ND2 ASN 499.A OD1 no hydrogen 2.697 N/A LEU 504.A N LEU 500.A O no hydrogen 2.810 N/A ALA 508.A N PRO 505.A O no hydrogen 3.027 N/A LEU 509.A N PRO 505.A O no hydrogen 2.932 N/A GLU 510.A N GLU 506.A O no hydrogen 2.843 N/A GLU 511.A N ALA 508.A O no hydrogen 3.104 N/A CYS 512.A N LEU 509.A O no hydrogen 3.183 N/A CYS 512.A SG ALA 508.A O no hydrogen 3.529 N/A SER 513.A N LEU 509.A O no hydrogen 3.048 N/A GLN 515.A N GLN 515.A OE1 no hydrogen 2.847 N/A GLN 515.A NE2 GLY 366.A O no hydrogen 2.921 N/A LEU 516.A N CYS 512.A O no hydrogen 2.997 N/A ASP 517.A N SER 513.A O no hydrogen 3.030 N/A GLU 518.A N ARG 514.A O no hydrogen 2.983 N/A LEU 519.A N GLN 515.A O no hydrogen 3.079 N/A ILE 520.A N LEU 516.A O no hydrogen 3.147 N/A THR 521.A N ASP 517.A O no hydrogen 2.980 N/A THR 521.A OG1 ASP 517.A O no hydrogen 3.250 N/A LEU 522.A N GLU 518.A O no hydrogen 2.925 N/A ALA 523.A N LEU 519.A O no hydrogen 2.799 N/A GLN 524.A N ILE 520.A O no hydrogen 2.831 N/A GLN 524.A NE2 GLU 494.A OE1 no hydrogen 3.006 N/A GLY 525.A N THR 521.A O no hydrogen 2.892 N/A ASP 526.A N LEU 522.A O no hydrogen 2.658 N/A LYS 527.A N ALA 523.A O no hydrogen 2.878 N/A LYS 527.A NZ ASP 531.A OD2 no hydrogen 2.689 N/A ALA 528.A N GLN 524.A O no hydrogen 2.981 N/A SER 529.A N GLY 525.A O no hydrogen 2.964 N/A SER 529.A OG GLY 525.A O no hydrogen 2.812 N/A LEU 530.A N ASP 526.A O no hydrogen 3.103 N/A ASP 531.A N LYS 527.A O no hydrogen 2.978 N/A MET 532.A N ALA 528.A O no hydrogen 2.898 N/A ILE 533.A N SER 529.A O no hydrogen 2.998 N/A VAL 534.A N LEU 530.A O no hydrogen 2.898 N/A ALA 535.A N ASP 531.A O no hydrogen 3.018 N/A GLN 536.A N MET 532.A O no hydrogen 3.361 N/A LEU 537.A N ILE 533.A O no hydrogen 3.053 N/A ASN 538.A N VAL 534.A O no hydrogen 2.888 N/A GLU 539.A N GLN 536.A O no hydrogen 3.072 N/A ASP 540.A N ALA 535.A O no hydrogen 2.760 N/A ALA 543.A N ASP 540.A OD1 no hydrogen 3.191 N/A TYR 544.A N ASP 540.A O no hydrogen 3.079 N/A GLU 545.A N THR 541.A O no hydrogen 3.109 N/A SER 546.A N GLU 542.A O no hydrogen 3.168 N/A ALA 547.A N ALA 543.A O no hydrogen 2.966 N/A LYS 548.A N TYR 544.A O no hydrogen 2.775 N/A LYS 548.A NZ GLU 545.A OE1 no hydrogen 3.548 N/A GLU 549.A N GLU 545.A O no hydrogen 3.057 N/A ALA 551.A N ALA 547.A O no hydrogen 2.884 N/A GLN 552.A N LYS 548.A O no hydrogen 2.877 N/A GLN 552.A NE2 GLN 552.A O no hydrogen 3.431 N/A GLN 552.A NE2 ASN 556.A OD1 no hydrogen 2.867 N/A ASN 553.A N GLU 549.A O no hydrogen 2.890 N/A LYS 554.A N ILE 550.A O no hydrogen 2.867 N/A LYS 554.A NZ GLN 524.A OE1 no hydrogen 2.734 N/A LEU 555.A N ALA 551.A O no hydrogen 2.979 N/A ASN 556.A N GLN 552.A O no hydrogen 2.838 N/A THR 557.A N ASN 553.A O no hydrogen 2.993 N/A THR 557.A OG1 ASN 553.A O no hydrogen 3.127 N/A ALA 558.A N LYS 554.A O no hydrogen 3.088 N/A LEU 559.A N LEU 555.A O no hydrogen 2.939 N/A SER 560.A N ASN 556.A O no hydrogen 3.080 N/A SER 560.A OG ASN 556.A O no hydrogen 3.392 N/A SER 561.A OG GLU 518.A OE2 no hydrogen 2.923 N/A VAL 564.A N GLY 366.A O no hydrogen 3.046 N/A SER 566.A OG HIS 442.A ND1 no hydrogen 2.829 N/A GLU 567.A N GLU 567.A OE1 no hydrogen 2.878 N/A VAL 569.A N SER 566.A O no hydrogen 3.209 N/A ALA 570.A N SER 566.A OG no hydrogen 2.812 N/A GLN 571.A N SER 566.A O no hydrogen 3.016 N/A SER 572.A N GLU 567.A O no hydrogen 2.998 N/A SER 572.A OG GLU 576.A OE2 no hydrogen 2.733 N/A PHE 573.A N VAL 569.A O no hydrogen 2.860 N/A ILE 574.A N GLN 571.A O no hydrogen 3.188 N/A GLU 576.A N SER 572.A O no hydrogen 2.794 N/A ALA 577.A N PHE 573.A O no hydrogen 2.899 N/A LEU 578.A N ILE 574.A O no hydrogen 2.907 N/A SER 579.A N GLN 575.A O no hydrogen 3.116 N/A SER 579.A N GLU 576.A O no hydrogen 3.306 N/A SER 579.A OG GLN 575.A O no hydrogen 3.104 N/A PHE 580.A N ALA 577.A O no hydrogen 3.355 N/A LEU 582.A N GLN 536.A OE1 no hydrogen 3.110 N/A THR 583.A N ASP 581.A OD2 no hydrogen 3.048 N/A THR 583.A OG1 ASP 581.A OD2 no hydrogen 2.632 N/A