Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 6up4_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): SER 2.A OG SER 788.A OG no hydrogen 3.203 N/A ASP 5.A N SER 2.A O no hydrogen 3.000 N/A ARG 6.A NH1 TYR 3.A O no hydrogen 3.476 N/A THR 8.A OG1 ASP 5.A O no hydrogen 2.687 N/A TYR 10.A OH SER 147.A OG no hydrogen 2.570 N/A LEU 12.A N THR 8.A O no hydrogen 3.051 N/A ASN 15.A ND2 ALA 97.A O no hydrogen 3.639 N/A GLU 16.A N GLN 145.A OE1 no hydrogen 2.826 N/A ASN 18.A N GLU 16.A O no hydrogen 2.717 N/A SER 20.A OG ASN 18.A OD1 no hydrogen 3.467 N/A LEU 21.A N ASN 18.A OD1 no hydrogen 3.119 N/A ASP 22.A N ASN 18.A O no hydrogen 3.010 N/A HIS 24.A N SER 20.A O no hydrogen 2.838 N/A LEU 25.A N LEU 21.A O no hydrogen 2.939 N/A LEU 26.A N ASP 22.A O no hydrogen 3.439 N/A GLU 27.A N GLN 23.A O no hydrogen 2.829 N/A ASP 28.A N HIS 24.A O no hydrogen 2.939 N/A LEU 29.A N LEU 25.A O no hydrogen 3.106 N/A GLN 30.A NE2 LEU 26.A O no hydrogen 2.508 N/A LYS 32.A N ASP 28.A O no hydrogen 2.826 N/A LYS 32.A NZ ARG 121.A O no hydrogen 2.448 N/A LYS 32.A NZ GLU 123.A OE2 no hydrogen 2.342 N/A LYS 33.A N LEU 29.A O no hydrogen 3.214 N/A THR 34.A N ARG 31.A O no hydrogen 3.087 N/A THR 34.A OG1 ARG 31.A O no hydrogen 3.129 N/A ASP 35.A N LYS 32.A O no hydrogen 3.003 N/A ILE 39.A N ASP 35.A O no hydrogen 3.045 N/A GLU 40.A N PRO 36.A O no hydrogen 2.825 N/A MET 41.A N ARG 37.A O no hydrogen 3.194 N/A GLN 42.A N TYR 38.A O no hydrogen 2.779 N/A ARG 43.A N ILE 39.A O no hydrogen 3.135 N/A ARG 43.A N GLU 40.A O no hydrogen 3.308 N/A ARG 45.A N MET 41.A O no hydrogen 3.066 N/A ARG 45.A NE GLN 80.A OE1 no hydrogen 2.628 N/A ARG 45.A NH1 GLN 42.A OE1 no hydrogen 2.954 N/A ARG 45.A NH2 GLN 80.A OE1 no hydrogen 3.453 N/A LYS 46.A N GLN 42.A O no hydrogen 3.284 N/A LEU 48.A N ARG 45.A O no hydrogen 3.100 N/A SER 50.A N CYS 75.A O no hydrogen 3.064 N/A SER 50.A OG CYS 75.A O no hydrogen 3.204 N/A TYR 51.A N LEU 48.A O no hydrogen 2.974 N/A MET 53.A N SER 50.A O no hydrogen 2.884 N/A GLN 54.A N TYR 51.A O no hydrogen 3.042 N/A GLU 56.A N MET 53.A O no hydrogen 2.861 N/A LEU 57.A N MET 53.A O no hydrogen 2.904 N/A LEU 57.A N GLN 54.A O no hydrogen 3.137 N/A VAL 58.A N GLN 54.A O no hydrogen 3.068 N/A LEU 60.A N GLU 56.A O no hydrogen 3.343 N/A ILE 61.A N LEU 57.A O no hydrogen 2.935 N/A ASN 62.A N VAL 58.A O no hydrogen 2.747 N/A ASN 62.A ND2 ASN 88.A OD1 no hydrogen 3.192 N/A ASN 63.A N ASN 59.A O no hydrogen 3.083 N/A ASN 63.A N LEU 60.A O no hydrogen 3.203 N/A HIS 64.A N LEU 60.A O no hydrogen 3.091 N/A HIS 64.A ND1 LEU 60.A O no hydrogen 3.230 N/A GLN 65.A NE2 LEU 195.A O no hydrogen 3.558 N/A GLN 65.A NE2 LEU 201.A O no hydrogen 3.663 N/A THR 67.A N VAL 203.A O no hydrogen 2.993 N/A VAL 68.A N PRO 223.A O no hydrogen 3.106 N/A ILE 69.A N LEU 205.A O no hydrogen 2.670 N/A SER 70.A N ILE 225.A O no hydrogen 2.674 N/A GLY 71.A N SER 207.A O no hydrogen 3.099 N/A CYS 75.A N GLU 72.A O no hydrogen 3.353 N/A CYS 75.A SG GLU 72.A O no hydrogen 3.274 N/A LYS 77.A NZ GLY 71.A O no hydrogen 2.806 N/A LYS 77.A NZ GLU 72.A O no hydrogen 3.517 N/A THR 78.A OG1 ASP 175.A OD1 no hydrogen 3.527 N/A THR 78.A OG1 ASP 175.A OD2 no hydrogen 2.621 N/A THR 78.A OG1 GLU 176.A OE2 no hydrogen 2.971 N/A GLN 80.A N GLY 76.A O no hydrogen 2.764 N/A GLN 80.A NE2 THR 79.A OG1 no hydrogen 2.688 N/A GLN 80.A NE2 GLU 120.A OE1 no hydrogen 3.103 N/A GLN 80.A NE2 GLU 120.A OE2 no hydrogen 3.506 N/A THR 82.A OG1 TYR 150.A OH no hydrogen 2.803 N/A GLN 83.A NE2 THR 79.A O no hydrogen 2.804 N/A GLN 83.A NE2 GLU 120.A OE1 no hydrogen 2.777 N/A PHE 84.A N GLN 80.A O no hydrogen 2.747 N/A ILE 85.A N VAL 81.A O no hydrogen 3.087 N/A LEU 86.A N THR 82.A O no hydrogen 3.172 N/A ASP 87.A N GLN 83.A O no hydrogen 3.001 N/A ASN 88.A N PHE 84.A O no hydrogen 3.091 N/A TYR 89.A N ILE 85.A O no hydrogen 3.017 N/A ILE 90.A N LEU 86.A O no hydrogen 2.713 N/A GLU 91.A N ASP 87.A O no hydrogen 2.909 N/A ARG 92.A N ASN 88.A O no hydrogen 3.183 N/A ARG 92.A NH1 ASN 88.A OD1 no hydrogen 2.775 N/A GLY 93.A N ILE 90.A O no hydrogen 2.991 N/A SER 96.A N ASP 22.A OD1 no hydrogen 2.870 N/A SER 96.A OG ASN 18.A O no hydrogen 3.288 N/A SER 96.A OG ASP 22.A OD1 no hydrogen 2.549 N/A ALA 97.A N LYS 94.A O no hydrogen 3.088 N/A ARG 99.A N SER 170.A OG no hydrogen 2.960 N/A ARG 99.A NE SER 168.A O no hydrogen 2.729 N/A ARG 99.A NH1 LYS 144.A O no hydrogen 2.711 N/A ARG 99.A NH2 TYR 10.A O no hydrogen 2.642 N/A ARG 99.A NH2 SER 168.A OG no hydrogen 2.736 N/A ILE 100.A N SER 147.A O no hydrogen 2.879 N/A VAL 101.A N HIS 171.A O no hydrogen 2.849 N/A CYS 102.A N LEU 149.A O no hydrogen 2.816 N/A CYS 102.A SG THR 103.A O no hydrogen 4.007 N/A CYS 102.A SG VAL 173.A O no hydrogen 3.778 N/A THR 103.A N VAL 173.A O no hydrogen 2.738 N/A GLN 104.A N CYS 151.A O no hydrogen 2.787 N/A GLN 104.A NE2 ASP 175.A OD2 no hydrogen 2.907 N/A ARG 106.A NH1 GLU 179.A OE1 no hydrogen 3.404 N/A ARG 106.A NH1 GLU 179.A OE2 no hydrogen 2.999 N/A ARG 106.A NH2 GLU 179.A OE1 no hydrogen 3.072 N/A SER 109.A N ARG 106.A O no hydrogen 3.030 N/A ALA 110.A N ARG 106.A O no hydrogen 3.203 N/A ILE 111.A N ARG 107.A O no hydrogen 3.333 N/A SER 112.A N ILE 108.A O no hydrogen 2.941 N/A SER 112.A OG ILE 108.A O no hydrogen 2.729 N/A VAL 113.A N SER 109.A O no hydrogen 2.911 N/A ALA 114.A N ALA 110.A O no hydrogen 3.282 N/A GLU 115.A N ILE 111.A O no hydrogen 2.925 N/A ARG 116.A N SER 112.A O no hydrogen 2.894 N/A VAL 117.A N VAL 113.A O no hydrogen 2.827 N/A ALA 118.A N ALA 114.A O no hydrogen 2.971 N/A THR 119.A N GLU 115.A O no hydrogen 2.957 N/A THR 119.A OG1 GLU 115.A O no hydrogen 2.766 N/A GLU 120.A N ARG 116.A O no hydrogen 2.876 N/A ARG 121.A N ALA 118.A O no hydrogen 3.054 N/A ARG 121.A NE SER 130.A OG no hydrogen 3.023 N/A ARG 121.A NH1 GLN 83.A OE1 no hydrogen 3.392 N/A ARG 121.A NH1 ASP 87.A OD1 no hydrogen 3.121 N/A ARG 121.A NH1 ASP 87.A OD2 no hydrogen 3.159 N/A ARG 121.A NH2 ASP 87.A OD1 no hydrogen 2.858 N/A ALA 122.A N THR 119.A O no hydrogen 3.092 N/A GLU 123.A N ALA 118.A O no hydrogen 3.063 N/A SER 124.A OG CYS 125.A O no hydrogen 3.482 N/A GLY 126.A N THR 131.A O no hydrogen 2.797 N/A ASN 127.A ND2 CYS 125.A O no hydrogen 3.178 N/A GLY 128.A N LEU 141.A O no hydrogen 3.357 N/A ASN 129.A N GLY 126.A O no hydrogen 2.819 N/A SER 130.A N GLU 123.A OE1 no hydrogen 2.934 N/A SER 130.A OG GLU 123.A OE1 no hydrogen 2.483 N/A SER 130.A OG GLU 123.A OE2 no hydrogen 3.384 N/A GLY 132.A N ILE 148.A O no hydrogen 2.980 N/A TYR 133.A N ARG 140.A O no hydrogen 3.006 N/A GLN 134.A N TYR 150.A O no hydrogen 2.854 N/A GLN 134.A NE2 ILE 135.A O no hydrogen 2.845 N/A ILE 135.A N GLN 138.A O no hydrogen 2.832 N/A ARG 136.A NH1 TYR 3.A OH no hydrogen 2.609 N/A LEU 137.A N ASP 7.A OD1 no hydrogen 3.456 N/A LEU 137.A N ASP 7.A OD2 no hydrogen 2.877 N/A GLN 138.A N ILE 135.A O no hydrogen 3.242 N/A GLN 138.A NE2 TYR 133.A OH no hydrogen 2.773 N/A ARG 140.A N TYR 133.A O no hydrogen 2.967 N/A ARG 140.A NE SER 139.A O no hydrogen 2.903 N/A ARG 143.A N ASN 129.A O no hydrogen 2.691 N/A ARG 143.A NE GLN 145.A O no hydrogen 3.095 N/A ARG 143.A NE GLY 146.A O no hydrogen 3.009 N/A ARG 143.A NH2 GLY 146.A O no hydrogen 3.124 N/A LYS 144.A NZ GLU 14.A O no hydrogen 2.986 N/A LYS 144.A NZ GLU 16.A OE1 no hydrogen 3.341 N/A LYS 144.A NZ GLN 145.A OE1 no hydrogen 2.822 N/A GLN 145.A NE2 ASN 15.A OD1 no hydrogen 3.249 N/A GLN 145.A NE2 SER 96.A O no hydrogen 2.273 N/A SER 147.A N CYS 98.A O no hydrogen 3.097 N/A SER 147.A OG TYR 10.A OH no hydrogen 2.570 N/A SER 147.A OG ARG 143.A O no hydrogen 3.197 N/A ILE 148.A N SER 130.A O no hydrogen 2.836 N/A LEU 149.A N ILE 100.A O no hydrogen 2.762 N/A TYR 150.A N GLY 132.A O no hydrogen 2.874 N/A TYR 150.A OH THR 78.A O no hydrogen 2.959 N/A CYS 151.A N CYS 102.A O no hydrogen 2.951 N/A CYS 151.A SG THR 152.A O no hydrogen 3.550 N/A THR 153.A OG1 GLN 183.A OE1 no hydrogen 3.210 N/A ILE 156.A N THR 152.A O no hydrogen 3.384 N/A LEU 157.A N THR 153.A O no hydrogen 3.073 N/A GLN 158.A N GLY 154.A O no hydrogen 2.825 N/A TRP 159.A N ILE 155.A O no hydrogen 2.776 N/A TRP 159.A NE1 ASP 7.A O no hydrogen 3.025 N/A LEU 160.A N ILE 156.A O no hydrogen 2.868 N/A GLN 161.A N GLN 158.A O no hydrogen 3.030 N/A SER 162.A N TRP 159.A O no hydrogen 2.870 N/A SER 162.A OG ILE 4.A O no hydrogen 3.047 N/A ASP 163.A N TRP 159.A O no hydrogen 2.836 N/A ARG 165.A N ASP 163.A OD1 no hydrogen 3.027 N/A LEU 166.A N ASP 163.A O no hydrogen 3.021 N/A SER 167.A N ASP 163.A OD2 no hydrogen 2.893 N/A SER 167.A OG ASP 163.A OD2 no hydrogen 2.715 N/A SER 168.A OG LEU 11.A O no hydrogen 2.872 N/A VAL 169.A N LEU 166.A O no hydrogen 3.072 N/A SER 170.A N ARG 99.A O no hydrogen 3.183 N/A SER 170.A OG HIS 171.A ND1 no hydrogen 2.520 N/A HIS 171.A ND1 SER 170.A OG no hydrogen 2.520 N/A ILE 172.A N LYS 202.A O no hydrogen 2.937 N/A VAL 173.A N VAL 101.A O no hydrogen 2.640 N/A LEU 174.A N ILE 204.A O no hydrogen 2.907 N/A ASP 175.A N THR 103.A O no hydrogen 3.361 N/A GLU 176.A N ASP 175.A OD1 no hydrogen 2.723 N/A ILE 177.A N MET 206.A O no hydrogen 3.395 N/A HIS 178.A NE2 THR 385.A OG1 no hydrogen 2.937 N/A GLU 179.A N GLU 176.A O no hydrogen 2.959 N/A ARG 180.A N ILE 177.A O no hydrogen 3.161 N/A ARG 180.A NE ASP 185.A OD1 no hydrogen 2.866 N/A ARG 180.A NE ASP 185.A OD2 no hydrogen 3.056 N/A ARG 180.A NH1 ASP 489.A OD2 no hydrogen 3.037 N/A ARG 180.A NH2 ASP 185.A OD2 no hydrogen 2.685 N/A ARG 180.A NH2 ASP 489.A OD2 no hydrogen 2.880 N/A LEU 182.A N GLU 459.A OE1 no hydrogen 3.104 N/A ASP 185.A N ASN 181.A O no hydrogen 3.037 N/A VAL 186.A N LEU 182.A O no hydrogen 2.942 N/A LEU 187.A N GLN 183.A O no hydrogen 2.857 N/A MET 188.A N SER 184.A O no hydrogen 3.076 N/A THR 189.A N ASP 185.A O no hydrogen 3.436 N/A THR 189.A OG1 TYR 218.A OH no hydrogen 2.673 N/A VAL 190.A N VAL 186.A O no hydrogen 2.984 N/A ILE 191.A N LEU 187.A O no hydrogen 2.810 N/A LYS 192.A N MET 188.A O no hydrogen 2.935 N/A LYS 192.A NZ TYR 218.A O no hydrogen 3.078 N/A ASP 193.A N THR 189.A O no hydrogen 3.326 N/A LEU 194.A N VAL 190.A O no hydrogen 3.157 N/A LEU 194.A N ILE 191.A O no hydrogen 3.005 N/A LEU 195.A N ILE 191.A O no hydrogen 3.156 N/A LEU 195.A N LYS 192.A O no hydrogen 3.336 N/A PHE 197.A N LEU 194.A O no hydrogen 3.112 N/A ARG 198.A N LEU 195.A O no hydrogen 3.393 N/A ARG 198.A NE ASP 200.A OD1 no hydrogen 2.993 N/A ARG 198.A NH1 ARG 165.A O no hydrogen 3.084 N/A ARG 198.A NH1 LEU 166.A O no hydrogen 2.810 N/A ARG 198.A NH1 VAL 169.A O no hydrogen 3.556 N/A ARG 198.A NH2 VAL 169.A O no hydrogen 3.068 N/A ARG 198.A NH2 ASP 200.A OD2 no hydrogen 3.040 N/A ASP 200.A N ASP 200.A OD1 no hydrogen 2.484 N/A LEU 201.A N ARG 198.A O no hydrogen 3.418 N/A LYS 202.A N SER 170.A O no hydrogen 3.056 N/A LYS 202.A NZ ILE 61.A O no hydrogen 2.948 N/A LYS 202.A NZ ASN 62.A O no hydrogen 3.137 N/A VAL 203.A N GLN 65.A O no hydrogen 2.793 N/A ILE 204.A N ILE 172.A O no hydrogen 3.081 N/A LEU 205.A N THR 67.A O no hydrogen 2.752 N/A MET 206.A N LEU 174.A O no hydrogen 2.963 N/A SER 207.A N ILE 69.A O no hydrogen 2.834 N/A SER 207.A OG ALA 208.A O no hydrogen 2.579 N/A ALA 208.A N HIS 178.A ND1 no hydrogen 3.333 N/A ALA 212.A N THR 209.A O no hydrogen 3.422 N/A LYS 214.A N ASN 211.A O no hydrogen 3.157 N/A SER 216.A OG CYS 222.A O no hydrogen 3.104 N/A GLU 217.A N GLU 213.A O no hydrogen 2.900 N/A TYR 218.A N LYS 214.A O no hydrogen 2.935 N/A TYR 218.A OH THR 189.A OG1 no hydrogen 2.673 N/A TYR 218.A OH ARG 486.A O no hydrogen 2.765 N/A PHE 219.A N PHE 215.A O no hydrogen 3.220 N/A PHE 219.A N SER 216.A O no hydrogen 2.963 N/A GLY 220.A N GLU 217.A O no hydrogen 3.176 N/A CYS 222.A N SER 216.A O no hydrogen 3.473 N/A CYS 222.A SG PRO 223.A O no hydrogen 3.853 N/A ILE 225.A N VAL 68.A O no hydrogen 3.005 N/A ILE 227.A N SER 70.A O no hydrogen 2.874 N/A GLY 229.A N GLU 72.A OE1 no hydrogen 3.134 N/A PHE 232.A N GLY 433.A O no hydrogen 2.629 N/A VAL 235.A N GLY 438.A O no hydrogen 2.979 N/A TYR 237.A N CYS 440.A O no hydrogen 2.888 N/A TYR 237.A OH HIS 439.A ND1 no hydrogen 2.917 N/A LEU 238.A N ASP 241.A OD2 no hydrogen 2.918 N/A LEU 239.A N TYR 444.A O no hydrogen 2.954 N/A GLU 240.A N GLU 240.A OE1 no hydrogen 2.559 N/A ILE 242.A N LEU 238.A O no hydrogen 2.989 N/A ILE 243.A N LEU 239.A O no hydrogen 2.906 N/A GLU 244.A N GLU 240.A O no hydrogen 2.965 N/A LYS 245.A N ASP 241.A O no hydrogen 2.772 N/A ILE 246.A N ILE 242.A O no hydrogen 3.042 N/A ARG 247.A N GLU 244.A O no hydrogen 3.314 N/A ARG 247.A NH1 GLU 244.A O no hydrogen 2.710 N/A TYR 248.A N ILE 243.A O no hydrogen 3.016 N/A TYR 248.A OH ASP 308.A OD2 no hydrogen 3.141 N/A LYS 253.A N ASP 251.A O no hydrogen 2.863 N/A LYS 256.A N ILE 562.A O no hydrogen 2.383 N/A GLN 261.A N GLY 258.A O no hydrogen 2.898 N/A GLN 261.A NE2 PHE 560.A O no hydrogen 3.599 N/A GLY 262.A N PHE 259.A O no hydrogen 3.299 N/A HIS 263.A N GLY 258.A O no hydrogen 2.993 N/A GLU 268.A N GLU 268.A OE2 no hydrogen 2.799 N/A LYS 269.A NZ GLU 418.A OE1 no hydrogen 2.908 N/A LYS 269.A NZ GLU 418.A OE2 no hydrogen 3.380 N/A GLU 270.A N ARG 266.A O no hydrogen 3.108 N/A GLU 271.A N GLN 267.A O no hydrogen 3.244 N/A LYS 272.A NZ LEU 451.A O no hydrogen 3.295 N/A LYS 272.A NZ ASP 453.A OD1 no hydrogen 2.172 N/A GLU 273.A N LYS 269.A O no hydrogen 3.170 N/A ALA 274.A N GLU 270.A O no hydrogen 3.142 N/A ILE 275.A N GLU 271.A O no hydrogen 3.310 N/A TYR 276.A N LYS 272.A O no hydrogen 2.907 N/A LYS 277.A N GLU 273.A O no hydrogen 2.899 N/A GLU 278.A N ALA 274.A O no hydrogen 2.886 N/A ARG 279.A N ILE 275.A O no hydrogen 3.025 N/A TYR 283.A N ARG 279.A O no hydrogen 3.109 N/A ILE 284.A N TRP 280.A O no hydrogen 2.977 N/A LYS 285.A N PRO 281.A O no hydrogen 3.161 N/A GLU 286.A N ALA 282.A O no hydrogen 3.208 N/A LEU 287.A N TYR 283.A O no hydrogen 3.073 N/A ARG 288.A N ILE 284.A O no hydrogen 3.063 N/A ARG 288.A N LYS 285.A O no hydrogen 3.239 N/A ARG 288.A NH1 GLN 300.A OE1 no hydrogen 3.421 N/A ARG 288.A NH2 GLN 300.A OE1 no hydrogen 3.211 N/A THR 289.A N GLU 286.A O no hydrogen 3.109 N/A THR 289.A OG1 GLU 286.A O no hydrogen 2.761 N/A ARG 290.A N LEU 287.A O no hydrogen 2.794 N/A TYR 291.A N LEU 287.A O no hydrogen 2.804 N/A TYR 291.A OH ASP 241.A OD1 no hydrogen 2.518 N/A SER 292.A N GLU 244.A OE1 no hydrogen 3.100 N/A SER 292.A OG GLU 244.A OE1 no hydrogen 3.503 N/A SER 292.A OG THR 295.A OG1 no hydrogen 3.054 N/A THR 295.A N SER 292.A OG no hydrogen 2.953 N/A THR 295.A OG1 GLU 244.A OE1 no hydrogen 2.458 N/A THR 295.A OG1 SER 292.A OG no hydrogen 3.054 N/A VAL 296.A N SER 292.A O no hydrogen 3.061 N/A ASP 297.A N ALA 293.A O no hydrogen 2.750 N/A VAL 298.A N SER 294.A O no hydrogen 3.003 N/A LEU 299.A N THR 295.A O no hydrogen 2.899 N/A GLN 300.A N VAL 296.A O no hydrogen 2.887 N/A MET 301.A N VAL 298.A O no hydrogen 3.126 N/A MET 302.A N LEU 299.A O no hydrogen 3.196 N/A ASP 305.A N ASP 303.A OD1 no hydrogen 2.649 N/A LEU 311.A N ASP 308.A OD1 no hydrogen 2.855 N/A ILE 312.A N ASP 308.A O no hydrogen 3.160 N/A ALA 313.A N LEU 309.A O no hydrogen 2.856 N/A ALA 314.A N ASN 310.A O no hydrogen 3.000 N/A LEU 315.A N LEU 311.A O no hydrogen 2.842 N/A ILE 316.A N ILE 312.A O no hydrogen 2.911 N/A ARG 317.A N ALA 313.A O no hydrogen 3.191 N/A ARG 317.A NE GLN 348.A OE1 no hydrogen 3.258 N/A ARG 317.A NH2 GLN 348.A OE1 no hydrogen 2.454 N/A TYR 318.A N ALA 314.A O no hydrogen 2.951 N/A ILE 319.A N LEU 315.A O no hydrogen 2.920 N/A VAL 320.A N ILE 316.A O no hydrogen 2.975 N/A LEU 321.A N ARG 317.A O no hydrogen 3.292 N/A LEU 321.A N TYR 318.A O no hydrogen 3.284 N/A GLU 322.A N TYR 318.A O no hydrogen 2.892 N/A GLU 322.A N ILE 319.A O no hydrogen 3.398 N/A GLU 323.A N ILE 319.A O no hydrogen 3.074 N/A ALA 327.A N ASP 391.A O no hydrogen 3.134 N/A ILE 328.A N LYS 375.A O no hydrogen 2.809 N/A LEU 329.A N TYR 394.A O no hydrogen 2.949 N/A VAL 330.A N VAL 377.A O no hydrogen 2.783 N/A PHE 331.A N ILE 396.A O no hydrogen 2.977 N/A LEU 332.A N ALA 379.A O no hydrogen 2.826 N/A ASN 337.A ND2 PRO 333.A O no hydrogen 3.014 N/A ILE 338.A N GLY 334.A O no hydrogen 3.399 N/A SER 339.A N TRP 335.A O no hydrogen 3.084 N/A SER 339.A OG TRP 335.A O no hydrogen 3.299 N/A SER 339.A OG ASP 336.A O no hydrogen 3.397 N/A THR 340.A N ASP 336.A O no hydrogen 3.327 N/A THR 340.A OG1 ASP 336.A O no hydrogen 2.644 N/A LEU 341.A N ASN 337.A O no hydrogen 3.115 N/A HIS 342.A N ILE 338.A O no hydrogen 2.993 N/A ASP 343.A N SER 339.A O no hydrogen 2.986 N/A LEU 344.A N THR 340.A O no hydrogen 2.940 N/A LEU 345.A N LEU 341.A O no hydrogen 3.010 N/A MET 346.A N HIS 342.A O no hydrogen 2.916 N/A SER 347.A N ASP 343.A O no hydrogen 3.004 N/A SER 347.A OG ASP 343.A O no hydrogen 3.288 N/A SER 347.A OG LEU 344.A O no hydrogen 3.206 N/A GLN 348.A N LEU 345.A O no hydrogen 3.218 N/A GLN 348.A NE2 LEU 344.A O no hydrogen 3.166 N/A PHE 351.A N GLN 348.A O no hydrogen 3.139 N/A LYS 352.A N VAL 349.A O no hydrogen 3.131 N/A LYS 352.A NZ MET 346.A O no hydrogen 3.416 N/A LYS 355.A N SER 353.A OG no hydrogen 2.791 N/A LYS 355.A NZ ASP 354.A OD2 no hydrogen 2.736 N/A PHE 356.A N SER 353.A O no hydrogen 3.323 N/A LEU 357.A N ARG 374.A O no hydrogen 2.856 N/A ILE 359.A N ILE 376.A O no hydrogen 2.760 N/A LEU 361.A N ILE 378.A O no hydrogen 2.785 N/A LYS 368.A NZ THR 369.A O no hydrogen 3.412 N/A THR 369.A OG1 VAL 373.A O no hydrogen 3.455 N/A THR 369.A OG1 ASP 391.A OD2 no hydrogen 3.071 N/A ARG 374.A N LYS 355.A O no hydrogen 2.882 N/A ARG 374.A NH1 GLU 324.A O no hydrogen 3.123 N/A ARG 374.A NH1 GLY 326.A O no hydrogen 2.852 N/A ARG 374.A NH2 VAL 320.A O no hydrogen 3.304 N/A ARG 374.A NH2 GLU 323.A O no hydrogen 3.114 N/A LYS 375.A NZ VAL 365.A O no hydrogen 2.902 N/A LYS 375.A NZ LYS 367.A O no hydrogen 3.342 N/A LYS 375.A NZ ASP 391.A OD2 no hydrogen 3.327 N/A ILE 376.A N LEU 357.A O no hydrogen 2.636 N/A VAL 377.A N ILE 328.A O no hydrogen 2.831 N/A ILE 378.A N ILE 359.A O no hydrogen 2.829 N/A ALA 379.A N VAL 330.A O no hydrogen 2.796 N/A ILE 382.A N THR 380.A OG1 no hydrogen 3.406 N/A ALA 383.A N THR 380.A O no hydrogen 3.114 N/A GLU 384.A N ASN 381.A O no hydrogen 3.058 N/A THR 385.A OG1 HIS 178.A NE2 no hydrogen 2.937 N/A SER 386.A OG ILE 382.A O no hydrogen 2.605 N/A VAL 393.A N ALA 327.A O no hydrogen 2.907 N/A TYR 394.A N ALA 327.A O no hydrogen 3.260 N/A TYR 394.A OH GLU 324.A O no hydrogen 2.344 N/A VAL 395.A N HIS 439.A O no hydrogen 2.831 N/A ILE 396.A N LEU 329.A O no hydrogen 2.807 N/A ASP 397.A N TYR 441.A O no hydrogen 2.854 N/A GLY 398.A N PHE 331.A O no hydrogen 3.140 N/A GLY 399.A N ASP 397.A OD1 no hydrogen 2.808 N/A LYS 400.A NZ ASP 304.A O no hydrogen 2.297 N/A ILE 401.A N GLU 418.A O no hydrogen 2.743 N/A GLU 403.A N SER 416.A O no hydrogen 2.934 N/A HIS 405.A N THR 414.A O no hydrogen 2.746 N/A HIS 405.A NE2 GLU 403.A OE2 no hydrogen 2.534 N/A ASP 407.A N ILE 412.A O no hydrogen 2.827 N/A ASN 410.A N ASP 407.A O no hydrogen 3.300 N/A ASN 410.A ND2 ASP 407.A OD1 no hydrogen 2.489 N/A ASN 410.A ND2 ASP 407.A OD2 no hydrogen 3.325 N/A ASN 411.A ND2 ASN 411.A O no hydrogen 2.497 N/A ILE 412.A N ASP 407.A O no hydrogen 3.431 N/A THR 414.A N HIS 405.A O no hydrogen 3.004 N/A SER 416.A N GLU 403.A O no hydrogen 3.295 N/A SER 416.A OG GLU 418.A OE2 no hydrogen 2.750 N/A GLU 418.A N ILE 401.A O no hydrogen 2.686 N/A VAL 420.A N GLY 399.A O no hydrogen 2.988 N/A SER 421.A OG ASN 424.A OD1 no hydrogen 3.083 N/A LYS 422.A N ASP 453.A O no hydrogen 2.860 N/A LYS 422.A NZ SER 450.A O no hydrogen 3.294 N/A LYS 422.A NZ LEU 452.A O no hydrogen 3.540 N/A ALA 423.A N ASP 454.A O no hydrogen 3.098 N/A ASN 424.A N SER 421.A OG no hydrogen 3.068 N/A ASN 424.A ND2 GLU 384.A OE1 no hydrogen 2.487 N/A ALA 425.A N SER 421.A O no hydrogen 2.808 N/A LYS 426.A N LYS 422.A O no hydrogen 2.910 N/A GLN 427.A N ALA 423.A O no hydrogen 2.962 N/A ARG 428.A N ASN 424.A O no hydrogen 2.850 N/A ARG 428.A NH1 ASP 397.A OD1 no hydrogen 2.535 N/A ARG 428.A NH2 GLU 384.A OE2 no hydrogen 2.661 N/A LYS 429.A N ALA 425.A O no hydrogen 3.045 N/A LYS 429.A NZ GLU 236.A OE1 no hydrogen 3.121 N/A GLY 430.A N LYS 426.A O no hydrogen 3.007 N/A ARG 431.A N GLN 427.A O no hydrogen 3.205 N/A ARG 431.A NH1 ALA 383.A O no hydrogen 3.378 N/A ALA 432.A N LYS 429.A O no hydrogen 3.106 N/A GLY 433.A N GLY 430.A O no hydrogen 2.880 N/A ARG 434.A NH1 GLY 74.A O no hydrogen 3.133 N/A ARG 434.A NH2 ASP 390.A OD1 no hydrogen 2.954 N/A GLY 438.A N PRO 233.A O no hydrogen 3.088 N/A HIS 439.A N VAL 393.A O no hydrogen 3.002 N/A HIS 439.A ND1 TYR 237.A OH no hydrogen 2.917 N/A CYS 440.A N VAL 235.A O no hydrogen 2.859 N/A CYS 440.A SG VAL 395.A O no hydrogen 3.931 N/A TYR 441.A N VAL 395.A O no hydrogen 2.743 N/A HIS 442.A N TYR 237.A O no hydrogen 2.613 N/A HIS 442.A ND1 ASP 397.A OD2 no hydrogen 2.615 N/A HIS 442.A NE2 GLU 236.A OE2 no hydrogen 3.174 N/A LEU 443.A N ASP 397.A O no hydrogen 2.903 N/A ASN 445.A ND2 TYR 276.A OH no hydrogen 2.898 N/A GLY 446.A N GLU 240.A OE1 no hydrogen 3.140 N/A GLY 446.A N GLU 240.A OE2 no hydrogen 2.839 N/A GLY 446.A N TYR 283.A OH no hydrogen 3.184 N/A ARG 448.A N ASN 445.A OD1 no hydrogen 2.796 N/A ARG 448.A NH1 GLU 273.A OE2 no hydrogen 3.201 N/A ARG 448.A NH2 GLU 273.A OE1 no hydrogen 3.217 N/A ALA 449.A N ASN 445.A O no hydrogen 2.963 N/A SER 450.A N GLY 446.A O no hydrogen 3.183 N/A SER 450.A OG LEU 447.A O no hydrogen 2.957 N/A LEU 451.A N ARG 448.A O no hydrogen 2.904 N/A LEU 452.A N ALA 449.A O no hydrogen 3.469 N/A GLN 456.A NE2 GLU 403.A OE1 no hydrogen 2.531 N/A LEU 461.A N PRO 458.A O no hydrogen 3.096 N/A ARG 462.A N GLU 459.A O no hydrogen 2.887 N/A ARG 462.A NE THR 404.A O no hydrogen 3.148 N/A ARG 462.A NH1 LEU 457.A O no hydrogen 2.555 N/A THR 463.A N GLU 459.A O no hydrogen 2.685 N/A THR 463.A OG1 GLU 459.A O no hydrogen 2.881 N/A LEU 465.A N SER 499.A OG no hydrogen 3.280 N/A GLU 466.A N GLU 466.A OE2 no hydrogen 2.653 N/A CYS 469.A N LEU 465.A O no hydrogen 2.747 N/A CYS 469.A SG LEU 465.A O no hydrogen 3.296 N/A LEU 470.A N GLU 466.A O no hydrogen 3.134 N/A GLN 471.A N GLU 467.A O no hydrogen 3.208 N/A ILE 472.A N LEU 468.A O no hydrogen 2.986 N/A LYS 473.A N CYS 469.A O no hydrogen 3.165 N/A LYS 473.A NZ GLY 478.A O no hydrogen 3.083 N/A LYS 473.A NZ GLU 514.A OE2 no hydrogen 3.342 N/A ILE 474.A N LEU 470.A O no hydrogen 2.871 N/A LEU 475.A N GLN 471.A O no hydrogen 3.082 N/A ARG 476.A N LYS 473.A O no hydrogen 3.124 N/A LEU 477.A N ILE 472.A O no hydrogen 3.198 N/A PHE 483.A N GLY 479.A O no hydrogen 2.816 N/A LEU 484.A N ILE 480.A O no hydrogen 2.929 N/A SER 485.A N ALA 481.A O no hydrogen 3.118 N/A SER 485.A OG TYR 482.A O no hydrogen 2.582 N/A ARG 486.A N PHE 483.A O no hydrogen 2.888 N/A ARG 486.A NH1 ASP 193.A OD2 no hydrogen 2.723 N/A ARG 486.A NH2 ASP 193.A OD1 no hydrogen 2.800 N/A ARG 486.A NH2 ASP 193.A OD2 no hydrogen 3.411 N/A LEU 487.A N LEU 484.A O no hydrogen 3.132 N/A ALA 495.A N SER 492.A OG no hydrogen 3.176 N/A VAL 496.A N SER 492.A O no hydrogen 3.109 N/A VAL 497.A N ASN 493.A O no hydrogen 2.843 N/A LEU 498.A N GLU 494.A O no hydrogen 3.010 N/A SER 499.A N ALA 495.A O no hydrogen 3.046 N/A SER 499.A OG GLU 466.A OE2 no hydrogen 3.401 N/A SER 499.A OG ALA 495.A O no hydrogen 2.913 N/A ILE 500.A N VAL 496.A O no hydrogen 2.924 N/A LYS 501.A N VAL 497.A O no hydrogen 2.998 N/A HIS 502.A N LEU 498.A O no hydrogen 2.846 N/A HIS 502.A ND1 GLU 466.A OE1 no hydrogen 2.848 N/A LEU 503.A N SER 499.A O no hydrogen 3.029 N/A MET 504.A N ILE 500.A O no hydrogen 2.992 N/A GLU 505.A N LYS 501.A O no hydrogen 2.917 N/A LEU 506.A N HIS 502.A O no hydrogen 2.738 N/A SER 507.A N MET 504.A O no hydrogen 2.979 N/A ALA 508.A N LEU 503.A O no hydrogen 2.808 N/A LEU 509.A N LEU 503.A O no hydrogen 3.249 N/A ASP 510.A N GLU 514.A O no hydrogen 2.917 N/A GLU 513.A N ASP 510.A O no hydrogen 2.879 N/A GLU 514.A N ASP 510.A OD1 no hydrogen 2.834 N/A THR 516.A N ALA 508.A O no hydrogen 2.992 N/A THR 516.A OG1 SER 507.A O no hydrogen 2.746 N/A THR 516.A OG1 ALA 508.A O no hydrogen 3.029 N/A GLY 519.A N THR 516.A OG1 no hydrogen 2.985 N/A VAL 520.A N THR 516.A O no hydrogen 2.980 N/A HIS 521.A N PRO 517.A O no hydrogen 3.216 N/A HIS 521.A NE2 LEU 782.A O no hydrogen 2.927 N/A LEU 522.A N LEU 518.A O no hydrogen 2.822 N/A ALA 523.A N GLY 519.A O no hydrogen 3.002 N/A ALA 523.A N VAL 520.A O no hydrogen 3.061 N/A ARG 524.A N HIS 521.A O no hydrogen 2.910 N/A ARG 524.A NH1 ILE 786.A O no hydrogen 3.098 N/A ARG 524.A NH2 ILE 786.A O no hydrogen 2.844 N/A LEU 525.A N LEU 522.A O no hydrogen 3.157 N/A VAL 527.A N LEU 525.A O no hydrogen 2.648 N/A GLY 532.A N GLU 528.A O no hydrogen 2.865 N/A LYS 533.A N PRO 529.A O no hydrogen 2.933 N/A LYS 533.A NZ LEU 506.A O no hydrogen 2.845 N/A MET 534.A N HIS 530.A O no hydrogen 3.229 N/A ILE 535.A N ILE 531.A O no hydrogen 3.040 N/A LEU 536.A N GLY 532.A O no hydrogen 2.944 N/A PHE 537.A N LYS 533.A O no hydrogen 3.046 N/A GLY 538.A N MET 534.A O no hydrogen 2.819 N/A ALA 539.A N ILE 535.A O no hydrogen 3.083 N/A ALA 539.A N LEU 536.A O no hydrogen 2.998 N/A LEU 540.A N LEU 536.A O no hydrogen 2.969 N/A PHE 541.A N PHE 537.A O no hydrogen 2.955 N/A CYS 542.A N ALA 539.A O no hydrogen 3.262 N/A CYS 542.A SG LYS 649.A O no hydrogen 3.183 N/A CYS 543.A N GLY 538.A O no hydrogen 3.074 N/A LEU 544.A N ALA 650.A O no hydrogen 3.181 N/A ASP 545.A N ASN 651.A OD1 no hydrogen 2.891 N/A VAL 547.A N CYS 543.A O no hydrogen 3.315 N/A LEU 548.A N LEU 544.A O no hydrogen 2.800 N/A THR 549.A N ASP 545.A O no hydrogen 3.066 N/A THR 549.A OG1 ASP 545.A O no hydrogen 3.105 N/A ILE 550.A N PRO 546.A O no hydrogen 3.027 N/A ALA 551.A N VAL 547.A O no hydrogen 2.769 N/A ALA 552.A N LEU 548.A O no hydrogen 2.836 N/A SER 553.A N THR 549.A O no hydrogen 3.087 N/A SER 553.A OG THR 549.A O no hydrogen 3.444 N/A SER 553.A OG ILE 550.A O no hydrogen 2.599 N/A LEU 554.A N ILE 550.A O no hydrogen 2.935 N/A SER 555.A N ALA 551.A O no hydrogen 2.891 N/A SER 555.A OG ALA 551.A O no hydrogen 3.098 N/A PHE 556.A N ALA 552.A O no hydrogen 2.835 N/A VAL 561.A N PHE 614.A O no hydrogen 2.897 N/A LEU 564.A N GLN 254.A O no hydrogen 2.723 N/A GLY 565.A N GLU 567.A OE2 no hydrogen 2.959 N/A LYS 566.A N PRO 563.A O no hydrogen 2.948 N/A ALA 570.A N LYS 566.A O no hydrogen 2.891 N/A ASP 571.A N GLU 567.A O no hydrogen 3.069 N/A ALA 572.A N LYS 568.A O no hydrogen 3.228 N/A ARG 573.A N ILE 569.A O no hydrogen 2.995 N/A ARG 573.A NH2 GLU 612.A OE1 no hydrogen 3.504 N/A ARG 574.A N ALA 570.A O no hydrogen 3.030 N/A ARG 574.A NH2 ASP 571.A OD2 no hydrogen 2.761 N/A LYS 575.A N ASP 571.A O no hydrogen 3.121 N/A GLU 576.A N ALA 572.A O no hydrogen 3.188 N/A LEU 577.A N ARG 573.A O no hydrogen 2.988 N/A ALA 578.A N LYS 575.A O no hydrogen 3.124 N/A THR 581.A N ALA 578.A O no hydrogen 3.184 N/A THR 581.A OG1 ALA 578.A O no hydrogen 2.643 N/A ARG 582.A NE ASP 705.A O no hydrogen 3.314 N/A ARG 582.A NE HIS 707.A ND1 no hydrogen 3.110 N/A ARG 582.A NH1 GLU 580.A OE2 no hydrogen 3.483 N/A ARG 582.A NH2 ASP 705.A O no hydrogen 3.116 N/A SER 583.A OG THR 728.A OG1 no hydrogen 2.899 N/A ASP 584.A N CYS 727.A O no hydrogen 3.073 N/A HIS 585.A ND1 THR 728.A OG1 no hydrogen 2.525 N/A HIS 585.A NE2 ASP 726.A OD2 no hydrogen 3.082 N/A LEU 586.A N SER 583.A OG no hydrogen 2.658 N/A THR 587.A N SER 583.A O no hydrogen 3.134 N/A THR 587.A OG1 SER 583.A O no hydrogen 2.650 N/A VAL 588.A N ASP 584.A O no hydrogen 3.402 N/A VAL 589.A N HIS 585.A O no hydrogen 3.304 N/A ASN 590.A N LEU 586.A O no hydrogen 2.854 N/A ASN 590.A ND2 LEU 577.A O no hydrogen 2.770 N/A ALA 591.A N THR 587.A O no hydrogen 2.926 N/A PHE 592.A N VAL 588.A O no hydrogen 2.807 N/A GLU 593.A N VAL 589.A O no hydrogen 2.917 N/A GLY 594.A N ASN 590.A O no hydrogen 3.037 N/A TRP 595.A N ALA 591.A O no hydrogen 3.040 N/A TRP 595.A NE1 GLU 606.A OE2 no hydrogen 2.967 N/A GLU 596.A N PHE 592.A O no hydrogen 2.988 N/A GLU 597.A N GLU 593.A O no hydrogen 3.187 N/A ALA 598.A N GLY 594.A O no hydrogen 2.844 N/A LYS 599.A N TRP 595.A O no hydrogen 2.931 N/A ARG 600.A N GLU 596.A O no hydrogen 3.176 N/A ARG 601.A N GLU 597.A O no hydrogen 3.274 N/A ARG 601.A N ALA 598.A O no hydrogen 3.274 N/A ARG 601.A NH2 TYR 605.A OH no hydrogen 3.123 N/A GLY 602.A N LYS 599.A O no hydrogen 3.487 N/A GLU 606.A N GLY 602.A O no hydrogen 3.179 N/A LYS 607.A N PHE 603.A O no hydrogen 3.290 N/A ASP 608.A N ARG 604.A O no hydrogen 3.117 N/A TYR 609.A N TYR 605.A O no hydrogen 2.969 N/A TYR 609.A OH ALA 591.A O no hydrogen 2.800 N/A CYS 610.A N GLU 606.A O no hydrogen 3.036 N/A CYS 610.A SG GLU 606.A O no hydrogen 3.486 N/A TRP 611.A N ASP 608.A O no hydrogen 3.048 N/A GLU 612.A N ASP 608.A O no hydrogen 2.891 N/A TYR 613.A N TYR 609.A O no hydrogen 3.178 N/A TYR 613.A OH GLU 576.A OE1 no hydrogen 2.658 N/A LEU 615.A N CYS 610.A O no hydrogen 2.880 N/A SER 616.A N PRO 559.A O no hydrogen 2.975 N/A SER 616.A OG THR 619.A OG1 no hydrogen 2.999 N/A ASN 618.A ND2 ASP 336.A OD2 no hydrogen 3.358 N/A THR 619.A N SER 616.A OG no hydrogen 2.976 N/A THR 619.A OG1 SER 616.A OG no hydrogen 2.999 N/A LEU 620.A N SER 616.A O no hydrogen 2.953 N/A GLN 621.A N SER 617.A O no hydrogen 2.693 N/A MET 622.A N ASN 618.A O no hydrogen 3.403 N/A LEU 623.A N THR 619.A O no hydrogen 2.983 N/A HIS 624.A N LEU 620.A O no hydrogen 2.901 N/A ASN 625.A N GLN 621.A O no hydrogen 3.101 N/A MET 626.A N MET 622.A O no hydrogen 2.944 N/A LYS 627.A N LEU 623.A O no hydrogen 2.996 N/A LYS 627.A NZ ASP 545.A OD1 no hydrogen 2.811 N/A LYS 627.A NZ THR 549.A OG1 no hydrogen 2.917 N/A GLY 628.A N HIS 624.A O no hydrogen 3.416 N/A GLN 629.A N ASN 625.A O no hydrogen 3.292 N/A PHE 630.A N MET 626.A O no hydrogen 2.871 N/A ALA 631.A N LYS 627.A O no hydrogen 2.920 N/A GLU 632.A N GLY 628.A O no hydrogen 2.968 N/A HIS 633.A N GLN 629.A O no hydrogen 3.020 N/A LEU 634.A N PHE 630.A O no hydrogen 3.034 N/A LEU 635.A N ALA 631.A O no hydrogen 2.723 N/A GLY 636.A N GLU 632.A O no hydrogen 2.860 N/A ALA 637.A N HIS 633.A O no hydrogen 2.997 N/A GLY 638.A N LEU 635.A O no hydrogen 3.091 N/A PHE 639.A N LEU 634.A O no hydrogen 2.962 N/A SER 641.A OG ASP 647.A OD2 no hydrogen 3.529 N/A SER 644.A N SER 642.A OG no hydrogen 3.088 N/A LYS 646.A NZ ASP 545.A OD1 no hydrogen 3.151 N/A LYS 646.A NZ GLU 596.A OE1 no hydrogen 2.703 N/A LYS 646.A NZ GLU 596.A OE2 no hydrogen 2.933 N/A ASP 647.A N SER 644.A O no hydrogen 3.175 N/A LYS 649.A N ASP 647.A OD1 no hydrogen 3.029 N/A LYS 649.A NZ ASP 795.A OD2 no hydrogen 2.987 N/A ALA 650.A N ASP 647.A O no hydrogen 3.135 N/A ASN 651.A N PRO 648.A O no hydrogen 2.974 N/A ASN 651.A ND2 PRO 645.A O no hydrogen 3.150 N/A ASN 651.A ND2 ASP 647.A O no hydrogen 2.624 N/A ASN 653.A N CYS 542.A O no hydrogen 2.724 N/A ASN 653.A ND2 PHE 541.A O no hydrogen 2.696 N/A SER 654.A N ASN 651.A O no hydrogen 3.024 N/A SER 654.A OG ASN 651.A O no hydrogen 3.462 N/A SER 654.A OG ASN 651.A OD1 no hydrogen 2.422 N/A ASN 656.A N ASN 653.A O no hydrogen 3.045 N/A LYS 658.A NZ TYR 708.A OH no hydrogen 2.686 N/A LYS 658.A NZ THR 814.A O no hydrogen 3.469 N/A ILE 659.A N ASN 656.A OD1 no hydrogen 3.004 N/A ILE 660.A N ASN 656.A O no hydrogen 3.072 N/A LYS 661.A N GLU 657.A O no hydrogen 3.011 N/A LYS 661.A NZ THR 581.A O no hydrogen 2.824 N/A LYS 661.A NZ GLU 729.A O no hydrogen 3.238 N/A ALA 662.A N LYS 658.A O no hydrogen 3.081 N/A VAL 663.A N ILE 659.A O no hydrogen 3.088 N/A ILE 664.A N ILE 660.A O no hydrogen 2.961 N/A CYS 665.A N LYS 661.A O no hydrogen 2.993 N/A ALA 666.A N ALA 662.A O no hydrogen 2.950 N/A GLY 667.A N VAL 663.A O no hydrogen 3.155 N/A LEU 668.A N ILE 664.A O no hydrogen 3.013 N/A LEU 668.A N CYS 665.A O no hydrogen 3.195 N/A TYR 669.A N CYS 665.A O no hydrogen 2.949 N/A LYS 671.A N LEU 668.A O no hydrogen 2.860 N/A LYS 671.A NZ LEU 668.A O no hydrogen 2.901 N/A ALA 673.A N LEU 711.A O no hydrogen 2.836 N/A LYS 674.A N HIS 685.A O no hydrogen 2.885 N/A ILE 675.A N ASN 709.A O no hydrogen 2.708 N/A ARG 676.A N LYS 683.A O no hydrogen 3.290 N/A ARG 676.A NH2 MET 681.A O no hydrogen 3.379 N/A ASN 678.A ND2 THR 704.A O no hydrogen 2.536 N/A VAL 684.A N VAL 692.A O no hydrogen 2.986 N/A HIS 685.A N LYS 674.A O no hydrogen 2.850 N/A THR 686.A N GLY 690.A O no hydrogen 2.881 N/A THR 686.A OG1 GLY 690.A O no hydrogen 2.912 N/A LYS 687.A NZ ASP 756.A OD2 no hydrogen 2.980 N/A VAL 692.A N VAL 684.A O no hydrogen 2.871 N/A SER 693.A N ILE 722.A O no hydrogen 2.950 N/A HIS 695.A N LEU 724.A O no hydrogen 2.861 N/A HIS 695.A NE2 PHE 259.A O no hydrogen 2.723 N/A LYS 697.A N HIS 695.A ND1 no hydrogen 3.184 N/A LYS 697.A NZ GLN 261.A OE1 no hydrogen 2.755 N/A LYS 697.A NZ ASP 558.A OD1 no hydrogen 3.193 N/A LYS 697.A NZ ASP 558.A OD2 no hydrogen 2.776 N/A LYS 697.A NZ TYR 725.A OH no hydrogen 3.075 N/A SER 698.A N HIS 695.A O no hydrogen 3.066 N/A SER 698.A OG ASP 584.A OD2 no hydrogen 2.677 N/A VAL 699.A N ASP 584.A OD1 no hydrogen 2.701 N/A ASN 700.A N SER 698.A OG no hydrogen 3.012 N/A ASN 700.A ND2 CYS 727.A O no hydrogen 3.334 N/A VAL 701.A N SER 698.A O no hydrogen 3.125 N/A GLN 703.A N ASN 700.A O no hydrogen 3.000 N/A ASP 705.A N GLN 703.A OE1 no hydrogen 3.038 N/A HIS 707.A N GLU 729.A OE1 no hydrogen 2.581 N/A LEU 711.A N ALA 673.A O no hydrogen 2.945 N/A ILE 712.A N THR 728.A O no hydrogen 2.918 N/A TYR 713.A N LYS 671.A O no hydrogen 3.030 N/A HIS 714.A N ASP 726.A O no hydrogen 3.315 N/A HIS 714.A N ASP 726.A OD1 no hydrogen 3.167 N/A LEU 715.A N ASP 726.A OD1 no hydrogen 3.269 N/A LYS 716.A NZ TYR 713.A OH no hydrogen 2.876 N/A MET 717.A N TYR 723.A O no hydrogen 2.830 N/A THR 719.A N SER 721.A O no hydrogen 3.196 N/A SER 720.A N THR 719.A OG1 no hydrogen 2.724 N/A TYR 723.A N MET 717.A O no hydrogen 2.816 N/A LEU 724.A N SER 693.A O no hydrogen 2.766 N/A TYR 725.A N LEU 715.A O no hydrogen 2.677 N/A CYS 727.A N ASP 584.A OD2 no hydrogen 3.037 N/A CYS 727.A SG SER 698.A OG no hydrogen 3.648 N/A THR 728.A N ILE 712.A O no hydrogen 2.900 N/A THR 728.A OG1 SER 583.A OG no hydrogen 2.899 N/A THR 728.A OG1 HIS 585.A ND1 no hydrogen 2.525 N/A GLU 729.A N ARG 582.A O no hydrogen 2.951 N/A VAL 730.A N TRP 710.A O no hydrogen 3.002 N/A TYR 733.A N SER 731.A OG no hydrogen 3.195 N/A TYR 733.A OH SER 763.A OG no hydrogen 3.159 N/A CYS 734.A N SER 731.A O no hydrogen 2.917 N/A LEU 736.A N PRO 732.A O no hydrogen 2.817 N/A PHE 737.A N TYR 733.A O no hydrogen 3.267 N/A PHE 737.A N CYS 734.A O no hydrogen 3.234 N/A PHE 738.A N CYS 734.A O no hydrogen 3.057 N/A SER 743.A N ALA 754.A O no hydrogen 2.884 N/A SER 743.A OG GLU 757.A OE2 no hydrogen 3.545 N/A GLN 745.A N ILE 752.A O no hydrogen 3.055 N/A GLN 745.A NE2 SER 743.A OG no hydrogen 3.254 N/A ASP 749.A N ASP 747.A OD2 no hydrogen 2.584 N/A GLN 750.A NE2 ASP 747.A OD1 no hydrogen 3.179 N/A ILE 752.A N GLN 745.A O no hydrogen 3.184 N/A ILE 753.A N PHE 761.A O no hydrogen 2.963 N/A ALA 754.A N SER 743.A O no hydrogen 2.692 N/A VAL 755.A N ILE 759.A O no hydrogen 2.631 N/A ASP 756.A N ASP 741.A O no hydrogen 2.930 N/A ILE 759.A N VAL 755.A O no hydrogen 2.923 N/A PHE 761.A N ILE 753.A O no hydrogen 3.072 N/A SER 763.A N GLU 751.A O no hydrogen 3.105 N/A SER 763.A OG TYR 733.A OH no hydrogen 3.159 N/A ILE 767.A N PRO 764.A O no hydrogen 3.172 N/A ALA 768.A N GLU 765.A O no hydrogen 3.000 N/A HIS 769.A N GLU 765.A O no hydrogen 3.356 N/A HIS 769.A NE2 GLU 765.A OE2 no hydrogen 3.015 N/A LEU 770.A N ARG 766.A O no hydrogen 2.971 N/A VAL 771.A N ILE 767.A O no hydrogen 2.906 N/A LYS 772.A N ALA 768.A O no hydrogen 2.944 N/A GLY 773.A N HIS 769.A O no hydrogen 2.868 N/A LEU 774.A N LEU 770.A O no hydrogen 2.930 N/A ARG 775.A N VAL 771.A O no hydrogen 2.956 N/A ARG 775.A NE PHE 737.A O no hydrogen 3.068 N/A ARG 775.A NH1 GLY 740.A O no hydrogen 3.079 N/A ARG 775.A NH2 LEU 736.A O no hydrogen 2.820 N/A ARG 775.A NH2 PHE 737.A O no hydrogen 3.394 N/A ARG 775.A NH2 GLY 740.A O no hydrogen 2.914 N/A LYS 776.A N LYS 772.A O no hydrogen 3.215 N/A GLU 777.A N GLY 773.A O no hydrogen 2.935 N/A LEU 778.A N LEU 774.A O no hydrogen 2.810 N/A ASP 779.A N ARG 775.A O no hydrogen 3.015 N/A SER 780.A N LYS 776.A O no hydrogen 3.071 N/A SER 780.A OG LYS 776.A O no hydrogen 3.129 N/A LEU 781.A N GLU 777.A O no hydrogen 3.121 N/A LEU 782.A N LEU 778.A O no hydrogen 2.898 N/A GLN 783.A N ASP 779.A O no hydrogen 2.671 N/A GLU 784.A N SER 780.A O no hydrogen 2.749 N/A LYS 785.A N LEU 781.A O no hydrogen 3.195 N/A LYS 785.A NZ ASP 801.A OD2 no hydrogen 3.355 N/A ILE 786.A N GLN 783.A O no hydrogen 3.084 N/A SER 788.A OG SER 2.A OG no hydrogen 3.203 N/A TRP 794.A NE1 LEU 540.A O no hydrogen 3.047 N/A ASP 795.A N ASP 793.A OD1 no hydrogen 2.852 N/A SER 799.A N ASP 796.A O no hydrogen 3.195 N/A SER 799.A OG ASP 796.A O no hydrogen 3.434 N/A SER 799.A OG ASP 796.A OD2 no hydrogen 2.562 N/A ARG 800.A NH2 LYS 798.A O no hydrogen 2.833 N/A CYS 802.A SG ASP 793.A O no hydrogen 3.176 N/A CYS 802.A SG ASP 796.A O no hydrogen 3.356 N/A ALA 803.A N SER 799.A O no hydrogen 2.819 N/A VAL 804.A N ARG 800.A O no hydrogen 2.892 N/A LEU 805.A N ASP 801.A O no hydrogen 2.852 N/A SER 806.A N CYS 802.A O no hydrogen 2.825 N/A SER 806.A OG CYS 802.A O no hydrogen 2.917 N/A ALA 807.A N ALA 803.A O no hydrogen 2.995 N/A ILE 808.A N VAL 804.A O no hydrogen 3.010 N/A LEU 809.A N LEU 805.A O no hydrogen 2.825 N/A ASP 810.A N SER 806.A O no hydrogen 2.850 N/A LEU 811.A N ALA 807.A O no hydrogen 2.931 N/A ILE 812.A N ILE 808.A O no hydrogen 3.049 N/A LYS 813.A N LEU 809.A O no hydrogen 3.198 N/A THR 814.A N LEU 811.A O no hydrogen 3.151 N/A THR 814.A OG1 ASP 810.A O no hydrogen 3.385 N/A THR 814.A OG1 LEU 811.A O no hydrogen 2.702 N/A