Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 5dto_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LYS 7.A N THR 3.A O no hydrogen 3.042 N/A TRP 8.A N LEU 4.A O no hydrogen 3.107 N/A TRP 8.A NE1 TYR 23.A OH no hydrogen 3.067 N/A LYS 9.A N GLY 5.A O no hydrogen 2.978 N/A LYS 9.A NZ SER 146.A O no hydrogen 2.927 N/A LYS 10.A N GLU 6.A O no hydrogen 3.043 N/A LYS 10.A NZ GLU 2.A OE1 no hydrogen 3.206 N/A LYS 10.A NZ GLU 2.A OE2 no hydrogen 2.951 N/A LYS 11.A N LYS 7.A O no hydrogen 3.166 N/A LEU 12.A N TRP 8.A O no hydrogen 2.845 N/A ASN 13.A N LYS 9.A O no hydrogen 3.065 N/A ASN 13.A ND2 PRO 147.A O no hydrogen 3.344 N/A GLN 14.A N LYS 11.A O no hydrogen 3.302 N/A GLN 14.A NE2 LYS 10.A O no hydrogen 3.117 N/A GLU 19.A N SER 16.A O no hydrogen 3.244 N/A GLU 19.A N SER 16.A OG no hydrogen 2.979 N/A PHE 20.A N SER 16.A O no hydrogen 2.853 N/A ASP 21.A N ARG 17.A O no hydrogen 3.323 N/A TYR 23.A N GLU 19.A O no hydrogen 3.223 N/A TYR 23.A OH LEU 233.A O no hydrogen 2.600 N/A LYS 24.A N PHE 20.A O no hydrogen 2.849 N/A LYS 24.A NZ SER 208.A OG no hydrogen 3.133 N/A SER 26.A N TYR 23.A O no hydrogen 3.210 N/A GLY 27.A N ARG 242.A O no hydrogen 3.121 N/A ILE 28.A N LYS 25.A O no hydrogen 3.351 N/A THR 29.A N PRO 203.A O no hydrogen 3.169 N/A GLU 30.A N THR 245.A O no hydrogen 2.665 N/A VAL 31.A N GLU 30.A OE1 no hydrogen 2.996 N/A ASP 32.A N GLU 247.A O no hydrogen 3.317 N/A ARG 33.A NH1 ALA 49.A O no hydrogen 2.641 N/A ARG 33.A NH1 ASP 249.A OD2 no hydrogen 3.018 N/A ARG 33.A NH2 ALA 49.A O no hydrogen 2.981 N/A THR 34.A N ASP 32.A OD1 no hydrogen 3.479 N/A THR 34.A OG1 ASP 32.A OD1 no hydrogen 2.902 N/A THR 34.A OG1 ASP 32.A OD2 no hydrogen 3.312 N/A LYS 37.A N ARG 33.A O no hydrogen 2.753 N/A GLU 38.A N THR 34.A O no hydrogen 3.299 N/A GLY 39.A N GLU 35.A O no hydrogen 3.039 N/A LEU 40.A N ALA 36.A O no hydrogen 2.975 N/A ARG 42.A N GLU 38.A O no hydrogen 3.061 N/A ARG 42.A NE GLU 44.A OE2 no hydrogen 2.959 N/A ARG 42.A NH2 GLU 44.A OE2 no hydrogen 3.030 N/A GLY 43.A N LEU 40.A O no hydrogen 3.162 N/A GLU 44.A N GLY 39.A O no hydrogen 2.801 N/A THR 45.A OG1 SER 112.A OG no hydrogen 3.132 N/A HIS 47.A N GLY 253.A O no hydrogen 2.649 N/A HIS 47.A ND1 ASP 251.A OD1 no hydrogen 2.777 N/A HIS 48.A N THR 46.A O no hydrogen 2.573 N/A HIS 48.A NE2 GLU 44.A OE1 no hydrogen 2.574 N/A ARG 52.A NH1 GLU 30.A OE1 no hydrogen 3.251 N/A ARG 52.A NH1 LEU 204.A O no hydrogen 3.541 N/A ARG 52.A NH2 LEU 204.A O no hydrogen 3.449 N/A GLY 53.A N SER 51.A OG no hydrogen 3.161 N/A SER 54.A N SER 51.A O no hydrogen 3.441 N/A SER 54.A OG GLY 81.A O no hydrogen 2.692 N/A LYS 56.A N ARG 52.A O no hydrogen 3.182 N/A LYS 56.A NZ GLU 211.A OE1 no hydrogen 3.080 N/A LEU 57.A N GLY 53.A O no hydrogen 2.873 N/A GLN 58.A N SER 54.A O no hydrogen 3.038 N/A TRP 59.A N ALA 55.A O no hydrogen 3.411 N/A TRP 59.A N LYS 56.A O no hydrogen 3.250 N/A PHE 60.A N LEU 57.A O no hydrogen 2.963 N/A VAL 61.A N LEU 57.A O no hydrogen 3.062 N/A GLU 62.A N GLN 58.A O no hydrogen 2.713 N/A ARG 63.A N PHE 60.A O no hydrogen 3.001 N/A ARG 63.A NH1 TRP 59.A O no hydrogen 2.976 N/A ARG 63.A NH1 GLU 62.A OE1 no hydrogen 2.654 N/A ASN 64.A N VAL 61.A O no hydrogen 3.355 N/A ASN 64.A ND2 GLU 291.A O no hydrogen 3.360 N/A MET 65.A N PHE 60.A O no hydrogen 3.168 N/A ILE 67.A N GLN 171.A OE1 no hydrogen 2.739 N/A GLU 69.A N THR 137.A OG1 no hydrogen 2.842 N/A GLY 70.A N LYS 91.A O no hydrogen 2.642 N/A ARG 71.A N ASP 136.A OD2 no hydrogen 2.872 N/A VAL 72.A N GLU 94.A O no hydrogen 2.515 N/A ILE 73.A N THR 137.A O no hydrogen 2.878 N/A ASP 74.A N ARG 96.A O no hydrogen 2.659 N/A LEU 75.A N LEU 139.A O no hydrogen 2.879 N/A GLY 76.A N TYR 98.A O no hydrogen 2.548 N/A CYS 77.A N TYR 98.A O no hydrogen 3.265 N/A CYS 77.A SG GLY 78.A O no hydrogen 3.786 N/A GLY 78.A N THR 99.A OG1 no hydrogen 3.108 N/A ARG 79.A NE VAL 50.A O no hydrogen 3.127 N/A ARG 79.A NH2 VAL 50.A O no hydrogen 3.569 N/A SER 83.A OG ASP 74.A OD2 no hydrogen 2.793 N/A TYR 84.A N GLY 80.A O no hydrogen 2.911 N/A TYR 84.A OH VAL 109.A O no hydrogen 2.470 N/A TYR 85.A N GLY 81.A O no hydrogen 3.365 N/A CYS 86.A N TRP 82.A O no hydrogen 3.151 N/A CYS 86.A SG TRP 82.A O no hydrogen 3.152 N/A ALA 87.A N SER 83.A O no hydrogen 3.315 N/A GLY 88.A N TYR 85.A O no hydrogen 3.430 N/A LEU 89.A N CYS 86.A O no hydrogen 3.036 N/A LYS 90.A NZ ASN 292.A OD1 no hydrogen 3.506 N/A LYS 90.A NZ TYR 294.A O no hydrogen 3.283 N/A VAL 92.A N LEU 89.A O no hydrogen 3.116 N/A THR 93.A N GLY 70.A O no hydrogen 2.887 N/A GLU 94.A N GLY 70.A O no hydrogen 3.145 N/A VAL 95.A N ILE 118.A O no hydrogen 2.830 N/A ARG 96.A N VAL 72.A O no hydrogen 2.649 N/A ARG 96.A NE GLU 94.A OE2 no hydrogen 2.913 N/A ARG 96.A NH1 GLU 133.A OE1 no hydrogen 2.872 N/A ARG 96.A NH2 GLU 94.A OE2 no hydrogen 3.505 N/A GLY 97.A N LYS 120.A O no hydrogen 2.770 N/A TYR 98.A N ASP 74.A O no hydrogen 2.997 N/A TYR 98.A OH GLU 133.A OE1 no hydrogen 3.139 N/A THR 99.A N MET 122.A O no hydrogen 3.016 N/A GLY 102.A N GLU 107.A OE1 no hydrogen 2.662 N/A HIS 105.A N GLY 102.A O no hydrogen 3.027 N/A VAL 109.A N ARG 79.A O no hydrogen 3.057 N/A SER 112.A N THR 45.A O no hydrogen 2.477 N/A SER 112.A OG THR 45.A OG1 no hydrogen 3.132 N/A TYR 114.A N LEU 252.A O no hydrogen 2.906 N/A TYR 114.A OH GLU 262.A OE2 no hydrogen 2.728 N/A GLY 115.A N GLY 255.A O no hydrogen 3.045 N/A TRP 116.A N THR 113.A O no hydrogen 3.053 N/A ASN 117.A ND2 ARG 257.A O no hydrogen 3.020 N/A ILE 118.A N GLY 115.A O no hydrogen 3.097 N/A VAL 119.A N TRP 116.A O no hydrogen 3.058 N/A LYS 120.A N VAL 95.A O no hydrogen 2.813 N/A LYS 120.A NZ GLU 94.A OE2 no hydrogen 2.857 N/A MET 122.A N GLY 97.A O no hydrogen 2.805 N/A SER 123.A OG GLU 107.A OE2 no hydrogen 2.581 N/A GLY 124.A N LYS 100.A O no hydrogen 3.032 N/A LYS 125.A N THR 99.A O no hydrogen 3.196 N/A PHE 128.A N ASP 126.A OD1 no hydrogen 3.091 N/A TYR 129.A N ASP 126.A O no hydrogen 2.921 N/A LEU 130.A N VAL 127.A O no hydrogen 3.247 N/A CYS 135.A SG GLU 133.A O no hydrogen 4.031 N/A CYS 135.A SG THR 137.A O no hydrogen 3.691 N/A ASP 136.A N ARG 71.A O no hydrogen 3.030 N/A THR 137.A N ARG 71.A O no hydrogen 3.173 N/A THR 137.A OG1 GLU 69.A O no hydrogen 2.932 N/A LEU 138.A N GLN 171.A O no hydrogen 2.714 N/A LEU 139.A N ILE 73.A O no hydrogen 2.789 N/A CYS 140.A N CYS 173.A O no hydrogen 2.994 N/A CYS 140.A SG LEU 75.A O no hydrogen 4.000 N/A SER 146.A N GLU 152.A OE2 no hydrogen 2.959 N/A SER 146.A OG SER 148.A O no hydrogen 3.498 N/A SER 148.A N SER 146.A OG no hydrogen 3.102 N/A THR 150.A OG1 SER 148.A OG no hydrogen 3.259 N/A VAL 151.A N SER 148.A OG no hydrogen 3.351 N/A GLU 152.A N SER 148.A O no hydrogen 2.966 N/A GLU 153.A N PRO 149.A O no hydrogen 2.756 N/A SER 154.A N THR 150.A O no hydrogen 3.255 N/A SER 154.A OG VAL 151.A O no hydrogen 3.226 N/A ARG 155.A N VAL 151.A O no hydrogen 3.263 N/A ARG 155.A NH1 GLU 144.A O no hydrogen 2.949 N/A THR 156.A N GLU 152.A O no hydrogen 2.909 N/A THR 156.A OG1 GLU 152.A O no hydrogen 2.969 N/A ILE 157.A N GLU 153.A O no hydrogen 3.087 N/A ARG 158.A N SER 154.A O no hydrogen 2.913 N/A VAL 159.A N ARG 155.A O no hydrogen 3.050 N/A LEU 160.A N THR 156.A O no hydrogen 2.834 N/A LYS 161.A N ILE 157.A O no hydrogen 2.779 N/A MET 162.A N ARG 158.A O no hydrogen 2.994 N/A VAL 163.A N VAL 159.A O no hydrogen 2.942 N/A GLU 164.A N LEU 160.A O no hydrogen 3.062 N/A TRP 166.A N VAL 163.A O no hydrogen 3.072 N/A LEU 167.A N GLU 164.A O no hydrogen 2.932 N/A LYS 168.A N ASN 170.A OD1 no hydrogen 3.119 N/A ASN 170.A ND2 CYS 135.A O no hydrogen 3.059 N/A ASN 170.A ND2 TRP 166.A O no hydrogen 3.208 N/A GLN 171.A N ASP 136.A O no hydrogen 2.988 N/A GLN 171.A NE2 ASN 217.A OD1 no hydrogen 2.735 N/A PHE 172.A N SER 216.A OG no hydrogen 3.209 N/A CYS 173.A N LEU 138.A O no hydrogen 3.003 N/A ILE 174.A N TRP 214.A O no hydrogen 2.926 N/A LYS 175.A N CYS 140.A O no hydrogen 2.838 N/A LYS 175.A NZ ASP 141.A O no hydrogen 2.595 N/A VAL 176.A N MET 212.A O no hydrogen 2.652 N/A ASN 178.A N THR 156.A OG1 no hydrogen 3.115 N/A ASN 178.A ND2 GLU 152.A OE1 no hydrogen 2.990 N/A THR 183.A OG1 GLU 153.A OE2 no hydrogen 2.502 N/A VAL 184.A N MET 181.A O no hydrogen 2.893 N/A ILE 185.A N MET 181.A O no hydrogen 3.030 N/A GLU 186.A N PRO 182.A O no hydrogen 2.864 N/A HIS 187.A N THR 183.A O no hydrogen 2.924 N/A LEU 188.A N VAL 184.A O no hydrogen 2.742 N/A GLU 189.A N ILE 185.A O no hydrogen 3.119 N/A ARG 190.A N GLU 186.A O no hydrogen 3.349 N/A ARG 190.A NH2 HIS 187.A ND1 no hydrogen 2.904 N/A LEU 191.A N HIS 187.A O no hydrogen 3.026 N/A GLN 192.A N LEU 188.A O no hydrogen 2.726 N/A GLN 192.A NE2 GLY 197.A O no hydrogen 2.934 N/A GLN 192.A NE2 GLY 220.A O no hydrogen 2.872 N/A ARG 193.A N GLU 189.A O no hydrogen 3.112 N/A ARG 193.A N ARG 190.A O no hydrogen 3.278 N/A LYS 194.A N LEU 191.A O no hydrogen 3.160 N/A LYS 194.A NZ GLU 164.A OE2 no hydrogen 2.618 N/A HIS 195.A N LEU 191.A O no hydrogen 2.878 N/A HIS 195.A NE2 GLU 164.A OE2 no hydrogen 3.090 N/A GLY 196.A N GLN 192.A O no hydrogen 3.004 N/A MET 198.A N ILE 215.A O no hydrogen 2.929 N/A VAL 200.A N TYR 213.A O no hydrogen 2.936 N/A ARG 201.A NH1 THR 209.A O no hydrogen 2.812 N/A ARG 201.A NH1 GLU 211.A O no hydrogen 2.964 N/A ARG 201.A NH2 ARG 206.A O no hydrogen 3.002 N/A ARG 201.A NH2 THR 209.A O no hydrogen 3.162 N/A ASN 202.A ND2 LYS 56.A O no hydrogen 3.038 N/A LEU 204.A N ASN 202.A OD1 no hydrogen 2.846 N/A SER 205.A N ASN 202.A O no hydrogen 2.854 N/A SER 205.A OG ASN 202.A O no hydrogen 3.252 N/A SER 205.A OG GLU 211.A OE1 no hydrogen 3.035 N/A ARG 206.A NH2 GLU 30.A OE2 no hydrogen 2.382 N/A ASN 207.A N LYS 24.A O no hydrogen 3.014 N/A ASN 207.A ND2 TYR 23.A O no hydrogen 2.760 N/A ASN 207.A ND2 SER 26.A O no hydrogen 2.812 N/A THR 209.A N ARG 206.A O no hydrogen 3.158 N/A HIS 210.A NE2 SER 230.A OG no hydrogen 2.879 N/A GLU 211.A N THR 209.A OG1 no hydrogen 3.087 N/A MET 212.A N VAL 176.A O no hydrogen 3.092 N/A TYR 213.A N VAL 200.A O no hydrogen 2.782 N/A TYR 213.A OH ASP 141.A OD1 no hydrogen 2.825 N/A TYR 213.A OH GLU 211.A OE2 no hydrogen 3.182 N/A TRP 214.A N ILE 174.A O no hydrogen 2.719 N/A TRP 214.A NE1 GLY 196.A O no hydrogen 2.916 N/A ILE 215.A N MET 198.A O no hydrogen 2.973 N/A SER 216.A N PHE 172.A O no hydrogen 3.116 N/A SER 216.A OG ASN 217.A OD1 no hydrogen 3.384 N/A ASN 217.A N MET 65.A O no hydrogen 3.203 N/A ASN 217.A ND2 ASN 64.A O no hydrogen 3.062 N/A ASN 217.A ND2 GLN 171.A OE1 no hydrogen 2.743 N/A GLY 218.A N SER 216.A O no hydrogen 3.159 N/A SER 225.A N ASN 221.A O no hydrogen 3.159 N/A SER 225.A OG ASN 221.A O no hydrogen 3.536 N/A SER 225.A OG ILE 222.A O no hydrogen 2.988 N/A VAL 226.A N ILE 222.A O no hydrogen 3.067 N/A ASN 227.A N VAL 223.A O no hydrogen 2.998 N/A MET 228.A N SER 224.A O no hydrogen 2.920 N/A VAL 229.A N SER 225.A O no hydrogen 3.165 N/A SER 230.A N VAL 226.A O no hydrogen 3.024 N/A SER 230.A OG HIS 210.A NE2 no hydrogen 2.879 N/A SER 230.A OG VAL 226.A O no hydrogen 2.961 N/A ARG 231.A N ASN 227.A O no hydrogen 3.004 N/A LEU 232.A N MET 228.A O no hydrogen 3.016 N/A LEU 233.A N VAL 229.A O no hydrogen 2.830 N/A LEU 234.A N SER 230.A O no hydrogen 2.852 N/A ASN 235.A N ARG 231.A O no hydrogen 2.670 N/A ARG 236.A N LEU 232.A O no hydrogen 3.011 N/A ARG 236.A NH1 ASN 207.A OD1 no hydrogen 3.143 N/A PHE 237.A N LEU 234.A O no hydrogen 3.285 N/A THR 238.A N ASN 235.A O no hydrogen 3.087 N/A THR 238.A OG1 ASN 235.A O no hydrogen 3.190 N/A MET 239.A N ASN 235.A O no hydrogen 2.979 N/A ARG 242.A N SER 26.A OG no hydrogen 3.332 N/A THR 245.A N ILE 28.A O no hydrogen 2.862 N/A GLU 247.A N GLU 30.A O no hydrogen 2.745 N/A VAL 250.A N ASP 249.A OD1 no hydrogen 2.709 N/A ASP 251.A N GLU 351.A OE2 no hydrogen 2.946 N/A LEU 252.A N HIS 47.A O no hydrogen 2.874 N/A GLY 253.A N ASP 251.A OD1 no hydrogen 3.194 N/A GLY 255.A N SER 112.A O no hydrogen 2.939 N/A THR 256.A OG1 HIS 258.A NE2 no hydrogen 3.391 N/A ARG 257.A N ASN 117.A OD1 no hydrogen 2.873 N/A ARG 257.A NE GLU 262.A OE1 no hydrogen 3.358 N/A ARG 257.A NE GLU 262.A OE2 no hydrogen 2.783 N/A ARG 257.A NH1 ALA 87.A O no hydrogen 3.016 N/A ARG 257.A NH1 VAL 92.A O no hydrogen 2.868 N/A ARG 257.A NH2 LEU 89.A O no hydrogen 2.697 N/A ARG 257.A NH2 LYS 90.A O no hydrogen 2.898 N/A ARG 257.A NH2 GLU 262.A OE1 no hydrogen 3.173 N/A ALA 261.A N HIS 258.A O no hydrogen 2.852 N/A GLU 262.A N VAL 259.A O no hydrogen 3.472 N/A VAL 270.A N ASN 267.A O no hydrogen 2.866 N/A ILE 271.A N ASN 267.A O no hydrogen 3.002 N/A GLY 272.A N MET 268.A O no hydrogen 2.794 N/A ARG 274.A NH1 CYS 434.A O no hydrogen 3.399 N/A ARG 274.A NH1 LEU 539.A O no hydrogen 3.106 N/A ARG 274.A NH1 ASN 543.A O no hydrogen 3.123 N/A ARG 274.A NH2 VAL 270.A O no hydrogen 3.098 N/A ARG 274.A NH2 LEU 539.A O no hydrogen 2.749 N/A ILE 275.A N ILE 271.A O no hydrogen 3.274 N/A LYS 276.A N GLY 272.A O no hydrogen 2.978 N/A ARG 277.A N GLU 273.A O no hydrogen 3.121 N/A ARG 277.A NE GLU 273.A OE2 no hydrogen 2.930 N/A ILE 278.A N ARG 274.A O no hydrogen 3.132 N/A LYS 279.A N ILE 275.A O no hydrogen 2.815 N/A GLU 280.A N LYS 276.A O no hydrogen 3.150 N/A GLU 281.A N ARG 277.A O no hydrogen 2.997 N/A HIS 282.A N ILE 278.A O no hydrogen 3.147 N/A THR 285.A N HIS 282.A O no hydrogen 3.382 N/A HIS 287.A N SER 302.A O no hydrogen 2.707 N/A HIS 287.A ND1 THR 285.A O no hydrogen 2.938 N/A ASP 289.A N TYR 299.A OH no hydrogen 2.836 N/A GLU 291.A N ASP 289.A OD1 no hydrogen 2.942 N/A ASN 292.A N ASP 289.A O no hydrogen 3.379 N/A ASN 292.A ND2 ASP 289.A O no hydrogen 2.918 N/A TYR 294.A N ASN 292.A OD1 no hydrogen 3.304 N/A TYR 294.A OH ASP 559.A OD2 no hydrogen 2.575 N/A LYS 295.A N ASP 354.A OD2 no hydrogen 2.955 N/A LYS 295.A NZ GLY 88.A O no hydrogen 3.423 N/A LYS 295.A NZ ASP 354.A O no hydrogen 3.495 N/A THR 296.A N ASP 354.A OD1 no hydrogen 2.915 N/A THR 296.A OG1 ASP 354.A OD1 no hydrogen 2.571 N/A THR 296.A OG1 THR 355.A O no hydrogen 3.460 N/A ALA 298.A N SER 562.A O no hydrogen 3.015 N/A TYR 299.A OH SER 302.A OG no hydrogen 2.506 N/A HIS 300.A N ILE 560.A O no hydrogen 2.952 N/A HIS 300.A NE2 SER 562.A OG no hydrogen 2.631 N/A SER 302.A N HIS 287.A O no hydrogen 2.686 N/A SER 302.A OG TYR 299.A OH no hydrogen 2.506 N/A SER 302.A OG ASP 559.A OD1 no hydrogen 2.335 N/A TYR 303.A N MET 558.A O no hydrogen 3.187 N/A GLU 304.A N THR 285.A OG1 no hydrogen 3.242 N/A VAL 305.A N THR 556.A O no hydrogen 2.972 N/A SER 312.A OG SER 313.A O no hydrogen 3.301 N/A SER 313.A OG ALA 336.A O no hydrogen 2.999 N/A ASN 316.A N ARG 708.A O no hydrogen 2.844 N/A ASN 316.A ND2 THR 720.A O no hydrogen 2.891 N/A LYS 320.A NZ ASP 327.A OD1 no hydrogen 2.651 N/A LEU 321.A N GLY 317.A O no hydrogen 3.341 N/A THR 323.A OG1 VAL 319.A O no hydrogen 2.820 N/A TRP 326.A N THR 323.A O no hydrogen 3.152 N/A ASP 327.A N LYS 324.A O no hydrogen 3.102 N/A VAL 328.A N PRO 325.A O no hydrogen 3.331 N/A THR 333.A N VAL 329.A O no hydrogen 3.394 N/A THR 333.A OG1 VAL 329.A O no hydrogen 3.100 N/A GLN 334.A N VAL 332.A O no hydrogen 2.682 N/A MET 335.A N VAL 332.A O no hydrogen 3.394 N/A MET 337.A N GLN 334.A O no hydrogen 3.115 N/A THR 340.A N SER 310.A O no hydrogen 2.886 N/A THR 340.A OG1 SER 310.A O no hydrogen 3.322 N/A THR 341.A N ASP 339.A OD1 no hydrogen 2.721 N/A GLN 345.A N THR 341.A O no hydrogen 2.907 N/A GLN 346.A N PRO 342.A O no hydrogen 2.996 N/A GLN 346.A NE2 TYR 294.A OH no hydrogen 3.002 N/A GLN 346.A NE2 GLN 549.A O no hydrogen 2.869 N/A ARG 347.A N PHE 343.A O no hydrogen 2.957 N/A ARG 347.A NE GLU 62.A OE2 no hydrogen 2.232 N/A ARG 347.A NH1 GLU 247.A OE1 no hydrogen 2.837 N/A ARG 347.A NH2 GLU 62.A OE1 no hydrogen 3.191 N/A ARG 347.A NH2 GLU 247.A OE1 no hydrogen 3.399 N/A ARG 347.A NH2 GLU 247.A OE2 no hydrogen 3.315 N/A VAL 348.A N GLY 344.A O no hydrogen 3.265 N/A PHE 349.A N GLN 345.A O no hydrogen 2.942 N/A LYS 350.A N GLN 346.A O no hydrogen 3.188 N/A GLU 351.A N ARG 347.A O no hydrogen 3.207 N/A LYS 352.A N VAL 348.A O no hydrogen 2.919 N/A LYS 352.A NZ ASP 251.A OD2 no hydrogen 2.761 N/A VAL 353.A N PHE 349.A O no hydrogen 3.046 N/A ASP 354.A N PHE 349.A O no hydrogen 2.578 N/A THR 355.A N VAL 353.A O no hydrogen 2.797 N/A ARG 356.A NE GLU 262.A O no hydrogen 3.054 N/A ARG 356.A NH1 GLU 264.A OE1 no hydrogen 3.314 N/A ARG 356.A NH2 GLU 262.A O no hydrogen 3.216 N/A ARG 356.A NH2 GLU 264.A OE1 no hydrogen 2.993 N/A ARG 359.A NH2 ASP 513.A OD1 no hydrogen 3.216 N/A LEU 361.A N ASP 652.A OD2 no hydrogen 2.788 N/A GLY 363.A N LEU 602.A O no hydrogen 2.889 N/A THR 364.A OG1 ASP 652.A OD2 no hydrogen 2.908 N/A ARG 365.A N LEU 361.A O no hydrogen 2.953 N/A ARG 365.A NH1 PRO 360.A O no hydrogen 2.501 N/A LYS 366.A N PRO 362.A O no hydrogen 3.096 N/A LYS 366.A NZ GLU 369.A OE1 no hydrogen 3.167 N/A VAL 367.A N GLY 363.A O no hydrogen 3.068 N/A MET 368.A N THR 364.A O no hydrogen 3.070 N/A GLU 369.A N ARG 365.A O no hydrogen 3.015 N/A ILE 370.A N LYS 366.A O no hydrogen 2.885 N/A THR 371.A N VAL 367.A O no hydrogen 2.915 N/A THR 371.A OG1 VAL 367.A O no hydrogen 2.823 N/A ALA 372.A N MET 368.A O no hydrogen 2.981 N/A GLU 373.A N GLU 369.A O no hydrogen 3.091 N/A TRP 374.A N ILE 370.A O no hydrogen 3.187 N/A LEU 375.A N THR 371.A O no hydrogen 2.773 N/A TRP 376.A N ALA 372.A O no hydrogen 2.744 N/A TRP 376.A NE1 ASN 517.A O no hydrogen 2.869 N/A ARG 377.A N GLU 373.A O no hydrogen 3.268 N/A THR 378.A N TRP 374.A O no hydrogen 2.991 N/A THR 378.A OG1 TRP 374.A O no hydrogen 3.197 N/A LEU 379.A N LEU 375.A O no hydrogen 2.923 N/A GLY 380.A N TRP 376.A O no hydrogen 2.987 N/A ARG 381.A N THR 378.A O no hydrogen 3.322 N/A ARG 381.A NH1 THR 378.A O no hydrogen 2.962 N/A ARG 381.A NH1 ASN 470.A O no hydrogen 2.809 N/A ARG 381.A NH2 GLU 469.A O no hydrogen 3.013 N/A LYS 383.A NZ ASP 463.A O no hydrogen 3.249 N/A ARG 384.A NH2 ASP 526.A OD2 no hydrogen 2.767 N/A ARG 386.A NE ASP 463.A OD1 no hydrogen 3.089 N/A ARG 386.A NE ASP 463.A OD2 no hydrogen 2.928 N/A ARG 386.A NH1 LEU 387.A O no hydrogen 3.131 N/A ARG 386.A NH1 GLU 392.A OE1 no hydrogen 3.004 N/A ARG 386.A NH2 GLU 392.A OE1 no hydrogen 3.368 N/A ARG 386.A NH2 GLU 392.A OE2 no hydrogen 3.045 N/A ARG 386.A NH2 ASP 463.A OD1 no hydrogen 2.956 N/A CYS 388.A N GLU 455.A O no hydrogen 2.949 N/A CYS 388.A SG GLU 392.A OE1 no hydrogen 3.586 N/A ARG 390.A NH1 GLU 413.A OE1 no hydrogen 3.280 N/A ARG 390.A NH2 GLU 413.A OE1 no hydrogen 2.816 N/A ARG 390.A NH2 GLU 413.A OE2 no hydrogen 3.179 N/A GLU 391.A N GLU 391.A OE1 no hydrogen 2.591 N/A GLU 392.A N THR 389.A OG1 no hydrogen 3.196 N/A PHE 393.A N THR 389.A O no hydrogen 2.856 N/A THR 394.A N ARG 390.A O no hydrogen 2.754 N/A THR 394.A OG1 ARG 390.A O no hydrogen 2.845 N/A LYS 395.A N GLU 391.A O no hydrogen 3.172 N/A LYS 396.A N GLU 392.A O no hydrogen 3.104 N/A VAL 397.A N PHE 393.A O no hydrogen 3.083 N/A ARG 398.A N THR 394.A O no hydrogen 3.013 N/A THR 399.A N LYS 395.A O no hydrogen 3.106 N/A THR 399.A OG1 LYS 395.A O no hydrogen 2.828 N/A THR 399.A OG1 LYS 396.A O no hydrogen 3.392 N/A ALA 401.A N THR 399.A O no hydrogen 2.264 N/A LYS 407.A N ASP 404.A O no hydrogen 3.270 N/A ALA 408.A N ASP 404.A O no hydrogen 3.398 N/A ALA 409.A N SER 405.A O no hydrogen 2.925 N/A VAL 410.A N ALA 406.A O no hydrogen 3.466 N/A GLU 411.A N ALA 408.A O no hydrogen 3.241 N/A ASP 412.A N ALA 408.A O no hydrogen 3.175 N/A ASP 412.A N ALA 409.A O no hydrogen 2.958 N/A GLU 414.A N ASP 412.A OD1 no hydrogen 2.914 N/A PHE 415.A N ASP 412.A O no hydrogen 3.157 N/A TRP 416.A NE1 VAL 410.A O no hydrogen 2.435 N/A LYS 417.A N GLU 413.A O no hydrogen 3.328 N/A LEU 418.A N GLU 414.A O no hydrogen 3.396 N/A VAL 419.A N PHE 415.A O no hydrogen 3.199 N/A ASP 420.A N TRP 416.A O no hydrogen 2.922 N/A ARG 421.A N LYS 417.A O no hydrogen 3.040 N/A GLU 422.A N LEU 418.A O no hydrogen 2.926 N/A ARG 423.A N VAL 419.A O no hydrogen 2.883 N/A ARG 423.A NE GLU 455.A OE1 no hydrogen 3.334 N/A ARG 423.A NE GLU 455.A OE2 no hydrogen 3.127 N/A ARG 423.A NH1 ASP 420.A OD1 no hydrogen 2.707 N/A ARG 423.A NH2 ASP 420.A OD1 no hydrogen 3.549 N/A ARG 423.A NH2 GLU 455.A OE2 no hydrogen 3.118 N/A GLU 424.A N ASP 420.A O no hydrogen 3.120 N/A HIS 426.A N GLU 422.A O no hydrogen 3.198 N/A LYS 427.A N ARG 423.A O no hydrogen 3.053 N/A LYS 427.A NZ GLU 424.A OE2 no hydrogen 3.418 N/A LEU 428.A N LEU 425.A O no hydrogen 2.925 N/A GLY 429.A N HIS 426.A O no hydrogen 2.981 N/A LYS 430.A N LEU 425.A O no hydrogen 2.805 N/A CYS 431.A SG GLU 422.A OE2 no hydrogen 3.534 N/A CYS 431.A SG HIS 426.A NE2 no hydrogen 3.758 N/A GLY 432.A N GLU 422.A OE2 no hydrogen 2.989 N/A SER 433.A N GLU 422.A OE2 no hydrogen 3.405 N/A SER 433.A OG GLU 422.A OE1 no hydrogen 3.308 N/A CYS 434.A SG GLU 422.A OE2 no hydrogen 3.498 N/A CYS 434.A SG HIS 426.A NE2 no hydrogen 3.623 N/A TYR 436.A N VAL 545.A O no hydrogen 3.290 N/A MET 438.A N LYS 547.A O no hydrogen 3.289 N/A ILE 442.A N ARG 440.A O no hydrogen 2.581 N/A TYR 444.A N ALA 441.A O no hydrogen 3.365 N/A TYR 444.A OH ASP 412.A OD2 no hydrogen 2.466 N/A TRP 446.A N TRP 443.A O no hydrogen 3.065 N/A LEU 447.A N TRP 443.A O no hydrogen 2.961 N/A GLY 448.A N TYR 444.A O no hydrogen 2.791 N/A VAL 449.A N MET 445.A O no hydrogen 3.131 N/A ARG 450.A N TRP 446.A O no hydrogen 3.301 N/A TYR 451.A N LEU 447.A O no hydrogen 3.121 N/A TYR 451.A OH GLU 455.A OE2 no hydrogen 3.336 N/A LEU 452.A N GLY 448.A O no hydrogen 3.224 N/A GLU 453.A N VAL 449.A O no hydrogen 3.240 N/A PHE 454.A N ARG 450.A O no hydrogen 2.956 N/A GLU 455.A N TYR 451.A O no hydrogen 2.554 N/A ALA 456.A N LEU 452.A O no hydrogen 3.110 N/A LEU 457.A N GLU 453.A O no hydrogen 2.649 N/A GLY 458.A N PHE 454.A O no hydrogen 2.765 N/A LEU 460.A N LEU 457.A O no hydrogen 3.380 N/A ASN 461.A N GLY 458.A O no hydrogen 3.115 N/A GLU 462.A N GLY 458.A O no hydrogen 3.033 N/A ASP 463.A N PHE 459.A O no hydrogen 2.804 N/A HIS 464.A N ASN 461.A O no hydrogen 3.202 N/A HIS 464.A ND1 GLU 476.A OE1 no hydrogen 2.796 N/A TRP 465.A N LEU 460.A O no hydrogen 3.104 N/A SER 467.A N HIS 464.A O no hydrogen 3.187 N/A SER 467.A OG HIS 464.A O no hydrogen 3.021 N/A ARG 468.A NE GLY 474.A O no hydrogen 3.073 N/A ARG 468.A NH2 SER 473.A O no hydrogen 3.032 N/A ARG 468.A NH2 MET 627.A O no hydrogen 2.637 N/A ASN 470.A N SER 467.A O no hydrogen 3.203 N/A ASN 470.A ND2 LEU 379.A O no hydrogen 3.120 N/A ASN 470.A ND2 TRP 465.A O no hydrogen 2.805 N/A SER 471.A N SER 467.A O no hydrogen 2.898 N/A SER 471.A OG SER 467.A O no hydrogen 2.705 N/A TYR 472.A N ARG 468.A O no hydrogen 2.849 N/A SER 473.A N SER 471.A O no hydrogen 2.458 N/A SER 473.A OG LEU 624.A O no hydrogen 2.716 N/A GLY 474.A N SER 471.A OG no hydrogen 3.036 N/A GLU 476.A N PHE 466.A O no hydrogen 3.061 N/A LEU 480.A N HIS 767.A O no hydrogen 3.396 N/A LYS 482.A N GLY 479.A O no hydrogen 2.857 N/A LEU 483.A N GLY 479.A O no hydrogen 3.067 N/A ILE 486.A N LYS 482.A O no hydrogen 3.232 N/A LEU 487.A N LEU 483.A O no hydrogen 3.107 N/A ARG 488.A N GLY 484.A O no hydrogen 3.128 N/A ARG 488.A NH1 GLU 684.A OE2 no hydrogen 2.756 N/A ASP 489.A N TYR 485.A O no hydrogen 3.001 N/A ILE 490.A N ILE 486.A O no hydrogen 3.070 N/A SER 491.A N LEU 487.A O no hydrogen 3.064 N/A SER 491.A OG ARG 488.A O no hydrogen 2.698 N/A LYS 492.A N ASP 489.A O no hydrogen 3.212 N/A ILE 493.A N ILE 490.A O no hydrogen 2.986 N/A GLY 496.A N PRO 638.A O no hydrogen 2.809 N/A ALA 497.A N ASP 641.A OD1 no hydrogen 2.790 N/A MET 498.A N TRP 669.A O no hydrogen 2.700 N/A TYR 499.A N VAL 636.A O no hydrogen 2.652 N/A TYR 499.A OH ASP 641.A OD1 no hydrogen 2.511 N/A ALA 504.A N VAL 656.A O no hydrogen 2.971 N/A TRP 506.A NE1 ASN 578.A OD1 no hydrogen 2.822 N/A THR 508.A N GLY 505.A O no hydrogen 3.061 N/A THR 508.A OG1 GLY 505.A O no hydrogen 2.767 N/A ARG 509.A N TRP 506.A O no hydrogen 2.767 N/A ARG 509.A NE GLY 654.A O no hydrogen 2.754 N/A ARG 509.A NH2 GLY 654.A O no hydrogen 3.503 N/A THR 511.A N ASP 514.A OD2 no hydrogen 2.918 N/A ASP 514.A N THR 511.A OG1 no hydrogen 3.142 N/A LEU 515.A N THR 511.A O no hydrogen 2.924 N/A HIS 516.A N GLU 512.A O no hydrogen 3.075 N/A ASN 517.A N ASP 513.A O no hydrogen 2.992 N/A ASN 517.A N ASP 514.A O no hydrogen 3.070 N/A GLU 518.A N ASP 514.A O no hydrogen 2.954 N/A GLU 519.A N LEU 515.A O no hydrogen 3.291 N/A LYS 520.A N ASN 517.A O no hydrogen 3.360 N/A LYS 520.A NZ GLU 373.A OE2 no hydrogen 3.431 N/A ILE 522.A N GLU 519.A O no hydrogen 3.129 N/A GLN 523.A N LYS 520.A O no hydrogen 3.076 N/A GLN 524.A N ILE 521.A O no hydrogen 3.174 N/A GLN 524.A NE2 TRP 376.A O no hydrogen 3.099 N/A MET 525.A N ILE 522.A O no hydrogen 3.100 N/A GLU 528.A N GLU 528.A OE1 no hydrogen 2.564 N/A HIS 529.A NE2 ALA 456.A O no hydrogen 2.786 N/A ARG 530.A N ASP 526.A O no hydrogen 2.708 N/A ARG 530.A NH1 ILE 522.A O no hydrogen 3.276 N/A GLN 531.A N PRO 527.A O no hydrogen 2.891 N/A GLN 531.A NE2 LYS 427.A O no hydrogen 3.356 N/A ALA 533.A N HIS 529.A O no hydrogen 2.916 N/A ASN 534.A N ARG 530.A O no hydrogen 2.672 N/A ALA 535.A N GLN 531.A O no hydrogen 3.159 N/A ILE 536.A N LEU 532.A O no hydrogen 3.076 N/A PHE 537.A N ALA 533.A O no hydrogen 2.917 N/A LYS 538.A N ASN 534.A O no hydrogen 2.986 N/A LYS 538.A NZ GLU 519.A OE2 no hydrogen 2.451 N/A LYS 538.A NZ ASN 534.A OD1 no hydrogen 3.203 N/A LEU 539.A N ALA 535.A O no hydrogen 2.943 N/A THR 540.A N ILE 536.A O no hydrogen 3.111 N/A THR 540.A OG1 ILE 536.A O no hydrogen 2.785 N/A TYR 541.A N ILE 536.A O no hydrogen 3.027 N/A TYR 541.A OH GLU 453.A OE1 no hydrogen 3.108 N/A TYR 541.A OH VAL 572.A O no hydrogen 2.928 N/A GLN 542.A N PHE 537.A O no hydrogen 2.878 N/A ASN 543.A ND2 ASN 267.A OD1 no hydrogen 3.243 N/A LYS 544.A N ARG 563.A O no hydrogen 2.957 N/A LYS 544.A NZ ARG 563.A O no hydrogen 2.637 N/A LYS 544.A NZ LYS 564.A O no hydrogen 3.290 N/A LYS 544.A NZ ASP 565.A O no hydrogen 2.471 N/A VAL 546.A N ILE 561.A O no hydrogen 2.784 N/A LYS 547.A N TYR 436.A O no hydrogen 3.088 N/A LYS 547.A NZ TYR 303.A OH no hydrogen 3.339 N/A VAL 548.A N ASP 559.A O no hydrogen 2.945 N/A ARG 550.A N VAL 557.A O no hydrogen 2.869 N/A ARG 550.A NH1 ASP 559.A OD2 no hydrogen 2.736 N/A ARG 550.A NH2 ASP 289.A OD2 no hydrogen 2.271 N/A THR 552.A N GLY 555.A O no hydrogen 2.828 N/A THR 552.A OG1 GLY 555.A O no hydrogen 2.294 N/A GLY 555.A N THR 552.A O no hydrogen 3.196 N/A VAL 557.A N ARG 550.A O no hydrogen 3.011 N/A MET 558.A N TYR 303.A O no hydrogen 2.629 N/A ASP 559.A N VAL 548.A O no hydrogen 2.692 N/A ILE 560.A N GLY 301.A O no hydrogen 2.917 N/A ILE 561.A N VAL 546.A O no hydrogen 2.999 N/A SER 562.A N ALA 298.A O no hydrogen 2.895 N/A SER 562.A OG HIS 300.A NE2 no hydrogen 2.631 N/A ARG 563.A N LYS 544.A O no hydrogen 3.110 N/A ARG 563.A NH2 THR 355.A O no hydrogen 2.482 N/A LYS 564.A N GLU 264.A OE2 no hydrogen 2.674 N/A LYS 564.A NZ THR 265.A O no hydrogen 2.729 N/A GLN 566.A N ILE 510.A O no hydrogen 3.028 N/A GLN 566.A NE2 VAL 353.A O no hydrogen 2.951 N/A GLN 566.A NE2 THR 355.A O no hydrogen 3.612 N/A ARG 567.A N ASP 507.A O no hydrogen 2.796 N/A ARG 567.A NH1 GLU 518.A OE2 no hydrogen 3.561 N/A ARG 567.A NH1 ASN 578.A OD1 no hydrogen 2.351 N/A ARG 567.A NH2 GLU 518.A OE2 no hydrogen 2.633 N/A SER 569.A OG ASP 507.A OD2 no hydrogen 2.859 N/A VAL 572.A N GLU 453.A OE1 no hydrogen 2.658 N/A THR 574.A OG1 GLY 568.A O no hydrogen 3.002 N/A THR 574.A OG1 GLN 571.A O no hydrogen 3.082 N/A TYR 575.A OH SER 630.A OG no hydrogen 2.842 N/A LEU 577.A N GLY 573.A O no hydrogen 2.909 N/A ASN 578.A N THR 574.A O no hydrogen 2.854 N/A ASN 578.A ND2 ASP 507.A OD1 no hydrogen 3.307 N/A THR 579.A N TYR 575.A O no hydrogen 2.846 N/A THR 579.A OG1 TYR 575.A O no hydrogen 2.792 N/A PHE 580.A N GLY 576.A O no hydrogen 2.818 N/A THR 581.A N LEU 577.A O no hydrogen 3.072 N/A THR 581.A OG1 GLU 518.A OE2 no hydrogen 2.398 N/A THR 581.A OG1 LEU 577.A O no hydrogen 3.212 N/A ASN 582.A N ASN 578.A O no hydrogen 2.921 N/A ASN 582.A ND2 GLY 631.A O no hydrogen 3.077 N/A MET 583.A N THR 579.A O no hydrogen 2.814 N/A GLU 584.A N PHE 580.A O no hydrogen 2.962 N/A ALA 585.A N THR 581.A O no hydrogen 2.707 N/A GLN 586.A N ASN 582.A O no hydrogen 2.916 N/A GLN 586.A NE2 ASN 582.A OD1 no hydrogen 3.201 N/A LEU 587.A N MET 583.A O no hydrogen 3.030 N/A VAL 588.A N GLU 584.A O no hydrogen 2.904 N/A ARG 589.A N ALA 585.A O no hydrogen 2.987 N/A ARG 589.A NE PHE 643.A O no hydrogen 3.307 N/A ARG 589.A NE ALA 646.A O no hydrogen 3.009 N/A ARG 589.A NH1 ASP 501.A OD2 no hydrogen 2.956 N/A ARG 589.A NH2 PHE 643.A O no hydrogen 2.935 N/A ARG 589.A NH2 SER 666.A OG no hydrogen 2.894 N/A GLN 590.A N GLN 586.A O no hydrogen 2.987 N/A GLN 590.A NE2 ARG 623.A O no hydrogen 3.338 N/A MET 591.A N LEU 587.A O no hydrogen 3.027 N/A GLU 592.A N VAL 588.A O no hydrogen 3.288 N/A GLY 593.A N ARG 589.A O no hydrogen 3.023 N/A GLU 594.A N GLN 590.A O no hydrogen 3.002 N/A GLY 595.A N GLU 592.A O no hydrogen 3.204 N/A LEU 597.A N MET 591.A O no hydrogen 3.251 N/A THR 598.A N ASP 601.A OD2 no hydrogen 3.210 N/A LYS 599.A NZ GLU 603.A OE2 no hydrogen 3.218 N/A ASP 601.A N THR 598.A O no hydrogen 2.779 N/A LEU 602.A N THR 598.A O no hydrogen 3.155 N/A GLU 603.A N LYS 599.A O no hydrogen 3.306 N/A ASN 604.A N ALA 600.A O no hydrogen 2.967 N/A LYS 611.A NZ VAL 596.A O no hydrogen 3.055 N/A LYS 611.A NZ ASP 601.A OD2 no hydrogen 2.701 N/A ILE 612.A N GLU 609.A O no hydrogen 3.054 N/A THR 613.A N GLU 609.A O no hydrogen 3.082 N/A THR 613.A OG1 GLU 609.A O no hydrogen 3.440 N/A GLN 614.A N LYS 610.A O no hydrogen 3.268 N/A TRP 615.A N LYS 611.A O no hydrogen 3.256 N/A TRP 615.A NE1 GLU 594.A OE1 no hydrogen 2.983 N/A LEU 616.A N ILE 612.A O no hydrogen 2.993 N/A GLU 617.A N THR 613.A O no hydrogen 2.858 N/A THR 618.A N GLN 614.A O no hydrogen 2.981 N/A THR 618.A N TRP 615.A O no hydrogen 3.277 N/A THR 618.A OG1 GLN 614.A O no hydrogen 2.590 N/A THR 618.A OG1 TRP 615.A O no hydrogen 3.280 N/A LYS 619.A N TRP 615.A O no hydrogen 2.713 N/A GLY 620.A N LEU 616.A O no hydrogen 2.987 N/A ARG 623.A N LYS 619.A O no hydrogen 2.899 N/A ARG 623.A NE GLU 594.A OE2 no hydrogen 2.767 N/A ARG 623.A NH1 GLU 622.A OE1 no hydrogen 2.592 N/A ARG 623.A NH2 GLU 594.A OE1 no hydrogen 3.028 N/A ARG 623.A NH2 GLU 594.A OE2 no hydrogen 3.516 N/A LEU 624.A N GLY 620.A O no hydrogen 2.872 N/A LYS 625.A N VAL 621.A O no hydrogen 3.050 N/A ARG 626.A N ARG 623.A O no hydrogen 3.158 N/A ARG 626.A NE GLU 622.A OE1 no hydrogen 3.155 N/A ARG 626.A NH1 PRO 494.A O no hydrogen 3.217 N/A ARG 626.A NH1 LYS 637.A O no hydrogen 2.821 N/A ARG 626.A NH2 PRO 494.A O no hydrogen 2.929 N/A MET 627.A N LEU 624.A O no hydrogen 3.162 N/A ALA 628.A N VAL 635.A O no hydrogen 2.914 N/A ILE 629.A N SER 473.A O no hydrogen 2.822 N/A SER 630.A N ASP 633.A O no hydrogen 2.674 N/A SER 630.A OG TYR 575.A OH no hydrogen 2.842 N/A SER 630.A OG HIS 767.A NE2 no hydrogen 2.755 N/A GLY 631.A N THR 579.A OG1 no hydrogen 2.937 N/A ASP 633.A N SER 630.A O no hydrogen 2.918 N/A CYS 634.A SG ASP 501.A O no hydrogen 3.696 N/A VAL 635.A N ALA 628.A O no hydrogen 2.939 N/A VAL 636.A N TYR 499.A O no hydrogen 2.705 N/A LYS 637.A N ARG 626.A O no hydrogen 2.937 N/A LYS 637.A NZ ILE 493.A O no hydrogen 2.761 N/A LYS 637.A NZ GLY 496.A O no hydrogen 2.768 N/A ARG 642.A N ASP 640.A OD1 no hydrogen 2.930 N/A ARG 642.A NE ASP 640.A OD1 no hydrogen 2.905 N/A ARG 642.A NE ASP 640.A OD2 no hydrogen 3.189 N/A ARG 642.A NH2 ASP 640.A OD2 no hydrogen 2.921 N/A ALA 644.A N ASP 641.A O no hydrogen 3.107 N/A ASN 645.A N ARG 642.A O no hydrogen 2.770 N/A ALA 646.A N PHE 643.A O no hydrogen 3.005 N/A LEU 648.A N GLU 592.A OE2 no hydrogen 2.833 N/A ALA 649.A N GLU 592.A OE1 no hydrogen 2.768 N/A ASN 651.A N LEU 647.A O no hydrogen 3.118 N/A ASN 651.A ND2 GLN 662.A O no hydrogen 2.774 N/A ASP 652.A N LEU 648.A O no hydrogen 3.018 N/A MET 653.A N ALA 649.A O no hydrogen 2.823 N/A GLY 654.A N ASN 651.A O no hydrogen 2.836 N/A LYS 655.A N LEU 650.A O no hydrogen 3.140 N/A LYS 655.A NZ ARG 509.A O no hydrogen 2.920 N/A LYS 655.A NZ ASP 514.A OD2 no hydrogen 2.764 N/A LYS 655.A NZ MET 653.A O no hydrogen 2.857 N/A ARG 657.A NH1 GLN 664.A O no hydrogen 2.975 N/A ARG 657.A NH1 SER 666.A OG no hydrogen 2.580 N/A ARG 657.A NH2 GLN 662.A O no hydrogen 3.364 N/A ARG 657.A NH2 GLN 664.A O no hydrogen 2.534 N/A LYS 658.A N ASP 502.A O no hydrogen 2.713 N/A GLN 664.A N PRO 661.A O no hydrogen 3.191 N/A SER 666.A N ALA 644.A O no hydrogen 2.902 N/A SER 666.A OG ASP 501.A OD2 no hydrogen 2.560 N/A TRP 669.A N MET 498.A O no hydrogen 2.913 N/A GLN 673.A N ASP 671.A OD1 no hydrogen 3.320 N/A GLN 674.A N ASP 671.A O no hydrogen 2.915 N/A VAL 675.A N TRP 672.A O no hydrogen 3.192 N/A PHE 677.A N HIS 680.A O no hydrogen 2.803 N/A CYS 678.A N ASP 633.A OD2 no hydrogen 2.671 N/A CYS 678.A SG SER 630.A OG no hydrogen 3.630 N/A HIS 680.A N PHE 677.A O no hydrogen 3.043 N/A HIS 680.A ND1 CYS 678.A O no hydrogen 2.656 N/A HIS 680.A NE2 TYR 735.A OH no hydrogen 2.591 N/A HIS 681.A N CYS 697.A O no hydrogen 2.842 N/A HIS 683.A N VAL 695.A O no hydrogen 3.063 N/A LEU 685.A N LEU 693.A O no hydrogen 2.668 N/A MET 687.A N ARG 691.A O no hydrogen 3.050 N/A ARG 691.A NH1 ASP 795.A O no hydrogen 2.933 N/A ARG 691.A NH1 THR 797.A O no hydrogen 2.657 N/A ARG 691.A NH2 THR 797.A O no hydrogen 2.983 N/A LEU 693.A N LEU 685.A O no hydrogen 2.849 N/A VAL 694.A N TYR 485.A OH no hydrogen 3.125 N/A VAL 695.A N HIS 683.A O no hydrogen 2.885 N/A CYS 697.A N HIS 681.A O no hydrogen 2.760 N/A CYS 697.A SG HIS 681.A NE2 no hydrogen 3.698 N/A CYS 697.A SG HIS 683.A NE2 no hydrogen 3.495 N/A CYS 697.A SG ARG 698.A O no hydrogen 3.837 N/A ARG 698.A NE GLU 702.A OE1 no hydrogen 3.107 N/A ARG 698.A NH2 GLU 702.A OE1 no hydrogen 2.704 N/A GLN 700.A N CYS 816.A O no hydrogen 2.878 N/A GLN 700.A NE2 ASP 740.A OD2 no hydrogen 3.411 N/A GLU 702.A N PRO 699.A O no hydrogen 3.227 N/A LEU 703.A N GLN 700.A O no hydrogen 3.051 N/A ILE 704.A N GLN 700.A O no hydrogen 2.946 N/A GLY 705.A N ASP 701.A O no hydrogen 2.686 N/A ALA 707.A N ILE 704.A O no hydrogen 3.163 N/A ARG 708.A N GLY 705.A O no hydrogen 3.356 N/A ARG 708.A NH1 THR 323.A OG1 no hydrogen 3.090 N/A ARG 708.A NH1 ASP 327.A OD1 no hydrogen 3.017 N/A ARG 708.A NH2 ASP 327.A OD1 no hydrogen 3.007 N/A SER 710.A N MET 314.A O no hydrogen 3.003 N/A SER 716.A N ALA 713.A O no hydrogen 3.389 N/A THR 720.A N SER 716.A O no hydrogen 2.984 N/A ALA 721.A N ILE 717.A O no hydrogen 3.260 N/A CYS 722.A SG ARG 718.A O no hydrogen 3.898 N/A CYS 722.A SG VAL 757.A O no hydrogen 3.097 N/A GLY 724.A N THR 720.A O no hydrogen 3.381 N/A LYS 725.A N ALA 721.A O no hydrogen 2.784 N/A LYS 725.A NZ PRO 753.A O no hydrogen 3.009 N/A ALA 726.A N LEU 723.A O no hydrogen 3.205 N/A TYR 727.A N LEU 723.A O no hydrogen 3.184 N/A ALA 728.A N GLY 724.A O no hydrogen 2.793 N/A GLN 729.A N LYS 725.A O no hydrogen 3.139 N/A GLN 729.A N ALA 726.A O no hydrogen 3.252 N/A MET 730.A N ALA 726.A O no hydrogen 2.965 N/A TRP 731.A N TYR 727.A O no hydrogen 2.803 N/A SER 732.A OG ALA 728.A O no hydrogen 2.552 N/A LEU 733.A N GLN 729.A O no hydrogen 3.049 N/A MET 734.A N MET 730.A O no hydrogen 2.735 N/A TYR 735.A N TRP 731.A O no hydrogen 2.988 N/A TYR 735.A OH HIS 680.A NE2 no hydrogen 2.591 N/A HIS 737.A NE2 MET 734.A O no hydrogen 3.134 N/A ARG 738.A N TYR 735.A O no hydrogen 3.119 N/A ARG 738.A NE ASP 813.A OD1 no hydrogen 2.584 N/A ARG 738.A NH1 ARG 698.A O no hydrogen 3.079 N/A ARG 738.A NH1 CYS 816.A O no hydrogen 3.553 N/A ARG 738.A NH2 ASP 813.A OD1 no hydrogen 3.284 N/A ARG 738.A NH2 CYS 816.A O no hydrogen 2.941 N/A ARG 739.A N ASP 813.A OD2 no hydrogen 3.371 N/A ARG 739.A NH1 LEU 808.A O no hydrogen 2.717 N/A ARG 739.A NH1 ASP 813.A OD2 no hydrogen 2.978 N/A ARG 739.A NH2 LEU 808.A O no hydrogen 2.903 N/A ARG 742.A N ARG 738.A O no hydrogen 3.041 N/A ARG 742.A NE PHE 736.A O no hydrogen 2.971 N/A ARG 742.A NH1 TRP 802.A O no hydrogen 3.042 N/A ARG 742.A NH2 PHE 736.A O no hydrogen 3.481 N/A ARG 742.A NH2 VAL 805.A O no hydrogen 2.593 N/A LEU 743.A N ARG 739.A O no hydrogen 3.169 N/A ALA 744.A N ASP 740.A O no hydrogen 2.699 N/A SER 745.A N LEU 741.A O no hydrogen 2.639 N/A SER 745.A OG ALA 728.A O no hydrogen 2.608 N/A SER 745.A OG SER 732.A OG no hydrogen 2.410 N/A ASN 746.A N ARG 742.A O no hydrogen 3.074 N/A ALA 747.A N ALA 744.A O no hydrogen 3.014 N/A ILE 748.A N ALA 744.A O no hydrogen 2.899 N/A CYS 749.A N SER 745.A O no hydrogen 3.157 N/A CYS 749.A SG SER 745.A O no hydrogen 3.183 N/A SER 750.A OG ASN 746.A O no hydrogen 2.722 N/A SER 750.A OG ALA 747.A O no hydrogen 3.546 N/A ALA 751.A N ILE 748.A O no hydrogen 2.851 N/A VAL 754.A N GLU 847.A O no hydrogen 2.890 N/A HIS 767.A N SER 765.A OG no hydrogen 3.244 N/A HIS 767.A NE2 SER 630.A OG no hydrogen 2.755 N/A ALA 768.A N SER 765.A O no hydrogen 2.983 N/A GLN 771.A N GLN 771.A OE1 no hydrogen 2.904 N/A THR 780.A N ASP 777.A O no hydrogen 3.148 N/A THR 780.A OG1 ASP 777.A O no hydrogen 2.626 N/A VAL 781.A N ASP 777.A O no hydrogen 3.267 N/A TRP 782.A N MET 778.A O no hydrogen 2.778 N/A ASN 783.A N LEU 779.A O no hydrogen 2.820 N/A ASN 783.A ND2 LEU 779.A O no hydrogen 2.842 N/A ASN 783.A ND2 VAL 799.A O no hydrogen 3.081 N/A ARG 784.A N THR 780.A O no hydrogen 3.069 N/A VAL 785.A N VAL 781.A O no hydrogen 3.128 N/A TRP 786.A N TRP 782.A O no hydrogen 2.850 N/A TRP 786.A NE1 LEU 733.A O no hydrogen 2.789 N/A ILE 787.A N ASN 783.A O no hydrogen 3.069 N/A GLU 788.A N ASN 783.A O no hydrogen 3.274 N/A GLU 789.A N ARG 784.A O no hydrogen 2.932 N/A ASN 790.A N ILE 787.A O no hydrogen 3.370 N/A ASN 790.A ND2 TYR 485.A OH no hydrogen 3.196 N/A ASN 790.A ND2 TRP 786.A O no hydrogen 3.412 N/A TRP 792.A N ASN 790.A OD1 no hydrogen 3.157 N/A TRP 792.A NE1 ASP 489.A OD2 no hydrogen 3.092 N/A MET 793.A N ASN 790.A O no hydrogen 3.137 N/A LYS 796.A NZ ILE 787.A O no hydrogen 2.841 N/A LYS 796.A NZ GLU 788.A O no hydrogen 3.196 N/A LYS 796.A NZ MET 793.A O no hydrogen 2.823 N/A THR 797.A N ASP 795.A OD1 no hydrogen 3.292 N/A THR 797.A OG1 ASP 795.A OD1 no hydrogen 3.070 N/A THR 797.A OG1 ASP 795.A OD2 no hydrogen 3.164 N/A VAL 799.A N ASN 783.A OD1 no hydrogen 2.730 N/A GLU 803.A N THR 801.A OG1 no hydrogen 3.178 N/A ASN 804.A N THR 801.A O no hydrogen 3.252 N/A LEU 808.A N HIS 737.A O no hydrogen 2.934 N/A ASP 813.A N GLY 809.A O no hydrogen 2.662 N/A GLN 814.A N LYS 810.A O no hydrogen 2.964 N/A GLN 814.A NE2 ILE 820.A O no hydrogen 3.649 N/A TRP 815.A N ARG 811.A O no hydrogen 3.122 N/A CYS 816.A N GLU 812.A O no hydrogen 3.228 N/A CYS 816.A N ASP 813.A O no hydrogen 3.276 N/A CYS 816.A SG HIS 681.A NE2 no hydrogen 3.371 N/A CYS 816.A SG HIS 683.A NE2 no hydrogen 3.552 N/A CYS 816.A SG GLU 812.A O no hydrogen 3.470 N/A GLY 817.A N GLN 814.A O no hydrogen 2.904 N/A SER 818.A N ASP 813.A O no hydrogen 3.198 N/A SER 818.A OG ASP 740.A OD1 no hydrogen 3.104 N/A SER 818.A OG ASP 740.A OD2 no hydrogen 3.537 N/A SER 818.A OG ASP 813.A OD2 no hydrogen 3.503 N/A LEU 819.A N ASP 740.A OD2 no hydrogen 3.012 N/A ILE 820.A N SER 818.A OG no hydrogen 3.400 N/A ARG 825.A N LEU 822.A O no hydrogen 3.116 N/A ARG 825.A NE ASP 740.A OD1 no hydrogen 3.456 N/A THR 827.A N THR 823.A O no hydrogen 2.870 N/A THR 827.A OG1 THR 823.A O no hydrogen 3.414 N/A THR 827.A OG1 SER 824.A O no hydrogen 2.795 N/A TRP 828.A N SER 824.A O no hydrogen 2.965 N/A TRP 828.A NE1 LEU 322.A O no hydrogen 2.772 N/A ALA 829.A N ARG 825.A O no hydrogen 2.728 N/A GLN 830.A N ALA 826.A O no hydrogen 3.153 N/A ASN 831.A N TRP 828.A O no hydrogen 3.213 N/A ILE 832.A N TRP 828.A O no hydrogen 3.111 N/A THR 834.A OG1 ASN 831.A O no hydrogen 2.419 N/A ALA 835.A N ASN 831.A O no hydrogen 3.032 N/A ILE 836.A N ILE 832.A O no hydrogen 2.785 N/A GLN 837.A N PRO 833.A O no hydrogen 2.926 N/A GLN 838.A N THR 834.A O no hydrogen 2.649 N/A VAL 839.A N ALA 835.A O no hydrogen 3.324 N/A ARG 840.A N ILE 836.A O no hydrogen 3.095 N/A ARG 840.A NH2 GLN 837.A OE1 no hydrogen 3.310 N/A SER 841.A N GLN 837.A O no hydrogen 3.206 N/A LEU 842.A N GLN 838.A O no hydrogen 2.782 N/A ILE 843.A N VAL 839.A O no hydrogen 2.535 N/A GLY 844.A N ARG 840.A O no hydrogen 2.977 N/A ASP 850.A N ASP 850.A OD1 no hydrogen 2.620 N/A