Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3hhd_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLU 2.A N HIS 176.A O no hydrogen 2.882 N/A VAL 5.A N THR 234.A O no hydrogen 2.953 N/A ILE 6.A N ALA 244.A O no hydrogen 2.974 N/A ALA 7.A N LEU 232.A O no hydrogen 2.844 N/A MET 9.A N ASP 92.A OD2 no hydrogen 2.912 N/A SER 10.A N ALA 230.A O no hydrogen 3.104 N/A SER 10.A OG GLU 88.A OE1 no hydrogen 2.710 N/A LYS 12.A N VAL 228.A O no hydrogen 2.825 N/A LYS 12.A NZ GLU 17.A O no hydrogen 3.373 N/A LYS 12.A NZ GLU 17.A OE2 no hydrogen 2.687 N/A LEU 13.A N SER 16.A O no hydrogen 2.970 N/A GLU 15.A N LYS 53.A O no hydrogen 3.225 N/A SER 16.A N LEU 13.A O no hydrogen 2.874 N/A SER 16.A OG PRO 14.A O no hydrogen 2.959 N/A GLU 17.A N GLU 21.A OE1 no hydrogen 2.889 N/A GLN 20.A N ASN 18.A OD1 no hydrogen 2.888 N/A GLN 20.A NE2 ASP 24.A OD1 no hydrogen 3.034 N/A GLU 21.A N ASN 18.A OD1 no hydrogen 2.978 N/A PHE 22.A N ASN 18.A O no hydrogen 3.016 N/A TRP 23.A N LEU 19.A O no hydrogen 2.935 N/A ASP 24.A N GLN 20.A O no hydrogen 2.878 N/A ASN 25.A N GLU 21.A O no hydrogen 2.933 N/A ASN 25.A ND2 GLU 15.A O no hydrogen 3.043 N/A ASN 25.A ND2 SER 16.A OG no hydrogen 3.024 N/A LEU 26.A N PHE 22.A O no hydrogen 2.864 N/A ILE 27.A N TRP 23.A O no hydrogen 2.821 N/A GLY 28.A N ASP 24.A O no hydrogen 2.885 N/A GLY 29.A N LEU 26.A O no hydrogen 3.250 N/A VAL 30.A N ASN 25.A O no hydrogen 2.908 N/A MET 32.A N ASN 328.A O no hydrogen 2.987 N/A VAL 33.A N ASP 31.A OD1 no hydrogen 3.070 N/A THR 34.A N SER 51.A O no hydrogen 3.099 N/A THR 34.A OG1 ASP 36.A OD2 no hydrogen 3.290 N/A ARG 38.A N ASP 36.A OD1 no hydrogen 2.840 N/A ARG 38.A NE ASP 36.A OD1 no hydrogen 3.006 N/A ARG 38.A NE ASP 36.A OD2 no hydrogen 3.361 N/A ARG 38.A NH1 GLU 15.A OE2 no hydrogen 2.900 N/A ARG 38.A NH1 LEU 54.A O no hydrogen 3.137 N/A ARG 38.A NH2 GLU 15.A OE2 no hydrogen 2.866 N/A ARG 38.A NH2 ASP 36.A OD2 no hydrogen 2.596 N/A ARG 39.A NE GLU 226.A OE2 no hydrogen 2.810 N/A ARG 39.A NH2 LEU 54.A O no hydrogen 3.090 N/A ARG 39.A NH2 GLU 226.A OE1 no hydrogen 2.710 N/A ALA 42.A N ASP 37.A OD1 no hydrogen 3.052 N/A LEU 44.A N LYS 41.A O no hydrogen 2.967 N/A GLY 46.A N GLY 43.A O no hydrogen 2.819 N/A LEU 47.A N LEU 44.A O no hydrogen 2.776 N/A ARG 50.A NE GLU 209.A O no hydrogen 3.115 N/A ARG 50.A NE GLY 210.A O no hydrogen 3.179 N/A ARG 50.A NH1 ASP 31.A OD2 no hydrogen 3.323 N/A ARG 50.A NH2 ASP 31.A OD2 no hydrogen 3.047 N/A ARG 50.A NH2 GLY 210.A O no hydrogen 3.440 N/A ARG 50.A NH2 THR 211.A OG1 no hydrogen 2.826 N/A SER 51.A N THR 34.A O no hydrogen 2.995 N/A GLY 52.A N ARG 224.A O no hydrogen 3.035 N/A LYS 53.A NZ THR 34.A O no hydrogen 3.379 N/A LYS 53.A NZ SER 51.A O no hydrogen 2.974 N/A LEU 54.A N GLU 226.A OE1 no hydrogen 2.743 N/A LYS 55.A NZ GLU 21.A OE1 no hydrogen 3.132 N/A SER 58.A N ASP 56.A OD1 no hydrogen 2.810 N/A SER 58.A OG ASP 56.A OD1 no hydrogen 2.636 N/A ARG 59.A NE ASP 56.A OD2 no hydrogen 3.158 N/A ARG 59.A NH1 LEU 840.A O no hydrogen 3.011 N/A ASP 61.A N GLU 84.A OE2 no hydrogen 2.824 N/A ALA 62.A N PHE 60.A O no hydrogen 2.879 N/A PHE 65.A N ASP 61.A O no hydrogen 3.479 N/A GLY 66.A N SER 63.A O no hydrogen 3.055 N/A VAL 67.A N ALA 62.A O no hydrogen 2.838 N/A LYS 70.A N HIS 68.A ND1 no hydrogen 2.739 N/A GLN 71.A NE2 GLN 71.A O no hydrogen 2.970 N/A GLN 71.A NE2 TYR 130.A O no hydrogen 2.974 N/A ALA 72.A N HIS 68.A O no hydrogen 2.963 N/A HIS 73.A N PRO 69.A O no hydrogen 3.067 N/A THR 74.A N GLN 71.A O no hydrogen 3.037 N/A THR 74.A OG1 LYS 70.A O no hydrogen 3.023 N/A THR 74.A OG1 GLN 71.A O no hydrogen 3.207 N/A MET 75.A N ALA 72.A O no hydrogen 3.429 N/A ASP 76.A N GLY 134.A O no hydrogen 2.876 N/A GLN 78.A N ASP 76.A OD1 no hydrogen 2.815 N/A GLN 78.A NE2 ASP 76.A OD1 no hydrogen 3.358 N/A GLN 78.A NE2 ASP 76.A OD2 no hydrogen 2.951 N/A GLN 78.A NE2 GLY 113.A O no hydrogen 3.312 N/A LEU 79.A N ASP 76.A O no hydrogen 2.945 N/A ARG 80.A N ASP 76.A O no hydrogen 3.143 N/A ARG 80.A NH1 ALA 72.A O no hydrogen 2.964 N/A ARG 80.A NH1 ASP 843.A O no hydrogen 2.849 N/A ARG 80.A NH2 LEU 57.A O no hydrogen 2.924 N/A ARG 80.A NH2 ASP 843.A O no hydrogen 3.118 N/A LEU 81.A N PRO 77.A O no hydrogen 2.988 N/A LEU 82.A N GLN 78.A O no hydrogen 2.932 N/A LEU 83.A N LEU 79.A O no hydrogen 2.904 N/A VAL 85.A N LEU 81.A O no hydrogen 2.966 N/A THR 86.A N LEU 82.A O no hydrogen 2.798 N/A THR 86.A OG1 LEU 82.A O no hydrogen 2.766 N/A TYR 87.A N LEU 83.A O no hydrogen 3.167 N/A GLU 88.A N GLU 84.A O no hydrogen 2.987 N/A ALA 89.A N VAL 85.A O no hydrogen 2.892 N/A ILE 90.A N THR 86.A O no hydrogen 3.119 N/A VAL 91.A N TYR 87.A O no hydrogen 3.102 N/A ASP 92.A N GLU 88.A O no hydrogen 2.894 N/A GLY 93.A N ILE 90.A O no hydrogen 3.021 N/A GLY 94.A N VAL 91.A O no hydrogen 2.748 N/A ILE 95.A N ILE 90.A O no hydrogen 3.404 N/A ASN 96.A ND2 ALA 459.A O no hydrogen 2.894 N/A ASP 98.A N ASN 96.A OD1 no hydrogen 2.911 N/A SER 99.A N ASN 96.A O no hydrogen 2.906 N/A SER 99.A OG ASN 96.A O no hydrogen 2.829 N/A LEU 100.A N PRO 97.A O no hydrogen 2.928 N/A ARG 101.A N ASP 98.A O no hydrogen 3.184 N/A ARG 101.A NH1 PHE 147.A O no hydrogen 2.904 N/A GLY 102.A N ASP 149.A O no hydrogen 2.845 N/A THR 103.A N LEU 100.A O no hydrogen 3.231 N/A THR 103.A OG1 LEU 100.A O no hydrogen 2.703 N/A THR 103.A OG1 THR 105.A OG1 no hydrogen 2.745 N/A THR 105.A OG1 THR 103.A OG1 no hydrogen 2.745 N/A GLY 106.A N ALA 182.A O no hydrogen 3.089 N/A VAL 107.A N PRO 153.A O no hydrogen 2.747 N/A TRP 108.A N ILE 184.A O no hydrogen 3.047 N/A VAL 109.A N ILE 155.A O no hydrogen 2.865 N/A GLY 110.A N GLY 186.A O no hydrogen 2.737 N/A VAL 111.A N LEU 157.A O no hydrogen 3.083 N/A SER 112.A OG.B ASP 158.A OD1 no hydrogen 2.930 N/A GLU 118.A N SER 114.A O no hydrogen 3.352 N/A ALA 119.A N GLU 115.A O no hydrogen 2.977 N/A LEU 120.A N THR 116.A O no hydrogen 2.926 N/A SER 121.A N SER 117.A O no hydrogen 3.245 N/A SER 121.A N GLU 118.A O no hydrogen 3.416 N/A SER 121.A OG SER 117.A O no hydrogen 2.824 N/A SER 121.A OG GLU 118.A O no hydrogen 3.410 N/A ARG 122.A NH1 ALA 119.A O no hydrogen 2.604 N/A GLU 125.A N ASP 123.A OD1 no hydrogen 3.189 N/A THR 126.A N ASP 123.A O no hydrogen 3.121 N/A LEU 127.A N ASP 123.A O no hydrogen 2.705 N/A SER 131.A N VAL 128.A O no hydrogen 3.210 N/A SER 131.A OG VAL 128.A O no hydrogen 2.769 N/A MET 132.A N GLY 129.A O no hydrogen 2.995 N/A GLY 134.A N TYR 130.A O no hydrogen 3.211 N/A CYS 135.A N MET 132.A O no hydrogen 3.434 N/A CYS 135.A SG THR 74.A O no hydrogen 3.400 N/A CYS 135.A SG SER 131.A O no hydrogen 3.313 N/A GLN 136.A N MET 132.A O no hydrogen 3.073 N/A ARG 137.A NH1 ASP 158.A OD2 no hydrogen 2.856 N/A MET 139.A N GLN 136.A O no hydrogen 2.947 N/A MET 140.A N ARG 137.A O no hydrogen 3.067 N/A ALA 141.A N ALA 138.A O no hydrogen 3.133 N/A ASN 142.A N ALA 138.A O no hydrogen 2.865 N/A ARG 143.A N MET 139.A O no hydrogen 2.760 N/A ARG 143.A NH1.A GLN 71.A OE1 no hydrogen 3.536 N/A LEU 144.A N ALA 141.A O no hydrogen 3.113 N/A SER 145.A N ALA 141.A O no hydrogen 3.169 N/A SER 145.A OG ALA 141.A O no hydrogen 3.559 N/A SER 145.A OG SER 154.A OG no hydrogen 2.813 N/A PHE 146.A N ASN 142.A O no hydrogen 2.950 N/A PHE 147.A N ARG 143.A O no hydrogen 3.048 N/A PHE 148.A N LEU 144.A O no hydrogen 3.028 N/A ASP 149.A N PHE 146.A O no hydrogen 3.346 N/A PHE 150.A N SER 145.A O no hydrogen 2.877 N/A ARG 151.A N THR 103.A O no hydrogen 2.876 N/A ARG 151.A NE ASP 149.A OD1 no hydrogen 3.237 N/A ARG 151.A NH2 ASP 149.A OD1 no hydrogen 3.329 N/A ARG 151.A NH2 ASP 149.A OD2 no hydrogen 3.336 N/A GLY 152.A N THR 105.A O no hydrogen 2.811 N/A SER 154.A OG ASN 142.A OD1 no hydrogen 2.970 N/A SER 154.A OG SER 145.A OG no hydrogen 2.813 N/A ILE 155.A N VAL 107.A O no hydrogen 2.959 N/A LEU 157.A N VAL 109.A O no hydrogen 2.823 N/A THR 159.A N SER 163.A OG no hydrogen 2.735 N/A THR 159.A OG1 SER 162.A OG no hydrogen 2.821 N/A ALA 160.A N ASP 158.A OD1 no hydrogen 2.791 N/A CYS 161.A SG HIS 331.A NE2 no hydrogen 3.800 N/A SER 162.A OG THR 159.A O no hydrogen 3.305 N/A SER 162.A OG THR 159.A OG1 no hydrogen 2.821 N/A SER 162.A OG SER 398.A O no hydrogen 3.026 N/A SER 163.A N ALA 160.A O no hydrogen 3.011 N/A SER 163.A OG ASP 158.A OD1 no hydrogen 3.565 N/A SER 163.A OG ALA 160.A O no hydrogen 2.657 N/A SER 164.A N PRO 334.A O no hydrogen 2.977 N/A SER 164.A OG PRO 334.A O no hydrogen 2.730 N/A MET 166.A N SER 162.A O no hydrogen 2.880 N/A ALA 167.A N SER 163.A O no hydrogen 2.853 N/A LEU 168.A N SER 164.A O no hydrogen 2.996 N/A GLN 169.A N LEU 165.A O no hydrogen 2.933 N/A GLN 169.A NE2 ALA 249.A O no hydrogen 3.470 N/A ASN 170.A N MET 166.A O no hydrogen 3.019 N/A ASN 170.A ND2 GLN 169.A OE1 no hydrogen 2.960 N/A ALA 171.A N ALA 167.A O no hydrogen 2.969 N/A TYR 172.A N LEU 168.A O no hydrogen 2.838 N/A GLN 173.A N GLN 169.A O no hydrogen 2.935 N/A ALA 174.A N ASN 170.A O no hydrogen 3.062 N/A ILE 175.A N ALA 171.A O no hydrogen 3.015 N/A HIS 176.A N TYR 172.A O no hydrogen 2.822 N/A HIS 176.A ND1 GLU 2.A O no hydrogen 2.978 N/A SER 177.A N GLN 173.A O no hydrogen 3.080 N/A SER 177.A OG GLN 173.A O no hydrogen 3.004 N/A SER 177.A OG ALA 174.A O no hydrogen 3.507 N/A GLY 178.A N ILE 175.A O no hydrogen 3.029 N/A CYS 180.A N ALA 174.A O no hydrogen 3.065 N/A CYS 180.A SG HIS 104.A O no hydrogen 3.432 N/A ALA 183.A N LEU 233.A O no hydrogen 2.872 N/A ILE 184.A N GLY 106.A O no hydrogen 2.818 N/A VAL 185.A N VAL 231.A O no hydrogen 2.892 N/A GLY 186.A N TRP 108.A O no hydrogen 2.941 N/A GLY 187.A N VAL 229.A O no hydrogen 2.974 N/A ILE 188.A N GLY 110.A O no hydrogen 3.170 N/A ASN 189.A N GLY 227.A O no hydrogen 2.845 N/A ASN 189.A ND2 SER 225.A O no hydrogen 2.860 N/A ASN 189.A ND2 GLU 333.A OE1 no hydrogen 3.100 N/A LEU 191.A N GLU 226.A OE2 no hydrogen 2.858 N/A LEU 192.A N GLU 115.A OE1 no hydrogen 2.950 N/A LYS 193.A N GLU 115.A OE1 no hydrogen 3.332 N/A LYS 193.A NZ GLU 118.A OE1 no hydrogen 2.796 N/A ASN 195.A N ASN 195.A OD1 no hydrogen 2.583 N/A ASN 195.A ND2 PRO 851.A O no hydrogen 2.888 N/A THR 196.A N LYS 193.A O no hydrogen 3.215 N/A THR 196.A OG1 GLU 115.A OE2 no hydrogen 3.079 N/A VAL 198.A N PRO 194.A O no hydrogen 3.111 N/A GLN 199.A N ASN 195.A O no hydrogen 3.014 N/A PHE 200.A N THR 196.A O no hydrogen 3.212 N/A LEU 201.A N SER 197.A O no hydrogen 2.849 N/A ARG 202.A N VAL 198.A O no hydrogen 2.893 N/A LEU 203.A N GLN 199.A O no hydrogen 3.083 N/A LEU 203.A N PHE 200.A O no hydrogen 3.163 N/A GLY 204.A N LEU 201.A O no hydrogen 2.959 N/A MET 205.A N PHE 200.A O no hydrogen 3.113 N/A SER 207.A N TYR 222.A O no hydrogen 3.056 N/A SER 207.A OG THR 211.A O no hydrogen 3.447 N/A SER 207.A OG ASN 220.A OD1 no hydrogen 2.719 N/A GLY 210.A N SER 207.A O no hydrogen 2.947 N/A THR 211.A OG1 GLU 209.A O no hydrogen 3.150 N/A CYS 212.A SG THR 295.A O no hydrogen 3.587 N/A LYS 213.A NZ GLU 209.A OE2 no hydrogen 2.273 N/A LYS 213.A NZ ALA 218.A O no hydrogen 3.451 N/A PHE 215.A N ASP 301.A OD2 no hydrogen 2.737 N/A ASP 216.A N LYS 213.A O no hydrogen 3.069 N/A THR 217.A N SER 361.A O no hydrogen 2.900 N/A THR 217.A OG1 SER 361.A O no hydrogen 3.084 N/A THR 217.A OG1 SER 361.A OG no hydrogen 2.867 N/A THR 217.A OG1 PRO 362.A O no hydrogen 2.978 N/A ALA 218.A N ASP 216.A OD1 no hydrogen 2.808 N/A GLY 219.A N ASP 216.A O no hydrogen 2.848 N/A ASN 220.A ND2 GLU 209.A OE1 no hydrogen 3.330 N/A ASN 220.A ND2 GLU 209.A OE2 no hydrogen 3.357 N/A GLY 221.A N GLY 296.A O no hydrogen 3.057 N/A TYR 222.A N MET 205.A O no hydrogen 2.896 N/A TYR 222.A OH GLU 333.A OE2 no hydrogen 2.822 N/A CYS 223.A SG ARG 50.A O no hydrogen 4.043 N/A CYS 223.A SG GLY 210.A O no hydrogen 3.270 N/A CYS 223.A SG ARG 224.A O no hydrogen 3.640 N/A ARG 224.A NE GLU 333.A OE1 no hydrogen 3.421 N/A ARG 224.A NE GLU 333.A OE2 no hydrogen 2.881 N/A ARG 224.A NH1 SER 197.A OG no hydrogen 2.779 N/A ARG 224.A NH2 GLU 333.A OE1 no hydrogen 2.944 N/A SER 225.A N HIS 331.A O no hydrogen 2.891 N/A SER 225.A OG MET 329.A O no hydrogen 2.599 N/A GLU 226.A N GLY 52.A O no hydrogen 2.937 N/A GLY 227.A N ASN 189.A O no hydrogen 3.029 N/A VAL 228.A N LYS 12.A O no hydrogen 3.008 N/A VAL 229.A N GLY 187.A O no hydrogen 2.945 N/A ALA 230.A N SER 10.A O no hydrogen 3.090 N/A VAL 231.A N VAL 185.A O no hydrogen 2.799 N/A LEU 232.A N GLY 8.A O no hydrogen 2.953 N/A LEU 233.A N ALA 183.A O no hydrogen 2.916 N/A THR 234.A N VAL 5.A O no hydrogen 3.137 N/A THR 234.A OG1 LYS 235.A O no hydrogen 2.990 N/A LYS 235.A N PRO 181.A O no hydrogen 3.073 N/A LYS 236.A N GLU 3.A O no hydrogen 2.817 N/A LYS 236.A NZ GLU 3.A OE2 no hydrogen 3.560 N/A LEU 238.A N LYS 235.A O no hydrogen 3.037 N/A ALA 239.A N LYS 236.A O no hydrogen 3.194 N/A ARG 241.A NE ASP 92.A O no hydrogen 2.926 N/A ARG 241.A NH1 THR 827.A O no hydrogen 2.960 N/A ARG 241.A NH1 PRO 828.A O no hydrogen 3.306 N/A ARG 241.A NH2 ASP 92.A O no hydrogen 3.063 N/A ARG 241.A NH2 PRO 828.A O no hydrogen 2.915 N/A TYR 243.A N ILE 6.A O no hydrogen 2.936 N/A TYR 243.A OH ASP 92.A OD1 no hydrogen 3.399 N/A TYR 243.A OH ASP 92.A OD2 no hydrogen 2.580 N/A THR 245.A N ARG 405.A O no hydrogen 2.939 N/A ILE 246.A N VAL 4.A O no hydrogen 2.873 N/A LEU 247.A N ILE 403.A O no hydrogen 2.744 N/A ASN 248.A ND2 LEU 276.A O no hydrogen 2.966 N/A ASN 248.A ND2 SER 279.A OG no hydrogen 2.960 N/A ALA 249.A N ASN 248.A OD1 no hydrogen 2.980 N/A GLY 250.A N HIS 401.A O no hydrogen 3.008 N/A THR 251.A OG1 ASN 252.A O no hydrogen 3.471 N/A THR 251.A OG1 ASN 399.A O no hydrogen 2.653 N/A ASN 252.A N ASN 399.A O no hydrogen 3.153 N/A ASN 252.A ND2 ILE 268.A O no hydrogen 3.148 N/A ASP 254.A N GLY 397.A O no hydrogen 2.973 N/A LYS 257.A NZ ASP 254.A OD2 no hydrogen 2.925 N/A LYS 257.A NZ VAL 261.A O no hydrogen 3.018 N/A LYS 257.A NZ PHE 263.A O no hydrogen 2.601 N/A GLN 259.A N GLN 259.A OE1 no hydrogen 2.805 N/A GLY 260.A N LYS 257.A O no hydrogen 3.094 N/A PHE 263.A N GLY 260.A O no hydrogen 3.251 N/A SER 265.A N ASP 254.A OD2 no hydrogen 3.138 N/A GLY 266.A N GLN 303.A OE1 no hydrogen 2.906 N/A ILE 268.A N SER 265.A OG no hydrogen 3.387 N/A GLN 269.A N SER 265.A O no hydrogen 3.069 N/A GLU 270.A N GLY 266.A O no hydrogen 2.881 N/A GLN 271.A N ASP 267.A O no hydrogen 3.150 N/A LEU 272.A N ILE 268.A O no hydrogen 3.055 N/A ILE 273.A N GLN 269.A O no hydrogen 3.053 N/A ARG 274.A N GLU 270.A O no hydrogen 2.998 N/A ARG 274.A NH1 GLU 270.A OE2 no hydrogen 3.344 N/A ARG 274.A NH2 GLU 270.A OE2 no hydrogen 2.677 N/A ARG 274.A NH2 ARG 310.A O no hydrogen 3.550 N/A SER 275.A N GLN 271.A O no hydrogen 2.827 N/A SER 275.A OG GLN 271.A O no hydrogen 3.316 N/A SER 275.A OG LEU 272.A O no hydrogen 3.116 N/A LEU 276.A N LEU 272.A O no hydrogen 3.035 N/A TYR 277.A N ILE 273.A O no hydrogen 3.274 N/A TYR 277.A OH ALA 311.A O no hydrogen 2.821 N/A GLN 278.A N ARG 274.A O no hydrogen 3.004 N/A SER 279.A N SER 275.A O no hydrogen 3.016 N/A SER 279.A OG SER 275.A O no hydrogen 3.037 N/A ALA 280.A N LEU 276.A O no hydrogen 3.101 N/A GLY 281.A N GLN 278.A O no hydrogen 3.183 N/A VAL 282.A N TYR 277.A O no hydrogen 2.888 N/A SER 286.A N ALA 283.A O no hydrogen 2.883 N/A SER 286.A OG ALA 283.A O no hydrogen 2.553 N/A PHE 287.A N PRO 284.A O no hydrogen 3.431 N/A GLU 288.A N ASN 387.A O no hydrogen 2.803 N/A TYR 289.A OH GLU 291.A OE1 no hydrogen 2.865 N/A ILE 290.A N LEU 321.A O no hydrogen 2.950 N/A GLU 291.A N GLY 389.A O no hydrogen 2.843 N/A ALA 292.A N GLY 323.A O no hydrogen 3.093 N/A HIS 293.A N GLU 304.A OE2 no hydrogen 2.615 N/A GLY 294.A N GLU 304.A OE1 no hydrogen 2.984 N/A GLY 296.A N ASP 301.A OD1 no hydrogen 3.136 N/A LYS 298.A NZ THR 217.A O no hydrogen 3.105 N/A GLY 300.A N THR 297.A OG1 no hydrogen 2.955 N/A ASP 301.A N THR 297.A O no hydrogen 3.215 N/A GLN 303.A N VAL 299.A O no hydrogen 3.367 N/A GLU 304.A N GLY 300.A O no hydrogen 2.904 N/A LEU 305.A N ASP 301.A O no hydrogen 2.804 N/A ASN 306.A N PRO 302.A O no hydrogen 2.818 N/A ASN 306.A ND2 GLU 365.A O no hydrogen 3.129 N/A GLY 307.A N GLN 303.A O no hydrogen 3.093 N/A ILE 308.A N GLU 304.A O no hydrogen 2.910 N/A THR 309.A N LEU 305.A O no hydrogen 2.966 N/A THR 309.A OG1 LEU 305.A O no hydrogen 2.674 N/A ARG 310.A N ASN 306.A O no hydrogen 3.064 N/A ARG 310.A NE GLU 270.A OE1 no hydrogen 2.731 N/A ARG 310.A NH2 GLU 270.A OE1 no hydrogen 2.995 N/A ALA 311.A N GLY 307.A O no hydrogen 2.893 N/A LEU 312.A N ILE 308.A O no hydrogen 2.757 N/A CYS 313.A N THR 309.A O no hydrogen 2.783 N/A ARG 316.A NE GLU 318.A O no hydrogen 3.085 N/A ARG 316.A NH1 PRO 284.A O no hydrogen 3.151 N/A ARG 316.A NH1 PHE 287.A O no hydrogen 2.765 N/A ARG 316.A NH2 PHE 287.A O no hydrogen 3.221 N/A ARG 316.A NH2 PRO 319.A O no hydrogen 3.076 N/A LEU 320.A N ARG 373.A O no hydrogen 2.851 N/A LEU 321.A N GLU 288.A O no hydrogen 3.198 N/A ILE 322.A N GLN 375.A O no hydrogen 2.934 N/A GLY 323.A N ILE 290.A O no hydrogen 3.256 N/A SER 324.A N ASN 356.A OD1 no hydrogen 2.831 N/A SER 324.A OG GLY 294.A O no hydrogen 2.791 N/A THR 325.A N GLU 291.A OE2 no hydrogen 2.782 N/A THR 325.A OG1 GLU 291.A OE2 no hydrogen 2.503 N/A LYS 326.A N SER 324.A OG no hydrogen 3.275 N/A LYS 326.A NZ HIS 293.A O no hydrogen 2.866 N/A SER 327.A N SER 324.A O no hydrogen 3.171 N/A SER 327.A OG SER 324.A O no hydrogen 2.810 N/A SER 327.A OG ASN 328.A OD1 no hydrogen 3.297 N/A ASN 328.A N THR 325.A O no hydrogen 3.102 N/A ASN 328.A ND2 PRO 355.A O no hydrogen 2.916 N/A MET 329.A N THR 325.A O no hydrogen 3.187 N/A GLY 330.A N LYS 326.A O no hydrogen 2.765 N/A HIS 331.A N CYS 223.A O no hydrogen 2.739 N/A GLU 333.A N HIS 331.A ND1 no hydrogen 3.088 N/A ALA 335.A N PRO 332.A O no hydrogen 3.131 N/A SER 336.A N GLU 333.A O no hydrogen 2.863 N/A SER 336.A OG CYS 161.A O no hydrogen 2.964 N/A SER 336.A OG GLU 333.A O no hydrogen 2.954 N/A LEU 338.A N SER 164.A OG no hydrogen 3.102 N/A ALA 339.A N ALA 335.A O no hydrogen 3.059 N/A ALA 340.A N SER 336.A O no hydrogen 3.084 N/A LEU 341.A N GLY 337.A O no hydrogen 2.978 N/A ALA 342.A N LEU 338.A O no hydrogen 2.840 N/A LYS 343.A N ALA 339.A O no hydrogen 3.094 N/A LYS 343.A NZ TYR 289.A OH no hydrogen 2.796 N/A LYS 343.A NZ GLU 291.A OE1 no hydrogen 2.975 N/A VAL 344.A N ALA 340.A O no hydrogen 2.983 N/A LEU 345.A N LEU 341.A O no hydrogen 2.889 N/A LEU 346.A N ALA 342.A O no hydrogen 2.971 N/A SER 347.A N LYS 343.A O no hydrogen 2.980 N/A SER 347.A OG LYS 343.A O no hydrogen 2.853 N/A LEU 348.A N VAL 344.A O no hydrogen 2.996 N/A GLU 349.A N LEU 345.A O no hydrogen 2.907 N/A HIS 350.A N LEU 346.A O no hydrogen 3.183 N/A HIS 350.A N SER 347.A O no hydrogen 3.237 N/A HIS 350.A ND1 LEU 346.A O no hydrogen 2.645 N/A GLY 351.A N LEU 348.A O no hydrogen 3.270 N/A LEU 352.A N SER 347.A O no hydrogen 3.205 N/A TRP 353.A N LEU 381.A O no hydrogen 2.777 N/A TRP 353.A NE1 GLU 288.A OE2 no hydrogen 2.977 N/A ALA 354.A N SER 347.A OG no hydrogen 3.290 N/A ASN 356.A N VAL 377.A O no hydrogen 2.821 N/A LEU 357.A N SER 327.A OG no hydrogen 3.071 N/A HIS 360.A N ASP 216.A OD2 no hydrogen 2.683 N/A SER 361.A N ASP 216.A OD2 no hydrogen 2.911 N/A SER 361.A OG THR 217.A OG1 no hydrogen 2.867 N/A ASN 363.A N PHE 215.A O no hydrogen 2.914 N/A GLU 365.A N ASN 363.A OD1 no hydrogen 2.987 N/A ILE 366.A N ASN 363.A O no hydrogen 3.146 N/A LEU 369.A N ILE 366.A O no hydrogen 3.289 N/A ASP 371.A N PRO 367.A O no hydrogen 2.902 N/A ARG 373.A N ASP 371.A OD1 no hydrogen 3.040 N/A ARG 373.A NE ASP 371.A OD1 no hydrogen 2.866 N/A ARG 373.A NE ASP 371.A OD2 no hydrogen 2.956 N/A ARG 373.A NH2 ASP 371.A OD2 no hydrogen 2.622 N/A LEU 374.A N ALA 368.A O no hydrogen 3.185 N/A GLN 375.A N LEU 320.A O no hydrogen 2.856 N/A VAL 377.A N ILE 322.A O no hydrogen 2.974 N/A VAL 383.A N GLY 351.A O no hydrogen 2.811 N/A ARG 384.A N GLU 288.A OE2 no hydrogen 2.789 N/A GLY 385.A N GLU 288.A OE1 no hydrogen 2.717 N/A ASN 387.A N SER 286.A O no hydrogen 2.768 N/A ASN 387.A ND2 SER 286.A OG no hydrogen 2.908 N/A VAL 388.A N LEU 404.A O no hydrogen 2.994 N/A GLY 389.A N TYR 289.A O no hydrogen 3.037 N/A ILE 390.A N ILE 402.A O no hydrogen 3.038 N/A ASN 391.A N GLU 291.A O no hydrogen 2.997 N/A ASN 391.A ND2 GLU 304.A OE2 no hydrogen 3.011 N/A SER 392.A N VAL 400.A O no hydrogen 2.981 N/A SER 392.A OG CYS 161.A O no hydrogen 3.557 N/A GLY 394.A N SER 398.A O no hydrogen 2.850 N/A GLY 397.A N GLY 394.A O no hydrogen 3.017 N/A ASN 399.A N ASN 252.A O no hydrogen 2.877 N/A ASN 399.A ND2 ASN 252.A OD1 no hydrogen 2.983 N/A ASN 399.A ND2 ASP 254.A OD1 no hydrogen 2.922 N/A VAL 400.A N SER 392.A O no hydrogen 2.900 N/A HIS 401.A N GLY 250.A O no hydrogen 3.100 N/A HIS 401.A ND1 ASN 391.A OD1 no hydrogen 2.622 N/A ILE 402.A N ILE 390.A O no hydrogen 3.024 N/A ILE 403.A N ASN 248.A O no hydrogen 2.852 N/A LEU 404.A N VAL 388.A O no hydrogen 2.806 N/A ARG 405.A N THR 245.A O no hydrogen 2.759 N/A ASN 407.A N TYR 243.A O no hydrogen 3.255 N/A ASN 407.A ND2 VAL 242.A O no hydrogen 3.011 N/A ASN 407.A ND2 ALA 823.A O no hydrogen 3.316 N/A GLN 409.A N ASN 407.A OD1 no hydrogen 2.986 N/A GLN 409.A NE2 PRO 822.A O no hydrogen 3.307 N/A ALA 418.A N ALA 415.A O no hydrogen 3.137 N/A THR 419.A N PRO 416.A O no hydrogen 3.257 N/A THR 419.A OG1 PRO 416.A O no hydrogen 2.308 N/A LEU 420.A N HIS 417.A O no hydrogen 2.908 N/A ARG 422.A N LEU 473.A O no hydrogen 2.842 N/A ARG 422.A NH1 HIS 417.A O no hydrogen 2.556 N/A ARG 422.A NH1 LEU 420.A O no hydrogen 3.260 N/A ARG 422.A NH2 HIS 417.A ND1 no hydrogen 2.490 N/A ARG 422.A NH2 HIS 417.A O no hydrogen 3.524 N/A LEU 424.A N ALA 471.A O no hydrogen 2.930 N/A ARG 425.A N ASN 455.A OD1 no hydrogen 2.894 N/A ARG 425.A NE ASN 455.A O no hydrogen 2.863 N/A ARG 425.A NH2 ASN 455.A O no hydrogen 2.774 N/A ALA 426.A N GLY 469.A O no hydrogen 2.977 N/A SER 427.A OG ALA 458.A O no hydrogen 2.499 N/A SER 427.A OG HIS 804.A NE2 no hydrogen 3.377 N/A GLY 428.A N PHE 467.A O no hydrogen 2.861 N/A ARG 429.A NE ASP 61.A OD1 no hydrogen 3.356 N/A ARG 429.A NE ASP 61.A OD2 no hydrogen 2.705 N/A ARG 429.A NH1 ALA 464.A O no hydrogen 2.807 N/A ARG 429.A NH2 ASP 61.A OD1 no hydrogen 2.700 N/A ARG 429.A NH2 ASP 61.A OD2 no hydrogen 3.522 N/A GLU 432.A N GLU 432.A OE1 no hydrogen 2.804 N/A ALA 433.A N THR 430.A O no hydrogen 3.109 N/A ALA 433.A N THR 430.A OG1 no hydrogen 3.202 N/A VAL 434.A N THR 430.A O no hydrogen 3.293 N/A GLN 435.A N PRO 431.A O no hydrogen 2.852 N/A LYS 436.A N GLU 432.A O no hydrogen 2.952 N/A LYS 436.A NZ GLU 439.A OE2 no hydrogen 3.121 N/A LEU 437.A N ALA 433.A O no hydrogen 3.396 N/A LEU 438.A N VAL 434.A O no hydrogen 3.034 N/A GLU 439.A N GLN 435.A O no hydrogen 2.935 N/A GLN 440.A N LYS 436.A O no hydrogen 3.185 N/A GLY 441.A N LEU 437.A O no hydrogen 2.919 N/A LEU 442.A N LEU 438.A O no hydrogen 2.896 N/A ARG 443.A N GLU 439.A O no hydrogen 2.945 N/A ARG 443.A NH1 GLN 440.A OE1 no hydrogen 2.256 N/A HIS 444.A N GLN 440.A O no hydrogen 2.946 N/A ASP 447.A N HIS 444.A O no hydrogen 3.133 N/A PHE 450.A N ASP 447.A OD1 no hydrogen 3.176 N/A LEU 451.A N ASP 447.A O no hydrogen 3.146 N/A SER 452.A N LEU 448.A O no hydrogen 2.862 N/A MET 453.A N ALA 449.A O no hydrogen 3.011 N/A LEU 454.A N PHE 450.A O no hydrogen 2.956 N/A ASN 455.A N LEU 451.A O no hydrogen 2.937 N/A ASN 455.A ND2 LEU 423.A O no hydrogen 3.016 N/A ASN 455.A ND2 ASN 813.A OD1 no hydrogen 3.158 N/A ASP 456.A N SER 452.A O no hydrogen 3.105 N/A ILE 457.A N MET 453.A O no hydrogen 3.218 N/A ILE 457.A N LEU 454.A O no hydrogen 3.253 N/A VAL 460.A N ALA 458.A O no hydrogen 2.872 N/A ALA 464.A N PRO 461.A O no hydrogen 2.982 N/A MET 465.A N PRO 461.A O no hydrogen 2.994 N/A PHE 467.A N GLY 428.A O no hydrogen 3.151 N/A ARG 468.A N GLN 483.A O no hydrogen 3.012 N/A ARG 468.A NH1 HIS 804.A O no hydrogen 3.043 N/A ARG 468.A NH1 ILE 808.A O no hydrogen 3.357 N/A ARG 468.A NH1 ASP 809.A OD1 no hydrogen 3.328 N/A ARG 468.A NH2 VAL 460.A O no hydrogen 2.913 N/A ARG 468.A NH2 ASP 809.A OD1 no hydrogen 2.952 N/A GLY 469.A N ALA 426.A O no hydrogen 2.872 N/A TYR 470.A N GLU 481.A O no hydrogen 2.871 N/A ALA 471.A N LEU 424.A O no hydrogen 3.005 N/A LEU 473.A N ARG 422.A O no hydrogen 2.721 N/A GLU 476.A N GLU 794.A OE1 no hydrogen 3.016 N/A ARG 477.A NE ARG 477.A O no hydrogen 3.393 N/A GLU 481.A N TYR 470.A O no hydrogen 2.953 N/A GLN 483.A N ARG 468.A O no hydrogen 2.987 N/A GLN 483.A NE2 LEU 805.A O no hydrogen 2.830 N/A VAL 485.A N PRO 466.A O no hydrogen 2.694 N/A ARG 490.A NE HIS 755.A O no hydrogen 2.645 N/A ARG 490.A NH2 HIS 755.A O no hydrogen 3.121 N/A ARG 490.A NH2 THR 780.A OG1 no hydrogen 2.949 N/A LEU 492.A N ASP 575.A OD2 no hydrogen 2.883 N/A TRP 493.A N VAL 757.A O no hydrogen 2.801 N/A PHE 494.A N GLY 576.A O no hydrogen 2.883 N/A ILE 495.A N LEU 759.A O no hydrogen 2.905 N/A CYS 496.A N VAL 578.A O no hydrogen 2.791 N/A SER 497.A N ILE 761.A O no hydrogen 3.340 N/A SER 497.A OG GLU 760.A OE2 no hydrogen 2.601 N/A THR 501.A OG1 GLY 498.A O no hydrogen 3.339 N/A GLN 502.A N GLN 502.A OE1 no hydrogen 2.627 N/A TRP 503.A NE1 PRO 763.A O no hydrogen 2.812 N/A ARG 504.A NE GLU 543.A OE1 no hydrogen 2.677 N/A ARG 504.A NH2 GLU 543.A OE1 no hydrogen 2.942 N/A MET 506.A N TRP 503.A O no hydrogen 3.101 N/A LEU 508.A N GLY 505.A O no hydrogen 3.285 N/A SER 509.A OG ASP 791.A OD1 no hydrogen 2.565 N/A MET 511.A N GLY 507.A O no hydrogen 3.092 N/A ARG 512.A N SER 509.A O no hydrogen 3.423 N/A ARG 512.A NH1 SER 509.A O no hydrogen 2.892 N/A ARG 512.A NH1 ASP 791.A OD1 no hydrogen 3.145 N/A LEU 513.A N LEU 510.A O no hydrogen 2.911 N/A ARG 517.A N LEU 513.A O no hydrogen 2.904 N/A ARG 517.A NE ASP 518.A OD1 no hydrogen 3.317 N/A ARG 517.A NH2 ASP 518.A OD1 no hydrogen 2.962 N/A ASP 518.A N ASP 514.A O no hydrogen 2.860 N/A SER 519.A N ARG 515.A O no hydrogen 3.057 N/A SER 519.A OG ASP 565.A OD2 no hydrogen 2.948 N/A ILE 520.A N PHE 516.A O no hydrogen 2.985 N/A LEU 521.A N ARG 517.A O no hydrogen 2.881 N/A ARG 522.A N ASP 518.A O no hydrogen 3.062 N/A ARG 522.A NE GLN 596.A OE1 no hydrogen 2.456 N/A ARG 522.A NH2 GLN 596.A OE1 no hydrogen 2.737 N/A SER 523.A N SER 519.A O no hydrogen 2.998 N/A SER 523.A OG SER 519.A O no hydrogen 3.407 N/A ASP 524.A N ILE 520.A O no hydrogen 2.872 N/A GLU 525.A N LEU 521.A O no hydrogen 3.229 N/A ALA 526.A N ARG 522.A O no hydrogen 3.339 N/A VAL 527.A N SER 523.A O no hydrogen 3.358 N/A LYS 528.A NZ GLU 525.A OE1 no hydrogen 2.905 N/A PHE 530.A N VAL 527.A O no hydrogen 2.913 N/A GLY 531.A N LYS 528.A O no hydrogen 3.007 N/A LEU 532.A N VAL 527.A O no hydrogen 3.333 N/A SER 535.A N ASP 524.A OD1 no hydrogen 2.871 N/A SER 535.A OG ASP 524.A OD2 no hydrogen 2.556 N/A GLN 536.A N LYS 533.A O no hydrogen 2.978 N/A LEU 537.A N LYS 533.A O no hydrogen 3.029 N/A LEU 538.A N VAL 534.A O no hydrogen 2.921 N/A LEU 539.A N SER 535.A O no hydrogen 3.117 N/A SER 540.A N LEU 537.A O no hydrogen 3.227 N/A SER 540.A OG THR 545.A OG1 no hydrogen 2.579 N/A ASP 542.A N SER 540.A OG no hydrogen 3.187 N/A SER 544.A N ASP 542.A OD1 no hydrogen 2.835 N/A SER 544.A OG ASP 542.A OD1 no hydrogen 2.879 N/A THR 545.A N ASP 542.A O no hydrogen 3.221 N/A THR 545.A OG1 SER 540.A OG no hydrogen 2.579 N/A THR 545.A OG1 ASP 542.A O no hydrogen 3.272 N/A ASP 547.A N SER 544.A O no hydrogen 2.859 N/A ASP 548.A N THR 545.A O no hydrogen 3.409 N/A HIS 551.A N ASP 548.A OD1 no hydrogen 3.173 N/A HIS 551.A ND1 THR 545.A O no hydrogen 2.987 N/A SER 552.A N ASP 548.A O no hydrogen 3.030 N/A SER 552.A OG ILE 549.A O no hydrogen 3.386 N/A PHE 553.A N ILE 549.A O no hydrogen 2.993 N/A VAL 554.A N VAL 550.A O no hydrogen 3.036 N/A SER 555.A N HIS 551.A O no hydrogen 3.050 N/A SER 555.A OG HIS 551.A O no hydrogen 2.938 N/A LEU 556.A N SER 552.A O no hydrogen 2.990 N/A THR 557.A N PHE 553.A O no hydrogen 3.128 N/A THR 557.A OG1 PHE 553.A O no hydrogen 3.193 N/A ALA 558.A N VAL 554.A O no hydrogen 2.926 N/A ILE 559.A N SER 555.A O no hydrogen 3.002 N/A GLN 560.A N LEU 556.A O no hydrogen 2.984 N/A GLN 560.A NE2 SER 497.A O no hydrogen 2.872 N/A GLN 560.A NE2 ILE 761.A O no hydrogen 2.925 N/A ILE 561.A N THR 557.A O no hydrogen 2.905 N/A GLY 562.A N ALA 558.A O no hydrogen 2.927 N/A LEU 563.A N ILE 559.A O no hydrogen 2.890 N/A ILE 564.A N GLN 560.A O no hydrogen 2.949 N/A ASP 565.A N ILE 561.A O no hydrogen 2.920 N/A LEU 566.A N GLY 562.A O no hydrogen 3.083 N/A LEU 567.A N LEU 563.A O no hydrogen 3.028 N/A SER 568.A N ILE 564.A O no hydrogen 2.877 N/A SER 568.A OG ILE 564.A O no hydrogen 2.924 N/A CYS 569.A N ASP 565.A O no hydrogen 3.063 N/A CYS 569.A SG LEU 566.A O no hydrogen 3.237 N/A CYS 569.A SG ALA 814.A O no hydrogen 3.633 N/A MET 570.A N LEU 567.A O no hydrogen 3.252 N/A GLY 571.A N SER 568.A O no hydrogen 2.739 N/A LEU 572.A N LEU 567.A O no hydrogen 3.213 N/A ASP 575.A N LEU 492.A O no hydrogen 2.627 N/A GLY 576.A N LEU 492.A O no hydrogen 3.261 N/A ILE 577.A N ARG 711.A O no hydrogen 2.953 N/A VAL 578.A N PHE 494.A O no hydrogen 2.958 N/A HIS 580.A N CYS 496.A O no hydrogen 2.756 N/A HIS 580.A NE2 ASN 644.A OD1 no hydrogen 2.735 N/A SER 581.A OG HIS 683.A NE2 no hydrogen 2.653 N/A LEU 582.A N SER 581.A OG no hydrogen 2.590 N/A GLY 583.A N HIS 580.A O no hydrogen 2.742 N/A GLU 584.A N SER 581.A O no hydrogen 2.941 N/A VAL 585.A N LEU 582.A O no hydrogen 3.085 N/A CYS 587.A N GLY 583.A O no hydrogen 2.986 N/A CYS 587.A SG GLY 583.A O no hydrogen 3.323 N/A GLY 588.A N GLU 584.A O no hydrogen 3.081 N/A TYR 589.A N VAL 585.A O no hydrogen 3.246 N/A TYR 589.A OH ASP 565.A OD1 no hydrogen 2.494 N/A ALA 590.A N ALA 586.A O no hydrogen 2.854 N/A ASP 591.A N CYS 587.A O no hydrogen 2.767 N/A GLY 592.A N TYR 589.A O no hydrogen 3.091 N/A CYS 593.A N GLY 588.A O no hydrogen 2.757 N/A CYS 593.A SG ASP 591.A OD2 no hydrogen 3.394 N/A CYS 593.A SG LYS 706.A O no hydrogen 3.861 N/A CYS 593.A SG PRO 707.A O no hydrogen 3.452 N/A LEU 594.A N GLY 588.A O no hydrogen 2.989 N/A SER 595.A N GLU 598.A OE1 no hydrogen 3.086 N/A GLN 596.A NE2 SER 519.A O no hydrogen 2.901 N/A GLN 596.A NE2 SER 523.A OG no hydrogen 2.915 N/A GLU 598.A N SER 595.A OG no hydrogen 3.227 N/A ALA 599.A N SER 595.A O no hydrogen 3.036 N/A VAL 600.A N GLN 596.A O no hydrogen 3.025 N/A LEU 601.A N GLU 597.A O no hydrogen 2.965 N/A ALA 602.A N GLU 598.A O no hydrogen 2.887 N/A ALA 603.A N ALA 599.A O no hydrogen 3.054 N/A TYR 604.A N VAL 600.A O no hydrogen 2.955 N/A TRP 605.A N LEU 601.A O no hydrogen 2.929 N/A ARG 606.A N ALA 602.A O no hydrogen 3.135 N/A ARG 606.A NH1 ASN 738.A OD1 no hydrogen 2.848 N/A ARG 606.A NH2 ASN 738.A OD1 no hydrogen 2.955 N/A GLY 607.A N ALA 603.A O no hydrogen 3.288 N/A GLN 608.A N TYR 604.A O no hydrogen 2.860 N/A GLN 608.A NE2 GLU 612.A OE2 no hydrogen 3.040 N/A CYS 609.A N TRP 605.A O no hydrogen 2.861 N/A CYS 609.A SG TRP 605.A O no hydrogen 3.277 N/A LYS 611.A N GLY 607.A O no hydrogen 2.937 N/A GLU 612.A N GLN 608.A O no hydrogen 2.917 N/A ALA 613.A N ILE 610.A O no hydrogen 3.167 N/A GLY 618.A N GLY 679.A O no hydrogen 3.187 N/A ALA 619.A N GLY 653.A O no hydrogen 2.902 N/A ALA 621.A N ILE 651.A O no hydrogen 3.036 N/A ALA 622.A N LYS 673.A O no hydrogen 2.707 N/A VAL 623.A N VAL 649.A O no hydrogen 2.648 N/A GLY 624.A N PHE 671.A O no hydrogen 2.662 N/A SER 626.A N GLU 629.A OE1 no hydrogen 3.090 N/A GLU 629.A N SER 626.A OG no hydrogen 2.963 N/A CYS 630.A N SER 626.A O no hydrogen 2.829 N/A LYS 631.A N TRP 627.A O no hydrogen 3.141 N/A ARG 633.A N GLU 629.A O no hydrogen 3.145 N/A ARG 633.A NH1 GLU 668.A OE1 no hydrogen 2.445 N/A ARG 633.A NH1 GLU 668.A OE2 no hydrogen 2.955 N/A ARG 633.A NH2 GLU 668.A OE1 no hydrogen 2.364 N/A CYS 634.A N CYS 630.A O no hydrogen 3.015 N/A CYS 634.A SG CYS 630.A O no hydrogen 3.232 N/A VAL 638.A N PRO 635.A O no hydrogen 3.041 N/A VAL 639.A N SER 652.A O no hydrogen 2.843 N/A ALA 641.A N THR 650.A O no hydrogen 2.657 N/A CYS 642.A N THR 650.A O no hydrogen 3.190 N/A HIS 643.A N VAL 743.A O no hydrogen 2.776 N/A HIS 643.A ND1 GLU 747.A OE2 no hydrogen 2.616 N/A SER 645.A N THR 648.A O no hydrogen 3.157 N/A SER 645.A OG THR 648.A OG1 no hydrogen 2.724 N/A THR 648.A N SER 645.A O no hydrogen 3.393 N/A THR 648.A OG1 SER 645.A OG no hydrogen 2.724 N/A VAL 649.A N VAL 623.A O no hydrogen 3.173 N/A THR 650.A N CYS 642.A O no hydrogen 2.926 N/A ILE 651.A N ALA 621.A O no hydrogen 2.797 N/A SER 652.A N VAL 639.A O no hydrogen 2.715 N/A SER 652.A OG PHE 682.A O no hydrogen 2.938 N/A GLY 653.A N ALA 619.A O no hydrogen 3.055 N/A GLN 655.A N PRO 617.A O no hydrogen 2.966 N/A VAL 658.A N PRO 654.A O no hydrogen 3.135 N/A PHE 659.A N GLN 655.A O no hydrogen 3.031 N/A GLU 660.A N ALA 656.A O no hydrogen 2.811 N/A PHE 661.A N PRO 657.A O no hydrogen 2.859 N/A VAL 662.A N VAL 658.A O no hydrogen 2.922 N/A GLU 663.A N PHE 659.A O no hydrogen 3.178 N/A GLN 664.A N GLU 660.A O no hydrogen 2.755 N/A LEU 665.A N PHE 661.A O no hydrogen 2.756 N/A ARG 666.A N VAL 662.A O no hydrogen 3.113 N/A ARG 666.A NE ALA 672.A O no hydrogen 3.120 N/A ARG 666.A NH1 GLU 663.A OE1 no hydrogen 3.542 N/A ARG 666.A NH2 GLU 674.A OE1 no hydrogen 3.270 N/A LYS 667.A N GLU 663.A O no hydrogen 2.883 N/A GLU 668.A N GLN 664.A O no hydrogen 3.062 N/A GLY 669.A N ARG 666.A O no hydrogen 3.041 N/A VAL 670.A N LEU 665.A O no hydrogen 2.883 N/A LYS 673.A N ALA 622.A O no hydrogen 2.909 N/A GLU 674.A N GLU 674.A OE1 no hydrogen 2.534 N/A VAL 675.A N MET 620.A O no hydrogen 2.874 N/A THR 677.A OG1 MET 680.A O no hydrogen 2.584 N/A MET 680.A N THR 677.A OG1 no hydrogen 3.047 N/A HIS 683.A N LEU 739.A O no hydrogen 3.177 N/A HIS 683.A ND1 ASN 738.A O no hydrogen 2.982 N/A HIS 683.A ND1 SER 741.A O no hydrogen 2.905 N/A HIS 683.A NE2 SER 581.A OG no hydrogen 2.653 N/A SER 684.A OG ALA 681.A O no hydrogen 2.527 N/A TYR 685.A OH GLY 637.A O no hydrogen 2.315 N/A PHE 686.A N SER 684.A OG no hydrogen 3.310 N/A MET 687.A N SER 684.A O no hydrogen 2.989 N/A GLU 688.A N TYR 685.A O no hydrogen 2.914 N/A ILE 690.A N MET 687.A O no hydrogen 2.777 N/A ALA 691.A N GLU 688.A O no hydrogen 3.198 N/A LEU 694.A N ILE 690.A O no hydrogen 3.031 N/A LEU 695.A N ALA 691.A O no hydrogen 2.740 N/A GLN 696.A N PRO 692.A O no hydrogen 3.132 N/A GLU 697.A N PRO 693.A O no hydrogen 3.104 N/A LEU 698.A N LEU 694.A O no hydrogen 2.861 N/A LYS 699.A N LEU 695.A O no hydrogen 3.040 N/A LYS 700.A N GLU 697.A O no hydrogen 3.202 N/A VAL 701.A N GLU 697.A O no hydrogen 3.292 N/A ILE 702.A N LEU 698.A O no hydrogen 2.732 N/A LYS 706.A NZ GLU 704.A O no hydrogen 3.096 N/A ARG 708.A N ARG 728.A O no hydrogen 2.870 N/A ARG 708.A NE ALA 727.A O no hydrogen 2.827 N/A ARG 708.A NH1 TRP 712.A O no hydrogen 3.024 N/A ARG 708.A NH2 ALA 727.A O no hydrogen 3.369 N/A SER 709.A N ASP 591.A OD2 no hydrogen 2.934 N/A SER 709.A OG ASP 591.A OD1 no hydrogen 2.525 N/A ARG 711.A N SER 709.A OG no hydrogen 3.175 N/A ARG 711.A NE SER 709.A OG no hydrogen 3.200 N/A ARG 711.A NH1 PRO 574.A O no hydrogen 3.174 N/A ARG 711.A NH2 ASP 591.A OD1 no hydrogen 2.992 N/A TRP 712.A N SER 709.A O no hydrogen 3.118 N/A LEU 713.A N ILE 577.A O no hydrogen 3.020 N/A SER 714.A OG TYR 734.A OH no hydrogen 2.712 N/A THR 715.A N GLU 584.A OE2 no hydrogen 3.106 N/A THR 715.A OG1 GLY 579.A O no hydrogen 2.600 N/A SER 716.A N SER 714.A OG no hydrogen 3.252 N/A SER 716.A OG GLU 584.A OE1 no hydrogen 2.890 N/A SER 716.A OG SER 714.A OG no hydrogen 3.225 N/A ILE 717.A N SER 714.A OG no hydrogen 3.197 N/A GLN 721.A N PRO 718.A O no hydrogen 2.775 N/A TRP 722.A N GLU 719.A O no hydrogen 3.017 N/A TRP 722.A NE1 ILE 717.A O no hydrogen 2.891 N/A SER 724.A N GLN 721.A O no hydrogen 2.973 N/A SER 724.A OG GLN 721.A O no hydrogen 2.902 N/A ALA 727.A N SER 724.A O no hydrogen 3.304 N/A ALA 727.A N SER 724.A OG no hydrogen 3.320 N/A ARG 728.A N SER 725.A O no hydrogen 3.430 N/A ARG 728.A NH2 HIS 723.A O no hydrogen 2.912 N/A SER 730.A N LYS 706.A O no hydrogen 3.103 N/A TYR 734.A N SER 731.A OG no hydrogen 3.065 N/A TYR 734.A OH GLU 584.A OE1 no hydrogen 3.324 N/A TYR 734.A OH GLU 584.A OE2 no hydrogen 2.714 N/A TYR 734.A OH SER 714.A OG no hydrogen 2.712 N/A ASN 735.A N SER 731.A O no hydrogen 3.013 N/A ASN 735.A ND2 SER 731.A O no hydrogen 2.805 N/A VAL 736.A N ALA 732.A O no hydrogen 2.889 N/A ASN 737.A N GLU 733.A O no hydrogen 2.926 N/A ASN 737.A ND2 SER 716.A O no hydrogen 3.474 N/A ASN 738.A N TYR 734.A O no hydrogen 3.090 N/A ASN 738.A ND2 SER 581.A O no hydrogen 2.963 N/A ASN 738.A ND2 GLU 584.A OE1 no hydrogen 2.977 N/A SER 741.A N ASN 737.A O no hydrogen 3.066 N/A SER 741.A N ASN 738.A O no hydrogen 3.405 N/A SER 741.A OG ASN 737.A O no hydrogen 2.738 N/A SER 741.A OG ASN 737.A OD1 no hydrogen 3.067 N/A VAL 743.A N ALA 641.A O no hydrogen 2.763 N/A LEU 744.A N THR 715.A O no hydrogen 2.794 N/A GLN 746.A N HIS 643.A O no hydrogen 2.790 N/A GLU 747.A N GLU 747.A OE1 no hydrogen 2.718 N/A LEU 749.A N PHE 745.A O no hydrogen 3.098 N/A TRP 750.A N GLN 746.A O no hydrogen 3.349 N/A HIS 751.A N ALA 748.A O no hydrogen 2.866 N/A HIS 751.A NE2 GLU 719.A OE1 no hydrogen 2.994 N/A VAL 752.A N LEU 749.A O no hydrogen 3.124 N/A HIS 755.A N SER 778.A OG no hydrogen 2.618 N/A VAL 757.A N PRO 491.A O no hydrogen 2.749 N/A VAL 758.A N THR 780.A O no hydrogen 2.645 N/A LEU 759.A N TRP 493.A O no hydrogen 2.908 N/A GLU 760.A N ILE 782.A O no hydrogen 2.898 N/A ILE 761.A N ILE 495.A O no hydrogen 2.667 N/A ALA 765.A N MET 785.A O no hydrogen 3.198 N/A LEU 766.A N HIS 764.A O no hydrogen 2.783 N/A LEU 767.A N GLU 760.A OE2 no hydrogen 2.931 N/A GLN 768.A NE2 GLU 760.A OE1 no hydrogen 2.901 N/A LEU 771.A N LEU 767.A O no hydrogen 2.811 N/A LYS 772.A N GLN 768.A O no hydrogen 2.948 N/A ARG 773.A N ALA 769.A O no hydrogen 3.016 N/A ARG 773.A NH1 THR 648.A OG1 no hydrogen 3.368 N/A GLY 774.A N VAL 770.A O no hydrogen 2.950 N/A LEU 775.A N LEU 771.A O no hydrogen 3.014 N/A LYS 776.A NZ TRP 750.A O no hydrogen 3.155 N/A LYS 776.A NZ VAL 752.A O no hydrogen 3.138 N/A SER 778.A OG GLU 754.A OE1 no hydrogen 2.439 N/A CYS 779.A N LYS 776.A O no hydrogen 3.195 N/A CYS 779.A SG PRO 753.A O no hydrogen 3.614 N/A CYS 779.A SG LYS 776.A O no hydrogen 3.488 N/A THR 780.A N ALA 756.A O no hydrogen 2.893 N/A ILE 782.A N VAL 758.A O no hydrogen 2.685 N/A LYS 786.A N ASN 792.A OD1 no hydrogen 2.749 N/A LYS 787.A N HIS 764.A ND1 no hydrogen 2.999 N/A HIS 789.A N LYS 786.A O no hydrogen 3.125 N/A ASP 791.A N HIS 789.A ND1 no hydrogen 2.730 N/A ASN 792.A ND2 LYS 786.A O no hydrogen 2.918 N/A LEU 793.A N SER 509.A OG no hydrogen 3.063 N/A LEU 793.A N ASP 791.A OD1 no hydrogen 3.087 N/A PHE 795.A N ASP 791.A O no hydrogen 3.159 N/A PHE 796.A N ASN 792.A O no hydrogen 2.679 N/A LEU 797.A N LEU 793.A O no hydrogen 2.948 N/A ALA 798.A N GLU 794.A O no hydrogen 2.928 N/A GLY 799.A N PHE 795.A O no hydrogen 3.178 N/A ILE 800.A N PHE 796.A O no hydrogen 3.001 N/A GLY 801.A N LEU 797.A O no hydrogen 2.847 N/A ARG 802.A N ALA 798.A O no hydrogen 2.841 N/A ARG 802.A NH1 ILE 781.A O no hydrogen 3.157 N/A LEU 803.A N GLY 799.A O no hydrogen 2.890 N/A HIS 804.A N ILE 800.A O no hydrogen 3.101 N/A HIS 804.A NE2 ALA 426.A O no hydrogen 2.960 N/A LEU 805.A N GLY 801.A O no hydrogen 3.024 N/A SER 806.A N ARG 802.A O no hydrogen 3.092 N/A SER 806.A N LEU 803.A O no hydrogen 3.082 N/A SER 806.A OG LEU 803.A O no hydrogen 2.716 N/A GLY 807.A N HIS 804.A O no hydrogen 2.853 N/A ILE 808.A N LEU 803.A O no hydrogen 3.179 N/A ASN 811.A ND2 ASP 456.A OD1 no hydrogen 2.932 N/A ASN 813.A N ASN 811.A OD1 no hydrogen 2.875 N/A ASN 813.A ND2 SER 452.A O no hydrogen 2.998 N/A ALA 814.A N ASN 811.A O no hydrogen 3.310 N/A LEU 815.A N PRO 812.A O no hydrogen 2.995 N/A PHE 816.A N ASN 813.A O no hydrogen 3.159 N/A ALA 823.A N ARG 240.A O no hydrogen 2.845 N/A ARG 825.A N GLN 409.A O no hydrogen 2.886 N/A GLY 826.A N GLU 349.A OE1 no hydrogen 2.806 N/A THR 827.A N PRO 824.A O no hydrogen 3.208 N/A THR 827.A OG1 PRO 824.A O no hydrogen 2.743 N/A ILE 830.A N ASP 92.A OD1 no hydrogen 2.968 N/A SER 831.A N ASP 92.A OD1 no hydrogen 2.943 N/A SER 831.A OG MET 9.A O no hydrogen 2.986 N/A LEU 833.A N ILE 830.A O no hydrogen 2.813 N/A ILE 834.A N SER 831.A O no hydrogen 3.283 N/A LYS 835.A NZ PRO 832.A O no hydrogen 2.826 N/A LYS 835.A NZ ILE 834.A O no hydrogen 3.527 N/A TRP 836.A NE1 GLU 88.A OE2 no hydrogen 2.761 N/A ASP 837.A N ASP 61.A OD2 no hydrogen 2.777 N/A HIS 838.A NE2 GLU 84.A OE1 no hydrogen 2.922 N/A HIS 838.A NE2 GLU 84.A OE2 no hydrogen 2.830 N/A SER 839.A N ASP 837.A OD1 no hydrogen 3.305 N/A SER 839.A OG ASP 837.A OD1 no hydrogen 3.014 N/A TRP 842.A N SER 58.A O no hydrogen 2.818 N/A TRP 842.A NE1 PHE 60.A O no hydrogen 2.935 N/A ASP 843.A N HIS 73.A ND1 no hydrogen 2.880 N/A ALA 846.A N ASP 849.A OD2 no hydrogen 2.805 N/A ASP 849.A N ALA 846.A O no hydrogen 2.811 N/A PHE 850.A N ALA 847.A O no hydrogen 3.342 N/A