Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 2wj1_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ARG 5.A N ARG 1.A O no hydrogen 2.847 N/A GLY 6.A N GLN 2.A O no hydrogen 2.948 N/A ALA 7.A N LYS 3.A O no hydrogen 2.858 N/A ALA 8.A N ALA 4.A O no hydrogen 2.958 N/A THR 9.A N ARG 5.A O no hydrogen 2.924 N/A THR 9.A OG1 ARG 5.A O no hydrogen 3.198 N/A ARG 10.A N GLY 6.A O no hydrogen 2.997 N/A ARG 10.A NE GLU 127.A OE1 no hydrogen 3.047 N/A ARG 10.A NH2 GLU 127.A OE1 no hydrogen 3.140 N/A ALA 11.A N ALA 7.A O no hydrogen 2.936 N/A ARG 12.A N ALA 8.A O no hydrogen 3.002 N/A ARG 12.A NE LEU 167.A O no hydrogen 3.048 N/A GLN 13.A N THR 9.A O no hydrogen 3.044 N/A LYS 14.A N ARG 10.A O no hydrogen 2.990 N/A LYS 14.A NZ ASP 118.A OD1 no hydrogen 2.957 N/A LYS 14.A NZ GLU 127.A OE2 no hydrogen 3.041 N/A GLN 15.A N ALA 11.A O no hydrogen 2.883 N/A GLN 15.A NE2 ASN 79.A OD1 no hydrogen 3.131 N/A GLN 15.A NE2 VAL 81.A O no hydrogen 2.751 N/A ARG 16.A N ARG 12.A O no hydrogen 2.956 N/A ALA 17.A N GLN 13.A O no hydrogen 3.036 N/A SER 18.A N LYS 14.A O no hydrogen 2.969 N/A LEU 19.A N GLN 15.A O no hydrogen 3.012 N/A GLU 20.A N ARG 16.A O no hydrogen 3.024 N/A THR 21.A N ALA 17.A O no hydrogen 2.926 N/A THR 21.A OG1 ALA 17.A O no hydrogen 2.889 N/A MET 22.A N SER 18.A O no hydrogen 3.010 N/A ASP 23.A N LEU 19.A O no hydrogen 3.047 N/A LYS 24.A N GLU 20.A O no hydrogen 2.974 N/A ALA 25.A N THR 21.A O no hydrogen 3.040 N/A VAL 26.A N MET 22.A O no hydrogen 2.930 N/A GLN 27.A N ASP 23.A O no hydrogen 2.917 N/A ARG 28.A N LYS 24.A O no hydrogen 3.023 N/A PHE 29.A N ALA 25.A O no hydrogen 3.099 N/A ARG 30.A N VAL 26.A O no hydrogen 2.938 N/A ARG 30.A NH2 GLU 73.A OE1 no hydrogen 3.385 N/A LEU 31.A N GLN 27.A O no hydrogen 2.856 N/A GLN 32.A N ARG 28.A O no hydrogen 3.176 N/A ASN 33.A N ARG 30.A O no hydrogen 3.357 N/A ASN 33.A ND2 PHE 29.A O no hydrogen 2.928 N/A ALA 40.A N ASP 37.A OD2 no hydrogen 3.420 N/A LEU 42.A N SER 38.A O no hydrogen 2.948 N/A THR 43.A N GLU 39.A O no hydrogen 3.259 N/A THR 43.A OG1 GLU 39.A O no hydrogen 3.124 N/A THR 43.A OG1 ALA 40.A O no hydrogen 3.388 N/A LEU 44.A N LEU 41.A O no hydrogen 3.291 N/A LEU 49.A N PRO 45.A O no hydrogen 2.975 N/A VAL 50.A N LEU 46.A O no hydrogen 2.798 N/A GLN 51.A N LEU 47.A O no hydrogen 3.192 N/A LYS 52.A N GLN 48.A O no hydrogen 3.000 N/A LYS 52.A NZ GLU 57.A OE1 no hydrogen 3.131 N/A LEU 53.A N LEU 49.A O no hydrogen 3.003 N/A GLN 54.A N VAL 50.A O no hydrogen 2.798 N/A GLN 54.A NE2 ARG 97.A O no hydrogen 2.784 N/A SER 55.A N GLN 51.A O no hydrogen 2.795 N/A SER 55.A OG GLN 51.A O no hydrogen 2.977 N/A SER 55.A OG LYS 52.A O no hydrogen 3.075 N/A GLY 56.A N LEU 53.A O no hydrogen 3.304 N/A LEU 58.A N LYS 52.A O no hydrogen 3.249 N/A SER 59.A OG GLU 61.A OE1 no hydrogen 3.397 N/A ALA 62.A N SER 59.A OG no hydrogen 2.943 N/A VAL 63.A N SER 59.A O no hydrogen 3.221 N/A PHE 64.A N PRO 60.A O no hydrogen 2.947 N/A PHE 65.A N GLU 61.A O no hydrogen 2.957 N/A THR 66.A N ALA 62.A O no hydrogen 3.044 N/A THR 66.A OG1 ALA 62.A O no hydrogen 2.719 N/A TYR 67.A N VAL 63.A O no hydrogen 3.125 N/A LEU 68.A N PHE 64.A O no hydrogen 2.870 N/A GLY 69.A N PHE 65.A O no hydrogen 3.053 N/A LYS 70.A N THR 66.A O no hydrogen 3.031 N/A ALA 71.A N TYR 67.A O no hydrogen 2.664 N/A TRP 72.A N LEU 68.A O no hydrogen 2.996 N/A GLU 73.A N GLY 69.A O no hydrogen 3.080 N/A VAL 74.A N LYS 70.A O no hydrogen 2.964 N/A ASN 75.A N ALA 71.A O no hydrogen 3.064 N/A LYS 76.A N GLU 73.A O no hydrogen 3.063 N/A GLY 77.A N VAL 74.A O no hydrogen 3.279 N/A THR 78.A N ASN 75.A O no hydrogen 3.349 N/A THR 78.A OG1 VAL 74.A O no hydrogen 2.705 N/A ASN 79.A N ASN 75.A O no hydrogen 2.921 N/A ASN 79.A ND2 PHE 168.A O no hydrogen 2.794 N/A ASN 79.A ND2 GLN 170.A O no hydrogen 2.968 N/A CYS 80.A SG ASN 75.A OD1 no hydrogen 3.902 N/A CYS 80.A SG THR 78.A OG1 no hydrogen 3.237 N/A VAL 81.A N ASN 75.A OD1 no hydrogen 2.943 N/A THR 82.A N HIS 151.A O no hydrogen 3.010 N/A THR 82.A OG1 HIS 151.A O no hydrogen 3.274 N/A SER 83.A OG TYR 84.A O no hydrogen 3.471 N/A SER 83.A OG HIS 117.A ND1 no hydrogen 3.062 N/A TYR 84.A N SER 18.A OG no hydrogen 2.944 N/A TYR 84.A OH GLU 89.A OE1 no hydrogen 2.698 N/A LEU 85.A N PHE 149.A O no hydrogen 2.861 N/A THR 86.A OG1 LEU 85.A O no hydrogen 2.640 N/A THR 86.A OG1 ASP 87.A OD1 no hydrogen 2.587 N/A THR 86.A OG1 HIS 117.A NE2 no hydrogen 3.246 N/A ASP 87.A N LEU 85.A O no hydrogen 2.636 N/A CYS 88.A SG TYR 84.A OH no hydrogen 3.699 N/A THR 90.A N ASP 87.A O no hydrogen 2.905 N/A THR 90.A OG1 ASP 87.A O no hydrogen 2.655 N/A GLN 91.A N ASP 87.A O no hydrogen 3.300 N/A GLN 91.A NE2 LYS 142.A O no hydrogen 3.254 N/A GLN 91.A NE2 ALA 146.A O no hydrogen 3.043 N/A LEU 92.A N CYS 88.A O no hydrogen 2.855 N/A SER 93.A N THR 90.A O no hydrogen 3.228 N/A SER 93.A OG THR 90.A O no hydrogen 3.199 N/A GLN 94.A N THR 90.A O no hydrogen 3.122 N/A GLN 94.A N GLN 91.A O no hydrogen 2.905 N/A ARG 97.A NH1 GLN 54.A O no hydrogen 3.236 N/A GLY 99.A N PRO 96.A O no hydrogen 2.934 N/A LEU 100.A N GLN 144.A OE1 no hydrogen 3.116 N/A LEU 101.A N GLN 144.A O no hydrogen 2.790 N/A TYR 102.A N GLY 99.A O no hydrogen 3.150 N/A GLY 103.A N GLY 145.A O no hydrogen 2.881 N/A VAL 104.A N LEU 101.A O no hydrogen 2.917 N/A VAL 106.A N VAL 147.A O no hydrogen 3.095 N/A SER 107.A N LEU 199.A O no hydrogen 2.909 N/A SER 107.A OG GLU 188.A OE1 no hydrogen 2.886 N/A SER 107.A OG SER 197.A OG no hydrogen 2.670 N/A SER 107.A OG LEU 199.A O no hydrogen 3.119 N/A LEU 108.A N VAL 150.A O no hydrogen 2.969 N/A LYS 109.A N LEU 201.A O no hydrogen 3.124 N/A LYS 109.A NZ SER 184.A OG no hydrogen 2.700 N/A LYS 109.A NZ SER 185.A OG no hydrogen 3.141 N/A LYS 109.A NZ THR 203.A O no hydrogen 3.196 N/A LYS 109.A NZ THR 203.A OG1 no hydrogen 2.933 N/A PHE 112.A N LYS 109.A O no hydrogen 3.074 N/A SER 113.A OG GLY 232.A O no hydrogen 2.459 N/A LYS 115.A N ASP 134.A OD2 no hydrogen 2.845 N/A LYS 115.A NZ GLU 132.A O no hydrogen 2.933 N/A GLY 116.A N SER 131.A O no hydrogen 2.771 N/A HIS 117.A N TYR 114.A O no hydrogen 3.034 N/A HIS 117.A ND1 SER 83.A OG no hydrogen 3.062 N/A HIS 117.A NE2 THR 86.A OG1 no hydrogen 3.246 N/A SER 119.A OG GLU 110.A O no hydrogen 2.711 N/A THR 120.A N GLU 110.A OE1 no hydrogen 2.956 N/A THR 120.A OG1 GLU 110.A OE1 no hydrogen 2.563 N/A THR 120.A OG1 GLU 110.A OE2 no hydrogen 3.254 N/A LEU 121.A N GLU 110.A OE2 no hydrogen 2.652 N/A GLY 122.A N THR 120.A OG1 no hydrogen 3.127 N/A LEU 123.A N THR 120.A O no hydrogen 2.967 N/A SER 124.A N ASP 362.A OD2 no hydrogen 3.175 N/A ASN 126.A N LEU 123.A O no hydrogen 3.127 N/A ASN 126.A ND2 THR 120.A O no hydrogen 3.132 N/A GLU 127.A N SER 124.A O no hydrogen 3.088 N/A GLY 128.A N ASP 118.A OD1 no hydrogen 2.745 N/A SER 131.A N HIS 117.A O no hydrogen 2.847 N/A SER 131.A OG SER 133.A O no hydrogen 2.555 N/A SER 133.A N SER 131.A OG no hydrogen 3.160 N/A CYS 135.A N SER 113.A O no hydrogen 3.000 N/A CYS 135.A SG SER 113.A O no hydrogen 3.635 N/A VAL 136.A N SER 231.A O no hydrogen 3.067 N/A GLN 139.A N CYS 135.A O no hydrogen 2.985 N/A GLN 139.A NE2 ASP 134.A O no hydrogen 3.061 N/A VAL 140.A N VAL 136.A O no hydrogen 2.912 N/A LEU 141.A N VAL 137.A O no hydrogen 2.886 N/A LYS 142.A N VAL 138.A O no hydrogen 2.956 N/A LYS 142.A NZ TYR 114.A OH no hydrogen 3.269 N/A LYS 142.A NZ ASP 134.A OD1 no hydrogen 2.672 N/A LEU 143.A N GLN 139.A O no hydrogen 2.983 N/A GLN 144.A N VAL 140.A O no hydrogen 2.884 N/A GLN 144.A NE2 ALA 263.A O no hydrogen 2.659 N/A GLY 145.A N LYS 142.A O no hydrogen 3.034 N/A ALA 146.A N LEU 141.A O no hydrogen 2.936 N/A VAL 147.A N VAL 104.A O no hydrogen 2.740 N/A PHE 149.A N VAL 106.A O no hydrogen 3.021 N/A HIS 151.A N SER 83.A O no hydrogen 2.963 N/A HIS 151.A NE2 PHE 112.A O no hydrogen 2.912 N/A THR 152.A N LEU 108.A O no hydrogen 2.910 N/A THR 152.A OG1 LEU 108.A O no hydrogen 3.189 N/A THR 152.A OG1 GLU 188.A OE2 no hydrogen 2.407 N/A ASN 153.A N CYS 80.A O no hydrogen 2.777 N/A ASN 153.A ND2 GLY 169.A O no hydrogen 3.261 N/A ASN 153.A ND2 THR 171.A OG1 no hydrogen 2.759 N/A GLN 156.A N SER 164.A O no hydrogen 2.968 N/A GLN 156.A NE2 GLY 122.A O no hydrogen 3.521 N/A GLN 156.A NE2 ASP 362.A OD2 no hydrogen 3.014 N/A GLN 156.A NE2 PHE 363.A O no hydrogen 2.730 N/A SER 157.A N LEU 121.A O no hydrogen 2.753 N/A SER 157.A OG GLN 156.A O no hydrogen 2.633 N/A MET 158.A N PRO 155.A O no hydrogen 2.850 N/A PHE 159.A N SER 157.A OG no hydrogen 3.341 N/A TYR 161.A OH ALA 454.A O no hydrogen 2.605 N/A ASP 162.A N SER 160.A OG no hydrogen 3.067 N/A CYS 163.A N ASP 162.A OD2 no hydrogen 2.991 N/A CYS 163.A SG ASN 153.A O no hydrogen 3.510 N/A CYS 163.A SG THR 171.A OG1 no hydrogen 3.719 N/A SER 164.A OG ASP 365.A OD1 no hydrogen 3.214 N/A SER 164.A OG ASP 365.A OD2 no hydrogen 2.878 N/A ASN 165.A N GLY 169.A O no hydrogen 3.100 N/A ASN 165.A ND2 ASN 153.A OD1 no hydrogen 2.824 N/A ASN 165.A ND2 VAL 154.A O no hydrogen 2.742 N/A LEU 167.A N ASN 165.A OD1 no hydrogen 2.982 N/A PHE 168.A N ASN 165.A OD1 no hydrogen 2.864 N/A GLY 169.A N ASN 165.A O no hydrogen 2.869 N/A GLN 170.A NE2 ASN 449.A OD1 no hydrogen 3.431 N/A THR 171.A N CYS 163.A O no hydrogen 2.895 N/A THR 171.A OG1 ASN 79.A O no hydrogen 2.787 N/A MET 172.A N THR 78.A O no hydrogen 2.922 N/A ASN 173.A N LYS 179.A O no hydrogen 3.097 N/A ASN 173.A ND2 SER 180.A O no hydrogen 3.026 N/A ASN 173.A ND2 PHE 215.A O no hydrogen 3.008 N/A TRP 175.A N ASN 173.A OD1 no hydrogen 2.847 N/A TRP 175.A NE1 CYS 216.A O no hydrogen 3.057 N/A LYS 176.A N ASN 173.A O no hydrogen 3.268 N/A LYS 176.A NZ ASN 508.A O no hydrogen 3.358 N/A LYS 179.A N LYS 176.A O no hydrogen 3.063 N/A LYS 179.A NZ ALA 445.A O no hydrogen 2.921 N/A LYS 179.A NZ ASP 447.A OD1 no hydrogen 2.843 N/A LYS 179.A NZ ALA 505.A O no hydrogen 2.772 N/A LYS 179.A NZ LYS 507.A O no hydrogen 2.863 N/A LYS 179.A NZ SER 509.A OG no hydrogen 3.075 N/A SER 180.A N LEU 446.A O no hydrogen 2.835 N/A SER 180.A OG ASP 162.A OD2 no hydrogen 2.795 N/A GLY 182.A N SER 180.A OG no hydrogen 3.057 N/A SER 184.A OG MET 158.A O no hydrogen 2.843 N/A SER 184.A OG SER 208.A OG no hydrogen 2.909 N/A SER 185.A N SER 208.A O no hydrogen 3.132 N/A SER 185.A OG SER 208.A O no hydrogen 2.704 N/A GLY 187.A N ASN 153.A O no hydrogen 3.113 N/A GLY 189.A N SER 185.A O no hydrogen 3.191 N/A ALA 190.A N GLY 186.A O no hydrogen 2.865 N/A LEU 191.A N GLY 187.A O no hydrogen 2.918 N/A ILE 192.A N GLU 188.A O no hydrogen 2.884 N/A GLY 193.A N GLY 189.A O no hydrogen 2.808 N/A SER 194.A N ALA 190.A O no hydrogen 3.060 N/A SER 194.A OG ALA 190.A O no hydrogen 2.857 N/A SER 194.A OG LEU 191.A O no hydrogen 3.292 N/A GLY 195.A N ILE 192.A O no hydrogen 3.170 N/A GLY 196.A N LEU 191.A O no hydrogen 2.809 N/A SER 197.A OG SER 107.A OG no hydrogen 2.670 N/A SER 197.A OG LEU 199.A O no hydrogen 2.881 N/A LEU 199.A N SER 197.A OG no hydrogen 3.324 N/A GLY 200.A N MET 250.A O no hydrogen 2.946 N/A LEU 201.A N SER 107.A O no hydrogen 3.161 N/A GLY 202.A N GLY 248.A O no hydrogen 2.978 N/A THR 203.A N SER 185.A OG no hydrogen 3.301 N/A ASP 204.A N SER 246.A O no hydrogen 2.840 N/A GLY 207.A N ASP 204.A OD2 no hydrogen 2.889 N/A SER 208.A OG SER 184.A OG no hydrogen 2.909 N/A ILE 209.A N ASP 204.A OD1 no hydrogen 2.981 N/A ARG 210.A N GLY 207.A O no hydrogen 2.700 N/A ARG 210.A NE ASP 204.A OD1 no hydrogen 2.939 N/A ARG 210.A NH1 THR 461.A O no hydrogen 3.036 N/A ARG 210.A NH1 GLN 517.A OE1 no hydrogen 2.750 N/A ARG 210.A NH2 ASP 204.A OD1 no hydrogen 3.469 N/A ARG 210.A NH2 ASP 204.A OD2 no hydrogen 2.856 N/A ARG 210.A NH2 THR 461.A O no hydrogen 3.261 N/A ARG 210.A NH2 ASN 465.A OD1 no hydrogen 2.769 N/A PHE 211.A N GLY 207.A O no hydrogen 2.746 N/A SER 213.A N ILE 209.A O no hydrogen 3.259 N/A SER 213.A OG ILE 209.A O no hydrogen 2.715 N/A ALA 214.A N ARG 210.A O no hydrogen 2.855 N/A PHE 215.A N PHE 211.A O no hydrogen 2.847 N/A CYS 216.A N PRO 212.A O no hydrogen 3.084 N/A CYS 216.A SG PRO 181.A O no hydrogen 3.338 N/A GLY 217.A N ALA 214.A O no hydrogen 3.348 N/A ILE 218.A N SER 213.A O no hydrogen 2.832 N/A CYS 219.A N ALA 251.A O no hydrogen 2.871 N/A CYS 219.A SG GLU 536.A OE1 no hydrogen 3.883 N/A GLY 220.A N VAL 473.A O no hydrogen 3.343 N/A LEU 221.A N PRO 249.A O no hydrogen 3.104 N/A LYS 222.A N ALA 471.A O no hydrogen 2.788 N/A LYS 222.A NZ LYS 222.A O no hydrogen 3.370 N/A LYS 222.A NZ PRO 223.A O no hydrogen 3.123 N/A LYS 222.A NZ PHE 469.A O no hydrogen 2.685 N/A THR 224.A N GLU 525.A OE2 no hydrogen 2.664 N/A THR 224.A OG1 GLU 525.A OE2 no hydrogen 2.430 N/A GLY 225.A N ASP 468.A OD2 no hydrogen 2.749 N/A ASN 226.A ND2 THR 275.A O no hydrogen 3.235 N/A ARG 227.A N THR 224.A O no hydrogen 2.984 N/A ARG 227.A NH1 LEU 279.A O no hydrogen 3.065 N/A ARG 227.A NH1 GLU 526.A OE2 no hydrogen 3.125 N/A ARG 227.A NH2 GLU 525.A OE1 no hydrogen 2.647 N/A ARG 227.A NH2 GLU 526.A OE1 no hydrogen 3.256 N/A SER 229.A OG ASP 273.A OD1 no hydrogen 2.436 N/A LYS 230.A NZ LEU 245.A O no hydrogen 3.024 N/A SER 231.A N SER 229.A OG no hydrogen 2.953 N/A LEU 233.A N LYS 230.A O no hydrogen 3.273 N/A LYS 234.A N CYS 111.A O no hydrogen 2.864 N/A LYS 234.A NZ ASN 126.A OD1 no hydrogen 3.059 N/A CYS 236.A SG SER 157.A O no hydrogen 3.516 N/A TYR 238.A OH GLY 235.A O no hydrogen 3.405 N/A GLN 240.A NE2 VAL 243.A O no hydrogen 2.724 N/A VAL 243.A N GLN 240.A OE1 no hydrogen 2.853 N/A SER 246.A N ASP 204.A O no hydrogen 2.943 N/A SER 246.A OG PRO 223.A O no hydrogen 2.675 N/A GLY 248.A N GLY 202.A O no hydrogen 3.066 N/A MET 250.A N GLY 200.A O no hydrogen 2.897 N/A ALA 251.A N CYS 219.A O no hydrogen 2.785 N/A ARG 252.A NH1 TYR 67.A OH no hydrogen 3.486 N/A ARG 252.A NH2 TYR 67.A OH no hydrogen 3.143 N/A VAL 254.A N GLU 536.A OE1 no hydrogen 3.102 N/A SER 256.A N ASP 253.A O no hydrogen 3.284 N/A SER 256.A N ASP 253.A OD2 no hydrogen 2.835 N/A SER 256.A OG ASP 253.A OD2 no hydrogen 2.497 N/A ALA 258.A N VAL 254.A O no hydrogen 3.052 N/A LEU 259.A N GLU 255.A O no hydrogen 2.939 N/A CYS 260.A N SER 256.A O no hydrogen 2.965 N/A LEU 261.A N LEU 257.A O no hydrogen 2.990 N/A LYS 262.A N ALA 258.A O no hydrogen 2.881 N/A ALA 263.A N LEU 259.A O no hydrogen 2.920 N/A LEU 264.A N CYS 260.A O no hydrogen 2.927 N/A LEU 265.A N LEU 261.A O no hydrogen 2.908 N/A CYS 266.A N LEU 264.A O no hydrogen 2.897 N/A CYS 266.A SG ALA 263.A O no hydrogen 3.373 N/A CYS 266.A SG LEU 264.A O no hydrogen 3.818 N/A PHE 270.A N CYS 266.A O no hydrogen 3.232 N/A THR 271.A N GLU 267.A O no hydrogen 2.889 N/A THR 271.A OG1 GLU 267.A O no hydrogen 3.203 N/A THR 271.A OG1 HIS 268.A O no hydrogen 3.135 N/A LEU 272.A N HIS 268.A O no hydrogen 2.869 N/A ASP 273.A N LEU 269.A O no hydrogen 2.885 N/A THR 275.A N ASP 273.A OD2 no hydrogen 3.102 N/A THR 275.A OG1 ASP 273.A OD1 no hydrogen 3.559 N/A THR 275.A OG1 ASP 273.A OD2 no hydrogen 2.805 N/A VAL 276.A N ASP 273.A O no hydrogen 3.146 N/A LEU 279.A N PRO 277.A O no hydrogen 2.815 N/A ARG 282.A N GLU 526.A OE2 no hydrogen 2.747 N/A GLU 284.A N GLU 284.A OE1 no hydrogen 3.000 N/A VAL 285.A N ARG 282.A O no hydrogen 3.164 N/A TYR 286.A N ARG 282.A O no hydrogen 3.259 N/A TYR 286.A OH GLU 255.A OE2 no hydrogen 2.282 N/A ARG 287.A N GLU 283.A O no hydrogen 2.847 N/A ARG 287.A NH1 GLU 255.A OE1 no hydrogen 3.166 N/A ARG 287.A NH2 GLU 255.A OE1 no hydrogen 3.319 N/A ARG 287.A NH2 GLU 255.A OE2 no hydrogen 2.938 N/A SER 288.A N VAL 285.A O no hydrogen 3.067 N/A LEU 292.A N HIS 325.A ND1 no hydrogen 3.000 N/A ARG 293.A N ASP 435.A OD1 no hydrogen 2.691 N/A ARG 293.A NE MET 432.A O no hydrogen 3.416 N/A ARG 293.A NE ASN 433.A O no hydrogen 2.887 N/A ARG 293.A NH2 MET 432.A O no hydrogen 2.814 N/A VAL 294.A N THR 326.A O no hydrogen 2.803 N/A GLY 295.A N VAL 436.A O no hydrogen 2.887 N/A TYR 296.A N ILE 328.A O no hydrogen 3.012 N/A TYR 297.A N LEU 438.A O no hydrogen 3.322 N/A TYR 297.A OH TYR 464.A OH no hydrogen 2.569 N/A THR 299.A OG1 TYR 493.A OH no hydrogen 2.596 N/A ASP 300.A N TYR 460.A OH no hydrogen 3.062 N/A ASN 301.A N THR 299.A OG1 no hydrogen 3.075 N/A TYR 302.A N ASP 300.A OD2 no hydrogen 2.777 N/A TYR 302.A OH GLU 340.A OE1 no hydrogen 2.808 N/A THR 303.A N ASP 300.A OD2 no hydrogen 2.841 N/A THR 303.A OG1 SER 459.A OG no hydrogen 2.759 N/A SER 306.A OG GLY 443.A O no hydrogen 2.802 N/A MET 309.A N SER 306.A OG no hydrogen 3.167 N/A ARG 310.A N SER 306.A O no hydrogen 2.943 N/A ARG 311.A N PRO 307.A O no hydrogen 2.980 N/A ARG 311.A NE ASP 483.A OD1 no hydrogen 3.117 N/A ARG 311.A NE ASP 483.A OD2 no hydrogen 3.068 N/A ARG 311.A NH1 THR 477.A OG1 no hydrogen 3.306 N/A ARG 311.A NH1 ASP 483.A OD1 no hydrogen 2.615 N/A ARG 311.A NH2 GLU 315.A OE2 no hydrogen 3.122 N/A ARG 311.A NH2 THR 477.A OG1 no hydrogen 3.075 N/A ALA 312.A N ALA 308.A O no hydrogen 2.862 N/A LEU 313.A N MET 309.A O no hydrogen 3.059 N/A ILE 314.A N ARG 310.A O no hydrogen 2.988 N/A GLU 315.A N ARG 311.A O no hydrogen 2.920 N/A THR 316.A N ALA 312.A O no hydrogen 3.205 N/A THR 316.A OG1 ALA 312.A O no hydrogen 2.835 N/A LYS 317.A N LEU 313.A O no hydrogen 2.988 N/A LYS 317.A NZ GLU 321.A OE1 no hydrogen 2.817 N/A GLN 318.A N ILE 314.A O no hydrogen 2.961 N/A ARG 319.A N GLU 315.A O no hydrogen 2.971 N/A ARG 319.A NH1 LEU 538.A O no hydrogen 2.537 N/A LEU 320.A N THR 316.A O no hydrogen 2.870 N/A GLU 321.A N LYS 317.A O no hydrogen 2.962 N/A ALA 322.A N GLN 318.A O no hydrogen 2.945 N/A ALA 323.A N ARG 319.A O no hydrogen 2.945 N/A ALA 323.A N LEU 320.A O no hydrogen 3.119 N/A GLY 324.A N GLU 321.A O no hydrogen 3.033 N/A HIS 325.A N LEU 320.A O no hydrogen 3.107 N/A HIS 325.A NE2 GLU 534.A OE1 no hydrogen 2.779 N/A THR 326.A N LEU 292.A O no hydrogen 2.971 N/A ILE 328.A N VAL 294.A O no hydrogen 2.844 N/A PHE 330.A N TYR 296.A O no hydrogen 3.023 N/A ASN 333.A N GLN 428.A OE1 no hydrogen 2.991 N/A ASN 333.A ND2 SER 424.A OG no hydrogen 3.119 N/A ASN 333.A ND2 GLN 428.A OE1 no hydrogen 2.988 N/A ASN 334.A ND2 ASN 333.A OD1 no hydrogen 2.784 N/A TYR 337.A OH GLU 417.A OE2 no hydrogen 2.511 N/A ALA 338.A N ASN 334.A O no hydrogen 2.969 N/A LEU 339.A N ILE 335.A O no hydrogen 2.968 N/A GLU 340.A N PRO 336.A O no hydrogen 2.745 N/A VAL 341.A N TYR 337.A O no hydrogen 2.911 N/A LEU 342.A N TYR 337.A O no hydrogen 3.091 N/A SER 343.A N ALA 338.A O no hydrogen 2.770 N/A SER 343.A OG ALA 338.A O no hydrogen 2.756 N/A THR 344.A N LEU 339.A O no hydrogen 3.160 N/A THR 344.A OG1 LEU 339.A O no hydrogen 2.868 N/A GLY 345.A N VAL 341.A O no hydrogen 3.128 N/A GLY 346.A N LEU 342.A O no hydrogen 2.840 N/A LEU 347.A N SER 343.A O no hydrogen 2.946 N/A PHE 348.A N THR 344.A O no hydrogen 2.901 N/A SER 349.A OG GLY 345.A O no hydrogen 2.688 N/A SER 349.A OG GLY 346.A O no hydrogen 3.339 N/A GLY 351.A N PHE 348.A O no hydrogen 2.877 N/A GLY 352.A N ASP 350.A OD1 no hydrogen 2.839 N/A SER 354.A N ASP 350.A OD2 no hydrogen 2.716 N/A SER 354.A OG ASP 350.A OD2 no hydrogen 2.377 N/A LEU 356.A N GLY 352.A O no hydrogen 2.787 N/A GLN 357.A N ARG 353.A O no hydrogen 3.222 N/A ASN 358.A N PHE 355.A O no hydrogen 3.217 N/A ASN 358.A ND2 CYS 236.A O no hydrogen 3.018 N/A ASN 358.A ND2 PHE 355.A O no hydrogen 2.812 N/A PHE 359.A N LEU 356.A O no hydrogen 3.066 N/A LYS 360.A N GLN 357.A O no hydrogen 3.398 N/A LYS 360.A NZ GLN 357.A OE1 no hydrogen 3.217 N/A ASP 362.A N PHE 359.A O no hydrogen 2.944 N/A PHE 363.A N ASP 362.A OD1 no hydrogen 2.805 N/A ASP 365.A N GLN 156.A OE1 no hydrogen 2.838 N/A CYS 367.A N ASP 365.A OD1 no hydrogen 2.865 N/A CYS 367.A SG SER 164.A O no hydrogen 3.404 N/A CYS 367.A SG ASP 365.A OD1 no hydrogen 3.378 N/A LEU 368.A N ASP 365.A O no hydrogen 3.089 N/A GLY 369.A N PRO 366.A O no hydrogen 3.005 N/A LEU 371.A N LEU 368.A O no hydrogen 3.228 N/A ILE 374.A N ASP 370.A O no hydrogen 2.903 N/A LEU 375.A N LEU 371.A O no hydrogen 2.969 N/A ARG 376.A N ILE 372.A O no hydrogen 3.009 N/A LEU 377.A N ILE 374.A O no hydrogen 3.131 N/A PHE 381.A N PRO 378.A O no hydrogen 2.994 N/A LYS 382.A N PRO 378.A O no hydrogen 3.007 N/A LYS 382.A NZ LEU 375.A O no hydrogen 3.102 N/A LYS 382.A NZ MET 403.A O no hydrogen 3.028 N/A ARG 383.A N SER 379.A O no hydrogen 3.078 N/A LEU 384.A N TRP 380.A O no hydrogen 3.002 N/A LEU 385.A N PHE 381.A O no hydrogen 2.788 N/A SER 386.A N LYS 382.A O no hydrogen 2.978 N/A SER 386.A OG ALA 397.A O no hydrogen 2.894 N/A LEU 387.A N ARG 383.A O no hydrogen 3.062 N/A LEU 388.A N LEU 384.A O no hydrogen 3.073 N/A LEU 389.A N LEU 385.A O no hydrogen 2.992 N/A LYS 390.A N SER 386.A O no hydrogen 3.024 N/A LEU 392.A N LEU 389.A O no hydrogen 2.987 N/A PHE 393.A N LEU 389.A O no hydrogen 2.710 N/A ARG 395.A NE ASP 496.A OD1 no hydrogen 2.740 N/A ARG 395.A NH2 ASP 496.A OD1 no hydrogen 3.287 N/A ARG 395.A NH2 ASP 496.A OD2 no hydrogen 2.750 N/A ARG 395.A NH2 ASP 499.A OD2 no hydrogen 2.936 N/A ALA 397.A N PHE 393.A O no hydrogen 2.954 N/A ALA 398.A N PRO 394.A O no hydrogen 2.945 N/A PHE 399.A N ARG 395.A O no hydrogen 3.157 N/A LEU 400.A N LEU 396.A O no hydrogen 3.127 N/A ASN 401.A N ALA 397.A O no hydrogen 3.065 N/A ASN 402.A N ALA 398.A O no hydrogen 3.129 N/A ASN 402.A ND2 ALA 398.A O no hydrogen 2.717 N/A MET 403.A N LEU 400.A O no hydrogen 3.315 N/A ARG 404.A NE SER 379.A OG no hydrogen 3.093 N/A ARG 404.A NH2 ASN 401.A OD1 no hydrogen 3.277 N/A ARG 406.A NE SER 349.A O no hydrogen 3.159 N/A ARG 406.A NH1 ASN 402.A O no hydrogen 2.805 N/A ARG 406.A NH1 ARG 404.A O no hydrogen 2.909 N/A LYS 410.A N SER 407.A OG no hydrogen 3.024 N/A LEU 411.A N SER 407.A O no hydrogen 3.080 N/A TRP 412.A N ALA 408.A O no hydrogen 2.936 N/A LYS 413.A N GLU 409.A O no hydrogen 3.235 N/A LEU 414.A N LYS 410.A O no hydrogen 2.959 N/A GLN 415.A N LEU 411.A O no hydrogen 2.766 N/A HIS 416.A N TRP 412.A O no hydrogen 2.980 N/A GLU 417.A N LYS 413.A O no hydrogen 3.021 N/A ILE 418.A N LEU 414.A O no hydrogen 2.853 N/A GLU 419.A N GLN 415.A O no hydrogen 3.053 N/A MET 420.A N HIS 416.A O no hydrogen 2.843 N/A TYR 421.A N GLU 417.A O no hydrogen 2.847 N/A TYR 421.A OH ASN 333.A O no hydrogen 2.700 N/A ARG 422.A N ILE 418.A O no hydrogen 3.039 N/A ARG 422.A NE LEU 467.A O no hydrogen 2.695 N/A ARG 422.A NH1 ASP 468.A O no hydrogen 2.996 N/A GLN 423.A N GLU 419.A O no hydrogen 3.158 N/A SER 424.A N MET 420.A O no hydrogen 2.921 N/A SER 424.A OG TYR 421.A O no hydrogen 2.557 N/A VAL 425.A N TYR 421.A O no hydrogen 3.079 N/A ILE 426.A N ARG 422.A O no hydrogen 2.998 N/A ALA 427.A N GLN 423.A O no hydrogen 2.931 N/A GLN 428.A N SER 424.A O no hydrogen 3.050 N/A GLN 428.A NE2 LEU 331.A O no hydrogen 2.816 N/A TRP 429.A N VAL 425.A O no hydrogen 2.983 N/A LYS 430.A N ILE 426.A O no hydrogen 2.930 N/A ALA 431.A N ALA 427.A O no hydrogen 2.965 N/A MET 432.A N GLN 428.A O no hydrogen 3.115 N/A MET 432.A N TRP 429.A O no hydrogen 3.203 N/A ASN 433.A N LYS 430.A O no hydrogen 2.963 N/A LEU 434.A N TRP 429.A O no hydrogen 3.186 N/A ASP 435.A N ARG 293.A O no hydrogen 2.864 N/A VAL 436.A N ARG 293.A O no hydrogen 3.179 N/A LEU 437.A N VAL 519.A O no hydrogen 2.998 N/A LEU 438.A N GLY 295.A O no hydrogen 2.788 N/A THR 439.A N GLN 517.A O no hydrogen 2.985 N/A THR 439.A OG1 PRO 440.A O no hydrogen 2.681 N/A ASP 447.A N ALA 505.A O no hydrogen 2.988 N/A LEU 448.A N SER 178.A O no hydrogen 3.039 N/A ASN 449.A N ASP 162.A OD1 no hydrogen 2.652 N/A THR 450.A N ASP 447.A O no hydrogen 3.244 N/A THR 450.A OG1 ASP 447.A O no hydrogen 2.680 N/A ARG 453.A N THR 450.A O no hydrogen 2.837 N/A ARG 453.A NH1 ASP 370.A OD2 no hydrogen 3.013 N/A ARG 453.A NH2 ASP 370.A OD2 no hydrogen 3.428 N/A ALA 454.A N PRO 451.A O no hydrogen 3.031 N/A ALA 457.A N ALA 454.A O no hydrogen 3.355 N/A VAL 458.A N THR 455.A O no hydrogen 3.262 N/A SER 459.A N GLY 456.A O no hydrogen 3.200 N/A SER 459.A OG ASP 300.A OD1 no hydrogen 2.706 N/A SER 459.A OG THR 303.A OG1 no hydrogen 2.759 N/A SER 459.A OG GLY 456.A O no hydrogen 3.518 N/A TYR 460.A OH THR 303.A O no hydrogen 2.613 N/A THR 461.A N VAL 458.A O no hydrogen 3.135 N/A THR 461.A OG1 GLY 206.A O no hydrogen 2.714 N/A THR 461.A OG1 VAL 458.A O no hydrogen 3.116 N/A MET 462.A N VAL 458.A O no hydrogen 2.792 N/A TYR 464.A N THR 461.A O no hydrogen 3.141 N/A TYR 464.A OH TYR 297.A OH no hydrogen 2.569 N/A ASN 465.A ND2 ASP 204.A OD2 no hydrogen 3.006 N/A CYS 466.A N MET 462.A O no hydrogen 2.981 N/A CYS 466.A SG ALA 338.A O no hydrogen 3.879 N/A LEU 467.A N LEU 463.A O no hydrogen 3.015 N/A ASP 468.A N ASN 465.A O no hydrogen 3.251 N/A PHE 469.A N TYR 464.A O no hydrogen 3.092 N/A ALA 471.A N LYS 222.A O no hydrogen 2.993 N/A GLY 472.A N CYS 518.A O no hydrogen 2.887 N/A VAL 473.A N GLY 220.A O no hydrogen 2.966 N/A VAL 474.A N VAL 516.A O no hydrogen 3.194 N/A VAL 476.A N VAL 514.A O no hydrogen 2.877 N/A THR 477.A N VAL 514.A O no hydrogen 3.194 N/A VAL 479.A N LEU 512.A O no hydrogen 2.892 N/A THR 480.A N ASP 483.A OD1 no hydrogen 3.167 N/A ASP 483.A N THR 480.A OG1 no hydrogen 2.993 N/A ASP 484.A N THR 480.A O no hydrogen 3.031 N/A ALA 485.A N ALA 481.A O no hydrogen 2.909 N/A GLN 486.A N GLU 482.A O no hydrogen 2.885 N/A MET 487.A N ASP 484.A O no hydrogen 3.154 N/A GLU 488.A N ALA 485.A O no hydrogen 3.094 N/A LEU 489.A N GLN 486.A O no hydrogen 2.940 N/A TYR 490.A N MET 487.A O no hydrogen 3.105 N/A TYR 490.A OH MET 304.A O no hydrogen 2.521 N/A TYR 493.A OH THR 299.A OG1 no hydrogen 2.596 N/A PHE 494.A N ASP 499.A OD1 no hydrogen 2.888 N/A GLY 495.A N ASP 499.A OD1 no hydrogen 2.701 N/A ASP 499.A N ASP 496.A OD2 no hydrogen 3.215 N/A ILE 500.A N ASP 496.A O no hydrogen 3.165 N/A ILE 501.A N ILE 497.A O no hydrogen 2.854 N/A LEU 502.A N TRP 498.A O no hydrogen 3.155 N/A LYS 503.A N ASP 499.A O no hydrogen 3.072 N/A LYS 503.A NZ GLU 488.A O no hydrogen 2.919 N/A LYS 504.A N ILE 500.A O no hydrogen 3.350 N/A ALA 505.A N ILE 501.A O no hydrogen 2.779 N/A MET 506.A N LEU 502.A O no hydrogen 3.138 N/A LYS 507.A N LYS 504.A O no hydrogen 3.282 N/A LYS 507.A NZ LYS 503.A O no hydrogen 3.163 N/A ASN 508.A N ASP 484.A OD2 no hydrogen 3.135 N/A SER 509.A N ASP 484.A OD1 no hydrogen 2.900 N/A SER 509.A OG MET 506.A O no hydrogen 3.015 N/A SER 509.A OG LYS 507.A O no hydrogen 3.479 N/A GLY 511.A N VAL 479.A O no hydrogen 2.898 N/A LEU 512.A N SER 509.A O no hydrogen 3.071 N/A VAL 514.A N THR 477.A O no hydrogen 2.879 N/A VAL 516.A N VAL 474.A O no hydrogen 3.187 N/A GLN 517.A N THR 439.A O no hydrogen 2.941 N/A GLN 517.A NE2 THR 439.A OG1 no hydrogen 2.943 N/A GLN 517.A NE2 TYR 460.A O no hydrogen 2.859 N/A CYS 518.A N GLY 472.A O no hydrogen 2.764 N/A VAL 519.A N LEU 437.A O no hydrogen 2.842 N/A ALA 520.A N PRO 470.A O no hydrogen 3.114 N/A LEU 521.A N GLN 524.A OE1 no hydrogen 3.008 N/A TRP 523.A N THR 224.A OG1 no hydrogen 2.928 N/A GLN 524.A N LEU 521.A O no hydrogen 3.047 N/A GLU 526.A N GLU 526.A OE1 no hydrogen 2.808 N/A CYS 528.A N GLN 524.A O no hydrogen 2.958 N/A CYS 528.A SG CYS 518.A O no hydrogen 3.391 N/A LEU 529.A N GLU 525.A O no hydrogen 2.913 N/A ARG 530.A N GLU 526.A O no hydrogen 2.893 N/A ARG 530.A NH1 ARG 530.A O no hydrogen 2.949 N/A ARG 530.A NH1 GLU 534.A OE2 no hydrogen 3.106 N/A ARG 530.A NH2 ARG 290.A O no hydrogen 3.018 N/A PHE 531.A N LEU 527.A O no hydrogen 2.982 N/A MET 532.A N CYS 528.A O no hydrogen 2.841 N/A ARG 533.A N LEU 529.A O no hydrogen 2.829 N/A ARG 533.A NE TYR 286.A O no hydrogen 3.353 N/A ARG 533.A NH1 TYR 286.A O no hydrogen 2.849 N/A ARG 533.A NH1 SER 288.A O no hydrogen 2.985 N/A GLU 534.A N ARG 530.A O no hydrogen 3.209 N/A VAL 535.A N PHE 531.A O no hydrogen 2.984 N/A GLU 536.A N MET 532.A O no hydrogen 2.921 N/A GLN 537.A N ARG 533.A O no hydrogen 3.000 N/A LEU 538.A N GLU 534.A O no hydrogen 2.992 N/A MET 539.A N VAL 535.A O no hydrogen 2.856 N/A THR 540.A N GLU 536.A O no hydrogen 2.823 N/A THR 540.A OG1 GLU 536.A O no hydrogen 2.783 N/A LYS 543.A N THR 540.A O no hydrogen 3.006 N/A