Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 5iix_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): SER 3.A N GLU 55.A OE2 no hydrogen 2.939 N/A SER 3.A OG CYS 60.A O no hydrogen 2.658 N/A HIS 7.A N SER 3.A O no hydrogen 3.009 N/A ARG 8.A N GLU 4.A O no hydrogen 2.930 N/A ARG 8.A NH1 ASP 248.A OD2 no hydrogen 2.696 N/A PHE 9.A N ILE 5.A O no hydrogen 2.918 N/A ASN 10.A N ALA 6.A O no hydrogen 2.823 N/A ASP 11.A N HIS 7.A O no hydrogen 2.962 N/A LEU 12.A N ARG 8.A O no hydrogen 2.875 N/A GLY 13.A N PHE 9.A O no hydrogen 3.050 N/A PHE 17.A N GLY 13.A O no hydrogen 2.873 N/A LYS 18.A N GLU 14.A O no hydrogen 2.851 N/A LYS 18.A NZ ASN 42.A OD1 no hydrogen 2.806 N/A GLY 19.A N LYS 15.A O no hydrogen 3.037 N/A LEU 20.A N HIS 16.A O no hydrogen 3.035 N/A VAL 21.A N PHE 17.A O no hydrogen 3.076 N/A LEU 22.A N LYS 18.A O no hydrogen 2.966 N/A VAL 23.A N GLY 19.A O no hydrogen 2.990 N/A ALA 24.A N LEU 20.A O no hydrogen 2.921 N/A PHE 25.A N VAL 21.A O no hydrogen 3.047 N/A SER 26.A N LEU 22.A O no hydrogen 2.967 N/A SER 26.A OG LEU 22.A O no hydrogen 2.640 N/A GLN 27.A N VAL 23.A O no hydrogen 2.966 N/A GLN 27.A NE2 HIS 143.A O no hydrogen 3.162 N/A GLN 27.A NE2 PHE 146.A O no hydrogen 3.102 N/A TYR 28.A N ALA 24.A O no hydrogen 3.186 N/A LEU 29.A N PHE 25.A O no hydrogen 2.951 N/A GLN 30.A NE2 ASP 105.A O no hydrogen 2.906 N/A GLN 30.A NE2 ARG 141.A O no hydrogen 2.847 N/A CYS 32.A SG ASP 36.A OD2 no hydrogen 3.260 N/A GLU 35.A N GLU 35.A OE2 no hydrogen 2.874 N/A HIS 37.A N PRO 33.A O no hydrogen 3.466 N/A VAL 38.A N PHE 34.A O no hydrogen 2.980 N/A LYS 39.A N GLU 35.A O no hydrogen 3.082 N/A LEU 40.A N ASP 36.A O no hydrogen 3.366 N/A VAL 41.A N HIS 37.A O no hydrogen 2.811 N/A ASN 42.A N VAL 38.A O no hydrogen 2.881 N/A GLU 43.A N LYS 39.A O no hydrogen 2.964 N/A VAL 44.A N LEU 40.A O no hydrogen 2.974 N/A THR 45.A N VAL 41.A O no hydrogen 2.837 N/A THR 45.A OG1 VAL 41.A O no hydrogen 2.799 N/A GLU 46.A N ASN 42.A O no hydrogen 3.002 N/A PHE 47.A N GLU 43.A O no hydrogen 3.107 N/A ALA 48.A N VAL 44.A O no hydrogen 2.973 N/A LYS 49.A N THR 45.A O no hydrogen 3.042 N/A LYS 49.A NZ GLU 14.A OE1 no hydrogen 2.852 N/A LYS 50.A N GLU 46.A O no hydrogen 3.128 N/A CYS 51.A N PHE 47.A O no hydrogen 2.961 N/A CYS 51.A SG PHE 47.A O no hydrogen 3.223 N/A ALA 52.A N ALA 48.A O no hydrogen 2.773 N/A ALA 53.A N LYS 49.A O no hydrogen 3.061 N/A ASP 54.A N LYS 50.A O no hydrogen 3.092 N/A SER 56.A N ASP 54.A OD1 no hydrogen 3.348 N/A SER 56.A OG ASP 54.A OD1 no hydrogen 2.777 N/A SER 56.A OG ASP 54.A OD2 no hydrogen 3.537 N/A ALA 57.A N ASP 54.A O no hydrogen 3.256 N/A ASN 59.A N GLU 58.A OE1 no hydrogen 3.186 N/A CYS 60.A N ALA 57.A O no hydrogen 3.209 N/A CYS 60.A SG ASP 54.A O no hydrogen 3.918 N/A LYS 62.A N ASN 59.A O no hydrogen 3.355 N/A SER 63.A OG THR 66.A OG1 no hydrogen 2.829 N/A THR 66.A N SER 63.A OG no hydrogen 3.084 N/A THR 66.A OG1 SER 63.A OG no hydrogen 2.829 N/A LEU 67.A N SER 63.A O no hydrogen 3.000 N/A PHE 68.A N LEU 64.A O no hydrogen 2.818 N/A GLY 69.A N HIS 65.A O no hydrogen 2.901 N/A ASP 70.A N THR 66.A O no hydrogen 3.006 N/A LYS 71.A N LEU 67.A O no hydrogen 3.154 N/A LYS 71.A NZ GLU 43.A OE1 no hydrogen 2.699 N/A LEU 72.A N PHE 68.A O no hydrogen 2.930 N/A CYS 73.A N GLY 69.A O no hydrogen 2.906 N/A CYS 73.A SG GLY 69.A O no hydrogen 3.179 N/A THR 74.A N LYS 71.A O no hydrogen 3.106 N/A THR 74.A OG1 LYS 71.A O no hydrogen 2.645 N/A VAL 75.A N LEU 72.A O no hydrogen 3.167 N/A THR 81.A N THR 77.A O no hydrogen 3.312 N/A THR 81.A OG1 THR 77.A O no hydrogen 2.877 N/A TYR 82.A N LEU 78.A O no hydrogen 2.673 N/A ALA 86.A N TYR 82.A O no hydrogen 3.057 N/A CYS 88.A N GLU 84.A O no hydrogen 3.397 N/A CYS 88.A SG GLU 84.A O no hydrogen 3.625 N/A CYS 88.A SG HIS 103.A ND1 no hydrogen 3.541 N/A CYS 89.A N LEU 85.A O no hydrogen 3.049 N/A CYS 89.A SG LEU 85.A O no hydrogen 3.432 N/A GLU 90.A N ASP 87.A O no hydrogen 3.232 N/A LYS 91.A N CYS 88.A O no hydrogen 2.969 N/A ARG 96.A N GLN 92.A O no hydrogen 2.831 N/A ARG 96.A NE GLU 93.A OE2 no hydrogen 2.908 N/A ARG 96.A NH1 HIS 65.A O no hydrogen 3.377 N/A ARG 96.A NH1 THR 66.A O no hydrogen 2.978 N/A ARG 96.A NH1 ASP 70.A OD1 no hydrogen 2.938 N/A ARG 96.A NH1 GLU 93.A OE2 no hydrogen 3.285 N/A ARG 96.A NH2 ASP 70.A OD1 no hydrogen 2.603 N/A ASN 97.A N GLU 93.A OE1 no hydrogen 2.988 N/A ASN 97.A ND2 TYR 28.A OH no hydrogen 2.980 N/A GLU 98.A N PRO 94.A O no hydrogen 3.126 N/A CYS 99.A N GLU 95.A O no hydrogen 2.852 N/A CYS 99.A SG HIS 103.A ND1 no hydrogen 3.729 N/A PHE 100.A N ARG 96.A O no hydrogen 2.857 N/A LEU 101.A N ASN 97.A O no hydrogen 2.854 N/A THR 102.A N GLU 98.A O no hydrogen 2.966 N/A THR 102.A OG1 GLU 98.A O no hydrogen 2.694 N/A HIS 103.A N PHE 100.A O no hydrogen 3.279 N/A LYS 104.A N LEU 101.A O no hydrogen 3.456 N/A LYS 104.A NZ PRO 144.A O no hydrogen 3.188 N/A ASP 105.A N GLN 30.A OE1 no hydrogen 3.118 N/A HIS 107.A N ASP 105.A OD1 no hydrogen 2.977 N/A GLU 116.A N GLN 120.A OE1 no hydrogen 3.005 N/A GLN 120.A N GLU 116.A O no hydrogen 2.901 N/A CYS 121.A N PRO 117.A O no hydrogen 2.838 N/A ALA 122.A N ASP 118.A O no hydrogen 3.026 N/A ALA 123.A N ALA 119.A O no hydrogen 3.032 N/A PHE 124.A N GLN 120.A O no hydrogen 2.769 N/A GLN 125.A N CYS 121.A O no hydrogen 3.050 N/A GLN 125.A NE2 CYS 121.A O no hydrogen 3.262 N/A GLU 126.A N ALA 122.A O no hydrogen 3.252 N/A ASP 127.A N ALA 123.A O no hydrogen 3.253 N/A LYS 130.A N ASP 127.A OD1 no hydrogen 3.473 N/A PHE 131.A N ASP 127.A O no hydrogen 3.030 N/A LEU 132.A N PRO 128.A O no hydrogen 2.609 N/A GLY 133.A N ASP 129.A O no hydrogen 2.760 N/A LYS 134.A N LYS 130.A O no hydrogen 2.868 N/A TYR 135.A N PHE 131.A O no hydrogen 3.201 N/A LEU 136.A N LEU 132.A O no hydrogen 3.148 N/A TYR 137.A N GLY 133.A O no hydrogen 2.916 N/A TYR 137.A OH CYS 32.A O no hydrogen 2.454 N/A GLU 138.A N LYS 134.A O no hydrogen 2.748 N/A VAL 139.A N TYR 135.A O no hydrogen 3.106 N/A ALA 140.A N LEU 136.A O no hydrogen 2.980 N/A ARG 141.A N TYR 137.A O no hydrogen 3.213 N/A ARG 141.A NE GLU 138.A OE1 no hydrogen 3.023 N/A ARG 141.A NH1 GLU 138.A OE1 no hydrogen 2.703 N/A ARG 142.A NE PRO 111.A O no hydrogen 3.292 N/A ARG 142.A NH1 GLU 138.A O no hydrogen 2.917 N/A ARG 142.A NH1 GLU 138.A OE1 no hydrogen 3.012 N/A ARG 142.A NH2 PRO 111.A O no hydrogen 2.632 N/A HIS 143.A N VAL 139.A O no hydrogen 2.925 N/A HIS 143.A ND1 SER 186.A OG no hydrogen 2.806 N/A PHE 146.A N HIS 143.A O no hydrogen 3.155 N/A LEU 151.A N TYR 147.A O no hydrogen 3.022 N/A LEU 152.A N GLY 148.A O no hydrogen 3.245 N/A PHE 153.A N PRO 149.A O no hydrogen 3.032 N/A HIS 154.A N GLU 150.A O no hydrogen 2.922 N/A HIS 154.A ND1 GLU 157.A OE1 no hydrogen 2.871 N/A ALA 155.A N LEU 151.A O no hydrogen 2.826 N/A GLU 156.A N LEU 152.A O no hydrogen 3.218 N/A GLU 156.A N PHE 153.A O no hydrogen 3.125 N/A GLU 157.A N PHE 153.A O no hydrogen 3.345 N/A TYR 158.A N HIS 154.A O no hydrogen 3.034 N/A LYS 159.A N ALA 155.A O no hydrogen 2.961 N/A ALA 160.A N GLU 156.A O no hydrogen 3.052 N/A ASP 161.A N GLU 157.A O no hydrogen 3.012 N/A PHE 162.A N TYR 158.A O no hydrogen 3.264 N/A THR 163.A N LYS 159.A O no hydrogen 2.776 N/A THR 163.A OG1 LYS 159.A O no hydrogen 2.728 N/A GLU 164.A N ALA 160.A O no hydrogen 2.818 N/A CYS 165.A N ASP 161.A O no hydrogen 3.065 N/A CYS 165.A SG ASP 161.A O no hydrogen 3.336 N/A CYS 166.A N PHE 162.A O no hydrogen 3.324 N/A CYS 166.A SG PHE 162.A O no hydrogen 3.074 N/A CYS 170.A SG GLU 164.A OE2 no hydrogen 3.603 N/A LYS 174.A NZ GLU 164.A OE1 no hydrogen 3.106 N/A LYS 174.A NZ GLU 164.A OE2 no hydrogen 3.381 N/A LEU 175.A N LEU 171.A O no hydrogen 3.093 N/A ASP 176.A N ILE 172.A O no hydrogen 2.966 N/A ALA 177.A N PRO 173.A O no hydrogen 3.114 N/A LEU 178.A N LYS 174.A O no hydrogen 3.077 N/A LYS 179.A N LEU 175.A O no hydrogen 3.000 N/A GLU 180.A N ASP 176.A O no hydrogen 3.300 N/A ARG 181.A N ALA 177.A O no hydrogen 3.196 N/A ARG 181.A NE GLU 157.A OE1 no hydrogen 3.350 N/A ARG 181.A NH2 GLU 157.A OE1 no hydrogen 3.247 N/A ILE 182.A N LEU 178.A O no hydrogen 2.851 N/A LEU 183.A N LYS 179.A O no hydrogen 2.928 N/A LEU 184.A N GLU 180.A O no hydrogen 3.012 N/A SER 185.A N ARG 181.A O no hydrogen 2.929 N/A SER 185.A OG GLU 150.A OE2 no hydrogen 3.486 N/A SER 186.A N ILE 182.A O no hydrogen 2.903 N/A SER 186.A OG HIS 143.A ND1 no hydrogen 2.806 N/A ALA 187.A N LEU 183.A O no hydrogen 3.016 N/A LYS 188.A N LEU 184.A O no hydrogen 2.943 N/A GLU 189.A N SER 185.A O no hydrogen 3.141 N/A ARG 190.A N SER 186.A O no hydrogen 2.996 N/A ARG 190.A NE ASP 106.A OD1 no hydrogen 2.596 N/A ARG 190.A NH1 ARG 190.A O no hydrogen 3.339 N/A ARG 190.A NH1 GLN 197.A OE1 no hydrogen 3.219 N/A ARG 190.A NH2 ASP 106.A OD1 no hydrogen 3.270 N/A ARG 190.A NH2 ASP 106.A OD2 no hydrogen 3.108 N/A LEU 191.A N ALA 187.A O no hydrogen 3.211 N/A LYS 192.A N LYS 188.A O no hydrogen 3.333 N/A CYS 193.A N GLU 189.A O no hydrogen 2.996 N/A CYS 193.A SG GLU 189.A O no hydrogen 3.430 N/A SER 194.A N ARG 190.A O no hydrogen 2.753 N/A SER 194.A OG ARG 190.A O no hydrogen 2.972 N/A SER 194.A OG ASN 451.A OD1 no hydrogen 3.423 N/A SER 195.A N LEU 191.A O no hydrogen 2.845 N/A SER 195.A OG LEU 191.A O no hydrogen 2.680 N/A PHE 196.A N LYS 192.A O no hydrogen 3.098 N/A GLN 197.A N CYS 193.A O no hydrogen 2.945 N/A GLN 197.A NE2 TYR 145.A OH no hydrogen 3.478 N/A ASN 198.A N SER 194.A O no hydrogen 2.856 N/A PHE 199.A N SER 195.A O no hydrogen 2.901 N/A GLY 200.A N SER 195.A O no hydrogen 2.913 N/A VAL 204.A N GLY 200.A O no hydrogen 3.405 N/A LYS 205.A N GLU 201.A O no hydrogen 2.984 N/A LYS 205.A NZ GLU 201.A OE1 no hydrogen 3.269 N/A ALA 206.A N ARG 202.A O no hydrogen 2.860 N/A TRP 207.A N ALA 203.A O no hydrogen 3.042 N/A SER 208.A N VAL 204.A O no hydrogen 2.998 N/A SER 208.A OG VAL 204.A O no hydrogen 2.857 N/A VAL 209.A N LYS 205.A O no hydrogen 2.683 N/A ALA 210.A N ALA 206.A O no hydrogen 2.989 N/A ARG 211.A N TRP 207.A O no hydrogen 2.981 N/A ARG 211.A NH1 GLN 214.A OE1 no hydrogen 2.927 N/A ARG 211.A NH1 GLU 288.A OE2 no hydrogen 2.955 N/A ARG 211.A NH2 GLU 288.A OE2 no hydrogen 3.475 N/A LEU 212.A N SER 208.A O no hydrogen 2.825 N/A SER 213.A N VAL 209.A O no hydrogen 2.963 N/A SER 213.A OG VAL 209.A O no hydrogen 2.682 N/A GLN 214.A N ALA 210.A O no hydrogen 3.200 N/A GLN 214.A NE2 HIS 331.A O no hydrogen 3.044 N/A GLN 214.A NE2 TYR 334.A O no hydrogen 2.806 N/A LYS 215.A N ARG 211.A O no hydrogen 3.041 N/A LYS 215.A NZ VAL 286.A O no hydrogen 3.246 N/A PHE 216.A N LEU 212.A O no hydrogen 2.733 N/A LYS 218.A NZ ASP 262.A O no hydrogen 3.492 N/A ALA 219.A N PHE 216.A O no hydrogen 3.099 N/A GLU 223.A N ASP 220.A OD1 no hydrogen 2.877 N/A VAL 224.A N ASP 220.A O no hydrogen 3.002 N/A SER 225.A N PHE 221.A O no hydrogen 2.864 N/A SER 225.A OG PHE 221.A O no hydrogen 2.881 N/A LYS 226.A N ALA 222.A O no hydrogen 2.846 N/A LYS 226.A NZ ASP 230.A OD2 no hydrogen 2.834 N/A ILE 227.A N GLU 223.A O no hydrogen 2.975 N/A VAL 228.A N VAL 224.A O no hydrogen 2.795 N/A THR 229.A N SER 225.A O no hydrogen 2.823 N/A THR 229.A OG1 SER 225.A O no hydrogen 2.827 N/A ASP 230.A N LYS 226.A O no hydrogen 3.049 N/A LEU 231.A N ILE 227.A O no hydrogen 2.740 N/A THR 232.A N VAL 228.A O no hydrogen 2.861 N/A THR 232.A OG1 VAL 228.A O no hydrogen 2.676 N/A LYS 233.A N THR 229.A O no hydrogen 3.290 N/A LYS 233.A NZ GLU 237.A OE2 no hydrogen 2.797 N/A LYS 233.A NZ ASP 249.A OD2 no hydrogen 3.094 N/A VAL 234.A N ASP 230.A O no hydrogen 3.092 N/A HIS 235.A N LEU 231.A O no hydrogen 3.113 N/A LYS 236.A N THR 232.A O no hydrogen 2.927 N/A GLU 237.A N LYS 233.A O no hydrogen 2.968 N/A CYS 238.A N VAL 234.A O no hydrogen 2.906 N/A CYS 239.A N HIS 235.A O no hydrogen 2.850 N/A CYS 239.A SG HIS 235.A O no hydrogen 3.113 N/A HIS 240.A N LYS 236.A O no hydrogen 3.092 N/A HIS 240.A N GLU 237.A O no hydrogen 3.237 N/A GLY 241.A N CYS 238.A O no hydrogen 3.479 N/A ASP 242.A N GLU 237.A O no hydrogen 2.841 N/A GLU 245.A N GLU 245.A OE1 no hydrogen 2.862 N/A CYS 246.A N ASP 242.A O no hydrogen 2.919 N/A CYS 246.A SG VAL 234.A O no hydrogen 3.393 N/A ALA 247.A N LEU 243.A O no hydrogen 2.884 N/A ASP 248.A N LEU 244.A O no hydrogen 2.984 N/A ASP 249.A N GLU 245.A O no hydrogen 2.928 N/A ARG 250.A N CYS 246.A O no hydrogen 2.988 N/A ALA 251.A N ALA 247.A O no hydrogen 3.063 N/A ASP 252.A N ASP 248.A O no hydrogen 3.085 N/A LEU 253.A N ASP 249.A O no hydrogen 3.037 N/A ALA 254.A N ARG 250.A O no hydrogen 3.030 N/A LYS 255.A N ALA 251.A O no hydrogen 3.121 N/A TYR 256.A N ASP 252.A O no hydrogen 3.097 N/A TYR 256.A OH GLU 223.A OE2 no hydrogen 2.590 N/A ILE 257.A N LEU 253.A O no hydrogen 2.909 N/A CYS 258.A N ALA 254.A O no hydrogen 2.893 N/A CYS 258.A SG ALA 254.A O no hydrogen 3.395 N/A GLU 259.A N LYS 255.A O no hydrogen 2.779 N/A HIS 260.A N TYR 256.A O no hydrogen 3.016 N/A HIS 260.A N ILE 257.A O no hydrogen 3.156 N/A HIS 260.A ND1 TYR 256.A O no hydrogen 2.872 N/A ILE 264.A N HIS 260.A O no hydrogen 3.178 N/A ILE 264.A N GLN 261.A O no hydrogen 3.279 N/A SER 265.A N GLN 261.A O no hydrogen 2.937 N/A GLY 266.A N ASP 289.A OD2 no hydrogen 3.023 N/A LYS 267.A N SER 265.A OG no hydrogen 2.996 N/A LEU 268.A N SER 265.A O no hydrogen 3.479 N/A CYS 272.A N LEU 268.A O no hydrogen 2.807 N/A CYS 272.A SG LEU 268.A O no hydrogen 3.252 N/A LYS 279.A N PRO 275.A O no hydrogen 2.755 N/A SER 280.A N LEU 276.A O no hydrogen 3.170 N/A SER 280.A OG LEU 276.A O no hydrogen 3.241 N/A HIS 281.A N LEU 277.A O no hydrogen 3.159 N/A CYS 282.A N GLN 278.A O no hydrogen 2.965 N/A ILE 283.A N LYS 279.A O no hydrogen 3.058 N/A ALA 284.A N SER 280.A O no hydrogen 3.140 N/A GLU 285.A N HIS 281.A O no hydrogen 3.093 N/A VAL 286.A N ILE 283.A O no hydrogen 3.190 N/A ASP 289.A N LYS 215.A O no hydrogen 3.017 N/A ASP 290.A N ASP 289.A OD1 no hydrogen 2.821 N/A PHE 302.A N LEU 298.A O no hydrogen 2.969 N/A ALA 303.A N ALA 299.A O no hydrogen 2.915 N/A GLU 304.A N ALA 299.A O no hydrogen 2.769 N/A GLU 307.A N ASP 305.A OD1 no hydrogen 2.662 N/A HIS 311.A N GLU 307.A O no hydrogen 3.070 N/A TYR 312.A N ILE 308.A O no hydrogen 2.858 N/A TYR 312.A OH GLU 351.A OE1 no hydrogen 2.576 N/A LYS 313.A N CYS 309.A O no hydrogen 3.145 N/A ASP 314.A N LYS 310.A O no hydrogen 2.858 N/A ALA 315.A N HIS 311.A O no hydrogen 2.908 N/A LYS 316.A NZ GLU 347.A OE2 no hydrogen 3.204 N/A PHE 319.A N ALA 315.A O no hydrogen 2.971 N/A LEU 320.A N LYS 316.A O no hydrogen 3.005 N/A GLY 321.A N ASP 317.A O no hydrogen 3.041 N/A THR 322.A N VAL 318.A O no hydrogen 2.888 N/A THR 322.A OG1 VAL 318.A O no hydrogen 2.513 N/A PHE 323.A N PHE 319.A O no hydrogen 3.079 N/A LEU 324.A N LEU 320.A O no hydrogen 2.968 N/A TYR 325.A N GLY 321.A O no hydrogen 2.950 N/A TYR 325.A OH ALA 219.A O no hydrogen 2.533 N/A GLU 326.A N THR 322.A O no hydrogen 2.809 N/A TYR 327.A N PHE 323.A O no hydrogen 2.790 N/A SER 328.A N LEU 324.A O no hydrogen 2.886 N/A SER 328.A OG LEU 324.A O no hydrogen 2.821 N/A ARG 329.A N TYR 325.A O no hydrogen 3.038 N/A ARG 329.A NE PRO 217.A O no hydrogen 2.998 N/A ARG 329.A NH1 GLU 326.A OE1 no hydrogen 2.946 N/A ARG 329.A NH2 PRO 217.A O no hydrogen 2.623 N/A ARG 330.A N GLU 326.A O no hydrogen 3.446 N/A ARG 330.A NH1 PRO 296.A O no hydrogen 3.172 N/A ARG 330.A NH2 PRO 296.A O no hydrogen 3.254 N/A HIS 331.A N SER 328.A O no hydrogen 2.913 N/A ASP 333.A N ASP 333.A OD1 no hydrogen 2.690 N/A TYR 334.A N HIS 331.A O no hydrogen 3.394 N/A SER 335.A OG GLU 443.A OE1 no hydrogen 2.563 N/A VAL 336.A N ASN 444.A OD1 no hydrogen 3.143 N/A SER 337.A OG GLU 443.A OE2 no hydrogen 3.270 N/A LEU 338.A N SER 335.A OG no hydrogen 3.168 N/A LEU 339.A N SER 335.A O no hydrogen 3.220 N/A LEU 340.A N VAL 336.A O no hydrogen 3.002 N/A ARG 341.A N SER 337.A O no hydrogen 2.802 N/A ARG 341.A NH1 GLU 443.A OE1 no hydrogen 3.415 N/A ARG 341.A NH1 GLU 443.A OE2 no hydrogen 2.981 N/A ARG 341.A NH2 SER 337.A OG no hydrogen 3.179 N/A ARG 341.A NH2 GLU 443.A OE2 no hydrogen 3.462 N/A ARG 341.A NH2 ALA 475.A O no hydrogen 2.780 N/A ILE 342.A N LEU 338.A O no hydrogen 2.832 N/A ALA 343.A N LEU 339.A O no hydrogen 2.941 N/A LYS 344.A N LEU 340.A O no hydrogen 3.022 N/A THR 345.A N ARG 341.A O no hydrogen 2.966 N/A THR 345.A OG1 ARG 341.A O no hydrogen 3.311 N/A TYR 346.A N ILE 342.A O no hydrogen 2.878 N/A TYR 346.A OH PHE 302.A O no hydrogen 2.826 N/A GLU 347.A N ALA 343.A O no hydrogen 2.967 N/A ALA 348.A N LYS 344.A O no hydrogen 2.938 N/A THR 349.A N THR 345.A O no hydrogen 3.036 N/A THR 349.A OG1 THR 345.A O no hydrogen 3.025 N/A LEU 350.A N TYR 346.A O no hydrogen 3.271 N/A GLU 351.A N GLU 347.A O no hydrogen 3.150 N/A GLU 351.A N ALA 348.A O no hydrogen 3.291 N/A LYS 352.A N ALA 348.A O no hydrogen 3.064 N/A CYS 353.A N THR 349.A O no hydrogen 2.927 N/A CYS 353.A SG THR 349.A O no hydrogen 3.200 N/A CYS 354.A SG LEU 350.A O no hydrogen 3.025 N/A GLU 356.A N CYS 353.A O no hydrogen 3.223 N/A CYS 362.A SG GLU 356.A OE1 no hydrogen 3.396 N/A CYS 362.A SG GLU 356.A OE2 no hydrogen 3.658 N/A TYR 363.A N PRO 359.A O no hydrogen 2.821 N/A TYR 363.A OH ASP 305.A O no hydrogen 2.750 N/A ARG 364.A N PRO 360.A O no hydrogen 2.946 N/A VAL 366.A N TYR 363.A O no hydrogen 3.071 N/A ASP 368.A N THR 365.A O no hydrogen 2.996 N/A GLN 369.A N VAL 366.A O no hydrogen 3.183 N/A GLN 369.A NE2 THR 365.A O no hydrogen 3.288 N/A PHE 370.A N PHE 367.A O no hydrogen 3.063 N/A THR 371.A OG1 ASP 368.A O no hydrogen 3.518 N/A VAL 374.A N PHE 370.A O no hydrogen 3.055 N/A GLU 375.A N THR 371.A O no hydrogen 3.099 N/A GLU 376.A N PRO 372.A O no hydrogen 3.190 N/A LYS 378.A N VAL 374.A O no hydrogen 3.403 N/A SER 379.A N GLU 375.A O no hydrogen 3.021 N/A SER 379.A OG GLU 375.A O no hydrogen 2.948 N/A LEU 380.A N GLU 376.A O no hydrogen 3.087 N/A VAL 381.A N PRO 377.A O no hydrogen 3.000 N/A LYS 382.A N LYS 378.A O no hydrogen 3.047 N/A LYS 383.A N SER 379.A O no hydrogen 2.941 N/A ASN 384.A N LEU 380.A O no hydrogen 2.959 N/A CYS 385.A N VAL 381.A O no hydrogen 2.903 N/A ASP 386.A N LYS 382.A O no hydrogen 2.858 N/A LEU 387.A N LYS 383.A O no hydrogen 3.160 N/A PHE 388.A N ASN 384.A O no hydrogen 2.991 N/A GLU 389.A N CYS 385.A O no hydrogen 3.012 N/A GLU 390.A N ASP 386.A O no hydrogen 3.232 N/A GLU 390.A N LEU 387.A O no hydrogen 3.010 N/A VAL 391.A N LEU 387.A O no hydrogen 2.888 N/A GLY 392.A N PHE 388.A O no hydrogen 2.733 N/A PHE 396.A N GLY 392.A O no hydrogen 2.961 N/A GLN 397.A N GLU 393.A O no hydrogen 2.780 N/A GLN 397.A NE2 ARG 421.A O no hydrogen 3.169 N/A ASN 398.A N TYR 394.A O no hydrogen 2.987 N/A ALA 399.A N ASP 395.A O no hydrogen 2.949 N/A LEU 400.A N PHE 396.A O no hydrogen 3.043 N/A ILE 401.A N GLN 397.A O no hydrogen 2.832 N/A VAL 402.A N ASN 398.A O no hydrogen 2.984 N/A ARG 403.A N ALA 399.A O no hydrogen 2.946 N/A ARG 403.A NH1 ASN 384.A OD1 no hydrogen 3.396 N/A ARG 403.A NH2 ASN 384.A OD1 no hydrogen 3.008 N/A TYR 404.A N LEU 400.A O no hydrogen 2.886 N/A THR 405.A N ILE 401.A O no hydrogen 2.887 N/A THR 405.A OG1 ILE 401.A O no hydrogen 2.650 N/A LYS 406.A N VAL 402.A O no hydrogen 2.959 N/A LYS 406.A NZ PRO 530.A O no hydrogen 2.934 N/A LYS 406.A NZ ALA 532.A O no hydrogen 2.714 N/A LYS 407.A N ARG 403.A O no hydrogen 3.321 N/A LYS 407.A NZ PHE 481.A O no hydrogen 2.870 N/A LYS 407.A NZ SER 482.A O no hydrogen 3.262 N/A LYS 407.A NZ LEU 484.A O no hydrogen 2.636 N/A ALA 408.A N TYR 404.A O no hydrogen 3.038 N/A GLN 410.A NE2 ASP 487.A OD2 no hydrogen 2.816 N/A VAL 411.A N ALA 408.A O no hydrogen 3.055 N/A SER 412.A OG THR 415.A OG1 no hydrogen 2.846 N/A THR 413.A OG1 GLU 524.A OE2 no hydrogen 2.539 N/A THR 415.A N SER 412.A OG no hydrogen 3.249 N/A THR 415.A OG1 SER 412.A OG no hydrogen 2.846 N/A LEU 416.A N SER 412.A O no hydrogen 2.903 N/A VAL 417.A N THR 413.A O no hydrogen 2.858 N/A GLU 418.A N PRO 414.A O no hydrogen 2.872 N/A ILE 419.A N THR 415.A O no hydrogen 3.005 N/A GLY 420.A N LEU 416.A O no hydrogen 2.943 N/A ARG 421.A N VAL 417.A O no hydrogen 2.859 N/A ARG 421.A NH2 GLN 515.A OE1 no hydrogen 3.241 N/A ARG 421.A NH2 GLN 519.A OE1 no hydrogen 2.615 N/A THR 422.A N GLU 418.A O no hydrogen 2.894 N/A THR 422.A OG1 GLU 418.A O no hydrogen 3.038 N/A LEU 423.A N ILE 419.A O no hydrogen 2.758 N/A GLY 424.A N GLY 420.A O no hydrogen 2.997 N/A LYS 425.A N ARG 421.A O no hydrogen 3.128 N/A VAL 426.A N THR 422.A O no hydrogen 3.273 N/A VAL 426.A N LEU 423.A O no hydrogen 3.251 N/A SER 428.A OG GLU 393.A OE1 no hydrogen 2.626 N/A ARG 429.A N LYS 425.A O no hydrogen 2.980 N/A CYS 430.A N VAL 426.A O no hydrogen 2.806 N/A CYS 430.A SG VAL 426.A O no hydrogen 3.308 N/A CYS 431.A N GLY 427.A O no hydrogen 2.861 N/A LYS 432.A NZ SER 428.A O no hydrogen 3.384 N/A LEU 433.A N CYS 430.A O no hydrogen 3.226 N/A GLU 437.A N PRO 434.A O no hydrogen 2.832 N/A ARG 438.A NE CYS 431.A O no hydrogen 3.130 N/A ARG 438.A NH2 CYS 431.A O no hydrogen 3.176 N/A CYS 441.A N GLU 437.A O no hydrogen 3.074 N/A SER 442.A N ARG 438.A O no hydrogen 2.680 N/A SER 442.A OG ARG 438.A O no hydrogen 2.785 N/A GLU 443.A N LEU 439.A O no hydrogen 2.938 N/A ASN 444.A N PRO 440.A O no hydrogen 2.961 N/A HIS 445.A N CYS 441.A O no hydrogen 3.055 N/A LEU 446.A N SER 442.A O no hydrogen 2.882 N/A ALA 447.A N GLU 443.A O no hydrogen 2.890 N/A LEU 448.A N ASN 444.A O no hydrogen 3.379 N/A ALA 449.A N HIS 445.A O no hydrogen 3.216 N/A LEU 450.A N LEU 446.A O no hydrogen 2.950 N/A ASN 451.A N ALA 447.A O no hydrogen 3.047 N/A ASN 451.A ND2 SER 194.A OG no hydrogen 3.151 N/A ARG 452.A N LEU 448.A O no hydrogen 3.136 N/A ARG 452.A NE GLU 418.A OE1 no hydrogen 3.078 N/A ARG 452.A NH1 ASP 106.A O no hydrogen 3.192 N/A ARG 452.A NH2 GLU 418.A OE2 no hydrogen 3.229 N/A LEU 453.A N ALA 449.A O no hydrogen 3.204 N/A CYS 454.A N LEU 450.A O no hydrogen 2.886 N/A CYS 454.A SG LEU 450.A O no hydrogen 3.290 N/A VAL 455.A N ASN 451.A O no hydrogen 2.760 N/A LEU 456.A N ARG 452.A O no hydrogen 3.022 N/A HIS 457.A N LEU 453.A O no hydrogen 2.978 N/A GLU 458.A N CYS 454.A O no hydrogen 3.041 N/A GLU 458.A N VAL 455.A O no hydrogen 3.187 N/A LYS 459.A NZ ASP 105.A OD1 no hydrogen 2.754 N/A LYS 459.A NZ ASP 105.A OD2 no hydrogen 3.376 N/A THR 460.A N LEU 456.A O no hydrogen 3.042 N/A VAL 462.A N HIS 457.A NE2 no hydrogen 3.273 N/A SER 463.A N HIS 457.A NE2 no hydrogen 3.252 N/A ILE 466.A N SER 463.A OG no hydrogen 3.410 N/A THR 467.A N SER 463.A O no hydrogen 3.024 N/A THR 467.A OG1 SER 463.A O no hydrogen 3.284 N/A LYS 468.A N GLU 464.A O no hydrogen 2.981 N/A CYS 469.A N LYS 465.A O no hydrogen 3.118 N/A CYS 469.A SG LYS 465.A O no hydrogen 3.708 N/A CYS 470.A N ILE 466.A O no hydrogen 2.908 N/A CYS 470.A SG ILE 466.A O no hydrogen 3.209 N/A THR 471.A N THR 467.A O no hydrogen 2.974 N/A THR 471.A N LYS 468.A O no hydrogen 3.260 N/A THR 471.A OG1 THR 467.A O no hydrogen 2.738 N/A ASP 472.A N LYS 468.A O no hydrogen 2.977 N/A GLU 476.A N SER 473.A OG no hydrogen 3.211 N/A ARG 477.A N LEU 474.A O no hydrogen 3.381 N/A ARG 477.A NH1 ASN 451.A OD1 no hydrogen 2.872 N/A ARG 477.A NH2 CYS 470.A O no hydrogen 2.763 N/A ARG 478.A NE GLU 443.A OE2 no hydrogen 3.258 N/A ARG 478.A NH1 GLU 376.A OE2 no hydrogen 3.036 N/A ARG 478.A NH1 SER 482.A OG no hydrogen 2.816 N/A ARG 478.A NH2 GLU 376.A OE1 no hydrogen 2.678 N/A ARG 478.A NH2 GLU 443.A OE2 no hydrogen 3.531 N/A CYS 480.A N GLU 476.A O no hydrogen 2.857 N/A PHE 481.A N ARG 477.A O no hydrogen 3.007 N/A SER 482.A N ARG 478.A O no hydrogen 2.923 N/A SER 482.A OG ARG 478.A O no hydrogen 3.341 N/A ALA 483.A N PRO 479.A O no hydrogen 3.026 N/A LEU 484.A N PHE 481.A O no hydrogen 3.186 N/A ASP 487.A N LYS 406.A O no hydrogen 3.269 N/A TYR 490.A N ASP 487.A O no hydrogen 3.271 N/A LYS 493.A N LYS 527.A O no hydrogen 3.143 N/A LYS 493.A NZ GLU 524.A OE1 no hydrogen 3.058 N/A LYS 493.A NZ GLU 524.A OE2 no hydrogen 3.277 N/A THR 499.A N LYS 496.A O no hydrogen 3.091 N/A PHE 500.A N ALA 497.A O no hydrogen 3.019 N/A THR 501.A N GLU 498.A O no hydrogen 3.289 N/A THR 501.A OG1 ALA 497.A O no hydrogen 2.635 N/A ALA 504.A N GLU 558.A OE1 no hydrogen 3.030 N/A ILE 506.A N HIS 503.A O no hydrogen 3.327 N/A CYS 507.A N ALA 504.A O no hydrogen 3.213 N/A CYS 507.A SG ALA 504.A O no hydrogen 3.397 N/A THR 508.A OG1 ASP 505.A O no hydrogen 3.038 N/A LEU 509.A N ILE 506.A O no hydrogen 3.185 N/A GLU 513.A N PRO 510.A O no hydrogen 2.983 N/A LYS 514.A N PRO 510.A O no hydrogen 3.066 N/A GLN 515.A N GLU 511.A O no hydrogen 3.037 N/A ILE 516.A N ASP 512.A O no hydrogen 3.126 N/A LYS 517.A N GLU 513.A O no hydrogen 3.268 N/A LYS 518.A N LYS 514.A O no hydrogen 3.139 N/A LYS 518.A NZ TYR 394.A OH no hydrogen 3.109 N/A LYS 518.A NZ SER 545.A OG no hydrogen 2.687 N/A GLN 519.A N GLN 515.A O no hydrogen 2.720 N/A GLN 519.A NE2 GLN 397.A OE1 no hydrogen 3.162 N/A GLN 519.A NE2 ASN 398.A OD1 no hydrogen 3.001 N/A SER 520.A N ILE 516.A O no hydrogen 2.772 N/A SER 520.A OG ILE 516.A O no hydrogen 2.720 N/A ALA 521.A N LYS 517.A O no hydrogen 3.153 N/A LEU 522.A N LYS 518.A O no hydrogen 2.872 N/A ALA 523.A N GLN 519.A O no hydrogen 2.965 N/A GLU 524.A N SER 520.A O no hydrogen 3.011 N/A LEU 525.A N ALA 521.A O no hydrogen 2.738 N/A VAL 526.A N LEU 522.A O no hydrogen 3.170 N/A LYS 527.A N ALA 523.A O no hydrogen 3.017 N/A LYS 527.A NZ VAL 411.A O no hydrogen 2.805 N/A LYS 527.A NZ THR 413.A OG1 no hydrogen 2.901 N/A HIS 528.A N GLU 524.A O no hydrogen 3.078 N/A HIS 528.A ND1 LYS 493.A O no hydrogen 2.753 N/A LYS 529.A N LEU 525.A O no hydrogen 2.978 N/A ALA 532.A N LYS 529.A O no hydrogen 3.250 N/A THR 533.A N GLN 536.A OE1 no hydrogen 2.878 N/A THR 533.A OG1 GLU 535.A OE1 no hydrogen 3.457 N/A THR 533.A OG1 GLN 536.A OE1 no hydrogen 3.305 N/A GLN 536.A N THR 533.A OG1 no hydrogen 3.023 N/A GLN 536.A NE2 ALA 575.A O no hydrogen 2.720 N/A GLN 536.A NE2 ALA 577.A O no hydrogen 2.874 N/A LEU 537.A N THR 533.A O no hydrogen 3.093 N/A LYS 538.A N LYS 534.A O no hydrogen 2.950 N/A THR 539.A N GLU 535.A O no hydrogen 3.284 N/A THR 539.A OG1 GLU 535.A O no hydrogen 3.357 N/A VAL 540.A N GLN 536.A O no hydrogen 3.053 N/A LEU 541.A N LEU 537.A O no hydrogen 2.860 N/A GLY 542.A N LYS 538.A O no hydrogen 2.826 N/A ASN 543.A N THR 539.A O no hydrogen 2.981 N/A PHE 544.A N VAL 540.A O no hydrogen 3.073 N/A SER 545.A N LEU 541.A O no hydrogen 2.866 N/A SER 545.A OG LEU 541.A O no hydrogen 3.400 N/A ALA 546.A N GLY 542.A O no hydrogen 2.989 N/A PHE 547.A N ASN 543.A O no hydrogen 3.090 N/A VAL 548.A N PHE 544.A O no hydrogen 2.933 N/A ALA 549.A N SER 545.A O no hydrogen 2.995 N/A LYS 550.A N ALA 546.A O no hydrogen 2.907 N/A LYS 550.A NZ GLU 564.A OE1 no hydrogen 3.396 N/A CYS 551.A N PHE 547.A O no hydrogen 3.148 N/A CYS 551.A SG PHE 547.A O no hydrogen 3.662 N/A CYS 552.A N VAL 548.A O no hydrogen 2.994 N/A CYS 552.A SG VAL 548.A O no hydrogen 3.239 N/A GLY 553.A N ALA 549.A O no hydrogen 3.223 N/A GLY 553.A N LYS 550.A O no hydrogen 3.086 N/A ALA 554.A N CYS 551.A O no hydrogen 3.354 N/A LYS 557.A NZ CYS 552.A O no hydrogen 2.933 N/A LYS 557.A NZ ALA 554.A O no hydrogen 3.165 N/A PHE 561.A N LYS 557.A O no hydrogen 3.182 N/A ALA 562.A N GLU 558.A O no hydrogen 2.856 N/A GLU 563.A N ALA 559.A O no hydrogen 2.949 N/A GLU 564.A N CYS 560.A O no hydrogen 2.894 N/A GLY 565.A N PHE 561.A O no hydrogen 2.892 N/A LEU 568.A N GLU 564.A O no hydrogen 3.402 N/A VAL 569.A N GLY 565.A O no hydrogen 2.954 N/A ALA 570.A N PRO 566.A O no hydrogen 3.089 N/A SER 571.A N LYS 567.A O no hydrogen 2.952 N/A SER 571.A OG LYS 567.A O no hydrogen 3.011 N/A SER 571.A OG LEU 568.A O no hydrogen 3.277 N/A SER 572.A N LEU 568.A O no hydrogen 2.983 N/A SER 572.A OG LEU 568.A O no hydrogen 2.695 N/A ALA 575.A N SER 571.A O no hydrogen 3.310 N/A LEU 576.A N GLN 573.A O no hydrogen 3.145 N/A