Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1o0s_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): SER 1.A OG ASP 582.A OD1 no hydrogen 3.168 N/A VAL 2.A N THR 580.A O no hydrogen 2.996 N/A ALA 3.A N GLU 6.A OE1 no hydrogen 2.993 N/A GLU 6.A N ALA 3.A O no hydrogen 2.982 N/A VAL 8.A N ASP 7.A OD1 no hydrogen 2.744 N/A TYR 9.A OH GLU 30.A OE1 no hydrogen 2.726 N/A SER 10.A OG VAL 8.A O no hydrogen 2.812 N/A ASP 17.A N GLU 20.A OE2 no hydrogen 3.019 N/A LYS 19.A N ASP 17.A OD1 no hydrogen 2.948 N/A LYS 19.A NZ GLU 558.A OE2 no hydrogen 3.492 N/A MET 21.A N ASP 17.A O no hydrogen 2.809 N/A ALA 22.A N GLU 18.A O no hydrogen 3.446 N/A LEU 23.A N LYS 19.A O no hydrogen 3.080 N/A TYR 24.A N GLU 20.A O no hydrogen 2.858 N/A LYS 25.A N MET 21.A O no hydrogen 2.944 N/A LYS 25.A NZ ASP 7.A OD2 no hydrogen 2.822 N/A LEU 26.A N ALA 22.A O no hydrogen 2.866 N/A TYR 27.A N LEU 23.A O no hydrogen 3.134 N/A ARG 28.A N TYR 24.A O no hydrogen 2.893 N/A ARG 28.A NH1 TYR 9.A O no hydrogen 2.925 N/A ARG 28.A NH1 SER 10.A OG no hydrogen 3.102 N/A ARG 28.A NH1 TYR 24.A OH no hydrogen 3.189 N/A ARG 28.A NH2 VAL 8.A O no hydrogen 3.172 N/A ARG 28.A NH2 SER 10.A OG no hydrogen 3.394 N/A ARG 31.A N TYR 9.A OH no hydrogen 3.034 N/A ARG 31.A NH1 ILE 577.A O no hydrogen 2.684 N/A THR 33.A OG1 LEU 576.A O no hydrogen 3.417 N/A ARG 37.A NH1 TYR 60.A O no hydrogen 2.890 N/A ARG 37.A NH2 TYR 60.A O no hydrogen 3.425 N/A SER 38.A N LEU 61.A O no hydrogen 3.117 N/A SER 38.A OG GLY 62.A O no hydrogen 2.652 N/A LEU 41.A N ARG 37.A O no hydrogen 3.123 N/A LEU 41.A N SER 38.A O no hydrogen 2.951 N/A LEU 42.A N SER 38.A O no hydrogen 3.078 N/A LYS 43.A N ALA 39.A O no hydrogen 2.890 N/A GLU 44.A N LEU 41.A O no hydrogen 2.945 N/A ARG 46.A NH1 GLU 106.A OE1 no hydrogen 2.996 N/A ARG 46.A NH1 GLU 106.A OE2 no hydrogen 3.343 N/A LEU 47.A N GLU 44.A O no hydrogen 3.001 N/A ASN 48.A N GLU 44.A O no hydrogen 2.876 N/A ASN 48.A ND2 ARG 104.A O no hydrogen 2.887 N/A LYS 49.A NZ GLU 57.A OE1 no hydrogen 2.636 N/A LYS 49.A NZ GLU 574.A O no hydrogen 2.750 N/A GLY 50.A N ASN 48.A OD1 no hydrogen 2.967 N/A GLY 52.A N LYS 49.A O no hydrogen 3.056 N/A PHE 53.A N GLY 50.A O no hydrogen 3.056 N/A SER 54.A N GLU 57.A OE2 no hydrogen 2.978 N/A GLU 57.A N SER 54.A OG no hydrogen 3.147 N/A ARG 58.A N SER 54.A O no hydrogen 2.934 N/A ARG 58.A NE PHE 53.A O no hydrogen 2.886 N/A ARG 58.A NH1 PRO 68.A O no hydrogen 2.836 N/A ARG 58.A NH2 MET 51.A O no hydrogen 3.150 N/A ARG 58.A NH2 PHE 53.A O no hydrogen 3.175 N/A ARG 58.A NH2 ALA 70.A O no hydrogen 2.857 N/A GLN 59.A N LEU 55.A O no hydrogen 3.041 N/A TYR 60.A N TYR 56.A O no hydrogen 3.014 N/A LEU 61.A N GLU 57.A O no hydrogen 3.032 N/A GLY 62.A N GLN 59.A O no hydrogen 3.475 N/A LEU 63.A N ARG 58.A O no hydrogen 2.722 N/A HIS 64.A N ARG 58.A O no hydrogen 2.871 N/A LEU 66.A N LEU 63.A O no hydrogen 2.995 N/A MET 72.A N MET 51.A O no hydrogen 2.865 N/A GLN 74.A NE2 THR 571.A O no hydrogen 2.809 N/A GLN 76.A N THR 73.A OG1 no hydrogen 3.066 N/A GLN 77.A N THR 73.A O no hydrogen 3.050 N/A GLN 77.A NE2 LYS 49.A O no hydrogen 2.815 N/A ALA 78.A N GLN 74.A O no hydrogen 2.861 N/A TYR 79.A N GLU 75.A O no hydrogen 2.988 N/A ARG 80.A N GLN 76.A O no hydrogen 3.139 N/A VAL 81.A N GLN 77.A O no hydrogen 3.032 N/A ILE 82.A N ALA 78.A O no hydrogen 2.861 N/A THR 83.A N TYR 79.A O no hydrogen 2.910 N/A THR 83.A OG1 TYR 79.A O no hydrogen 2.911 N/A LYS 84.A N ARG 80.A O no hydrogen 3.146 N/A LEU 85.A N VAL 81.A O no hydrogen 2.859 N/A ARG 86.A N ILE 82.A O no hydrogen 3.031 N/A ARG 86.A NE GLU 119.A OE1 no hydrogen 3.409 N/A ARG 86.A NE GLU 119.A OE2 no hydrogen 2.928 N/A ARG 86.A NH2 GLU 119.A OE1 no hydrogen 2.671 N/A GLU 87.A N THR 83.A O no hydrogen 3.199 N/A GLU 87.A N LYS 84.A O no hydrogen 3.282 N/A GLN 88.A N LEU 85.A O no hydrogen 3.111 N/A GLN 88.A NE2 GLN 97.A OE1 no hydrogen 2.673 N/A ALA 93.A N ASN 90.A OD1 no hydrogen 3.012 N/A ARG 94.A N ASN 90.A O no hydrogen 3.280 N/A ARG 94.A NE ASP 91.A OD1 no hydrogen 3.015 N/A ARG 94.A NH1 LEU 85.A O no hydrogen 3.081 N/A ARG 94.A NH1 GLN 88.A O no hydrogen 3.139 N/A ARG 94.A NH2 ASP 91.A OD1 no hydrogen 2.834 N/A TYR 95.A N ASP 91.A O no hydrogen 2.875 N/A ILE 96.A N LEU 92.A O no hydrogen 3.034 N/A GLN 97.A N ALA 93.A O no hydrogen 2.975 N/A GLN 97.A NE2 VAL 81.A O no hydrogen 3.423 N/A LEU 98.A N ARG 94.A O no hydrogen 2.893 N/A ASP 99.A N TYR 95.A O no hydrogen 2.870 N/A GLY 100.A N ILE 96.A O no hydrogen 3.086 N/A LEU 101.A N GLN 97.A O no hydrogen 2.960 N/A GLN 102.A N LEU 98.A O no hydrogen 3.033 N/A GLN 102.A NE2 TYR 110.A OH no hydrogen 3.527 N/A ASP 103.A N ASP 99.A O no hydrogen 3.290 N/A ARG 104.A N LEU 101.A O no hydrogen 3.063 N/A ASN 105.A N LEU 101.A O no hydrogen 3.009 N/A ASN 105.A ND2 TYR 573.A OH no hydrogen 2.801 N/A GLU 106.A N PRO 45.A O no hydrogen 2.934 N/A LYS 107.A NZ ASN 570.A O no hydrogen 2.764 N/A LYS 107.A NZ GLU 572.A O no hydrogen 2.764 N/A LYS 107.A NZ GLU 574.A OE1 no hydrogen 2.886 N/A LEU 108.A N ASN 105.A OD1 no hydrogen 2.974 N/A PHE 109.A N ASN 105.A O no hydrogen 2.921 N/A TYR 110.A N GLU 106.A O no hydrogen 3.089 N/A ARG 111.A N LYS 107.A O no hydrogen 2.883 N/A ARG 111.A NE ASP 115.A OD2 no hydrogen 2.645 N/A ARG 111.A NH1 GLN 74.A OE1 no hydrogen 2.697 N/A VAL 112.A N LEU 108.A O no hydrogen 2.821 N/A VAL 113.A N PHE 109.A O no hydrogen 2.960 N/A CYS 114.A N TYR 110.A O no hydrogen 2.815 N/A CYS 114.A SG TYR 110.A O no hydrogen 3.247 N/A CYS 114.A SG ALA 204.A O no hydrogen 3.254 N/A ASP 115.A N ARG 111.A O no hydrogen 2.931 N/A HIS 116.A N VAL 112.A O no hydrogen 3.053 N/A LEU 120.A N HIS 116.A O no hydrogen 2.785 N/A MET 121.A N VAL 117.A O no hydrogen 2.779 N/A ILE 123.A N LEU 120.A O no hydrogen 2.887 N/A VAL 124.A N LEU 120.A O no hydrogen 3.002 N/A TYR 125.A N MET 121.A O no hydrogen 3.042 N/A TYR 125.A OH GLU 270.A OE1 no hydrogen 2.358 N/A THR 126.A OG1 MET 121.A O no hydrogen 3.492 N/A THR 128.A N PRO 122.A O no hydrogen 3.323 N/A THR 128.A OG1 PRO 122.A O no hydrogen 2.650 N/A VAL 129.A N TYR 125.A O no hydrogen 3.356 N/A ALA 132.A N THR 128.A O no hydrogen 2.860 N/A CYS 133.A N VAL 129.A O no hydrogen 3.003 N/A CYS 133.A SG VAL 129.A O no hydrogen 3.255 N/A CYS 133.A SG TYR 190.A O no hydrogen 3.230 N/A GLN 134.A N GLY 130.A O no hydrogen 3.043 N/A ASN 135.A N LEU 131.A O no hydrogen 2.923 N/A ASN 135.A ND2 GLN 134.A OE1 no hydrogen 2.977 N/A PHE 136.A N ALA 132.A O no hydrogen 2.908 N/A GLY 137.A N CYS 133.A O no hydrogen 3.317 N/A ARG 141.A NH1 TYR 95.A OH no hydrogen 3.417 N/A ARG 141.A NH1 ASP 99.A OD1 no hydrogen 2.686 N/A ARG 141.A NH1 ASP 99.A OD2 no hydrogen 2.996 N/A LYS 142.A N ASP 103.A OD2 no hydrogen 3.383 N/A LYS 142.A NZ LYS 43.A O no hydrogen 2.867 N/A LYS 142.A NZ ASP 103.A O no hydrogen 2.656 N/A LYS 144.A NZ ASP 99.A O no hydrogen 3.360 N/A LYS 144.A NZ ASP 99.A OD1 no hydrogen 2.688 N/A LYS 144.A NZ GLN 102.A OE1 no hydrogen 2.605 N/A LEU 146.A N PRO 215.A O no hydrogen 3.073 N/A ILE 148.A N LEU 217.A O no hydrogen 3.061 N/A THR 149.A N ASP 152.A OD2 no hydrogen 3.085 N/A THR 149.A OG1 ASP 152.A OD2 no hydrogen 3.031 N/A ILE 150.A N ASP 219.A O no hydrogen 2.930 N/A ASN 151.A N THR 149.A OG1 no hydrogen 2.985 N/A ASP 152.A N THR 149.A O no hydrogen 2.921 N/A ASN 153.A ND2 ASP 245.A O no hydrogen 3.135 N/A LYS 157.A N SER 154.A OG no hydrogen 2.882 N/A ILE 158.A N SER 154.A O no hydrogen 3.103 N/A TYR 159.A N VAL 155.A O no hydrogen 2.775 N/A GLN 160.A N SER 156.A O no hydrogen 2.895 N/A ILE 161.A N LYS 157.A O no hydrogen 3.248 N/A LEU 162.A N ILE 158.A O no hydrogen 2.958 N/A SER 163.A N TYR 159.A O no hydrogen 2.882 N/A SER 163.A OG TYR 159.A O no hydrogen 2.893 N/A ASN 164.A N ILE 161.A O no hydrogen 3.029 N/A TRP 165.A N LEU 162.A O no hydrogen 3.049 N/A ASP 169.A N GLU 167.A OE2 no hydrogen 2.818 N/A ARG 171.A N TRP 212.A O no hydrogen 2.859 N/A ARG 171.A NE ASP 169.A OD1 no hydrogen 3.102 N/A ARG 171.A NH2 ASP 169.A OD2 no hydrogen 2.838 N/A ALA 172.A N TRP 212.A O no hydrogen 2.790 N/A ILE 173.A N LEU 266.A O no hydrogen 2.709 N/A VAL 174.A N LEU 214.A O no hydrogen 3.335 N/A VAL 175.A N GLN 268.A O no hydrogen 2.845 N/A THR 176.A N VAL 216.A O no hydrogen 3.176 N/A THR 176.A OG1 GLU 270.A O no hydrogen 2.642 N/A GLY 178.A N THR 176.A OG1 no hydrogen 3.008 N/A GLU 179.A N ASP 177.A OD1 no hydrogen 3.151 N/A ARG 180.A N ASP 271.A O no hydrogen 2.930 N/A ARG 180.A NE ARG 180.A O no hydrogen 2.785 N/A ARG 180.A NH1 ASN 274.A OD1 no hydrogen 3.008 N/A ARG 180.A NH2 ASP 271.A OD1 no hydrogen 3.277 N/A ARG 180.A NH2 ASP 294.A OD1 no hydrogen 2.989 N/A ILE 181.A N GLY 185.A O no hydrogen 3.010 N/A LEU 182.A N ASP 271.A OD2 no hydrogen 3.084 N/A LEU 184.A N ILE 181.A O no hydrogen 2.761 N/A GLY 185.A N ILE 181.A O no hydrogen 2.955 N/A LEU 187.A N GLY 178.A O no hydrogen 3.158 N/A GLY 188.A N ASP 186.A OD1 no hydrogen 3.044 N/A ALA 189.A N TYR 233.A OH no hydrogen 2.977 N/A TYR 190.A N LEU 187.A O no hydrogen 2.989 N/A TYR 190.A OH PHE 232.A O no hydrogen 2.845 N/A GLY 191.A N GLY 188.A O no hydrogen 2.908 N/A ILE 194.A N GLY 191.A O no hydrogen 2.887 N/A VAL 196.A N ILE 192.A O no hydrogen 3.461 N/A GLY 197.A N GLY 193.A O no hydrogen 2.916 N/A LYS 198.A N ILE 194.A O no hydrogen 2.854 N/A LYS 198.A NZ GLU 270.A OE1 no hydrogen 2.957 N/A LYS 198.A NZ ASP 293.A OD2 no hydrogen 2.653 N/A LEU 199.A N PRO 195.A O no hydrogen 2.923 N/A ALA 200.A N VAL 196.A O no hydrogen 2.997 N/A LEU 201.A N GLY 197.A O no hydrogen 3.209 N/A LEU 201.A N LYS 198.A O no hydrogen 3.038 N/A TYR 202.A N LYS 198.A O no hydrogen 3.041 N/A TYR 202.A OH GLN 268.A OE1 no hydrogen 2.650 N/A VAL 203.A N LEU 199.A O no hydrogen 3.073 N/A ALA 204.A N ALA 200.A O no hydrogen 2.987 N/A LEU 205.A N LEU 201.A O no hydrogen 2.726 N/A GLY 206.A N TYR 202.A O no hydrogen 2.920 N/A GLY 207.A N TYR 202.A O no hydrogen 3.110 N/A GLY 207.A N VAL 203.A O no hydrogen 2.988 N/A VAL 208.A N TYR 202.A O no hydrogen 3.391 N/A GLN 209.A NE2 GLN 567.A O no hydrogen 3.118 N/A TRP 212.A N GLN 209.A O no hydrogen 2.960 N/A CYS 213.A N PRO 210.A O no hydrogen 3.188 N/A CYS 213.A SG GLN 209.A O no hydrogen 3.673 N/A LEU 214.A N ALA 172.A O no hydrogen 2.782 N/A VAL 216.A N VAL 174.A O no hydrogen 2.947 N/A LEU 217.A N LEU 146.A O no hydrogen 2.968 N/A LEU 218.A N THR 176.A O no hydrogen 2.867 N/A ASP 219.A N ILE 148.A O no hydrogen 2.912 N/A GLY 221.A N ASP 219.A OD1 no hydrogen 2.901 N/A THR 222.A N HIS 238.A O no hydrogen 2.876 N/A THR 222.A OG1 ASP 186.A OD1 no hydrogen 2.704 N/A ASN 223.A N ASP 186.A OD2 no hydrogen 3.141 N/A ASN 224.A N THR 222.A OG1 no hydrogen 3.240 N/A ASN 224.A ND2 ASP 186.A O no hydrogen 2.766 N/A LEU 227.A N ASN 224.A O no hydrogen 3.097 N/A LEU 227.A N ASN 224.A OD1 no hydrogen 3.118 N/A LEU 228.A N ASN 224.A O no hydrogen 3.217 N/A ASN 229.A N MET 225.A O no hydrogen 2.952 N/A ASP 230.A N LEU 227.A O no hydrogen 3.078 N/A PHE 232.A N ASP 230.A OD1 no hydrogen 2.790 N/A TYR 233.A N ASP 230.A O no hydrogen 3.172 N/A LEU 236.A N ASP 219.A OD2 no hydrogen 2.921 N/A ARG 237.A NE LEU 228.A O no hydrogen 2.666 N/A HIS 238.A N LEU 236.A O no hydrogen 3.082 N/A HIS 238.A ND1 LYS 239.A O no hydrogen 2.912 N/A ARG 240.A N ASN 223.A OD1 no hydrogen 2.977 N/A ARG 240.A NE ASP 186.A OD2 no hydrogen 2.660 N/A ARG 240.A NH1 ASP 177.A O no hydrogen 3.259 N/A ARG 240.A NH2 ASP 177.A O no hydrogen 2.926 N/A ARG 240.A NH2 ASP 186.A OD1 no hydrogen 3.066 N/A VAL 241.A N VAL 220.A O no hydrogen 3.082 N/A ARG 242.A NH1 GLU 179.A OE1 no hydrogen 3.389 N/A ARG 242.A NH2 GLU 179.A OE2 no hydrogen 2.589 N/A TYR 246.A N GLY 243.A O no hydrogen 3.275 N/A TYR 246.A OH ASP 177.A OD2 no hydrogen 2.657 N/A ASP 247.A N GLY 243.A O no hydrogen 3.455 N/A THR 248.A N LYS 244.A O no hydrogen 2.682 N/A THR 248.A OG1 LYS 244.A O no hydrogen 2.788 N/A LEU 249.A N ASP 245.A O no hydrogen 2.992 N/A LEU 250.A N TYR 246.A O no hydrogen 3.095 N/A ASP 251.A N ASP 247.A O no hydrogen 3.091 N/A ASN 252.A N THR 248.A O no hydrogen 2.753 N/A ASN 252.A ND2 ASN 153.A OD1 no hydrogen 2.884 N/A PHE 253.A N LEU 249.A O no hydrogen 2.776 N/A MET 254.A N LEU 250.A O no hydrogen 3.060 N/A LYS 255.A N ASP 251.A O no hydrogen 3.038 N/A ALA 256.A N ASN 252.A O no hydrogen 2.888 N/A CYS 257.A N PHE 253.A O no hydrogen 2.888 N/A CYS 257.A SG PHE 253.A O no hydrogen 3.419 N/A THR 258.A N MET 254.A O no hydrogen 3.169 N/A THR 258.A OG1 MET 254.A O no hydrogen 2.749 N/A THR 258.A OG1 LYS 255.A O no hydrogen 2.883 N/A LYS 259.A N LYS 255.A O no hydrogen 2.694 N/A LYS 260.A N ALA 256.A O no hydrogen 2.834 N/A LYS 260.A NZ SER 163.A OG no hydrogen 3.140 N/A LYS 260.A NZ GLU 168.A OE1 no hydrogen 3.443 N/A TYR 261.A N CYS 257.A O no hydrogen 2.853 N/A GLY 262.A N THR 258.A O no hydrogen 2.754 N/A GLN 263.A NE2 LYS 287.A O no hydrogen 3.183 N/A LYS 264.A NZ TYR 261.A O no hydrogen 3.049 N/A THR 265.A N GLY 262.A O no hydrogen 3.044 N/A THR 265.A OG1 GLY 262.A O no hydrogen 2.643 N/A LEU 266.A N ARG 171.A O no hydrogen 2.952 N/A ILE 267.A N THR 289.A O no hydrogen 2.921 N/A GLN 268.A N ILE 173.A O no hydrogen 2.706 N/A GLN 268.A NE2 PHE 269.A O no hydrogen 2.876 N/A GLN 268.A NE2 GLU 270.A OE2 no hydrogen 2.903 N/A PHE 269.A N PHE 291.A O no hydrogen 3.062 N/A GLU 270.A N VAL 175.A O no hydrogen 2.854 N/A ASP 271.A N ASP 294.A OD2 no hydrogen 2.800 N/A ASN 276.A ND2 TYR 246.A OH no hydrogen 2.920 N/A ALA 277.A N ALA 273.A O no hydrogen 2.672 N/A PHE 278.A N ASN 274.A O no hydrogen 3.039 N/A ARG 279.A N PRO 275.A O no hydrogen 3.026 N/A ARG 279.A NH1 ASN 276.A OD1 no hydrogen 2.603 N/A LEU 280.A N ASN 276.A O no hydrogen 2.919 N/A LEU 281.A N ALA 277.A O no hydrogen 3.067 N/A ASP 282.A N PHE 278.A O no hydrogen 3.068 N/A LYS 283.A N ARG 279.A O no hydrogen 3.008 N/A LYS 283.A NZ ASP 251.A OD1 no hydrogen 3.117 N/A LYS 283.A NZ ASP 251.A OD2 no hydrogen 3.079 N/A TYR 284.A N LEU 280.A O no hydrogen 2.994 N/A TYR 284.A OH ASP 251.A OD1 no hydrogen 2.498 N/A GLN 285.A N LEU 281.A O no hydrogen 2.869 N/A LYS 287.A N TYR 284.A O no hydrogen 2.757 N/A LYS 287.A NZ LYS 283.A O no hydrogen 3.046 N/A TYR 288.A N TYR 284.A O no hydrogen 2.911 N/A THR 289.A OG1 GLN 263.A O no hydrogen 3.537 N/A THR 289.A OG1 ARG 495.A O no hydrogen 3.059 N/A ASN 292.A N GLN 296.A OE1 no hydrogen 2.694 N/A ILE 295.A N ASN 292.A OD1 no hydrogen 3.197 N/A GLN 296.A N ASN 292.A O no hydrogen 2.859 N/A THR 298.A N ASP 293.A O no hydrogen 3.012 N/A THR 298.A OG1 ASP 294.A O no hydrogen 2.615 N/A ALA 299.A N ILE 295.A O no hydrogen 3.182 N/A SER 300.A N GLN 296.A O no hydrogen 3.091 N/A SER 300.A OG PHE 502.A O no hydrogen 3.134 N/A VAL 301.A N GLY 297.A O no hydrogen 2.978 N/A ILE 302.A N THR 298.A O no hydrogen 3.175 N/A VAL 303.A N ALA 299.A O no hydrogen 3.172 N/A ALA 304.A N SER 300.A O no hydrogen 3.033 N/A GLY 305.A N VAL 301.A O no hydrogen 3.108 N/A LEU 306.A N ILE 302.A O no hydrogen 2.890 N/A LEU 307.A N VAL 303.A O no hydrogen 2.788 N/A THR 308.A N ALA 304.A O no hydrogen 3.038 N/A THR 308.A OG1 ALA 304.A O no hydrogen 3.064 N/A THR 308.A OG1 VAL 523.A O no hydrogen 3.435 N/A CYS 309.A N GLY 305.A O no hydrogen 2.996 N/A CYS 309.A SG GLY 305.A O no hydrogen 3.530 N/A THR 310.A N LEU 306.A O no hydrogen 3.040 N/A THR 310.A OG1 LYS 315.A O no hydrogen 3.246 N/A ARG 311.A N THR 308.A O no hydrogen 2.949 N/A ARG 311.A NH1 VAL 513.A O no hydrogen 3.185 N/A ARG 311.A NH2 VAL 513.A O no hydrogen 3.038 N/A VAL 312.A N CYS 309.A O no hydrogen 2.619 N/A THR 313.A N CYS 309.A O no hydrogen 2.987 N/A THR 313.A OG1 LYS 315.A O no hydrogen 3.499 N/A LYS 314.A N THR 310.A O no hydrogen 2.813 N/A LYS 314.A NZ ARG 311.A O no hydrogen 3.132 N/A LYS 315.A N THR 313.A OG1 no hydrogen 3.265 N/A SER 318.A OG GLU 345.A OE1 no hydrogen 2.708 N/A GLN 319.A N LEU 316.A O no hydrogen 2.675 N/A LYS 321.A N GLU 320.A OE2 no hydrogen 3.194 N/A TYR 322.A N ARG 355.A O no hydrogen 2.647 N/A LEU 323.A N ALA 400.A O no hydrogen 2.965 N/A PHE 324.A N TYR 357.A O no hydrogen 2.854 N/A PHE 325.A N ILE 402.A O no hydrogen 2.787 N/A GLY 326.A N MET 359.A O no hydrogen 2.493 N/A SER 331.A OG GLY 326.A O no hydrogen 2.889 N/A THR 332.A N GLY 328.A O no hydrogen 3.278 N/A THR 332.A OG1 ALA 327.A O no hydrogen 3.132 N/A THR 332.A OG1 GLY 328.A O no hydrogen 2.634 N/A THR 332.A OG1 HIS 376.A NE2 no hydrogen 3.120 N/A GLY 333.A N ALA 329.A O no hydrogen 2.945 N/A ILE 334.A N ALA 330.A O no hydrogen 2.883 N/A ALA 335.A N SER 331.A O no hydrogen 2.870 N/A GLU 336.A N THR 332.A O no hydrogen 3.017 N/A MET 337.A N GLY 333.A O no hydrogen 3.030 N/A ILE 338.A N ILE 334.A O no hydrogen 2.899 N/A VAL 339.A N ALA 335.A O no hydrogen 2.902 N/A HIS 340.A N GLU 336.A O no hydrogen 3.031 N/A HIS 340.A NE2 ASP 500.A OD1 no hydrogen 3.125 N/A GLN 341.A N MET 337.A O no hydrogen 3.009 N/A GLN 341.A NE2 GLU 345.A OE2 no hydrogen 3.441 N/A MET 342.A N ILE 338.A O no hydrogen 2.901 N/A GLN 343.A N VAL 339.A O no hydrogen 3.004 N/A ASN 344.A N HIS 340.A O no hydrogen 2.999 N/A GLU 345.A N MET 342.A O no hydrogen 2.894 N/A GLY 346.A N GLN 343.A O no hydrogen 2.741 N/A LYS 349.A NZ GLN 378.A OE1 no hydrogen 3.091 N/A GLU 351.A N SER 348.A OG no hydrogen 3.232 N/A ALA 352.A N SER 348.A O no hydrogen 2.836 N/A CYS 353.A N LYS 349.A O no hydrogen 2.993 N/A CYS 353.A SG LYS 349.A O no hydrogen 3.448 N/A ASN 354.A N GLU 350.A O no hydrogen 3.424 N/A ARG 355.A N ALA 352.A O no hydrogen 3.192 N/A ARG 355.A NH2 GLU 351.A OE2 no hydrogen 2.735 N/A ILE 356.A N CYS 353.A O no hydrogen 2.703 N/A TYR 357.A N TYR 322.A O no hydrogen 2.824 N/A MET 359.A N PHE 324.A O no hydrogen 2.971 N/A ASP 360.A N GLY 363.A O no hydrogen 2.759 N/A ASP 362.A N ASP 360.A OD1 no hydrogen 2.878 N/A GLY 363.A N ASP 360.A O no hydrogen 2.636 N/A LEU 364.A N THR 386.A O no hydrogen 3.002 N/A VAL 365.A N LEU 358.A O no hydrogen 2.882 N/A THR 366.A OG1 GLU 385.A OE2 no hydrogen 2.675 N/A LYS 367.A N LYS 381.A O no hydrogen 2.931 N/A ARG 369.A NH1 ASP 360.A OD1 no hydrogen 2.931 N/A ARG 369.A NH1 ASP 360.A OD2 no hydrogen 2.874 N/A ARG 369.A NH2 ASP 360.A OD1 no hydrogen 3.274 N/A ARG 369.A NH2 GLY 363.A O no hydrogen 3.391 N/A ARG 369.A NH2 LEU 364.A O no hydrogen 2.942 N/A ARG 375.A N ASN 373.A OD1 no hydrogen 2.646 N/A ARG 375.A NE GLU 336.A OE2 no hydrogen 3.012 N/A ARG 375.A NH2 GLU 336.A OE1 no hydrogen 2.578 N/A HIS 376.A N ASN 373.A O no hydrogen 2.700 N/A HIS 376.A NE2 THR 332.A OG1 no hydrogen 3.120 N/A VAL 377.A N PRO 374.A O no hydrogen 2.957 N/A PHE 379.A N HIS 376.A O no hydrogen 2.806 N/A ALA 380.A N HIS 376.A O no hydrogen 2.904 N/A LYS 381.A N VAL 365.A O no hydrogen 3.075 N/A LYS 381.A NZ CYS 353.A O no hydrogen 3.326 N/A LYS 381.A NZ ILE 356.A O no hydrogen 2.773 N/A LYS 381.A NZ PHE 379.A O no hydrogen 2.635 N/A MET 383.A N LYS 381.A O no hydrogen 2.799 N/A THR 386.A OG1 GLU 391.A OE1 no hydrogen 2.595 N/A SER 388.A N THR 386.A OG1 no hydrogen 2.981 N/A GLU 391.A N SER 388.A OG no hydrogen 3.073 N/A VAL 392.A N SER 388.A O no hydrogen 3.067 N/A ILE 393.A N ILE 389.A O no hydrogen 2.820 N/A ARG 394.A N LEU 390.A O no hydrogen 3.030 N/A ALA 395.A N GLU 391.A O no hydrogen 3.077 N/A ALA 396.A N VAL 392.A O no hydrogen 2.983 N/A ARG 397.A N ILE 393.A O no hydrogen 2.431 N/A GLY 399.A N LYS 321.A O no hydrogen 2.872 N/A ALA 400.A N LYS 321.A O no hydrogen 3.252 N/A LEU 401.A N ILE 427.A O no hydrogen 2.589 N/A ILE 402.A N LEU 323.A O no hydrogen 2.868 N/A GLY 403.A N PHE 429.A O no hydrogen 2.651 N/A ALA 404.A N PHE 325.A O no hydrogen 3.062 N/A SER 405.A N GLU 439.A OE2 no hydrogen 2.781 N/A SER 405.A OG GLU 439.A OE2 no hydrogen 3.114 N/A VAL 407.A N SER 405.A O no hydrogen 2.341 N/A ARG 408.A NH1 SER 436.A O no hydrogen 2.790 N/A GLY 409.A N ALA 438.A O no hydrogen 2.924 N/A PHE 411.A N GLU 439.A O no hydrogen 2.747 N/A VAL 415.A N ASN 412.A OD1 no hydrogen 2.947 N/A ILE 416.A N ASN 412.A O no hydrogen 2.909 N/A ARG 417.A N GLU 413.A O no hydrogen 2.724 N/A ARG 417.A NH2 GLU 413.A OE2 no hydrogen 3.301 N/A ALA 418.A N GLU 414.A O no hydrogen 3.035 N/A MET 419.A N VAL 415.A O no hydrogen 3.122 N/A ALA 420.A N ILE 416.A O no hydrogen 2.922 N/A ILE 422.A N ALA 418.A O no hydrogen 3.411 N/A ASN 423.A N MET 419.A O no hydrogen 3.219 N/A ASN 423.A ND2 PRO 398.A O no hydrogen 2.787 N/A ASN 423.A ND2 MET 419.A O no hydrogen 3.312 N/A ARG 425.A NE ALA 452.A O no hydrogen 2.792 N/A ILE 427.A N GLY 399.A O no hydrogen 3.214 N/A ILE 428.A N LEU 454.A O no hydrogen 2.908 N/A PHE 429.A N LEU 401.A O no hydrogen 2.757 N/A ALA 430.A N ALA 456.A O no hydrogen 3.046 N/A LEU 431.A N GLY 403.A O no hydrogen 2.865 N/A SER 432.A N GLU 439.A OE1 no hydrogen 3.429 N/A SER 432.A OG GLU 439.A OE1 no hydrogen 3.539 N/A SER 432.A OG GLU 439.A OE2 no hydrogen 3.033 N/A LYS 437.A N PRO 434.A O no hydrogen 2.798 N/A ALA 438.A N THR 435.A O no hydrogen 2.965 N/A GLU 439.A N GLU 439.A OE1 no hydrogen 2.776 N/A CYS 440.A SG THR 441.A O no hydrogen 3.580 N/A THR 441.A N GLU 444.A OE1 no hydrogen 3.000 N/A GLU 444.A N THR 441.A OG1 no hydrogen 3.232 N/A ALA 445.A N THR 441.A O no hydrogen 3.210 N/A TYR 446.A N ALA 442.A O no hydrogen 2.981 N/A THR 447.A N GLU 443.A O no hydrogen 3.027 N/A THR 447.A OG1 GLU 443.A O no hydrogen 2.687 N/A PHE 448.A N GLU 444.A O no hydrogen 2.985 N/A THR 449.A N TYR 446.A O no hydrogen 3.201 N/A THR 449.A OG1 ALA 445.A O no hydrogen 2.582 N/A THR 449.A OG1 TYR 446.A O no hydrogen 3.178 N/A ASN 450.A N THR 447.A O no hydrogen 3.313 N/A GLY 451.A N TYR 446.A O no hydrogen 2.565 N/A ALA 452.A N THR 449.A OG1 no hydrogen 3.246 N/A ALA 453.A N THR 449.A OG1 no hydrogen 3.176 N/A LEU 454.A N PRO 426.A O no hydrogen 2.535 N/A TYR 455.A OH CYS 440.A O no hydrogen 2.587 N/A ALA 456.A N ILE 428.A O no hydrogen 3.231 N/A SER 457.A N GLY 474.A O no hydrogen 2.973 N/A SER 457.A OG SER 459.A O no hydrogen 2.843 N/A GLY 458.A N ALA 430.A O no hydrogen 3.117 N/A SER 459.A OG ASN 433.A OD1 no hydrogen 2.823 N/A PHE 464.A N TYR 471.A O no hydrogen 2.865 N/A LEU 466.A N HIS 469.A O no hydrogen 3.093 N/A HIS 469.A ND1 ASN 467.A O no hydrogen 3.313 N/A TYR 471.A N PHE 464.A O no hydrogen 2.651 N/A TYR 471.A OH GLY 451.A O no hydrogen 2.889 N/A LYS 472.A N VAL 520.A O no hydrogen 2.871 N/A GLY 476.A N SER 457.A O no hydrogen 2.868 N/A ASN 478.A ND2 ASP 293.A OD2 no hydrogen 2.738 N/A ASN 478.A ND2 THR 298.A OG1 no hydrogen 3.228 N/A ALA 479.A N ASN 477.A OD1 no hydrogen 2.798 N/A TYR 480.A N ASN 477.A O no hydrogen 3.047 N/A TYR 480.A OH PRO 525.A O no hydrogen 2.602 N/A ILE 481.A N ASN 478.A O no hydrogen 2.777 N/A PHE 482.A N ASN 478.A O no hydrogen 3.227 N/A VAL 485.A N ILE 481.A O no hydrogen 3.068 N/A ALA 486.A N PHE 482.A O no hydrogen 2.858 N/A LEU 487.A N PRO 483.A O no hydrogen 2.800 N/A GLY 488.A N GLY 484.A O no hydrogen 3.008 N/A THR 489.A N VAL 485.A O no hydrogen 3.171 N/A THR 489.A OG1 VAL 485.A O no hydrogen 2.472 N/A ILE 490.A N ALA 486.A O no hydrogen 2.887 N/A LEU 491.A N LEU 487.A O no hydrogen 2.951 N/A PHE 492.A N GLY 488.A O no hydrogen 3.190 N/A GLN 493.A N ILE 490.A O no hydrogen 3.069 N/A ILE 494.A N THR 489.A O no hydrogen 3.155 N/A ARG 495.A N THR 550.A O no hydrogen 3.001 N/A ARG 495.A NE ASN 552.A OD1 no hydrogen 3.204 N/A HIS 496.A ND1 TYR 288.A O no hydrogen 2.905 N/A LEU 501.A N ASP 498.A OD1 no hydrogen 3.268 N/A PHE 502.A N ASP 498.A O no hydrogen 3.290 N/A LEU 503.A N ASN 499.A O no hydrogen 2.783 N/A LEU 504.A N ASP 500.A O no hydrogen 2.878 N/A ALA 505.A N LEU 501.A O no hydrogen 2.887 N/A ALA 506.A N PHE 502.A O no hydrogen 2.816 N/A LYS 507.A N LEU 503.A O no hydrogen 2.810 N/A LYS 508.A N LEU 504.A O no hydrogen 3.018 N/A LYS 508.A NZ GLU 540.A OE1 no hydrogen 3.036 N/A VAL 509.A N ALA 505.A O no hydrogen 2.926 N/A ALA 510.A N ALA 506.A O no hydrogen 3.011 N/A SER 511.A N LYS 507.A O no hydrogen 2.995 N/A SER 511.A OG LYS 508.A O no hydrogen 2.886 N/A CYS 512.A N VAL 509.A O no hydrogen 3.105 N/A CYS 512.A SG LYS 508.A O no hydrogen 3.677 N/A VAL 513.A N ALA 510.A O no hydrogen 3.040 N/A SER 517.A N THR 514.A O no hydrogen 3.287 N/A SER 517.A OG THR 514.A O no hydrogen 2.880 N/A LEU 518.A N THR 514.A O no hydrogen 3.029 N/A LYS 519.A N GLU 515.A O no hydrogen 2.950 N/A LYS 519.A NZ ASP 516.A OD1 no hydrogen 3.052 N/A VAL 520.A N SER 517.A O no hydrogen 2.912 N/A GLY 521.A N LEU 518.A O no hydrogen 3.266 N/A ARG 522.A N SER 517.A O no hydrogen 2.873 N/A TYR 524.A OH VAL 301.A O no hydrogen 2.712 N/A GLU 529.A N GLN 526.A O no hydrogen 2.825 N/A ILE 530.A N LEU 527.A O no hydrogen 3.011 N/A ILE 533.A N GLU 529.A O no hydrogen 2.944 N/A SER 534.A N ILE 530.A O no hydrogen 2.664 N/A SER 534.A OG LEU 205.A O no hydrogen 2.909 N/A SER 534.A OG ILE 530.A O no hydrogen 2.748 N/A ILE 535.A N ARG 531.A O no hydrogen 3.148 N/A GLN 536.A N GLU 532.A O no hydrogen 2.998 N/A GLN 536.A NE2 GLU 532.A OE2 no hydrogen 2.521 N/A ILE 537.A N ILE 533.A O no hydrogen 2.832 N/A ALA 538.A N SER 534.A O no hydrogen 2.916 N/A VAL 539.A N ILE 535.A O no hydrogen 3.000 N/A GLU 540.A N GLN 536.A O no hydrogen 3.114 N/A MET 541.A N ILE 537.A O no hydrogen 2.890 N/A ALA 542.A N ALA 538.A O no hydrogen 3.110 N/A LYS 543.A N VAL 539.A O no hydrogen 3.109 N/A TYR 544.A N GLU 540.A O no hydrogen 3.047 N/A CYS 545.A N MET 541.A O no hydrogen 2.774 N/A CYS 545.A SG MET 541.A O no hydrogen 3.099 N/A TYR 546.A N ALA 542.A O no hydrogen 2.752 N/A TYR 546.A OH LEU 553.A O no hydrogen 2.826 N/A LYS 547.A N LYS 543.A O no hydrogen 3.287 N/A ASN 548.A ND2 CYS 545.A O no hydrogen 2.703 N/A ASN 548.A ND2 THR 550.A OG1 no hydrogen 2.780 N/A GLY 549.A N TYR 546.A O no hydrogen 3.316 N/A THR 550.A N CYS 545.A O no hydrogen 2.882 N/A THR 550.A OG1 CYS 545.A O no hydrogen 3.444 N/A ASN 552.A N GLN 493.A O no hydrogen 3.018 N/A LEU 553.A N PHE 492.A O no hydrogen 3.025 N/A ASP 559.A N TYR 27.A OH no hydrogen 2.950 N/A LYS 562.A N ASP 559.A OD1 no hydrogen 2.880 N/A TYR 563.A N ASP 559.A O no hydrogen 2.888 N/A TYR 563.A OH LEU 491.A O no hydrogen 2.941 N/A VAL 564.A N LEU 560.A O no hydrogen 2.973 N/A ARG 565.A N GLU 561.A O no hydrogen 2.916 N/A ARG 565.A NE GLU 561.A OE2 no hydrogen 3.385 N/A ARG 565.A NH1 GLU 532.A OE1 no hydrogen 3.207 N/A ARG 565.A NH2 GLU 532.A OE2 no hydrogen 2.819 N/A ARG 565.A NH2 GLU 561.A OE2 no hydrogen 3.461 N/A ALA 566.A N LYS 562.A O no hydrogen 2.939 N/A ALA 566.A N TYR 563.A O no hydrogen 3.152 N/A GLN 567.A N TYR 563.A O no hydrogen 3.075 N/A GLN 567.A N VAL 564.A O no hydrogen 2.970 N/A VAL 568.A N VAL 564.A O no hydrogen 3.126 N/A TYR 569.A N GLY 207.A O no hydrogen 2.769 N/A GLU 572.A N ASN 570.A OD1 no hydrogen 3.043 N/A TYR 573.A OH GLN 77.A OE1 no hydrogen 2.708 N/A ASP 582.A N VAL 2.A O no hydrogen 2.845 N/A GLN 586.A NE2 GLN 586.A O no hydrogen 3.202 N/A ASP 587.A N PRO 584.A O no hydrogen 2.636 N/A MET 588.A N GLU 585.A O no hydrogen 3.204 N/A ARG 589.A NH2 PRO 593.A O no hydrogen 3.403 N/A