Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 2wu8_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): THR 4.A N ASP 2.A OD1 no hydrogen 2.933 N/A ALA 5.A N ASP 2.A O no hydrogen 2.966 N/A THR 6.A N ILE 3.A O no hydrogen 3.379 N/A THR 6.A OG1 ILE 3.A O no hydrogen 2.944 N/A TRP 9.A N THR 6.A OG1 no hydrogen 3.343 N/A ASP 10.A N THR 6.A O no hydrogen 3.176 N/A ALA 11.A N PRO 7.A O no hydrogen 2.785 N/A LEU 12.A N ALA 8.A O no hydrogen 3.108 N/A ALA 13.A N TRP 9.A O no hydrogen 2.971 N/A ARG 14.A N ASP 10.A O no hydrogen 2.914 N/A ARG 14.A NE ASP 10.A OD2 no hydrogen 3.180 N/A HIS 15.A N ALA 11.A O no hydrogen 2.942 N/A HIS 15.A NE2 THR 58.A OG1 no hydrogen 2.642 N/A HIS 16.A N LEU 12.A O no hydrogen 2.864 N/A ASP 17.A N ALA 13.A O no hydrogen 2.983 N/A GLN 18.A N ARG 14.A O no hydrogen 3.335 N/A GLN 18.A N HIS 15.A O no hydrogen 2.956 N/A ILE 19.A N HIS 15.A O no hydrogen 3.067 N/A GLY 20.A N HIS 16.A O no hydrogen 2.868 N/A THR 22.A N ILE 19.A O no hydrogen 3.000 N/A THR 22.A OG1 ILE 19.A O no hydrogen 3.248 N/A HIS 23.A NE2 PRO 458.A O no hydrogen 2.908 N/A LEU 24.A N ASN 460.A OD1 no hydrogen 2.976 N/A ARG 25.A N HIS 23.A ND1 no hydrogen 3.010 N/A ARG 25.A NE PHE 435.A O no hydrogen 2.743 N/A ARG 25.A NH1 GLU 441.A OE2 no hydrogen 2.972 N/A ARG 25.A NH2 PHE 435.A O no hydrogen 3.145 N/A ARG 25.A NH2 GLY 436.A O no hydrogen 3.134 N/A ARG 25.A NH2 GLU 441.A OE1 no hydrogen 3.000 N/A ARG 25.A NH2 GLU 441.A OE2 no hydrogen 3.570 N/A GLN 26.A N HIS 23.A O no hydrogen 2.918 N/A PHE 27.A N HIS 23.A O no hydrogen 3.020 N/A PHE 28.A N LEU 24.A O no hydrogen 2.969 N/A ALA 29.A N ARG 25.A O no hydrogen 3.064 N/A ASP 30.A N GLN 26.A O no hydrogen 2.924 N/A ASP 31.A N PHE 28.A O no hydrogen 3.182 N/A ARG 34.A N ASP 31.A O no hydrogen 3.095 N/A ARG 34.A NE SER 50.A O no hydrogen 2.992 N/A ARG 34.A NH1 VAL 54.A O no hydrogen 3.161 N/A ARG 34.A NH2 SER 50.A O no hydrogen 2.817 N/A ARG 34.A NH2 VAL 54.A O no hydrogen 3.032 N/A ARG 36.A N GLY 33.A O no hydrogen 2.992 N/A GLU 37.A N GLY 33.A O no hydrogen 2.958 N/A LEU 38.A N ARG 34.A O no hydrogen 2.815 N/A THR 39.A OG1 ARG 36.A O no hydrogen 2.896 N/A VAL 40.A N ILE 47.A O no hydrogen 2.775 N/A VAL 42.A N LEU 45.A O no hydrogen 2.933 N/A ASP 44.A N GLN 478.A OE1 no hydrogen 2.854 N/A LEU 45.A N VAL 42.A O no hydrogen 2.850 N/A TYR 46.A N LEU 467.A O no hydrogen 2.945 N/A ILE 47.A N VAL 40.A O no hydrogen 2.871 N/A ASP 48.A N SER 465.A O no hydrogen 2.866 N/A TYR 49.A N LEU 38.A O no hydrogen 3.019 N/A SER 50.A N ASP 48.A OD1 no hydrogen 2.774 N/A SER 50.A OG ASP 48.A OD1 no hydrogen 2.731 N/A LYS 51.A NZ THR 430.A OG1 no hydrogen 3.167 N/A HIS 52.A ND1 TYR 49.A O no hydrogen 3.263 N/A ARG 53.A N TYR 320.A OH no hydrogen 2.795 N/A ARG 53.A NE ASN 460.A O no hydrogen 3.231 N/A ARG 53.A NH2 ASN 460.A O no hydrogen 3.103 N/A VAL 54.A N HIS 52.A O no hydrogen 2.752 N/A THR 55.A N THR 58.A OG1 no hydrogen 2.790 N/A THR 55.A OG1 THR 58.A OG1 no hydrogen 3.152 N/A ARG 56.A NE ASP 31.A OD2 no hydrogen 2.737 N/A ARG 56.A NH1 GLU 37.A OE1 no hydrogen 3.231 N/A ARG 56.A NH2 ASP 31.A OD1 no hydrogen 2.912 N/A ARG 56.A NH2 ASP 31.A OD2 no hydrogen 3.483 N/A ARG 56.A NH2 GLU 37.A OE1 no hydrogen 2.745 N/A THR 58.A N THR 55.A OG1 no hydrogen 2.964 N/A THR 58.A OG1 HIS 15.A NE2 no hydrogen 2.642 N/A THR 58.A OG1 THR 55.A OG1 no hydrogen 3.152 N/A LEU 59.A N THR 55.A O no hydrogen 3.273 N/A ALA 60.A N ARG 56.A O no hydrogen 3.186 N/A LEU 61.A N GLU 57.A O no hydrogen 2.948 N/A LEU 62.A N THR 58.A O no hydrogen 2.806 N/A ILE 63.A N LEU 59.A O no hydrogen 2.910 N/A ASP 64.A N ALA 60.A O no hydrogen 2.823 N/A LEU 65.A N LEU 61.A O no hydrogen 3.057 N/A ALA 66.A N LEU 62.A O no hydrogen 3.062 N/A ARG 67.A N ILE 63.A O no hydrogen 2.946 N/A ARG 67.A NH1 GLU 306.A OE1 no hydrogen 3.393 N/A ARG 67.A NH2 GLU 306.A OE1 no hydrogen 3.220 N/A ARG 67.A NH2 GLU 306.A OE2 no hydrogen 3.276 N/A THR 68.A N ASP 64.A O no hydrogen 2.977 N/A THR 68.A OG1 LEU 65.A O no hydrogen 3.071 N/A ALA 69.A N LEU 65.A O no hydrogen 3.057 N/A ALA 69.A N ALA 66.A O no hydrogen 3.054 N/A HIS 70.A N ARG 67.A O no hydrogen 2.848 N/A LEU 71.A N ALA 66.A O no hydrogen 3.208 N/A ARG 74.A N HIS 70.A O no hydrogen 3.040 N/A ARG 75.A N LEU 71.A O no hydrogen 2.793 N/A ARG 75.A NE ASP 76.A OD1 no hydrogen 3.060 N/A ARG 75.A NH1 PHE 300.A O no hydrogen 3.057 N/A ARG 75.A NH2 ASP 76.A OD1 no hydrogen 3.012 N/A ASP 76.A N GLU 72.A O no hydrogen 3.020 N/A GLN 77.A N GLU 73.A O no hydrogen 2.852 N/A MET 78.A N ARG 74.A O no hydrogen 2.920 N/A MET 78.A N ARG 75.A O no hydrogen 3.109 N/A PHE 79.A N ARG 75.A O no hydrogen 3.187 N/A ALA 80.A N ASP 76.A O no hydrogen 2.938 N/A GLY 81.A N GLN 77.A O no hydrogen 3.164 N/A GLY 81.A N MET 78.A O no hydrogen 3.049 N/A VAL 82.A N GLN 77.A O no hydrogen 3.032 N/A HIS 83.A ND1 ASP 89.A O no hydrogen 2.835 N/A HIS 83.A NE2 ASP 108.A OD2 no hydrogen 2.697 N/A ILE 84.A N VAL 82.A O no hydrogen 2.927 N/A ASN 85.A N ARG 90.A O no hydrogen 3.277 N/A THR 86.A OG1 ALA 359.A O no hydrogen 3.237 N/A SER 87.A N ASP 497.A OD2 no hydrogen 3.285 N/A SER 87.A OG ASP 497.A OD2 no hydrogen 3.301 N/A SER 87.A OG ASP 500.A OD2 no hydrogen 2.550 N/A GLU 88.A N ASN 85.A O no hydrogen 3.342 N/A ASP 89.A N THR 86.A O no hydrogen 3.213 N/A ARG 90.A N ASN 85.A O no hydrogen 3.156 N/A LEU 93.A N TRP 262.A O no hydrogen 2.892 N/A THR 95.A OG1 ASP 297.A OD2 no hydrogen 3.160 N/A ALA 96.A N LEU 93.A O no hydrogen 2.853 N/A LEU 97.A N HIS 94.A O no hydrogen 2.966 N/A ARG 98.A NE ASP 297.A OD2 no hydrogen 2.672 N/A ARG 98.A NH1 ASP 270.A OD2 no hydrogen 2.873 N/A ARG 98.A NH1 GLU 484.A OE1 no hydrogen 3.200 N/A ARG 98.A NH2 ASP 297.A OD1 no hydrogen 3.015 N/A ARG 98.A NH2 ASP 297.A OD2 no hydrogen 3.465 N/A ARG 98.A NH2 GLU 484.A OE1 no hydrogen 2.964 N/A LEU 99.A N ALA 96.A O no hydrogen 3.350 N/A ARG 101.A NH1 ASP 121.A OD1 no hydrogen 3.114 N/A ALA 103.A N PRO 100.A O no hydrogen 3.038 N/A VAL 107.A N GLN 110.A O no hydrogen 2.844 N/A GLN 110.A N VAL 107.A O no hydrogen 2.881 N/A GLN 110.A NE2 ASP 115.A OD1 no hydrogen 2.944 N/A VAL 112.A N LEU 105.A O no hydrogen 3.345 N/A THR 114.A OG1 ASP 111.A OD1 no hydrogen 2.615 N/A ASP 115.A N ASP 111.A O no hydrogen 3.172 N/A VAL 116.A N VAL 112.A O no hydrogen 2.763 N/A HIS 117.A N VAL 113.A O no hydrogen 3.074 N/A HIS 117.A ND1 VAL 113.A O no hydrogen 3.184 N/A ALA 118.A N THR 114.A O no hydrogen 2.990 N/A VAL 119.A N ASP 115.A O no hydrogen 3.306 N/A LEU 120.A N VAL 116.A O no hydrogen 3.030 N/A ASP 121.A N HIS 117.A O no hydrogen 2.785 N/A ALA 122.A N ALA 118.A O no hydrogen 3.041 N/A MET 123.A N VAL 119.A O no hydrogen 2.836 N/A GLY 124.A N LEU 120.A O no hydrogen 2.814 N/A ALA 125.A N ASP 121.A O no hydrogen 2.835 N/A PHE 126.A N ALA 122.A O no hydrogen 2.966 N/A THR 127.A N MET 123.A O no hydrogen 2.816 N/A ASP 128.A N GLY 124.A O no hydrogen 2.933 N/A ARG 129.A N ALA 125.A O no hydrogen 3.273 N/A LEU 130.A N PHE 126.A O no hydrogen 3.305 N/A ARG 131.A N THR 127.A O no hydrogen 2.974 N/A ARG 131.A NH1 ASP 170.A OD2 no hydrogen 3.036 N/A ARG 131.A NH1 THR 279.A O no hydrogen 3.312 N/A ARG 131.A NH2 ASP 170.A OD2 no hydrogen 3.006 N/A SER 132.A N ASP 128.A O no hydrogen 2.952 N/A SER 132.A OG ASP 128.A O no hydrogen 3.149 N/A SER 132.A OG ARG 129.A O no hydrogen 3.354 N/A GLY 133.A N ARG 129.A O no hydrogen 3.008 N/A GLU 134.A N SER 132.A OG no hydrogen 3.344 N/A TRP 135.A N ARG 129.A O no hydrogen 3.122 N/A TRP 135.A NE1 ARG 234.A O no hydrogen 3.126 N/A GLY 137.A N LYS 141.A O no hydrogen 2.715 N/A ALA 138.A N HIS 235.A NE2 no hydrogen 2.825 N/A SER 144.A N THR 197.A O no hydrogen 2.860 N/A THR 145.A N THR 197.A O no hydrogen 3.248 N/A VAL 146.A N SER 174.A O no hydrogen 2.941 N/A VAL 147.A N LEU 199.A O no hydrogen 2.907 N/A ASN 148.A N ARG 176.A O no hydrogen 2.783 N/A ILE 149.A N ILE 201.A O no hydrogen 2.753 N/A SER 154.A N ILE 151.A O no hydrogen 2.943 N/A SER 154.A OG ALA 203.A O no hydrogen 3.568 N/A ASP 155.A N GLY 152.A O no hydrogen 2.826 N/A LEU 156.A N GLY 152.A O no hydrogen 2.869 N/A VAL 159.A N ASP 155.A O no hydrogen 3.007 N/A MET 160.A N LEU 156.A O no hydrogen 3.050 N/A VAL 161.A N GLY 157.A O no hydrogen 2.915 N/A TYR 162.A N PRO 158.A O no hydrogen 3.106 N/A GLN 163.A N VAL 159.A O no hydrogen 3.097 N/A ALA 164.A N MET 160.A O no hydrogen 2.793 N/A LEU 165.A N VAL 161.A O no hydrogen 3.112 N/A ARG 166.A N GLN 163.A O no hydrogen 3.438 N/A ARG 166.A NH1 ASP 337.A OD1 no hydrogen 3.288 N/A TYR 168.A N LEU 165.A O no hydrogen 2.830 N/A TYR 168.A OH LEU 471.A O no hydrogen 2.668 N/A ALA 169.A N ARG 166.A O no hydrogen 3.034 N/A ASP 170.A N VAL 280.A O no hydrogen 3.296 N/A SER 174.A N SER 144.A O no hydrogen 2.961 N/A ALA 175.A N TYR 162.A OH no hydrogen 3.134 N/A ARG 176.A N VAL 146.A O no hydrogen 2.895 N/A ARG 176.A NH1 THR 189.A O no hydrogen 3.058 N/A ARG 176.A NH1 ASP 192.A OD1 no hydrogen 2.733 N/A ARG 176.A NH2 ASP 192.A OD2 no hydrogen 3.390 N/A VAL 178.A N ASN 148.A O no hydrogen 2.865 N/A SER 179.A N ASP 185.A OD1 no hydrogen 2.815 N/A ASN 180.A N ASP 185.A OD1 no hydrogen 2.795 N/A ASP 182.A N ASN 180.A OD1 no hydrogen 3.057 N/A ALA 184.A N ASP 182.A OD2 no hydrogen 3.040 N/A ASP 185.A N ASP 182.A O no hydrogen 2.997 N/A ILE 187.A N PRO 183.A O no hydrogen 3.055 N/A ALA 188.A N ALA 184.A O no hydrogen 3.040 N/A THR 189.A N ASP 185.A O no hydrogen 3.023 N/A THR 189.A OG1 ASP 185.A O no hydrogen 3.197 N/A THR 189.A OG1 LEU 186.A O no hydrogen 3.250 N/A LEU 190.A N LEU 186.A O no hydrogen 3.005 N/A LEU 193.A N LEU 190.A O no hydrogen 3.223 N/A ALA 196.A N ASP 194.A OD1 no hydrogen 3.023 N/A THR 197.A N ASP 194.A O no hydrogen 3.022 N/A THR 197.A OG1 ASP 194.A O no hydrogen 3.213 N/A THR 198.A N PRO 195.A O no hydrogen 3.419 N/A THR 198.A OG1 ASP 194.A O no hydrogen 2.685 N/A LEU 199.A N THR 145.A O no hydrogen 2.963 N/A PHE 200.A N HIS 235.A O no hydrogen 2.697 N/A ILE 201.A N VAL 147.A O no hydrogen 2.909 N/A VAL 202.A N VAL 237.A O no hydrogen 3.005 N/A ALA 203.A N ILE 149.A O no hydrogen 2.838 N/A SER 204.A N VAL 239.A O no hydrogen 2.880 N/A LYS 205.A NZ ASP 261.A OD2 no hydrogen 3.138 N/A SER 208.A N THR 206.A OG1 no hydrogen 3.098 N/A GLU 211.A N GLU 211.A OE2 no hydrogen 2.704 N/A LEU 213.A N THR 209.A O no hydrogen 2.926 N/A THR 214.A N LEU 210.A O no hydrogen 3.175 N/A THR 214.A OG1 LEU 210.A O no hydrogen 2.539 N/A ASN 215.A N GLU 211.A O no hydrogen 2.762 N/A ASN 215.A ND2 ASN 180.A O no hydrogen 2.826 N/A ALA 216.A N THR 212.A O no hydrogen 2.737 N/A THR 217.A N LEU 213.A O no hydrogen 2.886 N/A ALA 218.A N THR 214.A O no hydrogen 3.194 N/A ALA 219.A N ASN 215.A O no hydrogen 2.994 N/A ARG 220.A N ALA 216.A O no hydrogen 2.932 N/A ARG 220.A NE PHE 249.A O no hydrogen 3.394 N/A ARG 220.A NH2 PHE 249.A O no hydrogen 3.143 N/A ARG 221.A N THR 217.A O no hydrogen 3.037 N/A TRP 222.A N ALA 218.A O no hydrogen 3.091 N/A LEU 223.A N ALA 219.A O no hydrogen 2.881 N/A THR 224.A N ARG 220.A O no hydrogen 2.771 N/A THR 224.A OG1 ARG 220.A O no hydrogen 3.136 N/A ASP 225.A N ARG 221.A O no hydrogen 2.850 N/A ALA 226.A N LEU 223.A O no hydrogen 3.214 N/A LEU 227.A N LEU 223.A O no hydrogen 2.907 N/A GLY 228.A N THR 224.A O no hydrogen 2.717 N/A ALA 231.A N GLY 228.A O no hydrogen 3.347 N/A ARG 234.A N ALA 231.A O no hydrogen 3.203 N/A ARG 234.A NH1 GLY 137.A O no hydrogen 3.186 N/A HIS 235.A N VAL 232.A O no hydrogen 3.066 N/A HIS 235.A ND1 THR 198.A O no hydrogen 2.723 N/A VAL 237.A N PHE 200.A O no hydrogen 2.938 N/A ALA 238.A N ASN 255.A O no hydrogen 3.022 N/A VAL 239.A N VAL 202.A O no hydrogen 3.090 N/A SER 240.A N PHE 257.A O no hydrogen 3.101 N/A SER 240.A OG SER 204.A O no hydrogen 2.768 N/A SER 240.A OG LYS 205.A O no hydrogen 3.471 N/A THR 241.A N LYS 205.A O no hydrogen 3.278 N/A ASN 242.A N SER 240.A OG no hydrogen 3.371 N/A ASN 242.A ND2 THR 206.A O no hydrogen 3.453 N/A LEU 245.A N ASN 242.A O no hydrogen 3.238 N/A LEU 245.A N ASN 242.A OD1 no hydrogen 2.716 N/A VAL 246.A N ASN 242.A O no hydrogen 3.118 N/A ASP 247.A N LYS 243.A O no hydrogen 3.310 N/A PHE 249.A N LEU 245.A O no hydrogen 3.036 N/A PHE 249.A N VAL 246.A O no hydrogen 2.964 N/A ILE 251.A N VAL 246.A O no hydrogen 3.216 N/A ASN 255.A N ASN 252.A O no hydrogen 2.702 N/A PHE 257.A N ALA 238.A O no hydrogen 2.763 N/A TRP 262.A NE1 GLN 110.A OE1 no hydrogen 3.115 N/A VAL 263.A N TRP 260.A O no hydrogen 3.085 N/A ARG 266.A NE SER 352.A OG no hydrogen 2.878 N/A ARG 266.A NH1 GLU 351.A OE1 no hydrogen 2.844 N/A ARG 266.A NH1 GLN 501.A OE1 no hydrogen 2.767 N/A ARG 266.A NH2 SER 498.A O no hydrogen 3.054 N/A ARG 266.A NH2 ASP 500.A O no hydrogen 3.075 N/A ARG 266.A NH2 GLN 501.A OE1 no hydrogen 3.520 N/A TYR 267.A N GLY 264.A O no hydrogen 2.777 N/A TYR 267.A OH SER 352.A OG no hydrogen 2.905 N/A SER 268.A N GLY 265.A O no hydrogen 3.129 N/A SER 268.A OG GLY 265.A O no hydrogen 2.795 N/A ASP 270.A N ASP 270.A OD1 no hydrogen 2.521 N/A SER 271.A N SER 268.A O no hydrogen 2.831 N/A SER 271.A OG SER 268.A O no hydrogen 2.600 N/A ILE 273.A N SER 271.A OG no hydrogen 3.246 N/A GLY 274.A N SER 271.A O no hydrogen 2.863 N/A LEU 275.A N ALA 272.A O no hydrogen 3.009 N/A MET 278.A N GLY 274.A O no hydrogen 3.013 N/A THR 279.A N LEU 275.A O no hydrogen 2.962 N/A THR 279.A OG1 LEU 275.A O no hydrogen 2.870 N/A VAL 280.A N SER 276.A O no hydrogen 3.239 N/A VAL 280.A N LEU 277.A O no hydrogen 3.045 N/A ILE 281.A N LEU 277.A O no hydrogen 2.965 N/A GLY 282.A N MET 278.A O no hydrogen 2.847 N/A ARG 283.A NE ASP 128.A OD2 no hydrogen 2.823 N/A PHE 286.A N GLY 282.A O no hydrogen 2.919 N/A ALA 287.A N ARG 283.A O no hydrogen 2.948 N/A ASP 288.A N ASP 284.A O no hydrogen 3.039 N/A PHE 289.A N ALA 285.A O no hydrogen 2.976 N/A LEU 290.A N PHE 286.A O no hydrogen 3.077 N/A ALA 291.A N ALA 287.A O no hydrogen 2.964 N/A GLY 292.A N ASP 288.A O no hydrogen 3.101 N/A GLY 292.A N PHE 289.A O no hydrogen 3.172 N/A HIS 294.A N LEU 290.A O no hydrogen 3.145 N/A ILE 295.A N ALA 291.A O no hydrogen 2.988 N/A ILE 296.A N GLY 292.A O no hydrogen 3.493 N/A ASP 297.A N PHE 293.A O no hydrogen 2.832 N/A ARG 298.A N HIS 294.A O no hydrogen 2.763 N/A HIS 299.A N ILE 295.A O no hydrogen 3.012 N/A PHE 300.A N ILE 296.A O no hydrogen 2.738 N/A ALA 301.A N ASP 297.A O no hydrogen 2.939 N/A THR 302.A N ARG 298.A O no hydrogen 3.116 N/A THR 302.A OG1 ARG 298.A O no hydrogen 3.014 N/A ALA 303.A N HIS 299.A O no hydrogen 3.031 N/A GLU 306.A N GLU 306.A OE2 no hydrogen 2.983 N/A SER 307.A N PRO 304.A O no hydrogen 2.816 N/A ASN 308.A N LEU 305.A O no hydrogen 3.379 N/A ASN 308.A ND2 PHE 300.A O no hydrogen 2.987 N/A ASN 308.A ND2 ALA 303.A O no hydrogen 2.959 N/A ALA 309.A N HIS 299.A NE2 no hydrogen 2.982 N/A LEU 312.A N ASN 308.A O no hydrogen 2.949 N/A LEU 313.A N ALA 309.A O no hydrogen 3.038 N/A GLY 314.A N PRO 310.A O no hydrogen 2.940 N/A LEU 315.A N VAL 311.A O no hydrogen 2.918 N/A ILE 316.A N LEU 312.A O no hydrogen 2.925 N/A GLY 317.A N LEU 313.A O no hydrogen 2.940 N/A LEU 318.A N GLY 314.A O no hydrogen 3.063 N/A TRP 319.A N LEU 315.A O no hydrogen 2.905 N/A TRP 319.A NE1 ARG 53.A O no hydrogen 2.976 N/A TYR 320.A N ILE 316.A O no hydrogen 3.229 N/A SER 321.A N GLY 317.A O no hydrogen 3.017 N/A SER 321.A OG ALA 326.A O no hydrogen 3.546 N/A ASN 322.A N LEU 318.A O no hydrogen 2.706 N/A ASN 322.A ND2 LEU 318.A O no hydrogen 3.645 N/A PHE 323.A N TRP 319.A O no hydrogen 3.041 N/A PHE 324.A N TYR 320.A O no hydrogen 2.973 N/A ALA 326.A N TYR 320.A O no hydrogen 3.102 N/A ARG 329.A N ILE 371.A O no hydrogen 2.739 N/A ARG 329.A NH1 ASP 398.A OD2 no hydrogen 2.951 N/A THR 330.A N PRO 396.A O no hydrogen 3.086 N/A THR 330.A OG1 TRP 373.A O no hydrogen 2.890 N/A VAL 331.A N TRP 373.A O no hydrogen 3.053 N/A LEU 332.A N ASP 398.A O no hydrogen 2.807 N/A TYR 334.A N ILE 400.A O no hydrogen 2.685 N/A TYR 334.A OH GLN 381.A OE1 no hydrogen 2.720 N/A TYR 334.A OH TYR 385.A OH no hydrogen 2.865 N/A SER 335.A N PRO 333.A O no hydrogen 2.882 N/A LEU 338.A N SER 335.A O no hydrogen 3.138 N/A LEU 338.A N SER 335.A OG no hydrogen 3.309 N/A SER 339.A N ASN 336.A O no hydrogen 3.130 N/A SER 339.A OG ASN 336.A O no hydrogen 3.364 N/A PHE 341.A N LEU 338.A O no hydrogen 2.939 N/A TYR 344.A N ARG 340.A O no hydrogen 3.132 N/A LEU 345.A N PHE 341.A O no hydrogen 2.952 N/A GLN 346.A N PRO 342.A O no hydrogen 2.972 N/A GLN 346.A NE2 PHE 372.A O no hydrogen 2.908 N/A GLN 347.A NE2 GLU 351.A OE1 no hydrogen 3.050 N/A LEU 348.A N TYR 344.A O no hydrogen 3.242 N/A THR 349.A N LEU 345.A O no hydrogen 2.849 N/A THR 349.A OG1 LEU 345.A O no hydrogen 2.730 N/A THR 349.A OG1 GLN 346.A O no hydrogen 3.402 N/A MET 350.A N GLN 346.A O no hydrogen 2.905 N/A GLU 351.A N GLN 347.A O no hydrogen 3.033 N/A SER 352.A OG TYR 267.A OH no hydrogen 2.905 N/A SER 352.A OG LEU 348.A O no hydrogen 2.576 N/A SER 352.A OG SER 498.A O no hydrogen 3.291 N/A ASN 353.A N THR 349.A O no hydrogen 2.906 N/A ASN 353.A ND2 VAL 487.A O no hydrogen 3.090 N/A GLY 354.A N MET 350.A O no hydrogen 2.885 N/A LYS 355.A N ASN 353.A O no hydrogen 2.885 N/A LYS 355.A NZ GLU 351.A O no hydrogen 2.992 N/A LYS 355.A NZ SER 352.A O no hydrogen 2.705 N/A LYS 355.A NZ ASP 497.A O no hydrogen 3.496 N/A LYS 355.A NZ ASP 500.A O no hydrogen 2.831 N/A ARG 358.A N SER 362.A O no hydrogen 2.776 N/A ALA 359.A N GLY 495.A O no hydrogen 2.877 N/A SER 362.A N ASP 360.A OD1 no hydrogen 2.819 N/A SER 362.A OG ASP 360.A OD1 no hydrogen 2.635 N/A SER 362.A OG ASP 360.A OD2 no hydrogen 3.137 N/A VAL 364.A N SER 356.A O no hydrogen 3.163 N/A SER 365.A OG ASP 2.A OD2 no hydrogen 2.626 N/A THR 368.A OG1 ASN 353.A O no hydrogen 3.368 N/A THR 368.A OG1 LYS 355.A O no hydrogen 2.522 N/A GLU 370.A N GLU 370.A OE1 no hydrogen 2.692 N/A ILE 371.A N GLN 327.A O no hydrogen 2.852 N/A TRP 373.A N ARG 329.A O no hydrogen 3.183 N/A TRP 373.A NE1 SER 328.A OG no hydrogen 3.173 N/A GLY 377.A N PRO 333.A O no hydrogen 2.678 N/A ASN 379.A N PRO 376.A O no hydrogen 3.175 N/A GLY 380.A N PRO 376.A O no hydrogen 3.157 N/A HIS 382.A N ASN 379.A O no hydrogen 2.977 N/A ALA 383.A N GLY 380.A O no hydrogen 2.827 N/A PHE 384.A N GLY 380.A O no hydrogen 2.917 N/A TYR 385.A OH TYR 334.A OH no hydrogen 2.865 N/A GLN 386.A NE2 GLN 390.A OE1 no hydrogen 2.879 N/A LEU 387.A N PHE 384.A O no hydrogen 3.097 N/A LEU 388.A N PHE 384.A O no hydrogen 3.326 N/A HIS 389.A N TYR 385.A O no hydrogen 2.768 N/A HIS 389.A NE2 GLN 429.A OE1 no hydrogen 2.824 N/A GLN 390.A N GLN 386.A O no hydrogen 2.845 N/A GLN 390.A NE2 HIS 454.A O no hydrogen 2.769 N/A GLN 390.A NE2 VAL 456.A O no hydrogen 3.044 N/A GLY 391.A N LEU 387.A O no hydrogen 2.725 N/A ALA 397.A N PRO 462.A O no hydrogen 3.082 N/A ASP 398.A N THR 330.A O no hydrogen 2.822 N/A PHE 399.A N THR 464.A O no hydrogen 2.791 N/A ILE 400.A N LEU 332.A O no hydrogen 3.273 N/A GLY 401.A N ILE 466.A O no hydrogen 2.843 N/A ALA 403.A N ALA 468.A O no hydrogen 2.937 N/A GLN 404.A N SER 469.A O no hydrogen 2.962 N/A LEU 409.A N ASP 408.A OD2 no hydrogen 2.770 N/A THR 411.A N THR 415.A O no hydrogen 2.812 N/A THR 411.A OG1 GLU 413.A OE2 no hydrogen 2.700 N/A THR 411.A OG1 THR 415.A O no hydrogen 2.772 N/A GLY 414.A N THR 411.A O no hydrogen 3.151 N/A SER 417.A OG ASP 408.A OD1 no hydrogen 2.403 N/A SER 417.A OG ASP 408.A OD2 no hydrogen 3.491 N/A MET 418.A N LEU 409.A O no hydrogen 2.798 N/A HIS 419.A N ASP 408.A OD2 no hydrogen 3.107 N/A ASP 420.A N SER 417.A OG no hydrogen 3.045 N/A LEU 421.A N SER 417.A O no hydrogen 3.174 N/A LEU 422.A N MET 418.A O no hydrogen 2.951 N/A MET 423.A N HIS 419.A O no hydrogen 2.969 N/A SER 424.A N ASP 420.A O no hydrogen 2.963 N/A SER 424.A OG LEU 421.A O no hydrogen 2.725 N/A ASN 425.A N LEU 422.A O no hydrogen 3.081 N/A PHE 426.A N LEU 422.A O no hydrogen 3.210 N/A PHE 427.A N MET 423.A O no hydrogen 3.033 N/A ALA 428.A N SER 424.A O no hydrogen 3.099 N/A GLN 429.A N ASN 425.A O no hydrogen 2.957 N/A THR 430.A OG1 PHE 427.A O no hydrogen 3.134 N/A GLN 431.A N PHE 427.A O no hydrogen 3.456 N/A VAL 432.A N ALA 428.A O no hydrogen 2.786 N/A LEU 433.A N GLN 429.A O no hydrogen 2.763 N/A ALA 434.A N THR 430.A O no hydrogen 2.961 N/A PHE 435.A N GLN 431.A O no hydrogen 3.121 N/A GLY 436.A N VAL 432.A O no hydrogen 2.941 N/A LYS 437.A N MET 457.A O no hydrogen 2.756 N/A THR 438.A N GLU 441.A OE1 no hydrogen 3.059 N/A GLU 441.A N THR 438.A OG1 no hydrogen 3.185 N/A ILE 442.A N THR 438.A O no hydrogen 2.937 N/A ALA 443.A N ALA 439.A O no hydrogen 2.830 N/A ALA 444.A N GLU 440.A O no hydrogen 3.076 N/A ASP 445.A N ILE 442.A O no hydrogen 2.885 N/A GLY 446.A N ALA 443.A O no hydrogen 3.163 N/A THR 447.A OG1 ILE 442.A O no hydrogen 3.557 N/A THR 447.A OG1 ASP 445.A OD1 no hydrogen 2.899 N/A VAL 451.A N PRO 448.A O no hydrogen 2.968 N/A VAL 452.A N PRO 448.A O no hydrogen 3.214 N/A VAL 452.A N ALA 449.A O no hydrogen 3.238 N/A HIS 454.A N VAL 451.A O no hydrogen 3.028 N/A LYS 455.A N VAL 452.A O no hydrogen 2.858 N/A LYS 455.A NZ THR 447.A OG1 no hydrogen 3.091 N/A VAL 456.A N ALA 453.A O no hydrogen 3.432 N/A MET 457.A N LYS 437.A O no hydrogen 2.990 N/A ASN 460.A N ALA 434.A O no hydrogen 2.752 N/A ASN 460.A ND2 THR 22.A O no hydrogen 3.145 N/A ARG 461.A N LEU 433.A O no hydrogen 3.035 N/A ARG 461.A NE GLY 459.A O no hydrogen 3.146 N/A ARG 461.A NH1 GLY 391.A O no hydrogen 3.177 N/A ARG 461.A NH2 LEU 388.A O no hydrogen 2.901 N/A ARG 461.A NH2 GLY 391.A O no hydrogen 3.156 N/A SER 463.A N LYS 51.A O no hydrogen 2.928 N/A THR 464.A N ALA 397.A O no hydrogen 2.966 N/A SER 465.A N ASP 48.A O no hydrogen 3.000 N/A ILE 466.A N PHE 399.A O no hydrogen 2.694 N/A LEU 467.A N TYR 46.A O no hydrogen 2.753 N/A ALA 468.A N GLY 401.A O no hydrogen 2.798 N/A SER 469.A N ASP 44.A O no hydrogen 2.988 N/A ARG 470.A NH1 GLN 404.A OE1 no hydrogen 2.958 N/A VAL 475.A N THR 472.A OG1 no hydrogen 3.087 N/A LEU 476.A N THR 472.A O no hydrogen 2.910 N/A GLY 477.A N PRO 473.A O no hydrogen 3.030 N/A GLN 478.A N SER 474.A O no hydrogen 2.816 N/A GLN 478.A NE2 ASP 44.A OD2 no hydrogen 2.816 N/A GLN 478.A NE2 SER 474.A OG no hydrogen 2.834 N/A LEU 479.A N VAL 475.A O no hydrogen 2.995 N/A ILE 480.A N LEU 476.A O no hydrogen 3.025 N/A ALA 481.A N GLY 477.A O no hydrogen 3.081 N/A LEU 482.A N GLN 478.A O no hydrogen 2.890 N/A TYR 483.A N LEU 479.A O no hydrogen 3.149 N/A TYR 483.A OH ASP 398.A OD2 no hydrogen 2.494 N/A GLU 484.A N ILE 480.A O no hydrogen 2.872 N/A HIS 485.A N ALA 481.A O no hydrogen 3.021 N/A HIS 485.A NE2 ASP 297.A OD1 no hydrogen 2.689 N/A GLN 486.A N LEU 482.A O no hydrogen 3.212 N/A VAL 487.A N TYR 483.A O no hydrogen 2.953 N/A PHE 488.A N GLU 484.A O no hydrogen 3.098 N/A THR 489.A N HIS 485.A O no hydrogen 2.934 N/A THR 489.A OG1 GLN 486.A O no hydrogen 3.553 N/A GLU 490.A N GLN 486.A O no hydrogen 3.014 N/A GLY 491.A N VAL 487.A O no hydrogen 3.059 N/A VAL 492.A N PHE 488.A O no hydrogen 2.972 N/A VAL 493.A N THR 489.A O no hydrogen 3.072 N/A TRP 494.A N GLU 490.A O no hydrogen 3.084 N/A GLY 495.A N GLY 491.A O no hydrogen 2.821 N/A GLY 495.A N VAL 492.A O no hydrogen 2.938 N/A ILE 496.A N GLY 491.A O no hydrogen 3.184 N/A PHE 499.A N ASP 497.A OD1 no hydrogen 3.064 N/A TRP 502.A NE1 SER 87.A OG no hydrogen 2.763 N/A GLU 505.A N TRP 502.A O no hydrogen 3.240 N/A LYS 508.A N GLU 505.A O no hydrogen 2.905 N/A THR 509.A N GLU 505.A O no hydrogen 3.169 N/A THR 509.A OG1 LEU 506.A O no hydrogen 3.149 N/A GLN 510.A N LEU 506.A O no hydrogen 2.854 N/A ALA 511.A N GLY 507.A O no hydrogen 3.094 N/A LYS 512.A N LYS 508.A O no hydrogen 3.049 N/A ALA 513.A N THR 509.A O no hydrogen 3.093 N/A LEU 514.A N GLN 510.A O no hydrogen 2.974 N/A LEU 515.A N ALA 511.A O no hydrogen 3.104 N/A ILE 518.A N LEU 514.A O no hydrogen 3.221 N/A THR 519.A N PRO 516.A O no hydrogen 3.346 N/A GLY 520.A N PRO 516.A O no hydrogen 2.726 N/A GLN 527.A N ASP 533.A OD1 no hydrogen 2.842 N/A THR 532.A N ASP 529.A OD1 no hydrogen 2.849 N/A ASP 533.A N ASP 529.A O no hydrogen 3.059 N/A GLY 534.A N SER 530.A O no hydrogen 3.004 N/A LEU 535.A N SER 531.A O no hydrogen 2.875 N/A VAL 536.A N THR 532.A O no hydrogen 2.879 N/A ARG 537.A N ASP 533.A O no hydrogen 3.315 N/A ARG 537.A NH2 PRO 524.A O no hydrogen 3.128 N/A ARG 538.A N GLY 534.A O no hydrogen 3.028 N/A TYR 539.A N LEU 535.A O no hydrogen 2.877 N/A ARG 540.A N VAL 536.A O no hydrogen 3.006 N/A ARG 540.A NE VAL 517.A O no hydrogen 2.969 N/A ARG 540.A NH1 GLY 520.A O no hydrogen 3.140 N/A ARG 540.A NH2 VAL 517.A O no hydrogen 3.002 N/A ARG 540.A NH2 GLY 520.A O no hydrogen 2.268 N/A THR 541.A N ARG 537.A O no hydrogen 3.043 N/A THR 541.A OG1 ARG 538.A O no hydrogen 3.333 N/A GLU 542.A N ARG 538.A O no hydrogen 2.964 N/A ARG 543.A N TYR 539.A O no hydrogen 2.890 N/A GLY 544.A N THR 541.A O no hydrogen 3.023 N/A ARG 545.A N ARG 540.A O no hydrogen 3.115 N/A GLU 549.A N ALA 546.A O no hydrogen 2.822 N/A