Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3azo_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): SER 2.A N ASP 411.A O no hydrogen 3.035 N/A ALA 4.A N THR 413.A O no hydrogen 3.058 N/A ALA 8.A N PRO 5.A O no hydrogen 2.950 N/A TRP 9.A N ARG 447.A O no hydrogen 3.196 N/A TRP 9.A NE1 ALA 4.A O no hydrogen 3.024 N/A SER 11.A OG SER 446.A OG no hydrogen 2.642 N/A ILE 13.A N SER 11.A OG no hydrogen 3.077 N/A LEU 17.A N ASP 14.A OD1 no hydrogen 3.021 N/A VAL 18.A N ASP 14.A O no hydrogen 3.144 N/A ALA 19.A N ALA 15.A O no hydrogen 2.916 N/A SER 20.A N ALA 16.A O no hydrogen 2.907 N/A ARG 21.A N LEU 17.A O no hydrogen 2.986 N/A ARG 21.A NH1 THR 376.A O no hydrogen 3.352 N/A ARG 21.A NH2 THR 376.A O no hydrogen 3.007 N/A SER 22.A N ALA 19.A O no hydrogen 3.164 N/A SER 22.A OG ALA 19.A O no hydrogen 2.627 N/A ARG 24.A NH1 PRO 25.A O no hydrogen 2.858 N/A ALA 26.A N VAL 38.A O no hydrogen 2.837 N/A VAL 28.A N THR 337.A OG1 no hydrogen 2.906 N/A GLY 29.A N TRP 36.A O no hydrogen 2.766 N/A ALA 30.A N THR 339.A OG1 no hydrogen 2.933 N/A VAL 31.A N GLU 34.A O no hydrogen 2.860 N/A GLU 34.A N VAL 31.A O no hydrogen 2.935 N/A VAL 35.A N ARG 53.A O no hydrogen 2.954 N/A TRP 36.A N GLY 29.A O no hydrogen 2.824 N/A TRP 36.A NE1 GLU 34.A OE1 no hydrogen 2.882 N/A TRP 37.A N VAL 51.A O no hydrogen 3.205 N/A VAL 38.A N ALA 26.A O no hydrogen 2.743 N/A ALA 39.A N THR 49.A O no hydrogen 2.903 N/A ARG 41.A N ARG 47.A O no hydrogen 2.884 N/A ARG 41.A NH1 PRO 40.A O no hydrogen 2.935 N/A GLU 44.A N ARG 41.A O no hydrogen 2.910 N/A ARG 47.A N GLU 44.A O no hydrogen 3.092 N/A ARG 47.A NE GLU 44.A OE1 no hydrogen 2.723 N/A ARG 47.A NH1 LEU 63.A O no hydrogen 3.091 N/A ARG 47.A NH1 TRP 67.A O no hydrogen 2.821 N/A ARG 47.A NH2 GLU 44.A OE1 no hydrogen 2.851 N/A ARG 47.A NH2 LEU 63.A O no hydrogen 2.961 N/A ALA 48.A N ASN 68.A OD1 no hydrogen 2.902 N/A THR 49.A N ALA 39.A O no hydrogen 2.808 N/A THR 49.A OG1 LEU 50.A O no hydrogen 3.521 N/A THR 49.A OG1 SER 61.A OG no hydrogen 2.874 N/A THR 49.A OG1 LEU 63.A O no hydrogen 2.889 N/A VAL 51.A N TRP 37.A O no hydrogen 2.804 N/A ARG 52.A N GLU 60.A O no hydrogen 2.824 N/A ARG 52.A NE GLU 34.A OE1 no hydrogen 2.763 N/A ARG 52.A NH1 ASP 109.A OD1 no hydrogen 2.846 N/A ARG 52.A NH2 GLU 34.A OE1 no hydrogen 3.508 N/A ARG 52.A NH2 GLU 34.A OE2 no hydrogen 2.951 N/A ARG 52.A NH2 ASP 109.A OD1 no hydrogen 3.420 N/A ARG 52.A NH2 ASP 109.A OD2 no hydrogen 2.733 N/A ARG 53.A N VAL 35.A O no hydrogen 2.845 N/A ARG 53.A NE ILE 371.A O no hydrogen 2.942 N/A ARG 54.A N ALA 58.A O no hydrogen 2.691 N/A GLY 57.A N ARG 54.A O no hydrogen 2.820 N/A ALA 58.A N ASP 56.A OD1 no hydrogen 3.087 N/A GLU 60.A N ARG 52.A O no hydrogen 3.186 N/A SER 61.A OG THR 49.A OG1 no hydrogen 2.874 N/A ALA 62.A N LEU 50.A O no hydrogen 2.653 N/A TRP 67.A N PRO 64.A O no hydrogen 3.180 N/A ASN 68.A N HIS 97.A ND1 no hydrogen 3.015 N/A VAL 69.A N ALA 48.A O no hydrogen 2.792 N/A ARG 70.A N THR 96.A O no hydrogen 3.273 N/A ASN 71.A N SER 77.A OG no hydrogen 3.053 N/A ASN 71.A ND2 GLY 78.A O no hydrogen 2.872 N/A ASN 71.A ND2 THR 96.A OG1 no hydrogen 3.125 N/A ARG 72.A N GLN 101.A OE1 no hydrogen 2.749 N/A ARG 72.A NE GLU 75.A OE1 no hydrogen 2.862 N/A ARG 72.A NE GLU 75.A OE2 no hydrogen 3.390 N/A ARG 72.A NH2 GLU 75.A OE1 no hydrogen 3.341 N/A ARG 72.A NH2 GLU 75.A OE2 no hydrogen 3.005 N/A VAL 73.A N ASN 71.A OD1 no hydrogen 3.123 N/A PHE 74.A N GLU 147.A OE2 no hydrogen 3.146 N/A GLU 75.A N ARG 72.A O no hydrogen 2.685 N/A TYR 76.A N VAL 73.A O no hydrogen 3.132 N/A TYR 76.A OH GLU 546.A OE2 no hydrogen 2.551 N/A SER 77.A N VAL 73.A O no hydrogen 2.986 N/A GLY 78.A N ASN 71.A OD1 no hydrogen 2.861 N/A PHE 79.A N PRO 291.A O no hydrogen 2.942 N/A TRP 81.A NE1 CYS 27.A O no hydrogen 2.911 N/A ALA 82.A N VAL 94.A O no hydrogen 3.050 N/A VAL 84.A N LEU 92.A O no hydrogen 3.012 N/A ARG 86.A NE GLY 90.A O no hydrogen 2.737 N/A ARG 86.A NH1 GLY 89.A O no hydrogen 3.250 N/A ARG 86.A NH1 GLY 90.A O no hydrogen 3.152 N/A ARG 86.A NH1 GLU 107.A OE2 no hydrogen 2.595 N/A ARG 86.A NH2 GLU 107.A OE2 no hydrogen 3.194 N/A LEU 92.A N VAL 84.A O no hydrogen 2.975 N/A LEU 93.A N PHE 106.A O no hydrogen 2.997 N/A VAL 94.A N ALA 82.A O no hydrogen 2.968 N/A PHE 95.A N TYR 104.A O no hydrogen 2.838 N/A THR 96.A N PRO 80.A O no hydrogen 2.978 N/A HIS 97.A N ARG 102.A O no hydrogen 2.989 N/A PHE 98.A N ASN 68.A O no hydrogen 2.772 N/A GLN 101.A NE2 PHE 98.A O no hydrogen 2.860 N/A ARG 102.A N ASP 100.A OD2 no hydrogen 2.932 N/A ARG 102.A NE THR 120.A O no hydrogen 2.781 N/A ARG 102.A NH2 THR 120.A O no hydrogen 2.958 N/A ARG 102.A NH2 ALA 171.A O no hydrogen 2.934 N/A LEU 103.A N THR 120.A OG1 no hydrogen 2.974 N/A TYR 104.A N PHE 95.A O no hydrogen 2.709 N/A TYR 104.A OH ASP 100.A OD1 no hydrogen 2.531 N/A ALA 105.A N ARG 117.A O no hydrogen 2.871 N/A PHE 106.A N LEU 93.A O no hydrogen 2.823 N/A ALA 110.A N GLU 107.A O no hydrogen 3.115 N/A GLY 113.A N ALA 110.A O no hydrogen 2.738 N/A ARG 117.A N ALA 105.A O no hydrogen 2.811 N/A ARG 117.A NH1 GLU 107.A OE1 no hydrogen 3.140 N/A ARG 117.A NH2 GLU 107.A OE1 no hydrogen 2.997 N/A LEU 119.A N LEU 103.A O no hydrogen 2.800 N/A VAL 125.A N SER 123.A OG no hydrogen 3.037 N/A GLY 126.A N GLU 152.A OE1 no hydrogen 3.134 N/A GLY 128.A N VAL 125.A O no hydrogen 2.814 N/A ARG 130.A N GLU 147.A O no hydrogen 2.927 N/A ARG 130.A NE GLY 127.A O no hydrogen 2.818 N/A ARG 130.A NH1 GLU 75.A OE2 no hydrogen 3.493 N/A ARG 130.A NH1 GLU 147.A OE1 no hydrogen 3.157 N/A ARG 130.A NH2 GLU 75.A OE2 no hydrogen 3.089 N/A ASP 133.A N PHE 79.A O no hydrogen 2.786 N/A VAL 135.A N TRP 144.A O no hydrogen 2.676 N/A LEU 137.A N GLU 142.A O no hydrogen 2.915 N/A ARG 140.A N LEU 137.A O no hydrogen 2.989 N/A ARG 140.A NH1 GLU 223.A O no hydrogen 3.192 N/A ARG 140.A NH2 GLU 223.A O no hydrogen 3.444 N/A GLY 141.A N PRO 138.A O no hydrogen 3.080 N/A GLU 142.A N LEU 137.A O no hydrogen 3.281 N/A VAL 143.A N VAL 164.A O no hydrogen 2.884 N/A TRP 144.A N VAL 135.A O no hydrogen 2.880 N/A TRP 144.A NE1 GLU 142.A OE1 no hydrogen 2.825 N/A CYS 145.A N ALA 162.A O no hydrogen 2.935 N/A GLU 147.A N ARG 130.A O no hydrogen 2.899 N/A GLU 148.A N ARG 158.A O no hydrogen 2.869 N/A PHE 149.A N GLY 128.A O no hydrogen 2.958 N/A THR 150.A N ASP 156.A O no hydrogen 2.778 N/A GLY 151.A N ASP 156.A O no hydrogen 3.266 N/A GLY 153.A N ASP 156.A OD2 no hydrogen 2.651 N/A SER 155.A OG ASP 544.A OD1 no hydrogen 2.736 N/A ASP 156.A N GLY 153.A O no hydrogen 3.033 N/A ARG 158.A N GLU 148.A O no hydrogen 2.969 N/A ARG 158.A NE ASP 183.A OD1 no hydrogen 2.755 N/A ARG 158.A NH1 GLU 148.A OE1 no hydrogen 2.811 N/A ARG 158.A NH1 GLU 179.A OE2 no hydrogen 2.972 N/A ARG 158.A NH2 GLU 179.A OE1 no hydrogen 3.059 N/A ARG 158.A NH2 ASP 183.A OD1 no hydrogen 3.184 N/A ARG 159.A NE GLU 147.A OE2 no hydrogen 2.724 N/A ARG 159.A NH1 ARG 186.A O no hydrogen 2.802 N/A ARG 159.A NH1 ASP 544.A OD2 no hydrogen 2.930 N/A ARG 159.A NH2 GLU 147.A OE2 no hydrogen 3.492 N/A ARG 159.A NH2 ASP 544.A OD2 no hydrogen 2.948 N/A PHE 160.A N ALA 146.A O no hydrogen 3.200 N/A LEU 161.A N SER 181.A OG no hydrogen 2.999 N/A ALA 162.A N CYS 145.A O no hydrogen 2.702 N/A ALA 163.A N ARG 178.A O no hydrogen 2.809 N/A VAL 164.A N VAL 143.A O no hydrogen 2.828 N/A LEU 166.A N GLY 141.A O no hydrogen 2.900 N/A GLY 168.A N PRO 165.A O no hydrogen 3.404 N/A SER 169.A N ASP 167.A OD2 no hydrogen 2.887 N/A SER 169.A OG ASP 167.A OD2 no hydrogen 2.746 N/A ALA 171.A N GLY 168.A O no hydrogen 3.064 N/A ASP 173.A N ALA 170.A O no hydrogen 3.129 N/A ARG 174.A NE GLU 148.A OE2 no hydrogen 2.745 N/A ARG 174.A NH1 ARG 174.A O no hydrogen 2.918 N/A ARG 174.A NH2 GLU 148.A OE1 no hydrogen 2.897 N/A ARG 174.A NH2 GLU 148.A OE2 no hydrogen 3.386 N/A ARG 174.A NH2 GLU 179.A OE2 no hydrogen 2.838 N/A SER 175.A N ASP 173.A OD1 no hydrogen 3.071 N/A SER 175.A OG ASP 173.A OD1 no hydrogen 2.537 N/A SER 175.A OG ASP 173.A OD2 no hydrogen 3.335 N/A ALA 176.A N ASP 173.A O no hydrogen 2.896 N/A VAL 177.A N ARG 174.A O no hydrogen 3.097 N/A ARG 178.A N ALA 163.A O no hydrogen 2.981 N/A ARG 178.A NE GLU 142.A OE2 no hydrogen 2.857 N/A ARG 178.A NH1 GLY 225.A O no hydrogen 3.055 N/A ARG 178.A NH2 GLU 142.A OE1 no hydrogen 2.975 N/A ARG 178.A NH2 GLY 225.A O no hydrogen 2.882 N/A LEU 180.A N LEU 161.A O no hydrogen 2.791 N/A SER 181.A N LEU 161.A O no hydrogen 3.428 N/A SER 181.A OG ASP 182.A O no hydrogen 2.911 N/A ALA 184.A N ASP 182.A OD1 no hydrogen 2.811 N/A HIS 185.A ND1 ASP 206.A OD1 no hydrogen 2.893 N/A ARG 186.A N ASP 206.A OD2 no hydrogen 2.915 N/A ARG 186.A NH1 SER 155.A O no hydrogen 3.035 N/A ARG 186.A NH1 ASP 544.A OD2 no hydrogen 2.994 N/A PHE 187.A N TRP 205.A O no hydrogen 3.077 N/A THR 189.A N LEU 203.A O no hydrogen 3.082 N/A GLY 190.A N ASP 133.A OD2 no hydrogen 2.685 N/A ARG 192.A N VAL 201.A O no hydrogen 3.006 N/A ARG 192.A NH1 ASP 133.A OD1 no hydrogen 3.185 N/A ARG 192.A NH1 PRO 191.A O no hydrogen 2.996 N/A ARG 192.A NH2 ASP 133.A OD1 no hydrogen 2.748 N/A SER 194.A N GLN 199.A O no hydrogen 2.830 N/A SER 194.A OG ASP 196.A OD1 no hydrogen 2.590 N/A SER 194.A OG GLN 199.A O no hydrogen 3.273 N/A GLY 197.A N SER 194.A O no hydrogen 2.879 N/A ARG 198.A N ASP 196.A OD1 no hydrogen 2.885 N/A GLN 199.A N SER 194.A OG no hydrogen 3.061 N/A GLN 199.A NE2 THR 218.A OG1 no hydrogen 2.929 N/A GLN 199.A NE2 PRO 269.A O no hydrogen 2.887 N/A ALA 200.A N ALA 219.A O no hydrogen 2.985 N/A VAL 201.A N ARG 192.A O no hydrogen 3.051 N/A TRP 202.A N LYS 217.A O no hydrogen 3.114 N/A LEU 203.A N THR 189.A OG1 no hydrogen 2.955 N/A ALA 204.A N GLU 215.A O no hydrogen 2.976 N/A TRP 205.A N PHE 187.A O no hydrogen 3.050 N/A HIS 207.A NE2 ASP 544.A OD1 no hydrogen 2.832 N/A ARG 209.A N ASP 206.A O no hydrogen 3.049 N/A ARG 209.A NH1 GLU 212.A OE1 no hydrogen 2.907 N/A THR 214.A N GLU 239.A O no hydrogen 2.990 N/A THR 214.A OG1 ILE 241.A O no hydrogen 2.774 N/A GLU 215.A N ALA 204.A O no hydrogen 2.955 N/A LEU 216.A N LEU 234.A O no hydrogen 2.784 N/A LYS 217.A N TRP 202.A O no hydrogen 2.746 N/A LYS 217.A NZ HIS 185.A NE2 no hydrogen 3.262 N/A LYS 217.A NZ THR 232.A OG1 no hydrogen 2.818 N/A THR 218.A N ARG 231.A O no hydrogen 2.896 N/A THR 218.A OG1 ALA 200.A O no hydrogen 3.041 N/A ALA 219.A N ALA 200.A O no hydrogen 3.034 N/A ARG 220.A N ALA 228.A O no hydrogen 2.917 N/A VAL 221.A N ARG 198.A O no hydrogen 2.804 N/A THR 222.A N ARG 226.A O no hydrogen 2.822 N/A THR 222.A OG1 ASP 224.A OD2 no hydrogen 2.417 N/A THR 222.A OG1 ARG 226.A O no hydrogen 3.403 N/A GLY 225.A N THR 222.A O no hydrogen 3.126 N/A ARG 226.A N THR 222.A OG1 no hydrogen 2.914 N/A ARG 226.A NE ASP 224.A OD1 no hydrogen 2.817 N/A ARG 226.A NH2 ASP 224.A OD1 no hydrogen 3.279 N/A ALA 228.A N ARG 220.A O no hydrogen 2.830 N/A ARG 231.A N THR 218.A O no hydrogen 2.993 N/A ARG 231.A NH1 ALA 270.A O no hydrogen 3.253 N/A ARG 231.A NH2 PRO 269.A O no hydrogen 3.498 N/A ARG 231.A NH2 ALA 270.A O no hydrogen 3.186 N/A THR 232.A OG1 GLU 215.A OE2 no hydrogen 3.418 N/A LEU 233.A N LEU 216.A O no hydrogen 2.744 N/A GLY 236.A N THR 214.A O no hydrogen 2.972 N/A GLU 239.A N GLY 236.A O no hydrogen 3.347 N/A ALA 240.A N ASP 257.A OD1 no hydrogen 2.890 N/A ILE 241.A N THR 214.A OG1 no hydrogen 2.984 N/A ALA 242.A N ALA 255.A O no hydrogen 2.930 N/A GLN 243.A NE2 GLU 245.A OE1 no hydrogen 2.690 N/A GLN 243.A NE2 PHE 295.A O no hydrogen 2.879 N/A GLU 245.A N ILE 253.A O no hydrogen 2.806 N/A TRP 246.A NE1 ARG 192.A O no hydrogen 2.779 N/A ALA 247.A N SER 251.A O no hydrogen 2.801 N/A GLY 250.A N ALA 247.A O no hydrogen 2.834 N/A SER 251.A N ASP 249.A OD1 no hydrogen 2.881 N/A SER 251.A OG ASP 249.A OD1 no hydrogen 2.696 N/A ILE 253.A N GLU 245.A O no hydrogen 2.838 N/A VAL 254.A N HIS 265.A O no hydrogen 2.978 N/A ALA 255.A N GLN 243.A O no hydrogen 2.968 N/A THR 256.A N ASN 263.A O no hydrogen 3.123 N/A THR 256.A OG1 GLU 239.A OE2 no hydrogen 2.634 N/A ASP 257.A N ALA 240.A O no hydrogen 3.284 N/A ARG 258.A N THR 256.A OG1 no hydrogen 3.329 N/A ARG 258.A NE GLU 239.A OE2 no hydrogen 2.884 N/A ARG 258.A NH2 GLU 239.A OE1 no hydrogen 3.521 N/A ARG 258.A NH2 GLU 239.A OE2 no hydrogen 2.870 N/A THR 259.A OG1 TRP 261.A O no hydrogen 3.250 N/A GLY 260.A N ASP 257.A O no hydrogen 2.791 N/A TRP 262.A N GLU 283.A OE1 no hydrogen 2.680 N/A TRP 262.A NE1 ALA 240.A O no hydrogen 2.889 N/A ASN 263.A N THR 256.A O no hydrogen 2.929 N/A ASN 263.A ND2 TRP 262.A O no hydrogen 2.741 N/A ASN 263.A ND2 ARG 280.A O no hydrogen 3.261 N/A ASN 263.A ND2 GLU 282.A O no hydrogen 3.261 N/A HIS 265.A N VAL 254.A O no hydrogen 2.899 N/A HIS 265.A ND1 ASN 263.A O no hydrogen 3.078 N/A ARG 266.A N THR 275.A O no hydrogen 2.749 N/A VAL 267.A N LEU 252.A O no hydrogen 2.733 N/A ASP 268.A N ALA 273.A O no hydrogen 2.799 N/A ALA 270.A N ASP 268.A OD1 no hydrogen 2.803 N/A THR 271.A N ASP 268.A OD1 no hydrogen 2.938 N/A GLY 272.A N ASP 268.A O no hydrogen 2.728 N/A ALA 273.A N THR 271.A OG1 no hydrogen 3.105 N/A THR 275.A N ARG 266.A O no hydrogen 2.781 N/A LEU 277.A N LEU 264.A O no hydrogen 2.899 N/A ARG 279.A NH1 GLN 276.A OE1 no hydrogen 2.584 N/A ARG 280.A N ASN 263.A OD1 no hydrogen 3.072 N/A ARG 280.A NH1 GLU 282.A OE1 no hydrogen 3.286 N/A GLU 283.A N GLY 308.A O no hydrogen 2.966 N/A PHE 284.A N TRP 262.A O no hydrogen 2.839 N/A TRP 289.A N PRO 287.A O no hydrogen 2.999 N/A TRP 289.A NE1 THR 430.A O no hydrogen 2.936 N/A ARG 293.A NE GLU 245.A OE1 no hydrogen 2.793 N/A ARG 293.A NH2 GLU 245.A OE2 no hydrogen 3.305 N/A TRP 294.A N GLN 243.A OE1 no hydrogen 2.825 N/A PHE 295.A N GLN 243.A OE1 no hydrogen 3.226 N/A ALA 296.A N ALA 304.A O no hydrogen 2.814 N/A LEU 298.A N LEU 302.A O no hydrogen 2.809 N/A ASN 300.A ND2 THR 363.A OG1 no hydrogen 3.362 N/A GLY 301.A N LEU 298.A O no hydrogen 3.008 N/A LEU 302.A N ASN 300.A OD1 no hydrogen 3.040 N/A ILE 303.A N LEU 317.A O no hydrogen 2.880 N/A ALA 304.A N ALA 296.A O no hydrogen 2.841 N/A VAL 305.A N GLY 315.A O no hydrogen 2.870 N/A VAL 306.A N TRP 294.A O no hydrogen 2.824 N/A HIS 307.A N VAL 313.A O no hydrogen 2.954 N/A HIS 307.A ND1 GLU 282.A OE1 no hydrogen 2.835 N/A HIS 307.A NE2 ASP 326.A OD1 no hydrogen 2.623 N/A GLY 308.A N GLU 283.A O no hydrogen 3.049 N/A GLY 310.A N GLY 461.A O no hydrogen 2.763 N/A VAL 313.A N HIS 307.A O no hydrogen 2.901 N/A GLY 315.A N VAL 305.A O no hydrogen 2.779 N/A ILE 316.A N VAL 325.A O no hydrogen 2.715 N/A LEU 317.A N ILE 303.A O no hydrogen 2.772 N/A ASP 318.A N GLU 323.A O no hydrogen 2.848 N/A GLU 320.A N ASP 318.A OD2 no hydrogen 3.114 N/A SER 321.A N ASP 318.A O no hydrogen 3.182 N/A GLY 322.A N ASP 318.A O no hydrogen 2.683 N/A GLU 323.A N SER 321.A OG no hydrogen 3.225 N/A VAL 325.A N ILE 316.A O no hydrogen 2.947 N/A ALA 327.A N LEU 314.A O no hydrogen 2.872 N/A TRP 331.A NE1 GLU 357.A OE1 no hydrogen 2.960 N/A THR 332.A N ALA 350.A O no hydrogen 2.838 N/A GLU 333.A N ALA 350.A O no hydrogen 3.214 N/A TRP 334.A N ALA 312.A O no hydrogen 2.769 N/A ALA 335.A N VAL 348.A O no hydrogen 2.756 N/A THR 339.A N VAL 346.A O no hydrogen 3.064 N/A SER 341.A N ARG 344.A O no hydrogen 2.925 N/A THR 343.A OG1 ASP 362.A OD1 no hydrogen 3.417 N/A THR 343.A OG1 ASP 362.A OD2 no hydrogen 3.311 N/A ARG 344.A N SER 341.A O no hydrogen 2.831 N/A ARG 344.A NH2 SER 341.A OG no hydrogen 3.150 N/A ALA 345.A N LEU 361.A O no hydrogen 2.811 N/A VAL 346.A N THR 339.A O no hydrogen 2.758 N/A GLY 347.A N VAL 359.A O no hydrogen 2.808 N/A ALA 349.A N GLU 357.A O no hydrogen 3.003 N/A ALA 350.A N GLU 333.A O no hydrogen 2.931 N/A SER 351.A N THR 354.A O no hydrogen 3.036 N/A SER 351.A OG THR 354.A OG1 no hydrogen 2.711 N/A ARG 353.A N SER 351.A OG no hydrogen 3.096 N/A THR 354.A N SER 351.A O no hydrogen 3.298 N/A THR 354.A OG1 SER 351.A OG no hydrogen 2.711 N/A ALA 355.A N HIS 375.A ND1 no hydrogen 3.272 N/A GLU 357.A N ALA 349.A O no hydrogen 2.776 N/A VAL 358.A N GLY 372.A O no hydrogen 2.882 N/A VAL 359.A N GLY 347.A O no hydrogen 2.886 N/A GLU 360.A N ARG 369.A O no hydrogen 2.793 N/A LEU 361.A N ALA 345.A O no hydrogen 2.710 N/A ASP 362.A N ARG 367.A O no hydrogen 2.944 N/A THR 363.A N THR 343.A O no hydrogen 2.835 N/A THR 363.A OG1 THR 343.A O no hydrogen 3.084 N/A VAL 364.A N ASP 362.A OD1 no hydrogen 2.558 N/A GLY 366.A N ASP 362.A O no hydrogen 2.624 N/A ARG 367.A N THR 365.A OG1 no hydrogen 3.177 N/A ARG 369.A N GLU 360.A O no hydrogen 2.860 N/A ARG 369.A NE GLU 360.A OE1 no hydrogen 2.801 N/A ARG 369.A NH2 GLU 360.A OE1 no hydrogen 3.488 N/A ARG 369.A NH2 GLU 360.A OE2 no hydrogen 3.024 N/A THR 370.A OG1 GLU 357.A OE1 no hydrogen 3.448 N/A ILE 371.A N VAL 358.A O no hydrogen 2.853 N/A GLY 372.A N VAL 358.A O no hydrogen 3.280 N/A ALA 373.A N GLU 59.A OE2 no hydrogen 2.747 N/A HIS 375.A N GLU 357.A OE2 no hydrogen 2.745 N/A HIS 375.A NE2 ASP 377.A OD2 no hydrogen 2.804 N/A ALA 382.A N ASP 380.A OD1 no hydrogen 2.817 N/A TYR 383.A N ASP 380.A O no hydrogen 2.842 N/A TYR 383.A OH ASP 411.A OD2 no hydrogen 2.466 N/A TYR 384.A N PRO 381.A O no hydrogen 3.042 N/A TYR 384.A OH ASP 377.A OD2 no hydrogen 2.657 N/A GLN 388.A N ILE 404.A O no hydrogen 2.879 N/A ARG 390.A N ALA 402.A O no hydrogen 2.874 N/A ARG 390.A NH1 GLU 492.A OE2 no hydrogen 3.234 N/A ARG 390.A NH2 GLU 492.A OE1 no hydrogen 3.124 N/A ARG 390.A NH2 GLU 492.A OE2 no hydrogen 3.308 N/A THR 391.A OG1 HIS 401.A ND1 no hydrogen 2.971 N/A PHE 392.A N ILE 400.A O no hydrogen 2.719 N/A ALA 394.A N ARG 398.A O no hydrogen 2.966 N/A GLY 397.A N ALA 394.A O no hydrogen 2.812 N/A ARG 398.A N ASP 396.A OD1 no hydrogen 3.104 N/A ARG 398.A NE ASP 481.A OD1 no hydrogen 2.909 N/A ARG 398.A NH1 ASP 396.A OD1 no hydrogen 2.953 N/A ARG 398.A NH2 ASP 481.A OD1 no hydrogen 2.906 N/A ILE 400.A N PHE 392.A O no hydrogen 2.851 N/A HIS 401.A N TYR 466.A OH no hydrogen 3.391 N/A HIS 401.A ND1 THR 391.A OG1 no hydrogen 2.971 N/A ALA 402.A N ARG 390.A O no hydrogen 2.740 N/A HIS 403.A N ASP 453.A O no hydrogen 2.794 N/A ILE 404.A N GLN 388.A O no hydrogen 2.965 N/A TYR 405.A N VAL 451.A O no hydrogen 2.694 N/A HIS 408.A N THR 445.A O no hydrogen 3.010 N/A ASP 411.A N SER 409.A OG no hydrogen 3.245 N/A THR 413.A N SER 2.A O no hydrogen 3.210 N/A GLU 418.A N PRO 415.A O no hydrogen 2.925 N/A TYR 422.A N ARG 499.A O no hydrogen 3.033 N/A VAL 423.A N GLY 450.A O no hydrogen 2.854 N/A VAL 424.A N ALA 501.A O no hydrogen 2.702 N/A HIS 426.A ND1 GLY 427.A O no hydrogen 2.674 N/A HIS 426.A NE2 SER 459.A OG no hydrogen 2.821 N/A THR 430.A N TYR 549.A OH no hydrogen 3.193 N/A THR 430.A OG1 TYR 549.A OH no hydrogen 2.617 N/A SER 431.A N PRO 429.A O no hydrogen 2.790 N/A SER 431.A OG HIS 426.A ND1 no hydrogen 3.402 N/A SER 431.A OG GLY 427.A O no hydrogen 2.769 N/A ARG 432.A NH1 GLU 333.A OE1 no hydrogen 3.092 N/A ARG 432.A NH2 GLU 333.A OE2 no hydrogen 3.076 N/A VAL 433.A N ASN 455.A OD1 no hydrogen 2.886 N/A ALA 435.A N GLU 333.A OE2 no hydrogen 2.923 N/A LEU 437.A N SER 351.A O no hydrogen 2.801 N/A ASP 440.A N ASP 438.A OD1 no hydrogen 2.776 N/A VAL 441.A N ASP 438.A O no hydrogen 2.846 N/A ALA 442.A N ASP 438.A O no hydrogen 2.951 N/A TYR 443.A N LEU 439.A O no hydrogen 2.713 N/A PHE 444.A N VAL 441.A O no hydrogen 2.950 N/A THR 445.A N VAL 441.A O no hydrogen 3.080 N/A THR 445.A OG1 VAL 441.A O no hydrogen 3.566 N/A THR 445.A OG1 ALA 442.A O no hydrogen 3.371 N/A SER 446.A N ALA 442.A O no hydrogen 2.850 N/A SER 446.A OG SER 11.A OG no hydrogen 2.642 N/A SER 446.A OG ALA 442.A O no hydrogen 2.683 N/A SER 446.A OG TYR 443.A O no hydrogen 3.460 N/A ARG 447.A N PHE 444.A O no hydrogen 2.946 N/A ARG 447.A NH1 ILE 13.A O no hydrogen 2.899 N/A ARG 447.A NH1 TYR 443.A O no hydrogen 2.916 N/A ARG 447.A NH2 ILE 13.A O no hydrogen 2.959 N/A GLY 448.A N THR 445.A O no hydrogen 3.121 N/A ILE 449.A N PHE 444.A O no hydrogen 3.095 N/A GLY 450.A N PRO 421.A O no hydrogen 2.965 N/A VAL 451.A N TYR 405.A O no hydrogen 2.823 N/A ALA 452.A N VAL 423.A O no hydrogen 2.962 N/A ASP 453.A N HIS 403.A O no hydrogen 2.802 N/A ASN 455.A N HIS 401.A O no hydrogen 2.850 N/A ASN 455.A ND2 VAL 433.A O no hydrogen 3.064 N/A TYR 456.A OH HIS 426.A O no hydrogen 2.712 N/A GLY 457.A N ASP 481.A OD2 no hydrogen 2.695 N/A GLY 458.A N TYR 466.A O no hydrogen 2.945 N/A SER 459.A N TYR 456.A O no hydrogen 2.934 N/A SER 459.A OG HIS 426.A NE2 no hydrogen 2.821 N/A SER 459.A OG TYR 456.A O no hydrogen 2.586 N/A THR 460.A N SER 431.A O no hydrogen 2.950 N/A GLY 463.A N GLU 283.A OE2 no hydrogen 2.999 N/A ARG 464.A N GLY 260.A O no hydrogen 2.888 N/A ARG 464.A NH1 GLU 212.A O no hydrogen 3.123 N/A ARG 464.A NH1 ASP 257.A OD2 no hydrogen 2.778 N/A ARG 464.A NH2 GLU 212.A O no hydrogen 3.006 N/A TYR 466.A OH ASN 455.A O no hydrogen 2.783 N/A ARG 467.A N GLY 463.A O no hydrogen 3.151 N/A ARG 467.A NH2 TRP 211.A O no hydrogen 2.948 N/A ARG 467.A NH2 ASP 257.A OD2 no hydrogen 2.785 N/A GLU 468.A N ARG 464.A O no hydrogen 2.706 N/A ARG 469.A N TYR 466.A O no hydrogen 3.338 N/A ARG 469.A NH1 GLU 399.A O no hydrogen 2.936 N/A ARG 469.A NH2 GLU 399.A O no hydrogen 3.563 N/A ARG 471.A N GLU 468.A O no hydrogen 3.009 N/A ARG 471.A NE GLU 468.A OE1 no hydrogen 2.789 N/A ARG 471.A NH1 GLU 212.A OE1 no hydrogen 3.135 N/A ARG 471.A NH2 GLU 212.A OE1 no hydrogen 3.125 N/A ARG 471.A NH2 GLU 468.A OE1 no hydrogen 3.379 N/A ARG 471.A NH2 GLU 468.A OE2 no hydrogen 3.025 N/A GLY 472.A N PHE 552.A O no hydrogen 2.689 N/A ARG 473.A N LEU 470.A O no hydrogen 2.825 N/A TRP 474.A N LEU 553.A O no hydrogen 2.941 N/A GLY 475.A N ASP 478.A OD1 no hydrogen 2.663 N/A VAL 476.A N ARG 473.A O no hydrogen 2.908 N/A VAL 477.A N ARG 473.A O no hydrogen 3.100 N/A GLU 480.A N VAL 476.A O no hydrogen 2.801 N/A ASP 481.A N VAL 477.A O no hydrogen 2.898 N/A CYS 482.A N ASP 478.A O no hydrogen 3.223 N/A CYS 482.A SG ASP 478.A O no hydrogen 3.415 N/A ALA 483.A N VAL 479.A O no hydrogen 3.036 N/A ALA 484.A N GLU 480.A O no hydrogen 2.886 N/A VAL 485.A N ASP 481.A O no hydrogen 3.232 N/A ALA 486.A N CYS 482.A O no hydrogen 3.084 N/A THR 487.A N ALA 483.A O no hydrogen 2.876 N/A THR 487.A OG1 ALA 483.A O no hydrogen 3.058 N/A THR 487.A OG1 ALA 484.A O no hydrogen 3.414 N/A ALA 488.A N ALA 484.A O no hydrogen 3.027 N/A LEU 489.A N VAL 485.A O no hydrogen 3.043 N/A ALA 490.A N ALA 486.A O no hydrogen 3.186 N/A GLU 491.A N THR 487.A O no hydrogen 2.864 N/A GLU 492.A N ALA 488.A O no hydrogen 2.894 N/A GLY 493.A N ALA 490.A O no hydrogen 2.998 N/A THR 494.A N LEU 489.A O no hydrogen 3.147 N/A THR 494.A OG1 LEU 489.A O no hydrogen 3.229 N/A ASP 496.A N PRO 420.A O no hydrogen 2.874 N/A ARG 497.A NH1 ARG 497.A O no hydrogen 2.943 N/A ARG 497.A NH1 VAL 521.A O no hydrogen 3.105 N/A ALA 498.A N ASP 496.A OD1 no hydrogen 2.900 N/A ARG 499.A N ASP 496.A O no hydrogen 2.921 N/A ARG 499.A NE ASP 496.A OD2 no hydrogen 2.840 N/A ARG 499.A NH1 PHE 642.A O no hydrogen 3.116 N/A ARG 499.A NH2 LEU 419.A O no hydrogen 2.870 N/A ALA 501.A N TYR 422.A O no hydrogen 2.917 N/A VAL 502.A N CYS 524.A O no hydrogen 3.168 N/A ARG 503.A N VAL 424.A O no hydrogen 2.899 N/A ARG 503.A NE GLU 634.A OE2 no hydrogen 2.836 N/A ARG 503.A NH2 GLU 634.A OE1 no hydrogen 2.691 N/A ARG 503.A NH2 GLU 634.A OE2 no hydrogen 3.534 N/A GLY 504.A N THR 526.A O no hydrogen 3.198 N/A SER 506.A N LEU 528.A O no hydrogen 2.878 N/A SER 506.A OG HIS 620.A NE2 no hydrogen 2.721 N/A GLY 508.A N GLY 505.A O no hydrogen 2.768 N/A GLY 509.A N SER 506.A O no hydrogen 2.774 N/A TRP 510.A N SER 506.A O no hydrogen 3.051 N/A THR 511.A N ALA 507.A O no hydrogen 2.996 N/A THR 511.A OG1 ASP 478.A OD2 no hydrogen 2.667 N/A THR 511.A OG1 ALA 507.A O no hydrogen 3.301 N/A ALA 512.A N GLY 508.A O no hydrogen 2.907 N/A ALA 513.A N GLY 509.A O no hydrogen 2.829 N/A SER 514.A N TRP 510.A O no hydrogen 2.668 N/A SER 514.A OG TRP 510.A O no hydrogen 2.681 N/A SER 515.A N THR 511.A O no hydrogen 2.863 N/A SER 515.A OG THR 511.A O no hydrogen 2.734 N/A LEU 516.A N ALA 512.A O no hydrogen 3.098 N/A VAL 517.A N ALA 513.A O no hydrogen 3.016 N/A SER 518.A N SER 514.A O no hydrogen 2.747 N/A SER 518.A OG SER 514.A O no hydrogen 2.695 N/A THR 519.A N SER 515.A O no hydrogen 3.083 N/A THR 519.A OG1 SER 515.A O no hydrogen 2.737 N/A VAL 521.A N THR 519.A OG1 no hydrogen 3.402 N/A ALA 523.A N LEU 500.A O no hydrogen 2.726 N/A GLY 525.A N PRO 579.A O no hydrogen 3.282 N/A THR 526.A N VAL 502.A O no hydrogen 2.949 N/A THR 526.A OG1 TYR 638.A OH no hydrogen 2.859 N/A VAL 527.A N LEU 581.A O no hydrogen 2.743 N/A LEU 528.A N GLY 504.A O no hydrogen 3.023 N/A TYR 529.A N LEU 583.A O no hydrogen 2.742 N/A LEU 532.A N GLN 595.A OE1 no hydrogen 2.566 N/A ASP 533.A N GLN 595.A OE1 no hydrogen 2.629 N/A GLY 536.A N ASP 533.A OD2 no hydrogen 2.929 N/A TRP 537.A N ASP 533.A O no hydrogen 2.894 N/A TRP 537.A NE1 VAL 590.A O no hydrogen 2.949 N/A ALA 538.A N LEU 534.A O no hydrogen 2.777 N/A ASP 539.A N LEU 535.A O no hydrogen 2.993 N/A ASP 539.A N GLY 536.A O no hydrogen 3.123 N/A GLY 541.A N TRP 537.A O no hydrogen 3.052 N/A THR 542.A OG1 VAL 590.A O no hydrogen 2.706 N/A HIS 543.A NE2 GLU 546.A OE2 no hydrogen 2.655 N/A GLU 546.A N HIS 543.A O no hydrogen 3.218 N/A SER 547.A N ASP 544.A O no hydrogen 3.000 N/A SER 547.A OG ASP 544.A O no hydrogen 2.722 N/A SER 547.A OG ASP 544.A OD1 no hydrogen 3.510 N/A ARG 548.A NE ASP 551.A OD1 no hydrogen 2.931 N/A ARG 548.A NH2 ASP 551.A OD2 no hydrogen 2.913 N/A TYR 549.A N GLU 546.A O no hydrogen 3.150 N/A TYR 549.A OH THR 430.A OG1 no hydrogen 2.617 N/A ASP 551.A N ARG 548.A O no hydrogen 2.999 N/A PHE 552.A N TYR 549.A O no hydrogen 3.043 N/A LEU 553.A N TYR 549.A O no hydrogen 2.997 N/A ILE 554.A N LEU 550.A O no hydrogen 2.756 N/A GLY 555.A N LEU 550.A O no hydrogen 3.054 N/A GLU 559.A N SER 556.A O no hydrogen 3.248 N/A GLU 559.A N SER 556.A OG no hydrogen 2.904 N/A PHE 560.A N SER 556.A O no hydrogen 2.786 N/A GLU 562.A N GLU 562.A OE2 no hydrogen 2.658 N/A ARG 563.A N PHE 560.A O no hydrogen 3.093 N/A ARG 563.A NH1 ILE 554.A O no hydrogen 2.870 N/A TYR 564.A N PRO 561.A O no hydrogen 3.108 N/A TYR 564.A OH GLY 555.A O no hydrogen 2.669 N/A ARG 565.A N GLU 562.A O no hydrogen 3.167 N/A ASP 566.A N GLU 562.A O no hydrogen 2.903 N/A ARG 567.A N ARG 563.A O no hydrogen 2.945 N/A ARG 567.A NH1 GLY 472.A O no hydrogen 2.731 N/A ARG 567.A NH1 TRP 474.A O no hydrogen 3.054 N/A ARG 567.A NH2 GLY 472.A O no hydrogen 3.040 N/A ALA 568.A N ARG 565.A O no hydrogen 3.360 N/A LEU 570.A N LEU 532.A O no hydrogen 3.073 N/A THR 571.A N ALA 568.A O no hydrogen 2.863 N/A THR 571.A OG1 ARG 565.A O no hydrogen 2.584 N/A ARG 572.A N PRO 569.A O no hydrogen 3.157 N/A ALA 573.A N LEU 570.A O no hydrogen 3.296 N/A ARG 575.A N ARG 572.A O no hydrogen 2.907 N/A VAL 576.A N ALA 573.A O no hydrogen 3.214 N/A ARG 577.A NH1 ASP 520.A OD2 no hydrogen 2.854 N/A LEU 581.A N GLY 525.A O no hydrogen 2.990 N/A LEU 582.A N ALA 611.A O no hydrogen 2.951 N/A LEU 583.A N VAL 527.A O no hydrogen 2.815 N/A GLN 584.A N LEU 613.A O no hydrogen 3.027 N/A GLN 584.A NE2 GLY 585.A O no hydrogen 2.811 N/A GLN 584.A NE2 ASP 588.A OD1 no hydrogen 3.514 N/A GLN 584.A NE2 CYS 591.A O no hydrogen 2.853 N/A LEU 586.A N PHE 615.A O no hydrogen 2.934 N/A GLU 587.A N GLU 618.A O no hydrogen 2.893 N/A ASP 588.A N GLY 585.A O no hydrogen 3.438 N/A VAL 590.A N ASP 588.A OD2 no hydrogen 2.729 N/A CYS 591.A N ASP 588.A OD2 no hydrogen 2.806 N/A CYS 591.A SG TYR 529.A O no hydrogen 3.422 N/A CYS 591.A SG PRO 530.A O no hydrogen 3.598 N/A GLN 595.A N PRO 592.A O no hydrogen 2.873 N/A GLN 595.A NE2 ASP 533.A O no hydrogen 3.209 N/A CYS 596.A SG GLN 584.A OE1 no hydrogen 3.432 N/A ASP 597.A N PRO 593.A O no hydrogen 3.108 N/A ARG 598.A N GLU 594.A O no hydrogen 3.099 N/A PHE 599.A N GLN 595.A O no hydrogen 3.289 N/A LEU 600.A N CYS 596.A O no hydrogen 2.787 N/A GLU 601.A N ASP 597.A O no hydrogen 3.012 N/A ALA 602.A N ARG 598.A O no hydrogen 3.060 N/A VAL 603.A N PHE 599.A O no hydrogen 3.099 N/A VAL 603.A N LEU 600.A O no hydrogen 3.328 N/A ALA 604.A N LEU 600.A O no hydrogen 3.105 N/A CYS 606.A N VAL 603.A O no hydrogen 2.968 N/A CYS 606.A SG ALA 602.A O no hydrogen 4.042 N/A HIS 610.A N GLY 655.A O no hydrogen 2.883 N/A HIS 610.A ND1 VAL 608.A O no hydrogen 2.636 N/A ALA 611.A N PHE 580.A O no hydrogen 3.195 N/A LEU 613.A N LEU 582.A O no hydrogen 2.945 N/A PHE 615.A N GLN 584.A O no hydrogen 2.770 N/A GLY 617.A N GLU 587.A OE1 no hydrogen 2.935 N/A HIS 620.A ND1 ASP 588.A OD1 no hydrogen 2.695 N/A HIS 620.A NE2 SER 506.A OG no hydrogen 2.721 N/A ARG 623.A N GLU 618.A OE1 no hydrogen 3.359 N/A ARG 623.A N GLU 618.A OE2 no hydrogen 2.901 N/A ARG 623.A NH1 HIS 620.A O no hydrogen 3.373 N/A ARG 624.A N GLU 618.A OE1 no hydrogen 2.899 N/A ARG 624.A NE GLY 617.A O no hydrogen 2.989 N/A ARG 624.A NH2 GLY 617.A O no hydrogen 3.266 N/A LYS 625.A N PRO 42.A O no hydrogen 2.865 N/A GLU 626.A N GLU 626.A OE1 no hydrogen 2.762 N/A THR 627.A OG1 GLU 618.A OE1 no hydrogen 2.649 N/A ARG 629.A N GLU 626.A O no hydrogen 3.277 N/A ALA 630.A N THR 627.A O no hydrogen 2.906 N/A GLU 632.A N VAL 628.A O no hydrogen 3.083 N/A ALA 633.A N ARG 629.A O no hydrogen 3.098 N/A GLU 634.A N ALA 630.A O no hydrogen 3.106 N/A LEU 635.A N LEU 631.A O no hydrogen 3.059 N/A SER 636.A N GLU 632.A O no hydrogen 2.994 N/A SER 636.A OG PRO 650.A O no hydrogen 3.386 N/A LEU 637.A N ALA 633.A O no hydrogen 3.083 N/A TYR 638.A N GLU 634.A O no hydrogen 3.188 N/A TYR 638.A OH THR 526.A OG1 no hydrogen 2.859 N/A TYR 638.A OH GLU 634.A OE2 no hydrogen 2.638 N/A ALA 639.A N LEU 635.A O no hydrogen 2.745 N/A GLN 640.A N SER 636.A O no hydrogen 2.883 N/A GLN 640.A NE2 SER 636.A O no hydrogen 3.427 N/A GLN 640.A NE2 SER 636.A OG no hydrogen 2.932 N/A GLN 640.A NE2 LEU 652.A O no hydrogen 2.879 N/A VAL 641.A N LEU 637.A O no hydrogen 2.859 N/A PHE 642.A N TYR 638.A O no hydrogen 2.709 N/A VAL 644.A N ALA 639.A O no hydrogen 2.851 N/A LEU 652.A N SER 636.A OG no hydrogen 2.745 N/A GLY 655.A N HIS 610.A O no hydrogen 2.685 N/A