Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3nz4_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): HIS 4.A N GLU 278.A OE1 no hydrogen 2.843 N/A ASP 7.A N SER 3.A O no hydrogen 3.236 N/A ILE 8.A N HIS 4.A O no hydrogen 2.987 N/A LEU 9.A N VAL 5.A O no hydrogen 2.976 N/A GLY 10.A N LYS 6.A O no hydrogen 2.819 N/A LEU 11.A N ASP 7.A O no hydrogen 2.940 N/A ILE 12.A N ILE 8.A O no hydrogen 3.021 N/A ASN 13.A N LEU 9.A O no hydrogen 3.006 N/A THR 14.A N GLY 10.A O no hydrogen 3.058 N/A THR 14.A OG1 GLY 10.A O no hydrogen 3.319 N/A PHE 15.A N LEU 11.A O no hydrogen 2.804 N/A ASN 16.A N ILE 12.A O no hydrogen 3.193 N/A GLU 17.A N ASN 13.A O no hydrogen 2.896 N/A GLU 17.A N THR 14.A O no hydrogen 3.181 N/A VAL 18.A N THR 14.A O no hydrogen 2.995 N/A ILE 21.A N LYS 44.A O no hydrogen 2.757 N/A VAL 23.A N ALA 46.A O no hydrogen 2.782 N/A THR 26.A N ASP 24.A OD2 no hydrogen 2.935 N/A THR 27.A N ASP 24.A OD2 no hydrogen 2.856 N/A ILE 29.A N ASN 341.A OD1 no hydrogen 2.832 N/A THR 30.A N HIS 33.A ND1 no hydrogen 2.775 N/A THR 30.A OG1 HIS 33.A ND1 no hydrogen 2.928 N/A VAL 31.A N GLU 337.A OE2 no hydrogen 3.069 N/A HIS 33.A N THR 30.A OG1 no hydrogen 3.377 N/A VAL 34.A N THR 30.A O no hydrogen 3.172 N/A ALA 35.A N VAL 31.A O no hydrogen 3.222 N/A ALA 36.A N ALA 32.A O no hydrogen 3.012 N/A LEU 37.A N HIS 33.A O no hydrogen 3.051 N/A ALA 38.A N VAL 34.A O no hydrogen 2.948 N/A ARG 39.A N ALA 35.A O no hydrogen 2.989 N/A ARG 39.A NH1 ASP 237.A OD2 no hydrogen 3.396 N/A ARG 39.A NH2 ASP 237.A OD1 no hydrogen 2.608 N/A ARG 40.A N ALA 36.A O no hydrogen 2.889 N/A ARG 40.A NH1 PHE 15.A O no hydrogen 2.732 N/A ARG 40.A NH1 VAL 18.A O no hydrogen 2.945 N/A ARG 40.A NH2 VAL 18.A O no hydrogen 3.179 N/A ARG 40.A NH2 ASP 42.A OD2 no hydrogen 3.541 N/A VAL 43.A N ARG 40.A O no hydrogen 3.458 N/A LYS 44.A N LYS 19.A O no hydrogen 3.049 N/A LYS 44.A NZ ASN 154.A O no hydrogen 3.359 N/A VAL 45.A N ASN 154.A OD1 no hydrogen 2.704 N/A ALA 46.A N ILE 21.A O no hydrogen 2.715 N/A LEU 47.A N GLU 150.A OE2 no hydrogen 2.687 N/A GLU 48.A N VAL 23.A O no hydrogen 2.882 N/A GLN 51.A N GLU 48.A O no hydrogen 3.246 N/A CYS 52.A N ALA 49.A O no hydrogen 3.085 N/A CYS 52.A SG GLU 48.A O no hydrogen 3.603 N/A ARG 53.A N ALA 49.A O no hydrogen 2.935 N/A ARG 53.A NH1 GLU 57.A OE2 no hydrogen 2.956 N/A ARG 55.A NE TYR 136.A O no hydrogen 3.372 N/A ARG 55.A NH1 GLN 51.A O no hydrogen 3.455 N/A VAL 56.A N CYS 52.A O no hydrogen 3.234 N/A GLU 57.A N ARG 53.A O no hydrogen 2.802 N/A THR 58.A N ALA 54.A O no hydrogen 2.931 N/A THR 58.A OG1 ALA 54.A O no hydrogen 2.634 N/A CYS 59.A N ARG 55.A O no hydrogen 3.144 N/A CYS 59.A SG GLY 137.A O no hydrogen 3.331 N/A SER 60.A N VAL 56.A O no hydrogen 2.934 N/A SER 61.A N GLU 57.A O no hydrogen 2.835 N/A SER 61.A OG GLU 57.A O no hydrogen 3.263 N/A TRP 62.A N THR 58.A O no hydrogen 2.883 N/A TRP 62.A NE1 ASP 354.A OD1 no hydrogen 3.024 N/A VAL 63.A N CYS 59.A O no hydrogen 3.091 N/A GLN 64.A N SER 60.A O no hydrogen 3.228 N/A ARG 65.A N.A SER 61.A O no hydrogen 2.769 N/A ARG 65.A N.B SER 61.A O no hydrogen 2.740 N/A LYS 66.A N TRP 62.A O no hydrogen 2.763 N/A LYS 66.A NZ ASP 354.A OD1 no hydrogen 2.327 N/A ALA 67.A N VAL 63.A O no hydrogen 2.776 N/A GLU 68.A N GLN 64.A O no hydrogen 2.823 N/A ASP 69.A N ARG 65.A O.A no hydrogen 3.409 N/A ASP 69.A N ARG 65.A O.B no hydrogen 3.284 N/A GLY 70.A N ALA 67.A O no hydrogen 3.298 N/A THR 77.A OG1 VAL 76.A O no hydrogen 2.076 N/A THR 78.A OG1 SER 84.A O no hydrogen 3.320 N/A THR 78.A OG1 ARG 86.A O no hydrogen 3.569 N/A GLY 79.A N ARG 86.A O no hydrogen 2.557 N/A GLY 81.A N TYR 74.A OH no hydrogen 2.879 N/A ALA 82.A N GLU 446.A OE2 no hydrogen 2.844 N/A CYS 83.A N PHE 80.A O no hydrogen 3.128 N/A CYS 83.A SG GLN 447.A OE1 no hydrogen 3.968 N/A ARG 86.A N CYS 83.A O no hydrogen 3.308 N/A ARG 87.A NE THR 78.A OG1 no hydrogen 3.072 N/A ARG 87.A NH2 SER 84.A O no hydrogen 3.472 N/A THR 88.A N THR 77.A O no hydrogen 3.330 N/A GLN 90.A N THR 88.A OG1 no hydrogen 3.230 N/A SER 92.A OG LEU 212.A O no hydrogen 3.120 N/A LEU 94.A N GLN 90.A O no hydrogen 3.281 N/A GLU 96.A N SER 92.A O no hydrogen 3.147 N/A SER 97.A N GLU 93.A O no hydrogen 2.955 N/A SER 97.A OG LEU 94.A O no hydrogen 3.345 N/A LEU 98.A N LEU 94.A O no hydrogen 3.195 N/A ILE 99.A N GLN 95.A O no hydrogen 3.312 N/A ARG 100.A N GLU 96.A O no hydrogen 3.070 N/A CYS 101.A N SER 97.A O no hydrogen 3.096 N/A CYS 101.A SG LEU 98.A O no hydrogen 4.038 N/A LEU 102.A N LEU 98.A O no hydrogen 3.311 N/A LEU 102.A N ILE 99.A O no hydrogen 3.076 N/A LEU 103.A N ILE 99.A O no hydrogen 3.079 N/A LEU 103.A N ARG 100.A O no hydrogen 3.397 N/A GLY 105.A N TYR 175.A OH no hydrogen 3.220 N/A THR 108.A N ASP 116.A O no hydrogen 3.438 N/A CYS 111.A SG SER 114.A OG no hydrogen 3.041 N/A LEU 118.A N VAL 161.A O no hydrogen 2.798 N/A VAL 122.A N PRO 119.A O no hydrogen 3.082 N/A THR 123.A N PRO 119.A O no hydrogen 3.049 N/A THR 123.A OG1 PRO 119.A O no hydrogen 3.346 N/A ARG 124.A N ALA 120.A O no hydrogen 2.840 N/A ARG 124.A NH1 LEU 153.A O no hydrogen 2.531 N/A ARG 124.A NH2 LEU 37.A O no hydrogen 3.179 N/A SER 125.A N THR 121.A O no hydrogen 3.095 N/A SER 125.A OG THR 121.A O no hydrogen 2.907 N/A ALA 126.A N VAL 122.A O no hydrogen 2.979 N/A MET 127.A N THR 123.A O no hydrogen 3.018 N/A LEU 128.A N ARG 124.A O no hydrogen 2.959 N/A LEU 129.A N SER 125.A O no hydrogen 3.075 N/A ARG 130.A N ALA 126.A O no hydrogen 2.859 N/A ARG 130.A NH1 LEU 220.A O no hydrogen 2.830 N/A ARG 130.A NH1 ASN 222.A O no hydrogen 2.348 N/A ARG 130.A NH2 SER 133.A OG no hydrogen 3.136 N/A ARG 130.A NH2 ASN 222.A O no hydrogen 2.862 N/A ARG 130.A NH2 ASN 344.A O no hydrogen 2.781 N/A LEU 131.A N MET 127.A O no hydrogen 2.973 N/A ASN 132.A N LEU 128.A O no hydrogen 2.842 N/A SER 133.A N LEU 129.A O no hydrogen 2.951 N/A PHE 134.A N LEU 131.A O no hydrogen 2.890 N/A THR 135.A N ASN 132.A O no hydrogen 2.953 N/A THR 135.A OG1 ASN 132.A O no hydrogen 2.444 N/A TYR 136.A OH ASN 132.A OD1 no hydrogen 3.147 N/A GLY 137.A N PHE 134.A O no hydrogen 3.155 N/A CYS 138.A SG TYR 136.A O no hydrogen 3.969 N/A SER 139.A OG ASP 345.A OD2 no hydrogen 2.779 N/A ARG 142.A N GLU 216.A OE2 no hydrogen 3.149 N/A ARG 142.A NE GLU 216.A OE1 no hydrogen 3.359 N/A ARG 142.A NE GLU 216.A OE2 no hydrogen 2.836 N/A ARG 142.A NH2 GLU 216.A OE1 no hydrogen 3.016 N/A VAL 145.A N ARG 142.A O no hydrogen 3.137 N/A MET 146.A N ARG 142.A O no hydrogen 3.484 N/A GLU 147.A N TRP 143.A O no hydrogen 2.971 N/A ALA 148.A N GLU 144.A O no hydrogen 3.063 N/A LEU 149.A N VAL 145.A O no hydrogen 3.204 N/A GLU 150.A N MET 146.A O no hydrogen 3.111 N/A LYS 151.A N GLU 147.A O no hydrogen 2.994 N/A LEU 152.A N ALA 148.A O no hydrogen 2.896 N/A LEU 153.A N LEU 149.A O no hydrogen 2.924 N/A ASN 154.A N GLU 150.A O no hydrogen 2.790 N/A ASN 154.A ND2 VAL 45.A O no hydrogen 3.157 N/A SER 155.A N LYS 151.A O no hydrogen 2.789 N/A SER 155.A N LEU 152.A O no hydrogen 3.177 N/A SER 155.A OG LYS 151.A O no hydrogen 2.986 N/A ASN 156.A N LEU 153.A O no hydrogen 3.023 N/A VAL 157.A N LEU 152.A O no hydrogen 2.900 N/A SER 158.A N ARG 189.A O no hydrogen 3.173 N/A LYS 160.A N ILE 187.A O no hydrogen 2.989 N/A LYS 160.A NZ GLU 117.A OE2 no hydrogen 2.790 N/A LYS 160.A NZ GLU 195.A OE2 no hydrogen 3.310 N/A SER 166.A OG ASP 169.A OD1 no hydrogen 2.562 N/A SER 168.A N SER 166.A OG no hydrogen 2.842 N/A SER 168.A OG ASP 169.A OD1 no hydrogen 2.773 N/A LEU 173.A N ASP 169.A O no hydrogen 2.960 N/A ALA 174.A N LEU 170.A O no hydrogen 2.838 N/A ALA 174.A N ILE 171.A O no hydrogen 2.760 N/A TYR 175.A N PRO 172.A O no hydrogen 3.322 N/A ILE 176.A N LEU 173.A O no hydrogen 3.018 N/A ALA 177.A N LEU 173.A O no hydrogen 3.038 N/A GLY 178.A N ALA 174.A O no hydrogen 2.658 N/A LEU 179.A N TYR 175.A O no hydrogen 3.094 N/A LEU 180.A N ILE 176.A O no hydrogen 3.110 N/A ILE 181.A N ALA 177.A O no hydrogen 3.085 N/A GLY 182.A N LEU 179.A O no hydrogen 2.858 N/A LYS 183.A N GLY 178.A O no hydrogen 2.839 N/A VAL 186.A N LYS 183.A O no hydrogen 3.231 N/A ALA 188.A N VAL 196.A O no hydrogen 2.762 N/A ARG 189.A N SER 158.A O no hydrogen 2.834 N/A ARG 189.A NH1 SER 158.A OG no hydrogen 3.430 N/A ARG 189.A NH2 LEU 118.A O no hydrogen 3.225 N/A ILE 190.A N VAL 194.A O no hydrogen 3.126 N/A GLY 191.A N ASN 156.A O no hydrogen 3.062 N/A VAL 194.A N ASP 192.A O no hydrogen 2.205 N/A VAL 196.A N ALA 188.A O no hydrogen 2.909 N/A ALA 198.A N VAL 186.A O no hydrogen 2.860 N/A GLU 200.A N PRO 197.A O no hydrogen 2.974 N/A ALA 201.A N PRO 197.A O no hydrogen 3.137 N/A LEU 202.A N ALA 198.A O no hydrogen 3.019 N/A SER 203.A N PRO 199.A O no hydrogen 3.225 N/A ARG 204.A N GLU 200.A O no hydrogen 3.063 N/A VAL 205.A N LEU 202.A O no hydrogen 3.066 N/A GLY 206.A N SER 203.A O no hydrogen 3.026 N/A LEU 207.A N LEU 202.A O no hydrogen 2.843 N/A PHE 210.A N LEU 180.A O no hydrogen 3.058 N/A GLN 213.A N GLU 216.A OE1 no hydrogen 2.581 N/A LYS 215.A NZ ASP 345.A OD2 no hydrogen 3.352 N/A LYS 215.A NZ ASN 346.A O no hydrogen 3.476 N/A GLU 216.A N GLN 213.A O no hydrogen 2.906 N/A ALA 219.A N LYS 215.A O no hydrogen 2.913 N/A LEU 220.A N GLU 216.A O no hydrogen 2.977 N/A VAL 221.A N GLY 217.A O no hydrogen 3.143 N/A ASN 222.A N LEU 218.A O no hydrogen 2.678 N/A THR 224.A OG1 THR 228.A OG1 no hydrogen 3.287 N/A THR 224.A OG1 GLU 339.A OE2 no hydrogen 2.554 N/A ALA 227.A N ASP 169.A OD2 no hydrogen 2.788 N/A THR 228.A N THR 224.A O no hydrogen 2.926 N/A THR 228.A OG1 THR 224.A O no hydrogen 2.766 N/A THR 228.A OG1 THR 224.A OG1 no hydrogen 3.287 N/A ALA 229.A N SER 225.A O no hydrogen 2.996 N/A LEU 230.A N PHE 226.A O no hydrogen 3.070 N/A ALA 231.A N ALA 227.A O no hydrogen 2.937 N/A SER 232.A N THR 228.A O no hydrogen 2.921 N/A SER 232.A OG THR 228.A O no hydrogen 2.679 N/A THR 233.A N ALA 229.A O no hydrogen 3.375 N/A THR 233.A OG1 LEU 230.A O no hydrogen 3.149 N/A VAL 234.A N LEU 230.A O no hydrogen 2.903 N/A MET 235.A N ALA 231.A O no hydrogen 2.726 N/A TYR 236.A N SER 232.A O no hydrogen 2.837 N/A ASP 237.A N THR 233.A O no hydrogen 2.977 N/A ALA 238.A N VAL 234.A O no hydrogen 2.784 N/A ASN 239.A N MET 235.A O no hydrogen 2.956 N/A VAL 240.A N TYR 236.A O no hydrogen 3.219 N/A LEU 241.A N ASP 237.A O no hydrogen 2.897 N/A LEU 242.A N ALA 238.A O no hydrogen 3.026 N/A LEU 243.A N ASN 239.A O no hydrogen 3.114 N/A LEU 244.A N VAL 240.A O no hydrogen 2.857 N/A VAL 245.A N LEU 241.A O no hydrogen 2.952 N/A GLU 246.A N LEU 242.A O no hydrogen 3.026 N/A THR 247.A N LEU 243.A O no hydrogen 2.994 N/A THR 247.A OG1 LEU 243.A O no hydrogen 3.151 N/A LEU 248.A N LEU 244.A O no hydrogen 2.886 N/A CYS 249.A N VAL 245.A O no hydrogen 3.017 N/A CYS 249.A N GLU 246.A O no hydrogen 3.257 N/A CYS 249.A SG VAL 245.A O no hydrogen 3.219 N/A GLY 250.A N THR 247.A O no hydrogen 2.930 N/A MET 251.A N THR 247.A O no hydrogen 3.415 N/A PHE 252.A N LEU 248.A O no hydrogen 2.912 N/A CYS 253.A N CYS 249.A O no hydrogen 3.062 N/A CYS 253.A SG GLN 293.A OE1 no hydrogen 3.730 N/A GLU 254.A N GLY 250.A O no hydrogen 3.096 N/A VAL 255.A N MET 251.A O no hydrogen 2.978 N/A ILE 256.A N PHE 252.A O no hydrogen 2.792 N/A GLY 258.A N CYS 253.A O no hydrogen 3.103 N/A ARG 259.A N ASP 311.A OD2 no hydrogen 2.631 N/A ARG 259.A NH1 ASP 311.A OD1 no hydrogen 2.737 N/A ARG 259.A NH2 PRO 308.A O no hydrogen 2.328 N/A GLU 260.A N GLU 260.A OE2 no hydrogen 2.592 N/A PHE 262.A N ARG 259.A O no hydrogen 3.417 N/A ALA 263.A N GLU 260.A O no hydrogen 3.126 N/A HIS 264.A N GLU 261.A O no hydrogen 2.892 N/A ILE 267.A N HIS 264.A O no hydrogen 3.123 N/A HIS 268.A N PRO 265.A O no hydrogen 3.262 N/A HIS 268.A NE2 PHE 262.A O no hydrogen 2.966 N/A LYS 269.A N PRO 265.A O no hydrogen 2.821 N/A LYS 271.A N HIS 268.A O no hydrogen 2.850 N/A HIS 273.A N LYS 271.A O no hydrogen 2.985 N/A GLN 276.A N HIS 273.A O no hydrogen 2.891 N/A GLN 276.A NE2 HIS 268.A ND1 no hydrogen 2.977 N/A ILE 277.A N HIS 273.A O no hydrogen 3.028 N/A GLU 278.A N PRO 274.A O no hydrogen 2.864 N/A SER 279.A N GLY 275.A O no hydrogen 3.077 N/A SER 279.A OG GLY 275.A O no hydrogen 3.058 N/A SER 279.A OG GLN 276.A O no hydrogen 3.450 N/A ALA 280.A N GLN 276.A O no hydrogen 2.997 N/A GLU 281.A N ILE 277.A O no hydrogen 2.972 N/A LEU 282.A N GLU 278.A O no hydrogen 3.245 N/A LEU 283.A N SER 279.A O no hydrogen 3.035 N/A GLU 284.A N ALA 280.A O no hydrogen 2.773 N/A TRP 285.A N GLU 281.A O no hydrogen 3.211 N/A LEU 286.A N LEU 282.A O no hydrogen 2.889 N/A LEU 287.A N LEU 283.A O no hydrogen 3.061 N/A ARG 288.A NH1 GLU 284.A OE2 no hydrogen 3.026 N/A SER 289.A OG ARG 288.A O no hydrogen 2.539 N/A SER 290.A N LEU 287.A O no hydrogen 3.270 N/A SER 290.A OG GLU 254.A OE2 no hydrogen 2.731 N/A PHE 292.A N SER 290.A OG no hydrogen 3.020 N/A GLN 293.A N SER 290.A OG no hydrogen 2.968 N/A GLN 293.A NE2 GLY 258.A O no hydrogen 2.698 N/A GLN 293.A NE2 GLU 260.A OE2 no hydrogen 3.216 N/A ASP 294.A N SER 290.A O no hydrogen 3.210 N/A SER 296.A N PHE 292.A O no hydrogen 2.975 N/A SER 296.A OG GLY 258.A O no hydrogen 2.959 N/A ARG 297.A N GLN 293.A O no hydrogen 3.022 N/A ARG 297.A NH2 GLU 260.A OE1 no hydrogen 3.417 N/A GLU 298.A N ASP 294.A O no hydrogen 2.921 N/A TYR 299.A N LEU 295.A O no hydrogen 2.779 N/A TYR 300.A N SER 296.A O no hydrogen 3.050 N/A TYR 300.A OH PHE 257.A O no hydrogen 2.955 N/A SER 301.A N GLU 298.A O no hydrogen 3.438 N/A SER 301.A OG GLU 298.A O no hydrogen 2.753 N/A LYS 306.A N ASP 303.A O no hydrogen 2.717 N/A LYS 307.A N LYS 304.A O no hydrogen 3.009 N/A LYS 307.A NZ TYR 299.A O no hydrogen 2.612 N/A LYS 307.A NZ ILE 302.A O no hydrogen 2.835 N/A LEU 315.A N ARG 312.A O no hydrogen 3.340 N/A ARG 316.A N ARG 312.A O no hydrogen 3.200 N/A ARG 316.A NE ASP 311.A O no hydrogen 2.671 N/A ARG 316.A NH2 ASP 311.A O no hydrogen 3.008 N/A SER 317.A N TYR 313.A O no hydrogen 2.840 N/A SER 318.A N LEU 315.A O no hydrogen 3.047 N/A SER 318.A OG LEU 315.A O no hydrogen 2.585 N/A GLN 320.A N GLN 320.A OE1 no hydrogen 2.820 N/A TRP 321.A N SER 317.A O no hydrogen 2.861 N/A TRP 321.A NE1 GLY 380.A O no hydrogen 3.057 N/A LEU 322.A N SER 318.A O no hydrogen 2.693 N/A ALA 323.A N PRO 319.A O no hydrogen 3.109 N/A VAL 326.A N LEU 322.A O no hydrogen 2.810 N/A GLN 327.A N ALA 323.A O no hydrogen 3.160 N/A THR 328.A N PRO 324.A O no hydrogen 2.892 N/A ILE 329.A N LEU 325.A O no hydrogen 2.974 N/A ARG 330.A N VAL 326.A O no hydrogen 2.757 N/A ASP 331.A N GLN 327.A O no hydrogen 3.032 N/A ALA 332.A N THR 328.A O no hydrogen 2.949 N/A THR 333.A N ILE 329.A O no hydrogen 3.251 N/A THR 333.A OG1 ASN 239.A OD1 no hydrogen 2.877 N/A THR 333.A OG1 ILE 329.A O no hydrogen 2.869 N/A THR 334.A N ARG 330.A O no hydrogen 3.503 N/A THR 335.A N ASP 331.A O no hydrogen 3.166 N/A VAL 336.A N ALA 332.A O no hydrogen 2.960 N/A GLU 337.A N THR 333.A O no hydrogen 2.961 N/A THR 338.A N THR 334.A O no hydrogen 2.923 N/A THR 338.A OG1 THR 334.A O no hydrogen 3.262 N/A GLU 339.A N THR 335.A O no hydrogen 3.115 N/A VAL 340.A N VAL 336.A O no hydrogen 2.739 N/A ASN 341.A N GLU 337.A O no hydrogen 3.041 N/A ASN 341.A ND2 ILE 29.A O no hydrogen 2.881 N/A ASN 341.A ND2 GLU 337.A O no hydrogen 2.979 N/A SER 342.A OG GLU 339.A O no hydrogen 2.774 N/A ILE 348.A N LEU 357.A O no hydrogen 2.897 N/A ILE 349.A N CYS 138.A O no hydrogen 2.874 N/A ASP 350.A N ARG 355.A O no hydrogen 2.902 N/A ASN 353.A N ASP 350.A O no hydrogen 2.888 N/A ASP 354.A N HIS 351.A O no hydrogen 2.931 N/A ARG 355.A N ASP 350.A O no hydrogen 3.323 N/A ARG 355.A NE ASP 350.A OD2 no hydrogen 2.793 N/A ARG 355.A NH2 ASP 350.A OD2 no hydrogen 3.243 N/A LEU 357.A N ILE 348.A O no hydrogen 2.880 N/A ASN 361.A ND2 ALA 343.A O no hydrogen 3.359 N/A GLN 363.A N ALA 360.A O no hydrogen 2.982 N/A GLN 363.A NE2 ILE 452.A O no hydrogen 3.135 N/A GLY 364.A N SER 168.A O no hydrogen 3.275 N/A GLY 368.A N GLY 364.A O no hydrogen 2.938 N/A PHE 369.A N SER 365.A O no hydrogen 2.976 N/A TYR 370.A N ALA 366.A O no hydrogen 3.218 N/A MET 371.A N VAL 367.A O no hydrogen 2.873 N/A MET 371.A N GLY 368.A O no hydrogen 3.241 N/A ASP 372.A N GLY 368.A O no hydrogen 3.140 N/A TYR 373.A N PHE 369.A O no hydrogen 3.085 N/A VAL 374.A N TYR 370.A O no hydrogen 2.942 N/A ARG 375.A N MET 371.A O no hydrogen 3.074 N/A ARG 375.A NE LEU 434.A O no hydrogen 2.792 N/A ARG 375.A NH1 ASP 372.A OD1 no hydrogen 3.535 N/A ARG 375.A NH1 SER 459.A OG no hydrogen 3.226 N/A ARG 375.A NH1 THR 463.A OG1 no hydrogen 2.735 N/A ARG 375.A NH2 ASP 372.A OD1 no hydrogen 2.742 N/A ARG 375.A NH2 ASN 436.A O no hydrogen 2.723 N/A ILE 376.A N ASP 372.A O no hydrogen 3.404 N/A ALA 377.A N TYR 373.A O no hydrogen 3.048 N/A VAL 378.A N VAL 374.A O no hydrogen 2.829 N/A ALA 379.A N ARG 375.A O no hydrogen 3.050 N/A GLY 380.A N ILE 376.A O no hydrogen 3.034 N/A LEU 381.A N ALA 377.A O no hydrogen 2.941 N/A GLY 382.A N VAL 378.A O no hydrogen 2.991 N/A LYS 383.A N ALA 379.A O no hydrogen 2.989 N/A LEU 384.A N GLY 380.A O no hydrogen 2.974 N/A LEU 385.A N LEU 381.A O no hydrogen 3.163 N/A PHE 386.A N GLY 382.A O no hydrogen 2.856 N/A ALA 387.A N LYS 383.A O no hydrogen 3.023 N/A GLN 388.A N LEU 384.A O no hydrogen 3.102 N/A GLN 388.A NE2 ALA 314.A O no hydrogen 2.952 N/A PHE 389.A N LEU 385.A O no hydrogen 2.944 N/A THR 390.A N PHE 386.A O no hydrogen 2.944 N/A THR 390.A OG1 PHE 386.A O no hydrogen 2.781 N/A GLU 391.A N ALA 387.A O no hydrogen 2.984 N/A LEU 392.A N GLN 388.A O no hydrogen 3.131 N/A MET 393.A N PHE 389.A O no hydrogen 3.153 N/A MET 393.A N THR 390.A O no hydrogen 2.984 N/A ILE 394.A N GLU 391.A O no hydrogen 3.384 N/A GLU 395.A N GLU 395.A OE1 no hydrogen 2.778 N/A TYR 397.A N ILE 394.A O no hydrogen 2.816 N/A SER 398.A N GLU 395.A O no hydrogen 3.207 N/A SER 398.A OG ILE 394.A O no hydrogen 3.381 N/A SER 398.A OG LEU 401.A O no hydrogen 3.055 N/A ASN 399.A ND2 ILE 256.A O no hydrogen 2.876 N/A ASN 404.A N MET 393.A O no hydrogen 2.832 N/A LEU 405.A N PRO 402.A O no hydrogen 2.920 N/A SER 406.A N GLY 403.A O no hydrogen 3.105 N/A SER 406.A OG ASP 414.A O no hydrogen 2.844 N/A SER 412.A N ASP 410.A OD1 no hydrogen 3.256 N/A SER 412.A OG ASP 410.A OD1 no hydrogen 3.459 N/A VAL 413.A N ASP 410.A O no hydrogen 3.398 N/A ASP 414.A N LEU 411.A O no hydrogen 3.140 N/A TYR 415.A OH SER 412.A O no hydrogen 3.223 N/A GLY 416.A N ASP 414.A OD1 no hydrogen 3.283 N/A LEU 417.A N ASN 404.A O no hydrogen 2.843 N/A LYS 418.A N TYR 415.A O no hydrogen 3.348 N/A LYS 418.A NZ ASN 404.A OD1 no hydrogen 3.331 N/A ASP 421.A N LEU 417.A O no hydrogen 2.853 N/A ILE 422.A N LYS 418.A O no hydrogen 3.054 N/A ALA 423.A N GLY 419.A O no hydrogen 2.994 N/A MET 424.A N LEU 420.A O no hydrogen 2.839 N/A ALA 425.A N ASP 421.A O no hydrogen 3.426 N/A ALA 426.A N ILE 422.A O no hydrogen 3.287 N/A TYR 427.A N ALA 423.A O no hydrogen 2.905 N/A SER 428.A N MET 424.A O no hydrogen 3.057 N/A SER 429.A N ALA 425.A O no hydrogen 3.009 N/A SER 429.A OG ALA 425.A O no hydrogen 2.745 N/A GLU 430.A N ALA 426.A O no hydrogen 3.317 N/A LEU 431.A N TYR 427.A O no hydrogen 2.951 N/A GLN 432.A N SER 428.A O no hydrogen 2.770 N/A GLN 432.A NE2 ALA 379.A O no hydrogen 2.996 N/A GLN 432.A NE2 SER 428.A O no hydrogen 3.665 N/A TYR 433.A N SER 429.A O no hydrogen 3.156 N/A LEU 434.A N GLU 430.A O no hydrogen 2.902 N/A LEU 434.A N LEU 431.A O no hydrogen 2.935 N/A ALA 435.A N GLN 432.A O no hydrogen 3.136 N/A VAL 438.A N ASP 372.A OD1 no hydrogen 2.960 N/A VAL 438.A N ASP 372.A OD2 no hydrogen 3.090 N/A THR 439.A N ASP 372.A OD2 no hydrogen 2.850 N/A THR 439.A OG1 ASP 372.A OD2 no hydrogen 2.563 N/A THR 440.A OG1 PRO 437.A O no hydrogen 3.531 N/A HIS 441.A N VAL 438.A O no hydrogen 2.923 N/A SER 444.A OG HIS 448.A ND1 no hydrogen 2.657 N/A ALA 445.A N GLN 450.A O no hydrogen 3.036 N/A HIS 448.A ND1 SER 444.A OG no hydrogen 2.657 N/A ASN 449.A N GLU 446.A O no hydrogen 3.005 N/A ASN 449.A ND2 GLU 446.A OE1 no hydrogen 2.575 N/A GLN 450.A N ALA 445.A O no hydrogen 2.835 N/A ASN 453.A ND2 HIS 443.A O no hydrogen 2.652 N/A ASN 453.A ND2 GLN 450.A O no hydrogen 3.249 N/A SER 454.A OG SER 168.A O no hydrogen 2.759 N/A LEU 455.A N VAL 167.A O no hydrogen 2.924 N/A ALA 456.A N SER 454.A OG no hydrogen 3.307 N/A LEU 457.A N SER 168.A OG no hydrogen 2.986 N/A SER 459.A N LEU 455.A O no hydrogen 2.994 N/A SER 459.A OG GLY 368.A O no hydrogen 3.316 N/A SER 459.A OG ASP 372.A OD1 no hydrogen 2.835 N/A ALA 460.A N ALA 456.A O no hydrogen 2.800 N/A ARG 461.A N LEU 457.A O no hydrogen 3.018 N/A LYS 462.A N ILE 458.A O no hydrogen 3.145 N/A THR 463.A N SER 459.A O no hydrogen 3.002 N/A THR 463.A OG1 MET 371.A O no hydrogen 2.967 N/A THR 463.A OG1 SER 459.A O no hydrogen 2.973 N/A ASP 464.A N ALA 460.A O no hydrogen 2.833 N/A GLU 465.A N ARG 461.A O no hydrogen 2.903 N/A ALA 466.A N LYS 462.A O no hydrogen 2.819 N/A LEU 467.A N THR 463.A O no hydrogen 2.956 N/A ASP 468.A N ASP 464.A O no hydrogen 3.057 N/A ILE 469.A N GLU 465.A O no hydrogen 3.111 N/A LEU 470.A N ALA 466.A O no hydrogen 2.906 N/A LYS 471.A N LEU 467.A O no hydrogen 2.960 N/A LYS 471.A NZ ASP 468.A OD1 no hydrogen 2.886 N/A LEU 472.A N ASP 468.A O no hydrogen 3.333 N/A MET 473.A N ILE 469.A O no hydrogen 3.110 N/A ILE 474.A N LEU 470.A O no hydrogen 2.927 N/A ALA 475.A N LYS 471.A O no hydrogen 2.840 N/A SER 476.A N LEU 472.A O no hydrogen 3.125 N/A SER 476.A OG LEU 472.A O no hydrogen 2.898 N/A HIS 477.A N MET 473.A O no hydrogen 2.801 N/A HIS 477.A NE2 GLN 388.A OE1 no hydrogen 3.053 N/A LEU 478.A N ILE 474.A O no hydrogen 2.778 N/A THR 479.A N ALA 475.A O no hydrogen 3.096 N/A ALA 480.A N SER 476.A O no hydrogen 3.012 N/A MET 481.A N HIS 477.A O no hydrogen 3.057 N/A MET 481.A N LEU 478.A O no hydrogen 2.975 N/A CYS 482.A N LEU 478.A O no hydrogen 3.207 N/A CYS 482.A SG LEU 478.A O no hydrogen 3.707 N/A GLN 483.A N THR 479.A O no hydrogen 3.203 N/A GLN 483.A NE2 LEU 405.A O no hydrogen 2.887 N/A GLN 483.A NE2 MET 616.A O no hydrogen 3.166 N/A ALA 484.A N ALA 480.A O no hydrogen 2.836 N/A VAL 485.A N MET 481.A O no hydrogen 2.787 N/A ASP 486.A N CYS 482.A O no hydrogen 3.116 N/A LEU 487.A N GLN 483.A O no hydrogen 3.102 N/A ARG 488.A N ALA 484.A O no hydrogen 2.937 N/A ARG 488.A NE VAL 255.A O no hydrogen 2.914 N/A ARG 488.A NH1 ASN 399.A O no hydrogen 3.031 N/A ARG 488.A NH1 GLU 491.A OE1 no hydrogen 3.179 N/A ARG 488.A NH2 VAL 255.A O no hydrogen 3.084 N/A ARG 488.A NH2 SER 398.A O no hydrogen 2.709 N/A ARG 488.A NH2 ASN 399.A O no hydrogen 3.371 N/A GLN 489.A N VAL 485.A O no hydrogen 2.956 N/A LEU 490.A N ASP 486.A O no hydrogen 2.781 N/A GLU 491.A N LEU 487.A O no hydrogen 2.770 N/A GLU 492.A N ARG 488.A O no hydrogen 3.029 N/A ALA 493.A N GLN 489.A O no hydrogen 3.186 N/A LEU 494.A N LEU 490.A O no hydrogen 2.816 N/A VAL 495.A N GLU 491.A O no hydrogen 3.037 N/A LYS 496.A N GLU 492.A O no hydrogen 3.371 N/A VAL 497.A N ALA 493.A O no hydrogen 3.418 N/A VAL 498.A N LEU 494.A O no hydrogen 3.220 N/A GLU 499.A N VAL 495.A O no hydrogen 3.037 N/A ASN 500.A N LYS 496.A O no hydrogen 2.771 N/A VAL 501.A N VAL 497.A O no hydrogen 2.670 N/A VAL 502.A N VAL 498.A O no hydrogen 2.937 N/A SER 503.A N GLU 499.A O no hydrogen 3.058 N/A THR 504.A N ASN 500.A O no hydrogen 3.014 N/A THR 504.A OG1 ASN 500.A O no hydrogen 2.594 N/A THR 504.A OG1 VAL 501.A O no hydrogen 3.530 N/A LEU 505.A N VAL 501.A O no hydrogen 2.783 N/A ALA 506.A N VAL 502.A O no hydrogen 2.758 N/A ASP 507.A N SER 503.A O no hydrogen 3.170 N/A GLU 508.A N THR 504.A O no hydrogen 2.848 N/A CYS 509.A N LEU 505.A O no hydrogen 3.022 N/A CYS 509.A SG LEU 505.A O no hydrogen 3.621 N/A GLY 510.A N ASP 507.A O no hydrogen 2.742 N/A LEU 511.A N ALA 506.A O no hydrogen 2.960 N/A THR 515.A OG1 PRO 512.A O no hydrogen 3.544 N/A THR 515.A OG1 SER 553.A OG no hydrogen 2.717 N/A LYS 516.A N PRO 512.A O no hydrogen 3.059 N/A LYS 516.A NZ ASP 507.A OD1 no hydrogen 2.916 N/A LYS 516.A NZ ASP 507.A OD2 no hydrogen 2.699 N/A ALA 517.A N ASN 513.A O no hydrogen 3.190 N/A ARG 518.A N ASP 514.A O no hydrogen 3.412 N/A LEU 519.A N THR 515.A O no hydrogen 2.983 N/A LEU 520.A N LYS 516.A O no hydrogen 2.901 N/A TYR 521.A N ALA 517.A O no hydrogen 2.983 N/A TYR 521.A OH ASP 303.A OD1 no hydrogen 2.491 N/A VAL 522.A N ARG 518.A O no hydrogen 3.322 N/A ALA 523.A N LEU 519.A O no hydrogen 3.225 N/A LYS 524.A N LEU 520.A O no hydrogen 2.898 N/A LYS 524.A NZ GLU 499.A OE2 no hydrogen 2.760 N/A ALA 525.A N TYR 521.A O no hydrogen 2.888 N/A VAL 526.A N VAL 522.A O no hydrogen 2.960 N/A TYR 529.A OH LEU 487.A O no hydrogen 2.735 N/A THR 530.A N PRO 527.A O no hydrogen 3.144 N/A THR 530.A OG1 PRO 527.A O no hydrogen 2.782 N/A TYR 531.A N VAL 528.A O no hydrogen 2.895 N/A CYS 536.A SG LEU 575.A O no hydrogen 3.613 N/A ASP 537.A N SER 534.A O no hydrogen 2.866 N/A THR 539.A N ASP 537.A OD2 no hydrogen 3.129 N/A THR 539.A OG1 ASP 537.A OD2 no hydrogen 3.065 N/A LEU 540.A N ASP 537.A O no hydrogen 2.987 N/A LEU 544.A N LEU 540.A O no hydrogen 3.248 N/A GLY 545.A N PRO 541.A O no hydrogen 3.318 N/A LEU 546.A N LEU 542.A O no hydrogen 2.815 N/A LYS 547.A N LEU 543.A O no hydrogen 2.706 N/A GLN 548.A N LEU 544.A O no hydrogen 3.117 N/A SER 549.A N GLY 545.A O no hydrogen 3.075 N/A SER 549.A OG ARG 518.A O no hydrogen 3.536 N/A SER 549.A OG GLY 545.A O no hydrogen 3.113 N/A CYS 550.A N LEU 546.A O no hydrogen 2.831 N/A CYS 550.A SG LEU 546.A O no hydrogen 3.466 N/A PHE 551.A N LYS 547.A O no hydrogen 3.182 N/A GLY 552.A N GLN 548.A O no hydrogen 2.771 N/A SER 553.A N SER 549.A O no hydrogen 2.897 N/A SER 553.A OG ASP 514.A OD1 no hydrogen 3.164 N/A SER 553.A OG THR 515.A OG1 no hydrogen 2.717 N/A ILE 554.A N CYS 550.A O no hydrogen 3.136 N/A LEU 555.A N PHE 551.A O no hydrogen 3.245 N/A ALA 556.A N GLY 552.A O no hydrogen 3.188 N/A LEU 557.A N SER 553.A O no hydrogen 2.993 N/A HIS 558.A N ALA 556.A O no hydrogen 3.274 N/A VAL 565.A N THR 561.A O no hydrogen 3.061 N/A ASP 566.A N ASP 562.A O no hydrogen 3.215 N/A ARG 567.A N THR 563.A O no hydrogen 3.010 N/A ARG 567.A NH1 GLY 510.A O no hydrogen 2.737 N/A LEU 568.A N LEU 564.A O no hydrogen 2.917 N/A ALA 569.A N VAL 565.A O no hydrogen 2.756 N/A GLU 570.A N ASP 566.A O no hydrogen 3.058 N/A PHE 571.A N ARG 567.A O no hydrogen 3.015 N/A GLU 572.A N LEU 568.A O no hydrogen 3.141 N/A LYS 573.A N ALA 569.A O no hydrogen 3.101 N/A ARG 574.A N GLU 570.A O no hydrogen 2.870 N/A ARG 574.A NE GLU 570.A OE2 no hydrogen 2.476 N/A LEU 575.A N PHE 571.A O no hydrogen 2.793 N/A SER 576.A N GLU 572.A O no hydrogen 2.931 N/A SER 576.A OG GLU 572.A O no hydrogen 2.930 N/A ASP 577.A N LYS 573.A O no hydrogen 3.134 N/A ARG 578.A N ARG 574.A O no hydrogen 2.994 N/A ARG 578.A N LEU 575.A O no hydrogen 3.310 N/A LEU 579.A N LEU 575.A O no hydrogen 2.935 N/A GLU 582.A N ARG 578.A O no hydrogen 3.238 N/A GLU 582.A N LEU 579.A O no hydrogen 3.143 N/A MET 583.A N LEU 579.A O no hydrogen 3.125 N/A THR 584.A N GLU 580.A O no hydrogen 2.878 N/A THR 584.A OG1 GLU 580.A O no hydrogen 3.160 N/A ALA 585.A N ASN 581.A O no hydrogen 2.956 N/A VAL 586.A N GLU 582.A O no hydrogen 3.234 N/A ARG 587.A N MET 583.A O no hydrogen 2.925 N/A ARG 587.A NH1 THR 584.A OG1 no hydrogen 3.007 N/A VAL 588.A N THR 584.A O no hydrogen 2.863 N/A LEU 589.A N ALA 585.A O no hydrogen 3.032 N/A TYR 590.A N VAL 586.A O no hydrogen 3.028 N/A TYR 590.A OH ASP 486.A OD1 no hydrogen 2.652 N/A TYR 590.A OH GLN 489.A OE1 no hydrogen 3.034 N/A GLU 591.A N ARG 587.A O no hydrogen 3.117 N/A ARG 594.A NE PRO 291.A O no hydrogen 2.980 N/A ARG 594.A NH1 GLU 492.A OE1 no hydrogen 3.366 N/A ARG 594.A NH2 PRO 291.A O no hydrogen 2.955 N/A GLY 597.A N ARG 594.A O no hydrogen 3.312 N/A SER 598.A N ILE 595.A O no hydrogen 2.702 N/A SER 598.A OG GLU 254.A OE1 no hydrogen 2.817 N/A SER 598.A OG GLU 254.A OE2 no hydrogen 3.384 N/A PHE 600.A N SER 598.A OG no hydrogen 2.787 N/A LEU 601.A N SER 598.A O no hydrogen 3.062 N/A PHE 603.A N PHE 600.A O no hydrogen 3.086 N/A TYR 604.A N PHE 600.A O no hydrogen 3.233 N/A TYR 604.A OH ASP 486.A OD1 no hydrogen 2.525 N/A ARG 605.A N LEU 601.A O no hydrogen 2.767 N/A PHE 606.A N PRO 602.A O no hydrogen 3.028 N/A VAL 607.A N PHE 603.A O no hydrogen 3.111 N/A ARG 608.A N TYR 604.A O no hydrogen 2.882 N/A ARG 608.A NE ASP 486.A OD2 no hydrogen 2.976 N/A ARG 608.A NH1 THR 613.A OG1 no hydrogen 3.123 N/A ARG 608.A NH2 ASP 486.A OD2 no hydrogen 2.668 N/A ASP 609.A N ARG 605.A O no hydrogen 2.544 N/A GLU 610.A N ARG 605.A O no hydrogen 3.090 N/A LEU 611.A N PHE 606.A O no hydrogen 2.779 N/A ASP 612.A N ASP 609.A O no hydrogen 3.300 N/A THR 613.A N ARG 608.A O no hydrogen 2.989 N/A THR 613.A OG1 VAL 607.A O no hydrogen 2.567 N/A MET 616.A N GLN 483.A OE1 no hydrogen 2.802 N/A ARG 619.A N SER 617.A OG no hydrogen 2.993 N/A ARG 619.A NH1 GLU 591.A OE2 no hydrogen 2.734 N/A THR 623.A N GLU 626.A OE2 no hydrogen 2.962 N/A THR 623.A OG1 GLU 626.A OE2 no hydrogen 3.294 N/A GLU 626.A N THR 623.A OG1 no hydrogen 3.256 N/A ASP 627.A N PRO 624.A O no hydrogen 3.041 N/A VAL 628.A N PRO 624.A O no hydrogen 2.914 N/A GLN 629.A N GLN 625.A O no hydrogen 2.729 N/A LYS 630.A NZ LEU 611.A O no hydrogen 3.089 N/A LYS 630.A NZ ASP 612.A O no hydrogen 2.967 N/A VAL 631.A N ASP 627.A O no hydrogen 3.458 N/A PHE 632.A N VAL 628.A O no hydrogen 2.766 N/A ASP 633.A N GLN 629.A O no hydrogen 2.991 N/A ALA 634.A N LYS 630.A O no hydrogen 3.205 N/A ILE 635.A N VAL 631.A O no hydrogen 2.932 N/A ALA 636.A N PHE 632.A O no hydrogen 2.748 N/A ASP 637.A N ASP 633.A O no hydrogen 2.835 N/A GLY 638.A N ILE 635.A O no hydrogen 3.310 N/A ARG 639.A NE ASP 637.A OD2 no hydrogen 2.699 N/A ARG 639.A NH2 ASP 637.A OD2 no hydrogen 3.038 N/A ILE 640.A N ALA 634.A O no hydrogen 2.954 N/A THR 641.A N GLY 638.A O no hydrogen 3.018 N/A THR 641.A OG1 GLY 638.A O no hydrogen 3.036 N/A VAL 642.A N ARG 639.A O no hydrogen 3.289 N/A LEU 644.A N ILE 640.A O no hydrogen 3.306 N/A LEU 645.A N THR 641.A O no hydrogen 2.890 N/A HIS 646.A N.A VAL 642.A O no hydrogen 2.958 N/A HIS 646.A N.B VAL 642.A O no hydrogen 2.979 N/A HIS 646.A ND1.B HIS 646.A O.B no hydrogen 2.690 N/A CYS 647.A N PRO 643.A O no hydrogen 2.801 N/A CYS 647.A SG ARG 599.A O no hydrogen 3.356 N/A LEU 648.A N LEU 644.A O no hydrogen 3.123 N/A LEU 648.A N LEU 645.A O no hydrogen 3.033 N/A GLN 649.A N LEU 645.A O no hydrogen 2.727 N/A GLN 649.A N HIS 646.A O.B no hydrogen 3.354 N/A PHE 651.A N LEU 648.A O no hydrogen 2.855 N/A