Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4yal_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LYS 4.A NZ GLU 54.A O no hydrogen 2.732 N/A LYS 4.A NZ TYR 56.A O no hydrogen 3.079 N/A GLU 5.A N GLU 55.A O no hydrogen 2.729 N/A VAL 9.A N SER 7.A OG no hydrogen 3.245 N/A GLU 10.A N SER 7.A OG no hydrogen 3.302 N/A LYS 11.A N SER 7.A O no hydrogen 3.191 N/A LYS 11.A NZ GLU 289.A O no hydrogen 3.457 N/A MET 12.A N PHE 8.A O no hydrogen 3.006 N/A LYS 13.A N VAL 9.A O no hydrogen 2.959 N/A LYS 13.A NZ GLU 10.A OE2 no hydrogen 3.477 N/A LYS 13.A NZ GLU 66.A OE2 no hydrogen 2.596 N/A LYS 14.A N GLU 10.A O no hydrogen 3.072 N/A THR 15.A N LYS 11.A O no hydrogen 3.066 N/A THR 15.A N MET 12.A O no hydrogen 3.288 N/A THR 15.A OG1 LYS 11.A O no hydrogen 2.692 N/A THR 15.A OG1 MET 12.A O no hydrogen 3.407 N/A GLY 16.A N LYS 13.A O no hydrogen 3.318 N/A ARG 17.A N MET 12.A O no hydrogen 2.863 N/A ARG 17.A NH2 ASP 287.A OD2 no hydrogen 3.003 N/A ASN 18.A N ARG 47.A O no hydrogen 2.910 N/A ASN 18.A ND2 LYS 69.A O no hydrogen 3.036 N/A ILE 19.A N ARG 47.A O no hydrogen 3.240 N/A ILE 20.A N LEU 71.A O no hydrogen 3.125 N/A VAL 21.A N MET 49.A O no hydrogen 2.867 N/A PHE 22.A N VAL 73.A O no hydrogen 2.865 N/A TYR 23.A N ALA 51.A O no hydrogen 3.172 N/A GLY 24.A N CYS 75.A O no hydrogen 2.855 N/A SER 25.A N ASN 87.A OD1 no hydrogen 3.057 N/A GLN 26.A NE2 ASP 86.A OD2 no hydrogen 3.192 N/A GLN 26.A NE2 TYR 390.A OH no hydrogen 3.252 N/A GLU 32.A N GLY 28.A O no hydrogen 3.119 N/A PHE 33.A N THR 29.A O no hydrogen 3.083 N/A ALA 34.A N ALA 30.A O no hydrogen 2.921 N/A ASN 35.A N GLU 31.A O no hydrogen 3.106 N/A ARG 36.A N GLU 32.A O no hydrogen 2.974 N/A ARG 36.A NH1 GLU 152.A OE1 no hydrogen 3.053 N/A ARG 36.A NH1 GLU 152.A OE2 no hydrogen 3.238 N/A ARG 36.A NH2 GLU 152.A OE2 no hydrogen 2.905 N/A LEU 37.A N PHE 33.A O no hydrogen 3.023 N/A SER 38.A N ALA 34.A O no hydrogen 2.899 N/A LYS 39.A N ASN 35.A O no hydrogen 2.981 N/A LYS 39.A NZ GLN 179.A OE1 no hydrogen 3.237 N/A ASP 40.A N ARG 36.A O no hydrogen 2.941 N/A ALA 41.A N LEU 37.A O no hydrogen 3.309 N/A ARG 43.A N ASP 40.A O no hydrogen 2.725 N/A ARG 43.A NH1 TYR 44.A OH no hydrogen 3.362 N/A ARG 43.A NH2 TYR 44.A OH no hydrogen 3.079 N/A TYR 44.A N ALA 41.A O no hydrogen 2.886 N/A MET 46.A N ALA 41.A O no hydrogen 3.179 N/A ARG 47.A N ASN 18.A OD1 no hydrogen 2.977 N/A MET 49.A N ILE 19.A O no hydrogen 3.120 N/A SER 50.A OG ASN 35.A OD1 no hydrogen 2.490 N/A ALA 51.A N VAL 21.A O no hydrogen 2.799 N/A GLU 54.A N ASP 52.A OD1 no hydrogen 2.946 N/A GLU 55.A N ASP 52.A O no hydrogen 3.056 N/A TYR 56.A N PRO 53.A O no hydrogen 3.008 N/A ALA 59.A N ASP 57.A OD1 no hydrogen 3.391 N/A ASP 60.A N ASP 57.A O no hydrogen 3.184 N/A LEU 61.A N LEU 58.A O no hydrogen 2.920 N/A SER 62.A N ALA 59.A O no hydrogen 3.216 N/A SER 62.A OG ALA 59.A O no hydrogen 3.083 N/A SER 63.A N ASP 60.A O no hydrogen 2.974 N/A LEU 64.A N LEU 61.A O no hydrogen 2.988 N/A GLU 66.A N SER 63.A O no hydrogen 2.951 N/A ILE 67.A N LEU 64.A O no hydrogen 2.999 N/A LYS 69.A NZ PHE 170.A O no hydrogen 3.522 N/A SER 70.A OG LEU 64.A O no hydrogen 2.898 N/A SER 70.A OG ILE 67.A O no hydrogen 3.112 N/A LEU 71.A N ASN 18.A O no hydrogen 2.892 N/A VAL 72.A N LYS 106.A O no hydrogen 3.065 N/A VAL 73.A N ILE 20.A O no hydrogen 2.944 N/A PHE 74.A N ALA 108.A O no hydrogen 2.940 N/A CYS 75.A N PHE 22.A O no hydrogen 2.871 N/A MET 76.A N PHE 110.A O no hydrogen 3.012 N/A ALA 77.A N GLY 24.A O no hydrogen 2.919 N/A THR 78.A N LEU 112.A O no hydrogen 3.021 N/A TYR 79.A N ASP 83.A O no hydrogen 2.833 N/A GLU 81.A N ASP 83.A OD2 no hydrogen 3.197 N/A ASP 83.A N TYR 79.A O no hydrogen 2.893 N/A THR 85.A OG1 ASN 87.A OD1 no hydrogen 2.659 N/A ASP 86.A N GLN 26.A OE1 no hydrogen 2.964 N/A ASN 87.A ND2 TYR 23.A O no hydrogen 2.856 N/A ASN 87.A ND2 ASP 52.A OD1 no hydrogen 2.971 N/A ALA 88.A N THR 85.A O no hydrogen 2.913 N/A GLN 89.A N ASP 86.A O no hydrogen 3.393 N/A TYR 92.A N ALA 88.A O no hydrogen 2.886 N/A ASP 93.A N GLN 89.A O no hydrogen 2.913 N/A TRP 94.A N ASP 90.A O no hydrogen 3.064 N/A LEU 95.A N PHE 91.A O no hydrogen 2.964 N/A GLN 96.A N TYR 92.A O no hydrogen 3.182 N/A GLU 97.A N ASP 93.A O no hydrogen 3.197 N/A THR 98.A N TRP 94.A O no hydrogen 2.785 N/A VAL 100.A N THR 98.A OG1 no hydrogen 3.004 N/A LEU 102.A N LEU 134.A O no hydrogen 2.904 N/A THR 103.A N ASP 101.A OD1 no hydrogen 3.238 N/A THR 103.A OG1 ASP 101.A OD1 no hydrogen 2.727 N/A THR 103.A OG1 ASP 101.A OD2 no hydrogen 3.319 N/A VAL 105.A N LEU 102.A O no hydrogen 3.042 N/A PHE 107.A N GLN 137.A O no hydrogen 3.062 N/A ALA 108.A N VAL 72.A O no hydrogen 3.126 N/A PHE 110.A N PHE 74.A O no hydrogen 2.854 N/A GLY 111.A N GLY 143.A O no hydrogen 2.753 N/A LEU 112.A N MET 76.A O no hydrogen 2.778 N/A GLY 113.A N GLY 145.A O no hydrogen 2.986 N/A LYS 115.A N ASP 146.A OD1 no hydrogen 2.956 N/A THR 116.A N ASN 114.A OD1 no hydrogen 2.883 N/A THR 116.A OG1 ASN 114.A OD1 no hydrogen 2.688 N/A TYR 117.A N ASN 114.A O no hydrogen 2.998 N/A HIS 119.A ND1 GLU 81.A OE1 no hydrogen 3.280 N/A ASN 121.A ND2 GLY 111.A O no hydrogen 3.689 N/A ASN 121.A ND2 GLY 145.A O no hydrogen 2.988 N/A ALA 122.A N HIS 119.A O no hydrogen 3.461 N/A MET 123.A N THR 78.A OG1 no hydrogen 3.046 N/A LYS 125.A N ASN 121.A O no hydrogen 3.005 N/A LYS 125.A NZ PHE 120.A O no hydrogen 3.059 N/A TYR 126.A N ALA 122.A O no hydrogen 2.926 N/A VAL 127.A N MET 123.A O no hydrogen 3.014 N/A ASP 128.A N GLY 124.A O no hydrogen 3.069 N/A GLN 129.A N LYS 125.A O no hydrogen 3.096 N/A ARG 130.A N TYR 126.A O no hydrogen 2.800 N/A ARG 130.A NE LEU 95.A O no hydrogen 2.752 N/A ARG 130.A NH1 GLN 133.A OE1 no hydrogen 3.064 N/A ARG 130.A NH2 LEU 95.A O no hydrogen 3.174 N/A LEU 131.A N VAL 127.A O no hydrogen 3.044 N/A GLN 133.A N GLN 129.A O no hydrogen 3.095 N/A LEU 134.A N ARG 130.A O no hydrogen 2.989 N/A GLY 135.A N GLU 132.A O no hydrogen 2.870 N/A ALA 136.A N LEU 131.A O no hydrogen 3.008 N/A GLN 137.A N VAL 105.A O no hydrogen 2.850 N/A ARG 138.A NE ASP 128.A OD1 no hydrogen 2.771 N/A ARG 138.A NE ASP 128.A OD2 no hydrogen 3.356 N/A ARG 138.A NH1 GLU 132.A OE1 no hydrogen 3.013 N/A ARG 138.A NH1 GLU 132.A OE2 no hydrogen 3.519 N/A ARG 138.A NH2 ASP 128.A O no hydrogen 3.258 N/A ARG 138.A NH2 ASP 128.A OD2 no hydrogen 3.151 N/A ARG 138.A NH2 GLU 132.A OE2 no hydrogen 3.116 N/A ILE 139.A N PHE 107.A O no hydrogen 2.806 N/A GLY 143.A N VAL 109.A O no hydrogen 2.848 N/A GLY 145.A N GLY 111.A O no hydrogen 2.792 N/A ASP 146.A N ASP 154.A OD2 no hydrogen 2.850 N/A ASP 147.A N GLY 113.A O no hydrogen 2.789 N/A ASP 148.A N ASP 146.A OD1 no hydrogen 2.850 N/A GLY 149.A N ASP 146.A O no hydrogen 3.072 N/A GLU 153.A N ASN 150.A OD1 no hydrogen 2.944 N/A ASP 154.A N ASN 150.A O no hydrogen 3.220 N/A PHE 155.A N LEU 151.A O no hydrogen 2.958 N/A ILE 156.A N GLU 152.A O no hydrogen 2.955 N/A THR 157.A N GLU 153.A O no hydrogen 2.941 N/A THR 157.A OG1 GLU 153.A O no hydrogen 3.041 N/A TRP 158.A N ASP 154.A O no hydrogen 3.087 N/A TRP 158.A NE1 GLU 141.A O no hydrogen 2.916 N/A ARG 159.A N PHE 155.A O no hydrogen 2.815 N/A ARG 159.A NE ASP 40.A OD2 no hydrogen 2.696 N/A ARG 159.A NH2 ASP 40.A OD1 no hydrogen 2.982 N/A ARG 159.A NH2 ASP 40.A OD2 no hydrogen 3.562 N/A GLU 160.A N ILE 156.A O no hydrogen 2.988 N/A GLN 161.A N TRP 158.A O no hydrogen 3.186 N/A PHE 162.A N TRP 158.A O no hydrogen 2.839 N/A TRP 163.A N ARG 159.A O no hydrogen 3.377 N/A TRP 163.A NE1 ASP 40.A OD2 no hydrogen 3.096 N/A ALA 165.A N GLN 161.A O no hydrogen 3.247 N/A VAL 166.A N PHE 162.A O no hydrogen 2.909 N/A CYS 167.A N TRP 163.A O no hydrogen 2.809 N/A CYS 167.A SG TRP 163.A O no hydrogen 3.175 N/A GLU 168.A N PRO 164.A O no hydrogen 2.831 N/A PHE 169.A N ALA 165.A O no hydrogen 3.014 N/A PHE 170.A N VAL 166.A O no hydrogen 3.001 N/A VAL 172.A N CYS 167.A O no hydrogen 2.931 N/A SER 176.A OG GLU 323.A OE2 no hydrogen 2.871 N/A ARG 178.A NE GLU 381.A OE2 no hydrogen 3.188 N/A ARG 178.A NH1 ASP 377.A OD2 no hydrogen 2.504 N/A ARG 178.A NH2 ASP 377.A OD2 no hydrogen 2.996 N/A ARG 178.A NH2 GLU 381.A OE2 no hydrogen 3.176 N/A GLN 179.A N GLU 381.A OE1 no hydrogen 2.846 N/A TYR 180.A N GLU 381.A OE2 no hydrogen 3.295 N/A GLU 181.A N ASN 284.A O no hydrogen 2.813 N/A VAL 183.A N SER 282.A O no hydrogen 2.980 N/A HIS 185.A N ILE 280.A O no hydrogen 2.954 N/A HIS 185.A NE2 SER 282.A OG no hydrogen 2.862 N/A ALA 191.A N ASP 189.A OD1 no hydrogen 3.480 N/A LYS 192.A N ASP 189.A O no hydrogen 3.000 N/A VAL 193.A N VAL 190.A O no hydrogen 3.402 N/A TYR 194.A N PRO 299.A O no hydrogen 2.808 N/A TYR 194.A OH GLY 199.A O no hydrogen 3.118 N/A THR 195.A N GLU 197.A OE1 no hydrogen 2.659 N/A THR 195.A OG1 GLU 197.A OE1 no hydrogen 3.497 N/A GLU 197.A N GLU 197.A OE1 no hydrogen 2.695 N/A LYS 202.A N GLU 197.A OE2 no hydrogen 2.694 N/A SER 203.A N ARG 200.A O no hydrogen 2.940 N/A SER 203.A OG ARG 200.A O no hydrogen 2.617 N/A GLU 205.A N LYS 202.A O no hydrogen 3.100 N/A ASN 206.A N LYS 202.A O no hydrogen 2.841 N/A ASN 206.A ND2 LYS 202.A O no hydrogen 3.532 N/A GLN 207.A NE2 SER 203.A O no hydrogen 3.042 N/A GLN 207.A NE2 PRO 216.A O no hydrogen 3.202 N/A ASP 212.A N ASN 215.A O no hydrogen 2.826 N/A LYS 214.A N ASP 212.A OD1 no hydrogen 3.024 N/A ASN 215.A N ASP 212.A O no hydrogen 2.990 N/A ASN 215.A N ASP 212.A OD1 no hydrogen 2.948 N/A ASN 215.A ND2 LYS 208.A O no hydrogen 2.833 N/A ASN 215.A ND2 PRO 210.A O no hydrogen 2.973 N/A PHE 217.A N MET 441.A O no hydrogen 2.767 N/A LEU 218.A N GLN 207.A OE1 no hydrogen 2.731 N/A ALA 219.A N VAL 439.A O no hydrogen 2.908 N/A VAL 221.A N ALA 437.A O no hydrogen 2.883 N/A THR 222.A N GLU 239.A O no hydrogen 2.891 N/A THR 222.A OG1 GLU 239.A O no hydrogen 3.252 N/A ASN 224.A ND2 ARG 430.A O no hydrogen 3.261 N/A ASN 224.A ND2 LYS 432.A O no hydrogen 2.916 N/A ARG 225.A N HIS 237.A O no hydrogen 2.941 N/A LYS 226.A NZ GLY 230.A O no hydrogen 2.752 N/A LEU 227.A N LEU 235.A O no hydrogen 2.752 N/A ASN 228.A ND2 ARG 233.A O no hydrogen 2.746 N/A GLN 229.A N GLU 501.A O no hydrogen 2.722 N/A GLN 229.A NE2 ASP 500.A O no hydrogen 3.050 N/A ARG 233.A NH2 ASP 502.A OD2 no hydrogen 2.888 N/A LEU 235.A N ASN 228.A OD1 no hydrogen 2.972 N/A MET 236.A N ALA 408.A O no hydrogen 2.795 N/A HIS 237.A N ARG 225.A O no hydrogen 2.892 N/A HIS 237.A ND1 TYR 505.A OH no hydrogen 2.731 N/A HIS 237.A NE2 GLU 239.A OE1 no hydrogen 2.789 N/A LEU 238.A N ILE 406.A O no hydrogen 2.854 N/A GLU 239.A N ALA 223.A O no hydrogen 2.991 N/A LEU 240.A N VAL 404.A O no hydrogen 2.835 N/A ASP 241.A N ALA 220.A O no hydrogen 2.825 N/A ILE 242.A N ASN 402.A O no hydrogen 2.992 N/A SER 243.A N ASP 241.A OD1 no hydrogen 2.837 N/A SER 243.A OG ASP 241.A OD1 no hydrogen 2.805 N/A SER 245.A N ILE 242.A O no hydrogen 3.132 N/A SER 245.A OG ILE 242.A O no hydrogen 2.649 N/A ILE 247.A N SER 245.A OG no hydrogen 3.150 N/A TYR 249.A OH SER 395.A OG no hydrogen 2.959 N/A TYR 249.A OH HIS 400.A O no hydrogen 2.743 N/A TYR 249.A OH SER 403.A O no hydrogen 2.806 N/A GLU 250.A N ASP 253.A OD2 no hydrogen 2.820 N/A SER 251.A OG SER 395.A O no hydrogen 3.442 N/A SER 251.A OG GLU 476.A OE1 no hydrogen 3.241 N/A ASP 253.A N GLU 250.A O no hydrogen 2.971 N/A HIS 254.A N ARG 444.A O no hydrogen 3.161 N/A HIS 254.A NE2 ASP 605.A OD1 no hydrogen 2.723 N/A VAL 255.A N TYR 391.A O no hydrogen 2.804 N/A ALA 256.A N PHE 442.A O no hydrogen 2.810 N/A VAL 257.A N ARG 389.A O no hydrogen 2.927 N/A TYR 258.A N PRO 440.A O no hydrogen 3.052 N/A TYR 258.A OH ALA 213.A O no hydrogen 2.675 N/A ASN 261.A N THR 307.A O no hydrogen 2.821 N/A ASN 261.A ND2 LEU 306.A O no hydrogen 2.875 N/A ASN 261.A ND2 LEU 310.A O no hydrogen 2.817 N/A ALA 264.A N ASP 262.A OD1 no hydrogen 2.658 N/A LEU 265.A N ASP 262.A OD1 no hydrogen 3.212 N/A VAL 266.A N ASP 262.A O no hydrogen 3.144 N/A ASN 267.A N SER 263.A O no hydrogen 2.898 N/A GLN 268.A N ALA 264.A O no hydrogen 2.987 N/A ILE 269.A N LEU 265.A O no hydrogen 3.058 N/A GLY 270.A N VAL 266.A O no hydrogen 3.153 N/A GLU 271.A N ASN 267.A O no hydrogen 2.878 N/A ILE 272.A N GLN 268.A O no hydrogen 2.826 N/A LEU 273.A N ILE 269.A O no hydrogen 3.213 N/A GLY 274.A N GLU 271.A O no hydrogen 3.047 N/A ALA 275.A N GLY 270.A O no hydrogen 2.982 N/A ASP 278.A N ASP 276.A OD1 no hydrogen 2.884 N/A VAL 279.A N ASP 276.A O no hydrogen 3.420 N/A MET 281.A N THR 300.A O no hydrogen 2.914 N/A SER 282.A N VAL 183.A O no hydrogen 3.010 N/A SER 282.A OG HIS 185.A NE2 no hydrogen 2.862 N/A ASN 284.A N GLU 181.A O no hydrogen 2.974 N/A ASN 285.A N LYS 293.A O no hydrogen 2.968 N/A ASN 285.A ND2 LYS 292.A O no hydrogen 2.882 N/A LEU 286.A N GLN 179.A O no hydrogen 2.895 N/A ASP 287.A N ASN 285.A OD1 no hydrogen 2.847 N/A GLU 289.A N ASP 287.A OD1 no hydrogen 2.780 N/A SER 290.A N ASP 287.A O no hydrogen 3.118 N/A SER 290.A N ASP 287.A OD1 no hydrogen 3.178 N/A LYS 292.A N SER 290.A OG no hydrogen 3.092 N/A HIS 294.A ND1 LEU 283.A O no hydrogen 2.949 N/A CYS 298.A SG PHE 296.A O no hydrogen 3.395 N/A THR 300.A N MET 281.A O no hydrogen 2.911 N/A THR 300.A OG1 TYR 194.A O no hydrogen 2.885 N/A THR 301.A OG1 THR 304.A OG1 no hydrogen 3.072 N/A ARG 303.A N LEU 277.A O no hydrogen 2.959 N/A ARG 303.A NE ASP 278.A OD1 no hydrogen 2.899 N/A ARG 303.A NH1 ASN 267.A OD1 no hydrogen 2.700 N/A ARG 303.A NH2 ASP 278.A OD2 no hydrogen 3.137 N/A THR 304.A N THR 301.A OG1 no hydrogen 3.028 N/A THR 304.A OG1 THR 301.A OG1 no hydrogen 3.072 N/A ALA 305.A N THR 301.A O no hydrogen 2.978 N/A LEU 306.A N TYR 302.A O no hydrogen 2.857 N/A THR 307.A N ARG 303.A O no hydrogen 2.965 N/A THR 307.A N THR 304.A O no hydrogen 3.240 N/A THR 307.A OG1 ARG 303.A O no hydrogen 2.555 N/A TYR 308.A N THR 304.A O no hydrogen 2.876 N/A TYR 309.A N ALA 305.A O no hydrogen 2.966 N/A TYR 309.A OH GLU 197.A O no hydrogen 2.648 N/A ASP 311.A N PRO 384.A O no hydrogen 2.885 N/A THR 313.A N ASP 311.A OD1 no hydrogen 3.118 N/A THR 313.A OG1 ASP 311.A OD1 no hydrogen 3.570 N/A ASN 314.A N ASP 311.A OD1 no hydrogen 3.036 N/A ASN 314.A ND2 ASP 311.A OD2 no hydrogen 2.713 N/A ARG 317.A NH1 GLU 152.A OE1 no hydrogen 3.315 N/A THR 318.A N GLU 152.A OE2 no hydrogen 3.002 N/A THR 318.A OG1 GLU 152.A OE2 no hydrogen 2.614 N/A VAL 320.A N ARG 317.A O no hydrogen 3.184 N/A LEU 321.A N ARG 317.A O no hydrogen 3.409 N/A TYR 322.A N THR 318.A O no hydrogen 2.846 N/A GLU 323.A N ASN 319.A O no hydrogen 3.003 N/A LEU 324.A N VAL 320.A O no hydrogen 3.056 N/A LEU 324.A N LEU 321.A O no hydrogen 3.232 N/A ALA 325.A N LEU 321.A O no hydrogen 3.089 N/A GLN 326.A NE2 SER 176.A OG no hydrogen 3.019 N/A GLN 326.A NE2 GLU 323.A O no hydrogen 2.679 N/A TYR 327.A N LEU 324.A O no hydrogen 2.871 N/A TYR 327.A OH HIS 378.A ND1 no hydrogen 2.627 N/A ALA 328.A N ALA 325.A O no hydrogen 3.187 N/A SER 329.A N SER 371.A O no hydrogen 3.324 N/A GLU 330.A N SER 371.A OG no hydrogen 3.087 N/A GLN 334.A N GLU 330.A O no hydrogen 2.945 N/A GLN 334.A NE2 ALA 325.A O no hydrogen 3.080 N/A GLU 335.A N PRO 331.A O no hydrogen 2.877 N/A HIS 336.A N SER 332.A O no hydrogen 2.950 N/A LEU 337.A N GLU 333.A O no hydrogen 3.053 N/A HIS 338.A N GLN 334.A O no hydrogen 2.914 N/A LYS 339.A N GLU 335.A O no hydrogen 2.903 N/A LYS 339.A NZ GLU 335.A OE2 no hydrogen 2.615 N/A MET 340.A N LEU 337.A O no hydrogen 3.248 N/A SER 342.A N LYS 339.A O no hydrogen 3.051 N/A SER 342.A OG SER 344.A O no hydrogen 2.560 N/A SER 343.A OG GLU 160.A OE1 no hydrogen 2.509 N/A SER 343.A OG GLU 160.A OE2 no hydrogen 3.263 N/A SER 344.A N SER 342.A OG no hydrogen 3.270 N/A LYS 348.A NZ SER 343.A O no hydrogen 3.373 N/A GLU 349.A N GLY 345.A O no hydrogen 3.073 N/A LEU 350.A N GLU 346.A O no hydrogen 2.793 N/A TYR 351.A N GLY 347.A O no hydrogen 3.073 N/A TYR 351.A OH PRO 316.A O no hydrogen 2.906 N/A LEU 352.A N LYS 348.A O no hydrogen 2.972 N/A SER 353.A N GLU 349.A O no hydrogen 3.019 N/A SER 353.A OG GLU 349.A O no hydrogen 3.100 N/A TRP 354.A N LEU 350.A O no hydrogen 2.786 N/A VAL 355.A N TYR 351.A O no hydrogen 3.063 N/A VAL 356.A N TYR 351.A O no hydrogen 3.022 N/A GLU 357.A N LEU 352.A O no hydrogen 2.891 N/A ALA 358.A N SER 353.A O no hydrogen 3.116 N/A ARG 359.A N VAL 356.A O no hydrogen 2.976 N/A ARG 359.A NE TYR 413.A OH no hydrogen 3.209 N/A ARG 359.A NH1 ASN 314.A OD1 no hydrogen 3.250 N/A ARG 360.A N VAL 355.A O no hydrogen 2.986 N/A ARG 360.A NE ASP 368.A OD2 no hydrogen 2.681 N/A ARG 360.A NH1 TRP 354.A O no hydrogen 2.862 N/A ARG 360.A NH2 ASP 368.A OD2 no hydrogen 3.099 N/A ALA 364.A N HIS 361.A ND1 no hydrogen 3.146 N/A ILE 365.A N HIS 361.A O no hydrogen 3.140 N/A LEU 366.A N ILE 362.A O no hydrogen 2.970 N/A GLN 367.A N LEU 363.A O no hydrogen 2.888 N/A ASP 368.A N ALA 364.A O no hydrogen 2.851 N/A TYR 369.A N ILE 365.A O no hydrogen 2.897 N/A SER 371.A N GLU 333.A OE2 no hydrogen 3.049 N/A SER 371.A OG GLU 333.A OE2 no hydrogen 2.440 N/A LEU 372.A N TYR 369.A O no hydrogen 2.985 N/A ARG 373.A N TYR 327.A O no hydrogen 3.018 N/A ARG 373.A NH1 LEU 366.A O no hydrogen 2.966 N/A ARG 373.A NH1 LEU 372.A O no hydrogen 2.928 N/A HIS 378.A ND1 TYR 327.A OH no hydrogen 2.627 N/A LEU 379.A N PRO 375.A O no hydrogen 3.174 N/A CYS 380.A N ILE 376.A O no hydrogen 2.980 N/A CYS 380.A SG ILE 376.A O no hydrogen 3.411 N/A GLU 381.A N ASP 377.A O no hydrogen 3.176 N/A GLU 381.A N HIS 378.A O no hydrogen 3.049 N/A LEU 382.A N HIS 378.A O no hydrogen 3.103 N/A LEU 382.A N LEU 379.A O no hydrogen 2.944 N/A LEU 383.A N LEU 379.A O no hydrogen 3.050 N/A ARG 385.A NE TYR 309.A O no hydrogen 2.789 N/A LEU 386.A N TYR 309.A O no hydrogen 2.959 N/A GLN 387.A NE2 ARG 385.A O no hydrogen 3.267 N/A ARG 389.A N VAL 257.A O no hydrogen 2.933 N/A ARG 389.A NH2 GLN 387.A O no hydrogen 2.767 N/A TYR 391.A N VAL 255.A O no hydrogen 2.883 N/A SER 392.A OG ASP 605.A OD2 no hydrogen 2.689 N/A ILE 393.A N ASP 253.A O no hydrogen 3.073 N/A ALA 394.A N HIS 405.A O no hydrogen 2.793 N/A SER 395.A OG TYR 249.A OH no hydrogen 2.959 N/A SER 395.A OG SER 403.A O no hydrogen 3.460 N/A SER 396.A N GLN 475.A OE1 no hydrogen 3.053 N/A SER 396.A OG GLU 476.A OE1 no hydrogen 2.546 N/A SER 397.A OG TYR 249.A O no hydrogen 2.664 N/A LYS 398.A N SER 396.A OG no hydrogen 3.175 N/A VAL 399.A N SER 396.A O no hydrogen 3.060 N/A HIS 400.A N SER 396.A O no hydrogen 2.692 N/A SER 403.A N HIS 400.A O no hydrogen 3.274 N/A SER 403.A OG LEU 240.A O no hydrogen 3.532 N/A SER 403.A OG HIS 405.A NE2 no hydrogen 3.199 N/A VAL 404.A N LEU 240.A O no hydrogen 2.947 N/A HIS 405.A N SER 395.A OG no hydrogen 3.144 N/A ILE 406.A N LEU 238.A O no hydrogen 2.783 N/A ALA 408.A N MET 236.A O no hydrogen 3.015 N/A ALA 410.A N HIS 234.A O no hydrogen 2.841 N/A VAL 411.A N THR 426.A OG1 no hydrogen 3.004 N/A TYR 413.A N ASN 421.A O no hydrogen 3.065 N/A ALA 415.A N ARG 419.A O no hydrogen 2.937 N/A GLY 418.A N ALA 415.A O no hydrogen 2.985 N/A ARG 419.A NH1 GLN 367.A OE1 no hydrogen 2.823 N/A ARG 419.A NH1 ASP 368.A OD1 no hydrogen 3.308 N/A ARG 419.A NH2 ASP 368.A OD2 no hydrogen 2.894 N/A ARG 419.A NH2 SER 417.A O no hydrogen 2.854 N/A ASN 421.A N TYR 413.A O no hydrogen 2.838 N/A ASN 421.A ND2 ARG 359.A O no hydrogen 3.103 N/A ASN 421.A ND2 TYR 413.A OH no hydrogen 3.064 N/A GLY 423.A N VAL 411.A O no hydrogen 2.819 N/A SER 427.A N GLY 423.A O no hydrogen 3.014 N/A SER 427.A OG GLY 423.A O no hydrogen 2.677 N/A TRP 428.A N VAL 424.A O no hydrogen 3.241 N/A LEU 429.A N ALA 425.A O no hydrogen 2.819 N/A ARG 430.A N THR 426.A O no hydrogen 2.860 N/A ALA 431.A N SER 427.A O no hydrogen 3.214 N/A LYS 432.A N LEU 429.A O no hydrogen 3.004 N/A LYS 432.A NZ LEU 438.A O no hydrogen 3.005 N/A VAL 439.A N ALA 219.A O no hydrogen 2.831 N/A MET 441.A N PHE 217.A O no hydrogen 2.831 N/A PHE 442.A N ALA 256.A O no hydrogen 3.031 N/A ARG 444.A N HIS 254.A O no hydrogen 2.950 N/A ARG 444.A NE ASP 86.A OD2 no hydrogen 3.174 N/A ARG 444.A NH2 ASP 86.A OD1 no hydrogen 3.160 N/A SER 446.A N ASP 253.A OD1 no hydrogen 3.003 N/A SER 446.A OG GLY 252.A O no hydrogen 2.497 N/A PHE 448.A N SER 446.A OG no hydrogen 3.206 N/A ARG 449.A NH1 ASP 253.A OD1 no hydrogen 2.771 N/A ARG 449.A NH1 PHE 448.A O no hydrogen 3.179 N/A ARG 449.A NH2 ASP 253.A OD1 no hydrogen 2.582 N/A SER 454.A OG GLU 486.A O no hydrogen 2.700 N/A THR 456.A N LYS 453.A O no hydrogen 3.199 N/A VAL 458.A N GLU 489.A O no hydrogen 2.915 N/A ILE 459.A N HIS 556.A O no hydrogen 2.842 N/A MET 460.A N LEU 491.A O no hydrogen 2.901 N/A VAL 461.A N TYR 558.A O no hydrogen 2.781 N/A GLY 462.A N TYR 493.A O no hydrogen 3.078 N/A GLY 464.A N GLY 495.A O no hydrogen 2.781 N/A GLY 466.A N PRO 463.A O no hydrogen 2.832 N/A ILE 467.A N GLY 464.A O no hydrogen 3.242 N/A ALA 468.A N THR 465.A O no hydrogen 3.132 N/A MET 471.A N ILE 467.A O no hydrogen 3.212 N/A MET 471.A N ALA 468.A O no hydrogen 3.285 N/A PHE 473.A N PRO 469.A O no hydrogen 3.002 N/A ILE 474.A N PHE 470.A O no hydrogen 2.823 N/A GLN 475.A N MET 471.A O no hydrogen 2.972 N/A GLU 476.A N GLY 472.A O no hydrogen 2.974 N/A ARG 477.A N PHE 473.A O no hydrogen 2.888 N/A ARG 477.A NE THR 490.A OG1 no hydrogen 2.950 N/A ARG 477.A NH1 THR 456.A O no hydrogen 3.226 N/A ARG 477.A NH2 THR 456.A O no hydrogen 2.906 N/A ARG 477.A NH2 GLU 489.A O no hydrogen 3.153 N/A ARG 477.A NH2 THR 490.A OG1 no hydrogen 3.184 N/A ALA 478.A N ILE 474.A O no hydrogen 2.894 N/A TRP 479.A N GLN 475.A O no hydrogen 2.987 N/A LEU 480.A N GLU 476.A O no hydrogen 2.830 N/A ARG 481.A N ARG 477.A O no hydrogen 3.231 N/A GLU 482.A N ALA 478.A O no hydrogen 3.026 N/A GLN 483.A N TRP 479.A O no hydrogen 2.845 N/A GLN 483.A N LEU 480.A O no hydrogen 2.966 N/A GLY 484.A N ARG 481.A O no hydrogen 3.071 N/A LYS 485.A N LEU 480.A O no hydrogen 3.048 N/A GLY 488.A N SER 454.A O no hydrogen 2.889 N/A THR 490.A N THR 519.A OG1 no hydrogen 2.835 N/A THR 490.A OG1 GLY 488.A O no hydrogen 3.396 N/A LEU 491.A N VAL 458.A O no hydrogen 2.944 N/A LEU 492.A N GLN 520.A O no hydrogen 3.111 N/A TYR 493.A N MET 460.A O no hydrogen 2.770 N/A TYR 493.A OH ASP 542.A OD2 no hydrogen 2.637 N/A TYR 494.A N ASN 522.A O no hydrogen 2.853 N/A TYR 494.A OH ASP 502.A O no hydrogen 3.375 N/A CYS 496.A N ALA 524.A O no hydrogen 3.048 N/A CYS 496.A SG ARG 498.A O no hydrogen 3.952 N/A CYS 496.A SG ASP 502.A OD1 no hydrogen 3.673 N/A ARG 497.A N ASP 502.A OD2 no hydrogen 2.863 N/A ARG 497.A NH1 GLU 232.A OE2 no hydrogen 2.754 N/A ARG 498.A N ASP 502.A OD1 no hydrogen 2.906 N/A ARG 498.A NH1 GLU 501.A OE2 no hydrogen 3.268 N/A SER 499.A N GLU 528.A OE1 no hydrogen 2.768 N/A SER 499.A OG GLU 528.A OE1 no hydrogen 2.980 N/A GLU 501.A N ARG 498.A O no hydrogen 2.994 N/A ASP 502.A N ARG 498.A O no hydrogen 3.176 N/A LEU 504.A N TYR 494.A OH no hydrogen 3.163 N/A TYR 505.A OH HIS 237.A ND1 no hydrogen 2.731 N/A ARG 506.A N TYR 503.A O no hydrogen 3.317 N/A GLU 508.A N GLU 508.A OE1 no hydrogen 2.624 N/A LEU 509.A N TYR 505.A O no hydrogen 2.848 N/A ALA 510.A N ARG 506.A O no hydrogen 2.918 N/A ARG 511.A N GLU 507.A O no hydrogen 3.141 N/A ARG 511.A NH1 ASP 515.A OD1 no hydrogen 2.714 N/A PHE 512.A N GLU 508.A O no hydrogen 3.067 N/A HIS 513.A N LEU 509.A O no hydrogen 2.996 N/A LYS 514.A N ALA 510.A O no hydrogen 2.863 N/A ASP 515.A N ARG 511.A O no hydrogen 2.862 N/A GLY 516.A N HIS 513.A O no hydrogen 3.111 N/A LEU 518.A N PHE 512.A O no hydrogen 3.112 N/A THR 519.A N THR 490.A O no hydrogen 2.804 N/A THR 519.A OG1 THR 490.A O no hydrogen 3.507 N/A ASN 522.A N LEU 492.A O no hydrogen 2.873 N/A ALA 524.A N TYR 494.A O no hydrogen 2.885 N/A SER 526.A N CYS 496.A O no hydrogen 2.842 N/A SER 526.A OG CYS 496.A O no hydrogen 3.348 N/A ARG 527.A N ARG 497.A O no hydrogen 2.930 N/A GLN 529.A NE2 PHE 525.A O no hydrogen 2.820 N/A GLN 529.A NE2 HIS 531.A O no hydrogen 2.966 N/A TYR 534.A N HIS 537.A ND1 no hydrogen 2.822 N/A GLN 536.A N GLN 536.A OE1 no hydrogen 2.765 N/A HIS 537.A N TYR 534.A O no hydrogen 2.983 N/A LEU 538.A N VAL 535.A O no hydrogen 3.012 N/A LEU 539.A N VAL 535.A O no hydrogen 3.009 N/A LYS 540.A N GLN 536.A O no hydrogen 2.997 N/A ARG 541.A N HIS 537.A O no hydrogen 3.065 N/A ARG 541.A NE ASP 542.A OD1 no hydrogen 2.891 N/A ARG 541.A NH2 ASP 542.A OD1 no hydrogen 3.488 N/A ARG 541.A NH2 ASP 542.A OD2 no hydrogen 2.962 N/A ASP 542.A N LEU 538.A O no hydrogen 2.976 N/A ARG 543.A N LYS 540.A O no hydrogen 3.079 N/A ARG 543.A NH1 LYS 540.A O no hydrogen 2.843 N/A HIS 545.A NE2 GLU 489.A OE1 no hydrogen 2.892 N/A LEU 546.A N ASP 542.A O no hydrogen 2.951 N/A TRP 547.A N ARG 543.A O no hydrogen 2.912 N/A LYS 548.A N GLU 544.A O no hydrogen 3.165 N/A LEU 549.A N HIS 545.A O no hydrogen 3.050 N/A ILE 550.A N LEU 546.A O no hydrogen 2.898 N/A HIS 551.A N TRP 547.A O no hydrogen 2.636 N/A GLU 552.A N LYS 548.A O no hydrogen 2.789 N/A GLY 553.A N LYS 548.A O no hydrogen 3.058 N/A ALA 555.A N LEU 549.A O no hydrogen 2.928 N/A HIS 556.A N PRO 457.A O no hydrogen 2.933 N/A ILE 557.A N ARG 601.A O no hydrogen 2.752 N/A TYR 558.A N ILE 459.A O no hydrogen 2.827 N/A TYR 558.A OH ARG 449.A O no hydrogen 2.499 N/A VAL 559.A N SER 603.A O no hydrogen 2.928 N/A CYS 560.A N VAL 461.A O no hydrogen 2.921 N/A CYS 560.A SG GLY 466.A O no hydrogen 3.215 N/A CYS 560.A SG ASP 605.A O no hydrogen 3.216 N/A CYS 560.A SG ASP 605.A OD2 no hydrogen 3.646 N/A GLY 561.A N ASP 605.A O no hydrogen 3.041 N/A ALA 563.A N TRP 607.A O no hydrogen 3.165 N/A ARG 564.A N ASP 562.A OD1 no hydrogen 3.017 N/A ASN 565.A N ASP 562.A OD2 no hydrogen 2.957 N/A MET 566.A N ASP 562.A OD2 no hydrogen 3.095 N/A ALA 567.A N ASP 562.A O no hydrogen 3.153 N/A ASP 569.A N ASN 565.A O no hydrogen 2.959 N/A VAL 570.A N MET 566.A O no hydrogen 2.872 N/A GLN 571.A N ALA 567.A O no hydrogen 2.929 N/A GLN 571.A NE2 GLU 118.A OE1 no hydrogen 3.078 N/A GLN 571.A NE2 TYR 575.A OH no hydrogen 2.731 N/A ASN 572.A N LYS 568.A O no hydrogen 2.823 N/A THR 573.A N ASP 569.A O no hydrogen 3.049 N/A THR 573.A OG1 ASP 569.A O no hydrogen 3.213 N/A PHE 574.A N VAL 570.A O no hydrogen 3.000 N/A TYR 575.A N GLN 571.A O no hydrogen 2.945 N/A ASP 576.A N ASN 572.A O no hydrogen 3.081 N/A ILE 577.A N THR 573.A O no hydrogen 2.978 N/A VAL 578.A N PHE 574.A O no hydrogen 3.048 N/A ALA 579.A N TYR 575.A O no hydrogen 2.898 N/A GLU 580.A N ASP 576.A O no hydrogen 3.012 N/A PHE 581.A N ILE 577.A O no hydrogen 3.013 N/A GLY 582.A N VAL 578.A O no hydrogen 2.803 N/A MET 584.A N ALA 579.A O no hydrogen 2.982 N/A ALA 589.A N GLU 585.A O no hydrogen 2.951 N/A VAL 590.A N HIS 586.A O no hydrogen 2.896 N/A ASP 591.A N THR 587.A O no hydrogen 3.163 N/A TYR 592.A N GLN 588.A O no hydrogen 2.873 N/A VAL 593.A N ALA 589.A O no hydrogen 2.975 N/A LYS 594.A N VAL 590.A O no hydrogen 2.890 N/A LYS 595.A N ASP 591.A O no hydrogen 2.887 N/A LEU 596.A N TYR 592.A O no hydrogen 3.136 N/A MET 597.A N VAL 593.A O no hydrogen 3.209 N/A THR 598.A N LYS 594.A O no hydrogen 3.146 N/A THR 598.A OG1 LYS 595.A O no hydrogen 2.669 N/A LYS 599.A N LYS 595.A O no hydrogen 2.958 N/A GLY 600.A N MET 597.A O no hydrogen 3.149 N/A ARG 601.A N LEU 596.A O no hydrogen 2.831 N/A ARG 601.A NE ALA 555.A O no hydrogen 3.170 N/A ARG 601.A NH2 ILE 550.A O no hydrogen 2.805 N/A ARG 601.A NH2 ALA 555.A O no hydrogen 3.014 N/A SER 603.A N ILE 557.A O no hydrogen 2.841 N/A ASP 605.A N VAL 559.A O no hydrogen 2.917 N/A TRP 607.A N GLY 561.A O no hydrogen 3.099 N/A