Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4o1p_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): SER 1.A OG SER 1.A O no hydrogen 2.712 N/A GLU 3.A N GLU 3.A OE1 no hydrogen 2.724 N/A LEU 6.A N LEU 2.A O no hydrogen 3.389 N/A THR 7.A N GLU 3.A O no hydrogen 3.085 N/A THR 7.A OG1 GLU 3.A O no hydrogen 2.991 N/A GLN 8.A N GLU 4.A O no hydrogen 3.435 N/A ALA 9.A N MET 5.A O no hydrogen 3.026 N/A VAL 10.A N LEU 6.A O no hydrogen 2.937 N/A GLN 11.A N THR 7.A O no hydrogen 3.097 N/A GLU 12.A N GLN 8.A O no hydrogen 2.985 N/A ALA 13.A N VAL 10.A O no hydrogen 3.201 N/A ASP 14.A N ALA 9.A O no hydrogen 2.974 N/A GLN 17.A NE2 ASP 14.A OD2 no hydrogen 2.742 N/A VAL 18.A N ASP 14.A O no hydrogen 3.247 N/A ARG 19.A N ILE 15.A O no hydrogen 3.005 N/A GLN 20.A N GLU 16.A O no hydrogen 3.013 N/A LEU 21.A N GLN 17.A O no hydrogen 3.028 N/A LEU 22.A N VAL 18.A O no hydrogen 2.949 N/A GLU 23.A N ARG 19.A O no hydrogen 3.038 N/A ARG 24.A N GLN 20.A O no hydrogen 2.716 N/A ALA 26.A N LEU 21.A O no hydrogen 3.089 N/A ASP 27.A N GLU 3.A OE2 no hydrogen 3.260 N/A ASN 29.A N ASP 27.A OD1 no hydrogen 2.922 N/A ASN 29.A ND2 GLY 59.A O no hydrogen 3.590 N/A GLN 31.A NE2 GLY 36.A O no hydrogen 2.766 N/A GLN 31.A NE2 ARG 65.A O no hydrogen 2.853 N/A GLU 32.A N TRP 37.A O no hydrogen 3.116 N/A TRP 35.A N GLU 32.A OE1 no hydrogen 3.285 N/A TRP 35.A N GLU 32.A OE2 no hydrogen 3.156 N/A GLY 36.A N GLU 32.A O no hydrogen 2.943 N/A TRP 37.A N GLU 32.A OE2 no hydrogen 2.952 N/A SER 38.A OG HIS 41.A ND1 no hydrogen 2.834 N/A HIS 41.A N SER 38.A OG no hydrogen 3.236 N/A HIS 41.A ND1 SER 38.A OG no hydrogen 2.834 N/A HIS 41.A NE2 ALA 70.A O no hydrogen 3.030 N/A SER 42.A N SER 38.A O no hydrogen 2.914 N/A SER 42.A OG SER 38.A O no hydrogen 3.013 N/A ALA 43.A N PRO 39.A O no hydrogen 2.804 N/A VAL 44.A N LEU 40.A O no hydrogen 2.945 N/A GLN 45.A N HIS 41.A O no hydrogen 2.937 N/A MET 46.A N SER 42.A O no hydrogen 3.007 N/A ASP 47.A N VAL 44.A O no hydrogen 3.098 N/A SER 48.A N ALA 43.A O no hydrogen 3.232 N/A LEU 51.A N SER 48.A OG no hydrogen 3.406 N/A VAL 52.A N SER 48.A O no hydrogen 3.251 N/A ALA 53.A N GLU 49.A O no hydrogen 2.908 N/A LEU 54.A N ASP 50.A O no hydrogen 3.076 N/A LEU 55.A N LEU 51.A O no hydrogen 2.885 N/A LEU 56.A N VAL 52.A O no hydrogen 3.131 N/A LYS 57.A N ALA 53.A O no hydrogen 2.981 N/A HIS 58.A N LEU 54.A O no hydrogen 3.377 N/A HIS 58.A ND1 LEU 54.A O no hydrogen 3.222 N/A GLY 59.A N LEU 56.A O no hydrogen 3.192 N/A ALA 60.A N LEU 55.A O no hydrogen 3.096 N/A ASP 61.A N ASN 29.A OD1 no hydrogen 2.779 N/A CYS 63.A N ASP 61.A OD1 no hydrogen 3.203 N/A LEU 64.A N ASP 61.A O no hydrogen 3.393 N/A ARG 65.A NH1 CYS 98.A O no hydrogen 2.707 N/A LYS 66.A N ALA 70.A O no hydrogen 3.148 N/A LYS 66.A NZ ASN 68.A OD1 no hydrogen 2.806 N/A ARG 67.A N TRP 35.A O no hydrogen 3.057 N/A ARG 67.A NE GLU 34.A O no hydrogen 3.053 N/A GLY 69.A N LYS 66.A O no hydrogen 2.589 N/A ALA 70.A N ASN 68.A OD1 no hydrogen 3.408 N/A THR 71.A OG1 GLU 97.A OE2 no hydrogen 2.504 N/A ILE 75.A N THR 71.A O no hydrogen 3.204 N/A ALA 76.A N PRO 72.A O no hydrogen 3.041 N/A GLY 77.A N ILE 74.A O no hydrogen 3.052 N/A ILE 78.A N ILE 75.A O no hydrogen 2.986 N/A THR 79.A N ILE 75.A O no hydrogen 3.183 N/A THR 79.A OG1 ALA 76.A O no hydrogen 3.068 N/A GLY 80.A N ALA 76.A O no hydrogen 2.900 N/A ASN 81.A ND2 ASP 47.A OD1 no hydrogen 2.890 N/A ARG 83.A N ASN 81.A OD1 no hydrogen 3.440 N/A LEU 85.A N ASN 81.A O no hydrogen 3.325 N/A GLN 86.A N VAL 82.A O no hydrogen 2.944 N/A LEU 87.A N ARG 83.A O no hydrogen 3.057 N/A LEU 88.A N LEU 84.A O no hydrogen 3.183 N/A LEU 89.A N LEU 85.A O no hydrogen 3.008 N/A VAL 92.A N LEU 89.A O no hydrogen 3.038 N/A ASN 96.A N ASP 94.A OD1 no hydrogen 3.200 N/A ASN 96.A ND2 GLY 125.A O no hydrogen 3.598 N/A GLU 97.A N ASP 94.A O no hydrogen 3.258 N/A CYS 98.A SG ASP 99.A O no hydrogen 3.724 N/A ASP 99.A N PHE 103.A O no hydrogen 2.937 N/A VAL 100.A N ASN 68.A O no hydrogen 2.836 N/A ASN 101.A N ASP 99.A OD1 no hydrogen 3.041 N/A GLY 102.A N ASP 99.A O no hydrogen 3.027 N/A PHE 103.A N ASP 99.A OD1 no hydrogen 2.855 N/A MET 107.A N THR 104.A OG1 no hydrogen 3.184 N/A GLU 108.A N THR 104.A O no hydrogen 3.016 N/A ALA 109.A N ALA 105.A O no hydrogen 2.957 N/A ALA 110.A N PHE 106.A O no hydrogen 3.021 N/A VAL 111.A N MET 107.A O no hydrogen 2.858 N/A TYR 112.A N GLU 108.A O no hydrogen 2.976 N/A GLY 113.A N ALA 110.A O no hydrogen 3.356 N/A ARG 114.A N ALA 109.A O no hydrogen 2.821 N/A ARG 114.A NH1 THR 79.A O no hydrogen 3.183 N/A GLU 116.A N GLU 116.A OE1 no hydrogen 2.702 N/A LEU 118.A N ARG 114.A O no hydrogen 3.007 N/A ARG 119.A N VAL 115.A O no hydrogen 3.045 N/A PHE 120.A N GLU 116.A O no hydrogen 3.050 N/A LEU 121.A N ALA 117.A O no hydrogen 2.990 N/A TYR 122.A N LEU 118.A O no hydrogen 3.007 N/A GLU 123.A N ARG 119.A O no hydrogen 3.052 N/A ASN 124.A N PHE 120.A O no hydrogen 3.184 N/A ASN 124.A ND2 PHE 120.A O no hydrogen 2.691 N/A GLY 125.A N TYR 122.A O no hydrogen 3.171 N/A ALA 126.A N LEU 121.A O no hydrogen 3.090 N/A ASP 127.A N ASN 96.A OD1 no hydrogen 3.157 N/A ASN 129.A N ASP 127.A OD1 no hydrogen 3.240 N/A ASN 129.A ND2 LYS 169.A O no hydrogen 3.532 N/A HIS 131.A ND1 GLY 145.A O no hydrogen 2.825 N/A ARG 132.A N ALA 146.A O no hydrogen 3.066 N/A ARG 132.A NH1 ASP 151.A OD2 no hydrogen 2.709 N/A ARG 132.A NH2 ASP 151.A OD1 no hydrogen 2.967 N/A ARG 132.A NH2 ASP 151.A OD2 no hydrogen 3.494 N/A LYS 135.A N THR 134.A OG1 no hydrogen 2.589 N/A GLN 138.A N LYS 135.A O no hydrogen 2.983 N/A GLU 139.A N LYS 135.A O no hydrogen 2.914 N/A ARG 140.A N GLN 136.A O no hydrogen 2.998 N/A ARG 140.A NH2 GLN 136.A OE1 no hydrogen 3.302 N/A ILE 141.A N GLN 138.A O no hydrogen 3.269 N/A ARG 142.A N GLU 139.A O no hydrogen 2.923 N/A LYS 143.A N GLN 138.A O no hydrogen 3.084 N/A GLY 145.A N ARG 132.A O no hydrogen 2.959 N/A MET 150.A N THR 147.A OG1 no hydrogen 3.383 N/A ASP 151.A N THR 147.A O no hydrogen 3.202 N/A ALA 152.A N ALA 148.A O no hydrogen 3.002 N/A ALA 153.A N LEU 149.A O no hydrogen 2.868 N/A GLU 154.A N MET 150.A O no hydrogen 2.849 N/A LYS 155.A N ASP 151.A O no hydrogen 2.918 N/A GLY 156.A N ALA 153.A O no hydrogen 3.426 N/A HIS 157.A N ALA 152.A O no hydrogen 3.031 N/A HIS 157.A NE2 VAL 111.A O no hydrogen 2.949 N/A VAL 161.A N HIS 157.A O no hydrogen 3.095 N/A THR 162.A N VAL 158.A O no hydrogen 2.845 N/A THR 162.A OG1 VAL 158.A O no hydrogen 2.616 N/A ILE 163.A N GLY 159.A O no hydrogen 2.915 N/A LEU 164.A N VAL 160.A O no hydrogen 2.820 N/A LEU 165.A N VAL 161.A O no hydrogen 3.045 N/A HIS 166.A N THR 162.A O no hydrogen 3.012 N/A ALA 167.A N ILE 163.A O no hydrogen 2.897 N/A MET 168.A N ILE 163.A O no hydrogen 3.203 N/A ALA 170.A N LEU 164.A O no hydrogen 2.980 N/A GLU 171.A N ASN 129.A OD1 no hydrogen 2.865 N/A ARG 175.A NE ASP 173.A O no hydrogen 3.154 N/A ARG 175.A NH2 ASP 173.A OD1 no hydrogen 3.398 N/A ARG 175.A NH2 ASP 173.A OD2 no hydrogen 3.179 N/A ASP 176.A N ARG 180.A O no hydrogen 3.055 N/A ASN 177.A N GLY 144.A O no hydrogen 3.101 N/A ASN 177.A ND2 LYS 143.A O no hydrogen 2.797 N/A MET 178.A N ASP 176.A OD1 no hydrogen 3.222 N/A GLY 179.A N ASP 176.A O no hydrogen 3.024 N/A ARG 180.A N ASP 176.A OD1 no hydrogen 2.827 N/A ARG 180.A NE ASP 176.A OD2 no hydrogen 2.849 N/A ARG 180.A NH2 ASP 176.A OD2 no hydrogen 3.191 N/A ASN 181.A ND2 ASP 173.A OD1 no hydrogen 3.117 N/A ASN 181.A ND2 ASP 208.A O no hydrogen 3.024 N/A VAL 184.A N ASN 181.A OD1 no hydrogen 3.186 N/A TYR 185.A N ASN 181.A O no hydrogen 3.443 N/A TYR 185.A OH ASP 176.A OD2 no hydrogen 2.611 N/A ALA 186.A N ALA 182.A O no hydrogen 2.942 N/A LEU 187.A N LEU 183.A O no hydrogen 3.234 N/A LEU 187.A N VAL 184.A O no hydrogen 3.120 N/A LEU 188.A N TYR 185.A O no hydrogen 3.111 N/A ASN 189.A N ALA 186.A O no hydrogen 3.376 N/A ASP 191.A N ASN 189.A OD1 no hydrogen 3.397 N/A LYS 194.A N ASP 191.A OD1 no hydrogen 3.241 N/A ALA 195.A N ASP 191.A O no hydrogen 2.988 N/A LYS 196.A N ASP 192.A O no hydrogen 2.874 N/A LYS 196.A NZ ASP 230.A OD2 no hydrogen 2.871 N/A ALA 197.A N GLY 193.A O no hydrogen 3.053 N/A ILE 198.A N LYS 194.A O no hydrogen 2.975 N/A THR 199.A N ALA 195.A O no hydrogen 3.041 N/A THR 199.A OG1 ALA 195.A O no hydrogen 2.525 N/A ARG 200.A N LYS 196.A O no hydrogen 3.172 N/A LEU 201.A N ALA 197.A O no hydrogen 3.082 N/A LEU 202.A N ILE 198.A O no hydrogen 2.929 N/A LEU 203.A N THR 199.A O no hydrogen 2.890 N/A ASP 204.A N ARG 200.A O no hydrogen 2.822 N/A HIS 205.A N LEU 201.A O no hydrogen 3.113 N/A HIS 205.A ND1 LEU 201.A O no hydrogen 2.984 N/A GLY 206.A N LEU 203.A O no hydrogen 3.053 N/A ALA 207.A N LEU 202.A O no hydrogen 3.007 N/A ASP 208.A N ASP 173.A OD1 no hydrogen 2.941 N/A ASN 210.A N ASP 208.A OD1 no hydrogen 3.044 N/A ASN 210.A ND2 GLN 240.A O no hydrogen 3.087 N/A ARG 212.A NH1 SER 216.A O no hydrogen 2.921 N/A ARG 212.A NH1 THR 246.A O no hydrogen 2.722 N/A GLY 213.A N LYS 217.A O no hydrogen 2.791 N/A LYS 217.A N GLU 214.A O no hydrogen 3.052 N/A LYS 217.A NZ GLU 225.A OE1 no hydrogen 3.158 N/A LYS 217.A NZ GLU 225.A OE2 no hydrogen 3.324 N/A ILE 221.A N THR 218.A OG1 no hydrogen 3.213 N/A LEU 222.A N THR 218.A O no hydrogen 2.940 N/A ALA 223.A N PRO 219.A O no hydrogen 2.980 N/A VAL 224.A N LEU 220.A O no hydrogen 2.999 N/A GLU 225.A N ILE 221.A O no hydrogen 2.870 N/A ARG 226.A N LEU 222.A O no hydrogen 3.122 N/A ARG 226.A NH1 ASN 189.A O no hydrogen 2.851 N/A ARG 226.A NH1 ASP 192.A OD1 no hydrogen 3.078 N/A ARG 226.A NH2 LEU 187.A O no hydrogen 2.784 N/A ARG 226.A NH2 ASN 189.A O no hydrogen 2.534 N/A LYS 227.A N VAL 224.A O no hydrogen 2.826 N/A ASN 228.A N ALA 223.A O no hydrogen 3.243 N/A LEU 231.A N ASN 228.A OD1 no hydrogen 2.930 N/A VAL 232.A N ASN 228.A O no hydrogen 3.222 N/A GLN 233.A N LEU 229.A O no hydrogen 2.921 N/A MET 234.A N ASP 230.A O no hydrogen 2.950 N/A LEU 235.A N LEU 231.A O no hydrogen 3.030 N/A LEU 236.A N VAL 232.A O no hydrogen 2.888 N/A GLU 237.A N GLN 233.A O no hydrogen 3.067 N/A GLN 238.A N LEU 235.A O no hydrogen 3.313 N/A GLN 240.A N GLN 240.A OE1 no hydrogen 2.566 N/A GLN 240.A NE2 GLN 238.A OE1 no hydrogen 3.406 N/A ILE 241.A N GLN 238.A O no hydrogen 3.479 N/A GLU 242.A N ASN 210.A OD1 no hydrogen 3.133 N/A ASN 244.A ND2 GLY 273.A O no hydrogen 3.438 N/A ASP 247.A N LYS 251.A O no hydrogen 2.912 N/A ARG 248.A N GLY 215.A O no hydrogen 2.946 N/A GLY 250.A N ASP 247.A O no hydrogen 2.940 N/A LYS 251.A N ASP 247.A OD1 no hydrogen 2.831 N/A LYS 251.A NZ GLU 259.A OE1 no hydrogen 2.920 N/A LYS 251.A NZ GLU 259.A OE2 no hydrogen 3.182 N/A THR 252.A OG1 ASP 245.A O no hydrogen 3.238 N/A LEU 256.A N THR 252.A O no hydrogen 3.169 N/A ALA 257.A N ALA 253.A O no hydrogen 2.981 N/A VAL 258.A N LEU 254.A O no hydrogen 2.995 N/A GLU 259.A N LEU 255.A O no hydrogen 3.011 N/A LEU 260.A N LEU 256.A O no hydrogen 2.951 N/A ARG 261.A N VAL 258.A O no hydrogen 3.080 N/A ARG 261.A NE ASN 288.A O no hydrogen 2.966 N/A ARG 261.A NH2 ASN 288.A O no hydrogen 3.238 N/A ARG 261.A NH2 TYR 289.A O no hydrogen 3.415 N/A LEU 262.A N ALA 257.A O no hydrogen 2.868 N/A ALA 266.A N LEU 262.A O no hydrogen 2.891 N/A LYS 267.A N GLU 263.A O no hydrogen 2.924 N/A LYS 267.A NZ GLU 263.A OE2 no hydrogen 3.147 N/A LEU 268.A N GLU 264.A O no hydrogen 2.923 N/A LEU 269.A N ILE 265.A O no hydrogen 3.048 N/A CYS 270.A N ALA 266.A O no hydrogen 3.048 N/A CYS 270.A SG ALA 266.A O no hydrogen 3.601 N/A HIS 271.A N LYS 267.A O no hydrogen 2.924 N/A ARG 272.A N LEU 268.A O no hydrogen 3.159 N/A ARG 272.A NE LEU 236.A O no hydrogen 2.873 N/A ARG 272.A NH2 LEU 236.A O no hydrogen 2.923 N/A GLY 273.A N CYS 270.A O no hydrogen 3.039 N/A ALA 274.A N LEU 269.A O no hydrogen 2.968 N/A SER 275.A N ASN 244.A OD1 no hydrogen 2.941 N/A SER 275.A OG ASN 244.A OD1 no hydrogen 3.238 N/A CYS 278.A SG SER 275.A O no hydrogen 3.372 N/A ALA 283.A N ASP 280.A OD1 no hydrogen 3.404 N/A ILE 284.A N ASP 280.A O no hydrogen 3.274 N/A ALA 285.A N LEU 281.A O no hydrogen 2.882 N/A ARG 286.A N VAL 282.A O no hydrogen 2.873 N/A ARG 287.A N ALA 283.A O no hydrogen 2.946 N/A ASN 288.A N ILE 284.A O no hydrogen 3.034 N/A ASN 288.A ND2 VAL 258.A O no hydrogen 3.216 N/A ASN 288.A ND2 GLU 259.A O no hydrogen 3.238 N/A TYR 289.A N ARG 286.A O no hydrogen 2.742 N/A ASP 290.A N ALA 285.A O no hydrogen 2.935 N/A VAL 294.A N ASP 290.A O no hydrogen 3.065 N/A LYS 295.A N SER 291.A O no hydrogen 3.125 N/A PHE 296.A N ASP 292.A O no hydrogen 3.094 N/A LEU 297.A N LEU 293.A O no hydrogen 2.913 N/A ARG 298.A N VAL 294.A O no hydrogen 2.948 N/A LEU 299.A N LYS 295.A O no hydrogen 3.018 N/A HIS 300.A N PHE 296.A O no hydrogen 3.111 N/A GLN 305.A N GLU 354.A OE1 no hydrogen 2.862 N/A SER 306.A N GLU 354.A OE2 no hydrogen 2.862 N/A SER 306.A OG GLU 404.A OE1 no hydrogen 3.437 N/A SER 306.A OG GLU 404.A OE2 no hydrogen 2.681 N/A ARG 308.A N GLU 404.A OE1 no hydrogen 2.950 N/A ARG 308.A NH1 GLU 404.A O no hydrogen 2.814 N/A TRP 309.A N SER 306.A OG no hydrogen 3.010 N/A TRP 309.A NE1 CYS 403.A O no hydrogen 3.229 N/A GLY 310.A N SER 307.A O no hydrogen 3.483 N/A LEU 313.A N TRP 309.A O no hydrogen 2.986 N/A LYS 314.A N GLY 310.A O no hydrogen 2.927 N/A HIS 315.A N GLU 311.A O no hydrogen 3.251 N/A HIS 315.A ND1 GLU 334.A OE1 no hydrogen 3.102 N/A HIS 315.A ND1 GLU 334.A OE2 no hydrogen 2.890 N/A LEU 316.A N ALA 312.A O no hydrogen 2.917 N/A HIS 317.A N LEU 313.A O no hydrogen 2.971 N/A ARG 318.A N LYS 314.A O no hydrogen 3.162 N/A ARG 318.A N HIS 315.A O no hydrogen 3.080 N/A ILE 319.A N HIS 315.A O no hydrogen 3.179 N/A ARG 321.A NE ILE 329.A O no hydrogen 2.972 N/A ARG 321.A NH2 ILE 329.A O no hydrogen 3.560 N/A ILE 324.A N LEU 327.A O no hydrogen 2.914 N/A LYS 326.A N GLU 390.A OE2 no hydrogen 3.075 N/A LEU 327.A N ILE 324.A O no hydrogen 2.926 N/A LYS 328.A N LEU 349.A O no hydrogen 2.821 N/A LYS 328.A NZ LEU 316.A O no hydrogen 2.773 N/A LYS 328.A NZ ILE 319.A O no hydrogen 2.729 N/A GLU 334.A N ASP 332.A OD1 no hydrogen 2.945 N/A TYR 335.A N ASP 332.A O no hydrogen 2.930 N/A LYS 336.A N GLU 333.A O no hydrogen 3.383 N/A LYS 336.A NZ ASP 339.A OD1 no hydrogen 2.547 N/A ILE 337.A N ILE 345.A O no hydrogen 2.722 N/A ALA 338.A N ILE 345.A O no hydrogen 3.303 N/A GLU 342.A N THR 340.A OG1 no hydrogen 3.231 N/A GLY 344.A N THR 340.A OG1 no hydrogen 2.772 N/A ILE 345.A N ALA 338.A O no hydrogen 2.876 N/A TYR 346.A N VAL 357.A O no hydrogen 2.894 N/A LEU 347.A N TYR 335.A O no hydrogen 2.805 N/A GLY 348.A N VAL 355.A O no hydrogen 2.979 N/A LEU 349.A N LYS 328.A O no hydrogen 2.940 N/A TYR 350.A N GLN 353.A O no hydrogen 2.792 N/A GLU 351.A N LYS 326.A O no hydrogen 3.223 N/A GLN 353.A N TYR 350.A O no hydrogen 2.857 N/A VAL 355.A N GLY 348.A O no hydrogen 2.842 N/A ALA 356.A N LEU 400.A O no hydrogen 2.877 N/A VAL 357.A N TYR 346.A O no hydrogen 2.707 N/A LYS 358.A N VAL 398.A O no hydrogen 2.870 N/A LYS 358.A NZ GLU 370.A OE1 no hydrogen 2.559 N/A LYS 358.A NZ ASP 470.A OD2 no hydrogen 3.099 N/A ARG 359.A N GLY 344.A O no hydrogen 3.202 N/A ARG 359.A NH1 GLY 343.A O no hydrogen 2.743 N/A PHE 360.A N LEU 396.A O no hydrogen 2.895 N/A SER 361.A N GLU 342.A OE1 no hydrogen 2.518 N/A GLU 362.A N SER 394.A O no hydrogen 2.753 N/A GLY 363.A N SER 361.A OG no hydrogen 3.315 N/A SER 364.A N SER 361.A O no hydrogen 2.942 N/A SER 364.A OG GLU 342.A OE2 no hydrogen 2.867 N/A GLY 367.A N SER 364.A OG no hydrogen 3.179 N/A GLN 368.A N SER 364.A O no hydrogen 3.153 N/A GLN 369.A N THR 365.A O no hydrogen 3.042 N/A GLU 370.A N ARG 366.A O no hydrogen 2.905 N/A VAL 371.A N GLY 367.A O no hydrogen 3.056 N/A SER 372.A N GLN 368.A O no hydrogen 2.962 N/A SER 372.A OG TYR 446.A OH no hydrogen 3.004 N/A CYS 373.A N GLN 369.A O no hydrogen 3.102 N/A LEU 374.A N GLU 370.A O no hydrogen 3.058 N/A GLN 375.A N VAL 371.A O no hydrogen 2.907 N/A SER 376.A N CYS 373.A O no hydrogen 3.182 N/A SER 377.A N LEU 374.A O no hydrogen 3.137 N/A SER 377.A OG CYS 373.A O no hydrogen 2.941 N/A ARG 378.A NH2 PHE 386.A O no hydrogen 3.199 N/A ARG 378.A NH2 TYR 387.A O no hydrogen 2.829 N/A ASN 380.A N SER 377.A O no hydrogen 2.877 N/A ASN 380.A ND2 ALA 437.A O no hydrogen 3.076 N/A ASN 382.A N ASN 380.A OD1 no hydrogen 3.107 N/A VAL 383.A N ASN 380.A O no hydrogen 3.174 N/A VAL 384.A N LEU 466.A O no hydrogen 2.928 N/A TYR 387.A N CYS 399.A O no hydrogen 2.983 N/A GLU 390.A N HIS 397.A O no hydrogen 2.931 N/A ASP 392.A N CYS 395.A O no hydrogen 3.179 N/A SER 394.A N ASP 392.A OD1 no hydrogen 2.785 N/A CYS 395.A N ASP 392.A OD1 no hydrogen 2.538 N/A CYS 395.A SG PHE 360.A O no hydrogen 3.456 N/A CYS 395.A SG LEU 396.A O no hydrogen 3.676 N/A LEU 396.A N PHE 360.A O no hydrogen 2.737 N/A HIS 397.A N GLU 390.A O no hydrogen 2.815 N/A HIS 397.A ND1 GLU 390.A O no hydrogen 2.969 N/A VAL 398.A N LYS 358.A O no hydrogen 2.861 N/A CYS 399.A N GLY 388.A O no hydrogen 2.911 N/A LEU 400.A N ALA 356.A O no hydrogen 2.835 N/A ALA 401.A N THR 385.A O no hydrogen 2.844 N/A CYS 403.A SG ALA 401.A O no hydrogen 3.994 N/A GLU 404.A N ILE 458.A O no hydrogen 2.952 N/A TYR 405.A N ILE 458.A O no hydrogen 3.187 N/A THR 406.A N GLU 409.A OE1 no hydrogen 2.922 N/A LEU 407.A N ILE 456.A O no hydrogen 2.809 N/A HIS 410.A N THR 406.A O no hydrogen 2.776 N/A LEU 411.A N LEU 407.A O no hydrogen 2.947 N/A ALA 412.A N GLN 408.A O no hydrogen 3.261 N/A ASN 413.A N GLU 409.A O no hydrogen 2.889 N/A HIS 414.A N HIS 410.A O no hydrogen 3.098 N/A HIS 414.A ND1 HIS 410.A O no hydrogen 3.078 N/A ARG 415.A N ALA 412.A O no hydrogen 3.446 N/A ARG 415.A NE ASP 501.A OD1 no hydrogen 2.991 N/A ARG 415.A NH1 ARG 415.A O no hydrogen 2.926 N/A ARG 415.A NH2 ASP 501.A OD2 no hydrogen 2.922 N/A ASP 417.A N HIS 414.A O no hydrogen 3.088 N/A VAL 419.A N GLU 422.A OE2 no hydrogen 3.466 N/A GLU 422.A N VAL 419.A O no hydrogen 3.224 N/A SER 426.A OG ASP 424.A OD1 no hydrogen 3.325 N/A ALA 427.A N ASP 424.A OD1 no hydrogen 3.039 N/A ARG 428.A NH1 GLU 423.A OE2 no hydrogen 2.880 N/A ARG 428.A NH2 GLU 423.A OE2 no hydrogen 3.014 N/A ASN 429.A N GLU 425.A O no hydrogen 3.212 N/A ILE 430.A N SER 426.A O no hydrogen 2.945 N/A LEU 431.A N ALA 427.A O no hydrogen 3.010 N/A SER 432.A N ARG 428.A O no hydrogen 2.985 N/A SER 432.A OG ARG 428.A O no hydrogen 3.286 N/A SER 432.A OG ASN 429.A O no hydrogen 3.439 N/A SER 433.A N ASN 429.A O no hydrogen 3.137 N/A SER 433.A OG ASN 429.A O no hydrogen 3.162 N/A LEU 434.A N ILE 430.A O no hydrogen 3.228 N/A PHE 435.A N LEU 431.A O no hydrogen 2.913 N/A LYS 436.A N SER 432.A O no hydrogen 3.053 N/A ALA 437.A N SER 433.A O no hydrogen 2.775 N/A ILE 438.A N LEU 434.A O no hydrogen 2.889 N/A GLY 439.A N PHE 435.A O no hydrogen 2.905 N/A GLU 440.A N LYS 436.A O no hydrogen 3.016 N/A LEU 441.A N ALA 437.A O no hydrogen 2.937 N/A HIS 442.A N ILE 438.A O no hydrogen 2.977 N/A HIS 442.A NE2 ASP 485.A OD2 no hydrogen 2.820 N/A ARG 443.A N GLY 439.A O no hydrogen 3.147 N/A SER 444.A N GLU 440.A O no hydrogen 2.973 N/A SER 444.A OG GLU 440.A O no hydrogen 2.864 N/A GLY 445.A N HIS 442.A O no hydrogen 2.800 N/A TYR 446.A N LEU 441.A O no hydrogen 3.189 N/A TYR 446.A OH SER 372.A OG no hydrogen 3.004 N/A SER 447.A N ILE 473.A O no hydrogen 2.832 N/A SER 447.A OG ASP 485.A OD2 no hydrogen 3.127 N/A HIS 448.A N ASP 485.A OD2 no hydrogen 3.137 N/A GLN 449.A N ASP 485.A OD1 no hydrogen 3.127 N/A GLN 449.A NE2 LYS 481.A O no hydrogen 3.346 N/A ASP 450.A N HIS 448.A ND1 no hydrogen 3.094 N/A GLN 454.A NE2 GLN 408.A OE1 no hydrogen 3.326 N/A ASN 455.A N GLN 452.A O no hydrogen 2.967 N/A ASN 455.A ND2 ASP 450.A O no hydrogen 2.784 N/A ASN 455.A ND2 ASP 450.A OD2 no hydrogen 3.165 N/A ILE 456.A N PRO 453.A O no hydrogen 3.396 N/A LEU 457.A N PHE 465.A O no hydrogen 2.798 N/A ILE 458.A N TYR 405.A O no hydrogen 2.695 N/A ASP 459.A N GLY 463.A O no hydrogen 2.963 N/A ASN 462.A N ASP 459.A O no hydrogen 2.972 N/A GLY 463.A N ASP 459.A OD1 no hydrogen 2.774 N/A PHE 465.A N LEU 457.A O no hydrogen 2.736 N/A LEU 466.A N ASN 382.A O no hydrogen 2.940 N/A ALA 467.A N ASN 455.A O no hydrogen 2.930 N/A PHE 469.A N GLU 370.A OE2 no hydrogen 2.964 N/A ASP 470.A N ASP 468.A OD1 no hydrogen 3.461 N/A SER 472.A N PHE 469.A O no hydrogen 3.094 N/A SER 472.A OG PHE 469.A O no hydrogen 2.787 N/A ILE 473.A N SER 447.A O no hydrogen 3.117 N/A TRP 475.A N GLY 445.A O no hydrogen 3.072 N/A TRP 475.A NE1 HIS 442.A O no hydrogen 2.801 N/A LYS 481.A N ASP 478.A O no hydrogen 3.040 N/A ILE 482.A N PRO 479.A O no hydrogen 3.180 N/A LYS 483.A N GLN 480.A O no hydrogen 3.202 N/A ARG 484.A N LYS 481.A O no hydrogen 3.088 N/A ARG 484.A NE GLN 449.A OE1 no hydrogen 3.188 N/A ASP 485.A N ILE 482.A O no hydrogen 3.233 N/A LEU 486.A N ILE 482.A O no hydrogen 3.467 N/A GLU 487.A N LYS 483.A O no hydrogen 3.011 N/A ALA 488.A N ARG 484.A O no hydrogen 3.182 N/A LEU 489.A N ASP 485.A O no hydrogen 2.918 N/A GLY 490.A N LEU 486.A O no hydrogen 3.030 N/A LEU 491.A N GLU 487.A O no hydrogen 3.063 N/A LEU 492.A N ALA 488.A O no hydrogen 2.837 N/A VAL 493.A N LEU 489.A O no hydrogen 2.882 N/A LEU 494.A N GLY 490.A O no hydrogen 3.360 N/A TYR 495.A N LEU 491.A O no hydrogen 2.924 N/A VAL 496.A N LEU 492.A O no hydrogen 2.982 N/A VAL 497.A N VAL 493.A O no hydrogen 3.068 N/A LYS 498.A N LEU 494.A O no hydrogen 2.764 N/A LYS 499.A N VAL 496.A O no hydrogen 2.938 N/A GLY 500.A N TYR 495.A O no hydrogen 3.110 N/A ASP 501.A N LYS 498.A O no hydrogen 3.048 N/A SER 503.A OG THR 506.A OG1 no hydrogen 2.996 N/A THR 506.A N SER 503.A OG no hydrogen 3.096 N/A THR 506.A OG1 SER 503.A OG no hydrogen 2.996 N/A LEU 507.A N SER 503.A O no hydrogen 3.182 N/A LYS 508.A N PHE 504.A O no hydrogen 2.798 N/A ASN 509.A N GLU 505.A O no hydrogen 3.188 N/A ASN 509.A N THR 506.A O no hydrogen 3.074 N/A ASN 509.A ND2 GLU 505.A OE1 no hydrogen 3.492 N/A GLN 510.A N LEU 507.A O no hydrogen 3.330 N/A SER 511.A N GLU 514.A OE1 no hydrogen 2.933 N/A SER 511.A OG GLU 514.A OE1 no hydrogen 3.282 N/A VAL 515.A N SER 511.A O no hydrogen 3.098 N/A ILE 516.A N PHE 512.A O no hydrogen 3.025 N/A GLN 517.A N GLU 513.A O no hydrogen 2.969 N/A GLY 518.A N GLU 514.A O no hydrogen 2.899 N/A GLY 518.A N VAL 515.A O no hydrogen 3.124 N/A SER 519.A N ILE 516.A O no hydrogen 3.260 N/A SER 519.A OG VAL 515.A O no hydrogen 3.252 N/A SER 519.A OG ILE 516.A O no hydrogen 3.321 N/A THR 524.A N ASP 521.A OD1 no hydrogen 2.888 N/A THR 524.A OG1 ASP 521.A OD1 no hydrogen 2.700 N/A THR 524.A OG1 ASP 521.A OD2 no hydrogen 3.102 N/A ARG 525.A N ASP 521.A O no hydrogen 3.280 N/A ARG 525.A NE ILE 516.A O no hydrogen 2.891 N/A ARG 525.A NH1 GLU 522.A OE2 no hydrogen 3.002 N/A ARG 525.A NH2 GLN 517.A O no hydrogen 3.117 N/A ASP 526.A N GLU 522.A O no hydrogen 3.041 N/A LEU 527.A N GLU 523.A O no hydrogen 3.052 N/A ILE 528.A N THR 524.A O no hydrogen 2.922 N/A HIS 529.A N ARG 525.A O no hydrogen 2.961 N/A HIS 530.A N ASP 526.A O no hydrogen 3.142 N/A HIS 530.A ND1 ASP 526.A O no hydrogen 2.870 N/A LEU 531.A N LEU 527.A O no hydrogen 3.185 N/A LEU 531.A N ILE 528.A O no hydrogen 3.142 N/A PHE 532.A N ILE 528.A O no hydrogen 3.016 N/A HIS 533.A N HIS 529.A O no hydrogen 2.922 N/A SER 539.A OG ASP 536.A O no hydrogen 3.358 N/A SER 540.A N ASP 536.A O no hydrogen 3.114 N/A SER 540.A OG ASP 536.A O no hydrogen 2.875 N/A LEU 541.A N ARG 537.A O no hydrogen 3.148 N/A LEU 542.A N SER 539.A O no hydrogen 3.360 N/A ALA 543.A N SER 540.A O no hydrogen 3.213 N/A HIS 544.A N LEU 541.A O no hydrogen 3.035 N/A HIS 544.A NE2 ASP 526.A OD2 no hydrogen 2.689 N/A PHE 546.A N HIS 544.A ND1 no hydrogen 3.130 N/A PHE 547.A N HIS 544.A O no hydrogen 2.940 N/A TRP 548.A N PRO 545.A O no hydrogen 3.050 N/A TRP 548.A NE1 ALA 543.A O no hydrogen 2.983 N/A SER 549.A OG SER 552.A OG no hydrogen 3.028 N/A TRP 550.A N GLU 423.A OE2 no hydrogen 2.924 N/A SER 552.A N SER 549.A OG no hydrogen 3.112 N/A SER 552.A OG SER 549.A OG no hydrogen 3.028 N/A ARG 553.A N SER 549.A O no hydrogen 2.926 N/A ARG 553.A NE TRP 548.A O no hydrogen 2.933 N/A ARG 553.A NH1 GLN 644.A OE1 no hydrogen 2.894 N/A ARG 553.A NH2 PRO 545.A O no hydrogen 2.806 N/A ARG 553.A NH2 PHE 546.A O no hydrogen 3.397 N/A TYR 554.A N TRP 550.A O no hydrogen 3.043 N/A ARG 555.A N GLU 551.A O no hydrogen 2.836 N/A ARG 555.A NE ARG 555.A O no hydrogen 3.183 N/A ARG 555.A NE ASP 559.A OD1 no hydrogen 3.010 N/A ARG 555.A NH2 ASP 559.A OD1 no hydrogen 2.934 N/A THR 556.A N SER 552.A O no hydrogen 2.954 N/A THR 556.A OG1 SER 552.A O no hydrogen 3.128 N/A THR 556.A OG1 HIS 666.A O no hydrogen 2.778 N/A LEU 557.A N ARG 553.A O no hydrogen 3.098 N/A ARG 558.A N TYR 554.A O no hydrogen 3.038 N/A ARG 558.A NH2 GLU 622.A OE2 no hydrogen 2.978 N/A ASP 559.A N ARG 555.A O no hydrogen 2.949 N/A VAL 560.A N THR 556.A O no hydrogen 2.989 N/A GLY 561.A N LEU 557.A O no hydrogen 2.927 N/A ASN 562.A N ASP 559.A O no hydrogen 3.430 N/A GLU 563.A N VAL 560.A O no hydrogen 3.058 N/A ILE 566.A N GLU 563.A O no hydrogen 3.002 N/A LYS 567.A N GLU 563.A O no hydrogen 3.202 N/A LYS 567.A NZ ASN 562.A OD1 no hydrogen 3.029 N/A THR 568.A N SER 564.A O no hydrogen 2.933 N/A THR 568.A OG1 SER 564.A O no hydrogen 3.108 N/A ARG 569.A N ILE 566.A O no hydrogen 3.272 N/A ARG 569.A NE ASP 612.A OD2 no hydrogen 3.343 N/A ARG 569.A NH2 ASP 612.A OD2 no hydrogen 2.665 N/A ASN 570.A N ASP 565.A O no hydrogen 3.016 N/A ASN 570.A ND2 ASP 565.A OD1 no hydrogen 3.491 N/A SER 573.A N ASN 570.A O no hydrogen 3.080 N/A SER 573.A OG ASN 570.A O no hydrogen 2.690 N/A ARG 574.A NE GLU 662.A OE1 no hydrogen 3.338 N/A LEU 576.A N SER 573.A OG no hydrogen 3.274 N/A GLN 577.A N SER 573.A O no hydrogen 3.014 N/A LEU 578.A N ARG 574.A O no hydrogen 3.016 N/A LEU 579.A N ILE 575.A O no hydrogen 3.117 N/A GLN 580.A N LEU 576.A O no hydrogen 2.941 N/A SER 587.A N ASP 649.A OD2 no hydrogen 3.045 N/A SER 587.A OG ASP 649.A OD1 no hydrogen 2.657 N/A ALA 589.A N THR 586.A O no hydrogen 3.483 N/A TRP 591.A NE1 THR 609.A O no hydrogen 2.801 N/A THR 592.A N ASP 608.A OD1 no hydrogen 3.187 N/A THR 592.A OG1 ASP 608.A OD1 no hydrogen 2.612 N/A THR 593.A N GLN 590.A O no hydrogen 3.276 N/A THR 593.A OG1 GLN 590.A O no hydrogen 3.002 N/A LYS 594.A N TRP 591.A O no hydrogen 3.102 N/A LYS 594.A NZ SER 587.A O no hydrogen 3.335 N/A LYS 594.A NZ ALA 589.A O no hydrogen 2.514 N/A ILE 595.A N TRP 591.A O no hydrogen 3.352 N/A PHE 598.A N ASP 596.A OD1 no hydrogen 3.023 N/A MET 600.A N ASP 596.A O no hydrogen 3.283 N/A GLU 601.A N PHE 598.A O no hydrogen 2.942 N/A MET 603.A N VAL 599.A O no hydrogen 3.252 N/A ASN 604.A N MET 600.A O no hydrogen 3.078 N/A ALA 605.A N GLU 601.A O no hydrogen 3.263 N/A GLN 607.A N ASP 612.A OD2 no hydrogen 2.883 N/A GLY 611.A N GLN 580.A OE1 no hydrogen 2.926 N/A ASP 612.A N THR 609.A OG1 no hydrogen 3.181 N/A LEU 613.A N THR 609.A O no hydrogen 3.165 N/A LEU 614.A N LEU 610.A O no hydrogen 2.996 N/A LYS 615.A N GLY 611.A O no hydrogen 2.971 N/A LYS 615.A NZ ASN 619.A OD1 no hydrogen 2.891 N/A PHE 616.A N ASP 612.A O no hydrogen 2.833 N/A ILE 617.A N LEU 613.A O no hydrogen 2.881 N/A ARG 618.A N LEU 614.A O no hydrogen 2.912 N/A ARG 618.A NE ASN 619.A OD1 no hydrogen 2.870 N/A ASN 619.A N LYS 615.A O no hydrogen 3.028 N/A ASN 619.A ND2 TYR 606.A OH no hydrogen 2.704 N/A LEU 620.A N PHE 616.A O no hydrogen 2.954 N/A GLY 621.A N ILE 617.A O no hydrogen 2.885 N/A GLU 622.A N ARG 618.A O no hydrogen 3.009 N/A HIS 623.A N ASN 619.A O no hydrogen 3.155 N/A HIS 623.A N LEU 620.A O no hydrogen 3.302 N/A HIS 623.A ND1 GLU 626.A OE2 no hydrogen 3.052 N/A GLU 626.A N HIS 623.A O no hydrogen 3.377 N/A ASN 629.A N GLU 626.A O no hydrogen 3.043 N/A ASN 629.A ND2 HIS 623.A O no hydrogen 2.934 N/A LYS 630.A N GLN 627.A O no hydrogen 3.374 N/A LYS 633.A N ASN 629.A O no hydrogen 3.010 N/A SER 634.A N LYS 630.A O no hydrogen 3.233 N/A SER 634.A OG LYS 631.A O no hydrogen 2.624 N/A ILE 635.A N LYS 631.A O no hydrogen 3.036 N/A ILE 635.A N MET 632.A O no hydrogen 3.106 N/A ILE 636.A N MET 632.A O no hydrogen 3.062 N/A GLY 637.A N LYS 633.A O no hydrogen 3.056 N/A SER 640.A N GLU 638.A OE1 no hydrogen 3.208 N/A SER 640.A OG TRP 550.A O no hydrogen 2.553 N/A GLN 641.A N GLU 638.A OE2 no hydrogen 2.911 N/A TYR 642.A N GLU 638.A O no hydrogen 3.011 N/A PHE 643.A N PRO 639.A O no hydrogen 3.113 N/A GLN 644.A N SER 640.A O no hydrogen 3.259 N/A GLN 644.A NE2 SER 640.A O no hydrogen 3.481 N/A GLN 644.A NE2 SER 640.A OG no hydrogen 3.226 N/A GLU 645.A N GLN 641.A O no hydrogen 3.108 N/A LYS 646.A N TYR 642.A O no hydrogen 2.993 N/A PHE 647.A N PHE 643.A O no hydrogen 2.762 N/A LEU 650.A N PHE 647.A O no hydrogen 2.971 N/A TYR 653.A N ASP 649.A O no hydrogen 2.938 N/A VAL 654.A N LEU 650.A O no hydrogen 3.018 N/A TYR 655.A N VAL 651.A O no hydrogen 2.943 N/A THR 656.A N MET 652.A O no hydrogen 2.904 N/A THR 656.A OG1 MET 652.A O no hydrogen 2.788 N/A LYS 657.A N TYR 653.A O no hydrogen 3.111 N/A LEU 658.A N VAL 654.A O no hydrogen 3.040 N/A THR 661.A N LEU 658.A O no hydrogen 3.182 N/A THR 661.A OG1 LEU 658.A O no hydrogen 2.932 N/A GLU 662.A N GLU 662.A OE1 no hydrogen 2.948 N/A TYR 663.A N THR 661.A OG1 no hydrogen 3.121 N/A MET 664.A N THR 661.A O no hydrogen 3.313 N/A LYS 665.A N GLU 662.A O no hydrogen 3.403 N/A HIS 666.A N TYR 663.A O no hydrogen 3.297 N/A HIS 666.A NE2 GLU 563.A OE2 no hydrogen 2.975 N/A PHE 667.A N MET 664.A O no hydrogen 2.839 N/A ASN 672.A ND2 THR 670.A O no hydrogen 3.413 N/A