Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4a0f_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): HIS 4.A N GLU 153.A OE2 no hydrogen 3.002 N/A LEU 5.A N LEU 335.A O no hydrogen 2.848 N/A LEU 7.A N SER 333.A O no hydrogen 2.782 N/A TYR 12.A N CYS 163.A O no hydrogen 2.819 N/A LEU 13.A N PRO 191.A O no hydrogen 3.028 N/A ILE 14.A N VAL 165.A O no hydrogen 2.852 N/A TRP 15.A N ILE 193.A O no hydrogen 2.962 N/A SER 16.A OG ASN 18.A O no hydrogen 2.623 N/A ALA 17.A N VAL 195.A O no hydrogen 3.100 N/A THR 19.A N ASN 18.A OD1 no hydrogen 2.573 N/A LYS 23.A NZ GLY 169.A O no hydrogen 2.846 N/A THR 24.A OG1 GLU 166.A OE2 no hydrogen 2.910 N/A VAL 26.A N GLY 22.A O no hydrogen 2.960 N/A SER 27.A N LYS 23.A O no hydrogen 3.085 N/A SER 27.A OG LYS 23.A O no hydrogen 3.268 N/A SER 27.A OG GLU 166.A OE1 no hydrogen 2.741 N/A THR 28.A N THR 24.A O no hydrogen 3.032 N/A THR 28.A OG1 THR 24.A O no hydrogen 2.766 N/A GLY 29.A N LEU 25.A O no hydrogen 2.915 N/A ILE 30.A N VAL 26.A O no hydrogen 2.959 N/A ALA 31.A N SER 27.A O no hydrogen 2.958 N/A ALA 32.A N THR 28.A O no hydrogen 3.023 N/A SER 33.A N GLY 29.A O no hydrogen 3.034 N/A PHE 34.A N ILE 30.A O no hydrogen 3.041 N/A PHE 34.A N ALA 31.A O no hydrogen 3.015 N/A LEU 35.A N ALA 31.A O no hydrogen 2.853 N/A LEU 36.A N ALA 32.A O no hydrogen 3.022 N/A GLN 37.A NE2 SER 33.A O no hydrogen 3.052 N/A SER 40.A N GLN 37.A O no hydrogen 3.159 N/A THR 44.A N SER 41.A O no hydrogen 2.917 N/A THR 44.A OG1 SER 41.A O no hydrogen 3.275 N/A LYS 45.A N ASP 160.A O no hydrogen 2.689 N/A LYS 45.A NZ GLU 159.A OE1 no hydrogen 2.570 N/A LEU 46.A N GLU 118.A O no hydrogen 2.950 N/A LEU 47.A N LEU 162.A O no hydrogen 2.855 N/A TYR 48.A N LEU 120.A O no hydrogen 2.716 N/A TYR 48.A OH GLU 166.A OE1 no hydrogen 2.818 N/A LEU 49.A N LEU 164.A O no hydrogen 2.901 N/A LYS 50.A N LYS 122.A O no hydrogen 2.881 N/A LYS 50.A NZ ASP 61.A OD2 no hydrogen 3.046 N/A LYS 50.A NZ GLU 166.A OE2 no hydrogen 3.304 N/A LYS 50.A NZ THR 167.A O no hydrogen 2.863 N/A GLN 53.A N TYR 125.A O no hydrogen 3.023 N/A GLN 53.A NE2 THR 54.A O no hydrogen 3.318 N/A THR 54.A OG1 ILE 131.A O no hydrogen 3.033 N/A GLY 55.A N ALA 129.A O no hydrogen 3.108 N/A PHE 56.A N TRP 127.A O no hydrogen 2.775 N/A SER 58.A OG GLY 55.A O no hydrogen 3.124 N/A ASP 59.A N GLY 55.A O no hydrogen 3.186 N/A ASP 61.A N GLN 53.A OE1 no hydrogen 2.634 N/A SER 62.A OG THR 123.A OG1 no hydrogen 2.828 N/A ARG 63.A N SER 60.A OG no hydrogen 3.362 N/A ARG 63.A NH1 PRO 57.A O no hydrogen 2.885 N/A ARG 63.A NH2 SER 58.A O no hydrogen 3.440 N/A PHE 64.A N SER 60.A O no hydrogen 2.936 N/A VAL 65.A N ASP 61.A O no hydrogen 2.994 N/A PHE 66.A N SER 62.A O no hydrogen 2.866 N/A SER 67.A N ARG 63.A O no hydrogen 2.831 N/A LYS 68.A N PHE 64.A O no hydrogen 2.963 N/A LYS 68.A NZ ASP 259.A O no hydrogen 2.832 N/A LYS 68.A NZ ASP 259.A OD1 no hydrogen 3.486 N/A LEU 69.A N VAL 65.A O no hydrogen 2.962 N/A ASP 70.A N PHE 66.A O no hydrogen 3.317 N/A SER 71.A N SER 67.A O no hydrogen 3.170 N/A LEU 72.A N LYS 68.A O no hydrogen 3.070 N/A SER 73.A N LEU 69.A O no hydrogen 2.786 N/A SER 73.A OG ILE 78.A O no hydrogen 2.668 N/A LEU 74.A N ASP 70.A O no hydrogen 3.397 N/A ARG 75.A N SER 71.A O no hydrogen 3.085 N/A ARG 75.A NE GLU 262.A OE2 no hydrogen 3.068 N/A ARG 75.A NH1 ARG 75.A O no hydrogen 3.533 N/A ARG 76.A N LEU 72.A O no hydrogen 2.700 N/A GLN 77.A N LEU 74.A O no hydrogen 2.928 N/A ILE 78.A N SER 73.A O no hydrogen 3.034 N/A SER 81.A N PRO 117.A O no hydrogen 3.035 N/A SER 81.A OG VAL 113.A O no hydrogen 2.770 N/A ILE 82.A N LYS 111.A O no hydrogen 3.205 N/A SER 83.A N LEU 119.A O no hydrogen 3.148 N/A ASN 84.A N ASP 109.A O no hydrogen 2.823 N/A SER 85.A N CYS 121.A O no hydrogen 2.890 N/A VAL 86.A N PHE 107.A O no hydrogen 3.337 N/A LEU 87.A N THR 123.A O no hydrogen 2.995 N/A HIS 88.A N LEU 124.A O no hydrogen 2.871 N/A HIS 88.A ND1 LEU 124.A O no hydrogen 2.868 N/A SER 89.A N CYS 103.A O no hydrogen 3.281 N/A SER 89.A OG SER 90.A O no hydrogen 3.194 N/A SER 90.A N ALA 126.A O no hydrogen 2.858 N/A SER 90.A OG GLU 140.A OE1 no hydrogen 2.375 N/A ALA 93.A N SER 90.A OG no hydrogen 3.362 N/A ALA 94.A N SER 90.A O no hydrogen 3.287 N/A LYS 95.A N LEU 91.A O no hydrogen 3.024 N/A SER 96.A N PRO 92.A O no hydrogen 3.260 N/A SER 96.A OG PRO 92.A O no hydrogen 3.380 N/A LEU 97.A N ALA 94.A O no hydrogen 3.324 N/A GLY 98.A N LYS 95.A O no hydrogen 2.754 N/A CYS 103.A SG SER 89.A O no hydrogen 3.825 N/A LEU 105.A N LEU 87.A O no hydrogen 2.712 N/A ASP 109.A N ASN 84.A O no hydrogen 3.037 N/A THR 112.A OG1 GLU 110.A O no hydrogen 3.330 N/A VAL 113.A N SER 81.A OG no hydrogen 2.906 N/A ALA 116.A N VAL 113.A O no hydrogen 3.164 N/A GLU 118.A N THR 44.A O no hydrogen 2.838 N/A LEU 119.A N SER 81.A O no hydrogen 3.030 N/A LEU 120.A N LEU 46.A O no hydrogen 3.037 N/A CYS 121.A N SER 83.A O no hydrogen 2.810 N/A CYS 121.A SG SER 62.A O no hydrogen 3.741 N/A LYS 122.A N TYR 48.A O no hydrogen 2.743 N/A THR 123.A N SER 85.A O no hydrogen 2.814 N/A THR 123.A OG1 SER 62.A OG no hydrogen 2.828 N/A LEU 124.A N LYS 50.A O no hydrogen 3.390 N/A TYR 125.A N PRO 51.A O no hydrogen 2.933 N/A ALA 126.A N HIS 88.A O no hydrogen 2.838 N/A TRP 127.A N GLN 53.A O no hydrogen 2.851 N/A TRP 127.A NE1 ALA 142.A O no hydrogen 2.655 N/A GLU 128.A N GLU 140.A OE1 no hydrogen 3.088 N/A ALA 129.A N GLU 140.A OE2 no hydrogen 2.542 N/A ILE 131.A N ALA 129.A O no hydrogen 2.844 N/A SER 132.A OG HIS 134.A ND1 no hydrogen 2.351 N/A HIS 134.A N SER 132.A OG no hydrogen 3.316 N/A HIS 134.A ND1 SER 132.A OG no hydrogen 2.351 N/A ALA 136.A N SER 132.A O no hydrogen 2.847 N/A ALA 137.A N PRO 133.A O no hydrogen 2.964 N/A ARG 139.A N LEU 135.A O no hydrogen 2.838 N/A GLU 140.A N ALA 136.A O no hydrogen 2.843 N/A ASN 141.A N GLU 138.A O no hydrogen 3.415 N/A ALA 142.A N ALA 137.A O no hydrogen 3.018 N/A VAL 149.A N GLU 145.A O no hydrogen 3.086 N/A LEU 150.A N ASP 146.A O no hydrogen 3.019 N/A GLN 151.A N SER 147.A O no hydrogen 2.818 N/A GLU 153.A N LEU 150.A O no hydrogen 2.833 N/A LYS 154.A N GLN 151.A O no hydrogen 2.859 N/A LEU 156.A N ILE 152.A O no hydrogen 2.943 N/A LYS 157.A N GLU 153.A O no hydrogen 3.110 N/A GLU 158.A N LYS 154.A O no hydrogen 3.026 N/A GLU 159.A N LEU 156.A O no hydrogen 3.031 N/A LEU 162.A N LYS 45.A O no hydrogen 2.856 N/A CYS 163.A N PRO 10.A O no hydrogen 3.033 N/A CYS 163.A SG LEU 47.A O no hydrogen 3.589 N/A LEU 164.A N LEU 47.A O no hydrogen 2.955 N/A VAL 165.A N TYR 12.A O no hydrogen 2.882 N/A GLU 166.A N LEU 49.A O no hydrogen 2.746 N/A THR 167.A N ILE 14.A O no hydrogen 3.134 N/A THR 167.A OG1 ILE 14.A O no hydrogen 2.503 N/A ALA 168.A N GLN 181.A OE1 no hydrogen 2.747 N/A GLY 170.A N SER 173.A OG no hydrogen 2.909 N/A SER 173.A N GLY 170.A O no hydrogen 3.332 N/A GLY 175.A N THR 179.A O no hydrogen 2.681 N/A SER 177.A OG ASP 146.A OD1 no hydrogen 2.671 N/A SER 177.A OG ASP 146.A OD2 no hydrogen 3.273 N/A SER 177.A OG THR 179.A OG1 no hydrogen 3.030 N/A GLY 178.A N GLY 175.A O no hydrogen 2.855 N/A THR 179.A OG1 ASP 146.A OD2 no hydrogen 2.662 N/A THR 179.A OG1 SER 177.A OG no hydrogen 3.030 N/A GLN 181.A N SER 173.A O no hydrogen 2.791 N/A GLN 181.A NE2 ALA 168.A O no hydrogen 2.998 N/A GLN 181.A NE2 GLY 170.A O no hydrogen 3.104 N/A CYS 182.A N VAL 171.A O no hydrogen 3.008 N/A CYS 182.A SG VAL 171.A O no hydrogen 3.095 N/A CYS 182.A SG ASP 183.A OD1 no hydrogen 3.713 N/A ASP 183.A N LEU 180.A O no hydrogen 2.968 N/A LEU 184.A N LEU 180.A O no hydrogen 3.173 N/A LEU 184.A N GLN 181.A O no hydrogen 3.031 N/A TYR 185.A N GLN 181.A O no hydrogen 3.374 N/A ARG 186.A NE ARG 216.A O no hydrogen 2.753 N/A ARG 186.A NH1 ARG 186.A O no hydrogen 2.674 N/A ARG 186.A NH2 ARG 319.A O no hydrogen 3.146 N/A PHE 188.A N TYR 185.A O no hydrogen 3.153 N/A ARG 189.A N TYR 185.A O no hydrogen 3.326 N/A ARG 189.A NE GLY 217.A O no hydrogen 2.899 N/A ARG 189.A NH2 GLY 217.A O no hydrogen 3.417 N/A GLY 192.A N ASP 219.A O no hydrogen 3.067 N/A ILE 193.A N LEU 13.A O no hydrogen 3.006 N/A LEU 194.A N ALA 222.A O no hydrogen 3.139 N/A VAL 195.A N TRP 15.A O no hydrogen 2.918 N/A GLY 196.A N VAL 224.A O no hydrogen 2.706 N/A ASP 197.A N THR 206.A OG1 no hydrogen 2.952 N/A ARG 199.A N ASP 197.A OD1 no hydrogen 2.873 N/A ARG 199.A NE ASP 197.A OD1 no hydrogen 3.034 N/A ARG 199.A NH2 ASP 197.A OD2 no hydrogen 3.107 N/A GLY 205.A N GLY 201.A O no hydrogen 2.905 N/A THR 206.A N GLY 202.A O no hydrogen 2.791 N/A THR 206.A OG1 GLY 202.A O no hydrogen 2.599 N/A ILE 207.A N ILE 203.A O no hydrogen 3.046 N/A ALA 208.A N SER 204.A O no hydrogen 3.060 N/A ALA 209.A N GLY 205.A O no hydrogen 3.026 N/A TYR 210.A N THR 206.A O no hydrogen 3.020 N/A GLU 211.A N ILE 207.A O no hydrogen 2.844 N/A SER 212.A N ALA 208.A O no hydrogen 3.005 N/A SER 212.A OG ALA 208.A O no hydrogen 3.414 N/A LEU 213.A N ALA 209.A O no hydrogen 3.022 N/A LYS 214.A N TYR 210.A O no hydrogen 2.840 N/A LYS 214.A NZ TYR 218.A O no hydrogen 3.087 N/A LEU 215.A N GLU 211.A O no hydrogen 2.968 N/A ARG 216.A N LEU 213.A O no hydrogen 2.663 N/A ARG 216.A NE ASP 183.A OD1 no hydrogen 2.564 N/A ARG 216.A NH1 SER 212.A O no hydrogen 3.085 N/A GLY 217.A N LYS 214.A O no hydrogen 3.041 N/A TYR 218.A OH CYS 182.A O no hydrogen 2.578 N/A ALA 221.A N GLY 192.A O no hydrogen 2.824 N/A VAL 223.A N PRO 245.A O no hydrogen 3.075 N/A VAL 224.A N LEU 194.A O no hydrogen 3.017 N/A PHE 225.A N LEU 247.A O no hydrogen 3.060 N/A ASP 227.A N LEU 249.A O no hydrogen 2.679 N/A HIS 228.A ND1 GLU 226.A O no hydrogen 2.787 N/A GLY 229.A N ASP 227.A OD1 no hydrogen 2.950 N/A ASN 232.A ND2 ASP 197.A O no hydrogen 2.766 N/A GLU 233.A N GLU 233.A OE1 no hydrogen 2.732 N/A VAL 234.A N VAL 231.A O no hydrogen 3.309 N/A THR 237.A N GLU 233.A O no hydrogen 2.921 N/A THR 237.A OG1 GLU 233.A O no hydrogen 3.176 N/A SER 238.A N VAL 234.A O no hydrogen 3.092 N/A TYR 239.A N PRO 235.A O no hydrogen 2.954 N/A TYR 239.A OH GLU 211.A OE2 no hydrogen 2.436 N/A LEU 240.A N LEU 236.A O no hydrogen 3.030 N/A ARG 241.A N SER 238.A O no hydrogen 3.196 N/A ASN 242.A N THR 237.A O no hydrogen 2.847 N/A LYS 243.A N LEU 240.A O no hydrogen 2.766 N/A LEU 247.A N VAL 223.A O no hydrogen 2.803 N/A LEU 249.A N PHE 225.A O no hydrogen 2.753 N/A VAL 252.A N GLU 226.A OE2 no hydrogen 2.933 N/A LYS 254.A NZ VAL 252.A O no hydrogen 3.545 N/A SER 257.A N ASP 255.A OD1 no hydrogen 3.039 N/A SER 257.A OG ASP 255.A OD1 no hydrogen 3.155 N/A ASP 258.A N ASP 255.A O no hydrogen 3.046 N/A LEU 260.A N ASP 258.A OD1 no hydrogen 2.545 N/A TRP 263.A N LEU 260.A O no hydrogen 3.105 N/A TRP 263.A NE1 PRO 250.A O no hydrogen 2.847 N/A PHE 264.A N LEU 260.A O no hydrogen 3.066 N/A VAL 265.A N ILE 261.A O no hydrogen 3.164 N/A GLU 266.A N GLU 262.A O no hydrogen 2.730 N/A SER 267.A N TRP 263.A O no hydrogen 2.899 N/A SER 267.A N PHE 264.A O no hydrogen 3.224 N/A SER 267.A OG TRP 263.A O no hydrogen 2.753 N/A ASP 268.A N VAL 265.A O no hydrogen 3.279 N/A PHE 271.A N SER 267.A O no hydrogen 3.022 N/A LYS 272.A N ASP 268.A O no hydrogen 2.744 N/A ALA 273.A N GLY 269.A O no hydrogen 2.973 N/A LEU 274.A N VAL 270.A O no hydrogen 3.013 N/A LYS 275.A N PHE 271.A O no hydrogen 2.790 N/A LYS 275.A NZ SER 33.A O no hydrogen 2.943 N/A LYS 275.A NZ SER 33.A OG no hydrogen 3.166 N/A GLU 276.A N LYS 272.A O no hydrogen 2.811 N/A THR 277.A N ALA 273.A O no hydrogen 3.029 N/A THR 277.A OG1 ALA 273.A O no hydrogen 2.964 N/A LEU 279.A N GLU 276.A O no hydrogen 2.683 N/A ALA 280.A N THR 277.A O no hydrogen 2.900 N/A LEU 282.A N VAL 278.A O no hydrogen 3.071 N/A GLU 283.A N LEU 279.A O no hydrogen 2.787 N/A ARG 284.A N ALA 280.A O no hydrogen 3.140 N/A ARG 284.A NH2 ASP 317.A OD2 no hydrogen 3.138 N/A LEU 285.A N ASN 281.A O no hydrogen 2.896 N/A GLU 286.A N LEU 282.A O no hydrogen 2.988 N/A ARG 287.A N GLU 283.A O no hydrogen 3.295 N/A LEU 288.A N ARG 284.A O no hydrogen 3.058 N/A ASN 289.A N LEU 285.A O no hydrogen 2.875 N/A GLY 290.A N ARG 287.A O no hydrogen 2.815 N/A LEU 293.A N GLY 290.A O no hydrogen 3.329 N/A GLY 295.A N ALA 291.A O no hydrogen 3.040 N/A GLU 296.A N LYS 292.A O no hydrogen 3.247 N/A GLU 296.A N LEU 293.A O no hydrogen 3.024 N/A VAL 297.A N ALA 294.A O no hydrogen 3.257 N/A PHE 298.A N ALA 294.A O no hydrogen 3.016 N/A TRP 300.A N HIS 305.A NE2 no hydrogen 3.043 N/A TYR 302.A OH ASP 439.A OD1 no hydrogen 3.188 N/A TYR 302.A OH ASP 439.A OD2 no hydrogen 2.509 N/A LYS 306.A N GLN 304.A OE1 no hydrogen 3.213 N/A LEU 307.A N GLN 304.A O no hydrogen 3.021 N/A VAL 308.A N HIS 305.A O no hydrogen 3.248 N/A THR 312.A N HIS 309.A O no hydrogen 2.960 N/A VAL 313.A N GLN 310.A O no hydrogen 3.202 N/A ASP 317.A N SER 325.A O no hydrogen 2.878 N/A ARG 319.A NE GLY 321.A O no hydrogen 2.757 N/A ARG 319.A NH1 ASP 340.A OD2 no hydrogen 3.296 N/A ARG 319.A NH2 GLY 321.A O no hydrogen 3.237 N/A ARG 319.A NH2 ASP 340.A OD2 no hydrogen 3.072 N/A CYS 320.A N ASN 323.A O no hydrogen 2.951 N/A GLY 321.A N GLN 355.A OE1 no hydrogen 2.860 N/A ASN 323.A N CYS 320.A O no hydrogen 3.461 N/A PHE 324.A N GLN 338.A O no hydrogen 2.820 N/A SER 325.A N SER 318.A O no hydrogen 2.926 N/A ILE 326.A N SER 336.A O no hydrogen 2.788 N/A TYR 327.A N VAL 315.A O no hydrogen 2.917 N/A TYR 327.A OH ASN 289.A OD1 no hydrogen 2.433 N/A TYR 327.A OH SER 333.A OG no hydrogen 3.340 N/A LYS 328.A N SER 334.A O no hydrogen 3.033 N/A SER 333.A OG TYR 327.A OH no hydrogen 3.340 N/A SER 334.A N LYS 328.A O no hydrogen 2.922 N/A LEU 335.A N LEU 5.A O no hydrogen 3.050 N/A SER 336.A N ILE 326.A O no hydrogen 2.939 N/A GLN 337.A N PHE 3.A O no hydrogen 3.099 N/A GLN 338.A N PHE 324.A O no hydrogen 2.908 N/A PHE 339.A N GLY 695.A O no hydrogen 2.916 N/A ASP 340.A N GLU 322.A O no hydrogen 2.976 N/A ALA 341.A N PHE 697.A O no hydrogen 2.916 N/A CYS 342.A SG ASP 340.A OD1 no hydrogen 3.593 N/A ALA 343.A N ASP 340.A O no hydrogen 3.341 N/A SER 344.A N ASP 340.A OD1 no hydrogen 3.099 N/A SER 344.A OG ASP 340.A OD1 no hydrogen 3.562 N/A SER 344.A OG ASP 340.A OD2 no hydrogen 2.520 N/A TRP 346.A N CYS 342.A O no hydrogen 3.154 N/A TRP 346.A NE1 TYR 706.A OH no hydrogen 2.929 N/A THR 347.A N ALA 343.A O no hydrogen 2.813 N/A THR 347.A N SER 344.A O no hydrogen 3.322 N/A THR 347.A OG1 ALA 343.A O no hydrogen 3.401 N/A THR 347.A OG1 SER 344.A O no hydrogen 2.754 N/A GLN 348.A NE2 THR 347.A OG1 no hydrogen 3.095 N/A GLN 348.A NE2 GLY 584.A O no hydrogen 3.010 N/A GLN 355.A N ASP 351.A O no hydrogen 2.937 N/A GLN 355.A NE2 ARG 319.A O no hydrogen 3.376 N/A ALA 356.A N PRO 352.A O no hydrogen 3.225 N/A GLU 357.A N THR 353.A O no hydrogen 3.183 N/A LEU 358.A N PHE 354.A O no hydrogen 2.946 N/A ALA 359.A N GLN 355.A O no hydrogen 3.080 N/A GLU 361.A N GLU 357.A O no hydrogen 3.135 N/A TYR 363.A N ARG 360.A O no hydrogen 2.875 N/A THR 364.A N GLU 361.A O no hydrogen 3.201 N/A THR 364.A OG1 GLU 361.A O no hydrogen 2.789 N/A ALA 366.A N GLY 362.A O no hydrogen 3.058 N/A ARG 367.A N TYR 363.A O no hydrogen 2.923 N/A ARG 367.A NH1 TYR 363.A OH no hydrogen 2.388 N/A PHE 368.A N THR 364.A O no hydrogen 2.806 N/A GLY 369.A N ALA 365.A O no hydrogen 3.038 N/A HIS 370.A NE2 SER 614.A O no hydrogen 2.962 N/A ASN 375.A N PHE 372.A O no hydrogen 2.812 N/A TYR 377.A OH VAL 371.A O no hydrogen 3.165 N/A TYR 377.A OH ALA 617.A O no hydrogen 2.454 N/A LEU 381.A N TYR 377.A O no hydrogen 3.134 N/A LYS 382.A N GLU 378.A O no hydrogen 2.779 N/A CYS 383.A N PRO 379.A O no hydrogen 3.007 N/A ALA 384.A N ALA 380.A O no hydrogen 3.062 N/A GLU 385.A N LEU 381.A O no hydrogen 3.017 N/A LEU 386.A N LYS 382.A O no hydrogen 2.943 N/A LEU 387.A N CYS 383.A O no hydrogen 2.908 N/A LEU 388.A N ALA 384.A O no hydrogen 2.939 N/A ASP 389.A N GLU 385.A O no hydrogen 2.952 N/A GLY 390.A N LEU 387.A O no hydrogen 3.294 N/A GLY 392.A N LEU 387.A O no hydrogen 2.903 N/A LYS 393.A N GLY 390.A O no hydrogen 2.800 N/A TRP 395.A N GLY 392.A O no hydrogen 3.353 N/A ALA 396.A N GLY 392.A O no hydrogen 2.943 N/A SER 397.A N ALA 592.A O no hydrogen 3.040 N/A ARG 398.A N ALA 592.A O no hydrogen 3.203 N/A TYR 400.A N THR 590.A O no hydrogen 3.163 N/A TYR 400.A OH HIS 611.A O no hydrogen 2.313 N/A SER 402.A N ALA 588.A O no hydrogen 2.797 N/A SER 402.A OG ALA 588.A O no hydrogen 3.551 N/A ASP 403.A N THR 407.A OG1 no hydrogen 3.031 N/A ASN 404.A N THR 407.A OG1 no hydrogen 3.245 N/A THR 407.A N ASN 404.A OD1 no hydrogen 2.930 N/A THR 407.A OG1 ASN 404.A O no hydrogen 3.091 N/A THR 407.A OG1 ASN 404.A OD1 no hydrogen 3.551 N/A ALA 408.A N ASN 404.A O no hydrogen 3.124 N/A ILE 409.A N GLY 405.A O no hydrogen 2.883 N/A GLU 410.A N SER 406.A O no hydrogen 3.091 N/A ILE 411.A N THR 407.A O no hydrogen 2.948 N/A ALA 412.A N ALA 408.A O no hydrogen 2.837 N/A LEU 413.A N ILE 409.A O no hydrogen 2.941 N/A LYS 414.A N GLU 410.A O no hydrogen 3.111 N/A LYS 414.A NZ HIS 611.A ND1 no hydrogen 2.797 N/A PHE 416.A N LEU 413.A O no hydrogen 3.078 N/A ARG 417.A N LYS 414.A O no hydrogen 3.286 N/A ARG 417.A NH1 SER 599.A O no hydrogen 3.532 N/A ARG 417.A NH1 LYS 607.A O no hydrogen 2.982 N/A ARG 417.A NH2 LYS 607.A O no hydrogen 3.428 N/A PHE 419.A N ALA 415.A O no hydrogen 3.096 N/A CYS 420.A N PHE 416.A O no hydrogen 2.791 N/A CYS 420.A SG PHE 416.A O no hydrogen 3.183 N/A ASP 422.A N LYS 418.A O no hydrogen 3.344 N/A HIS 423.A N PHE 419.A O no hydrogen 2.999 N/A LYS 428.A N HIS 511.A O no hydrogen 2.953 N/A VAL 429.A N ARG 463.A O no hydrogen 2.973 N/A ILE 430.A N ALA 514.A O no hydrogen 2.802 N/A ALA 431.A N LEU 465.A O no hydrogen 3.274 N/A ARG 433.A N LEU 467.A O no hydrogen 2.762 N/A ARG 433.A NE ASP 468.A OD1 no hydrogen 3.427 N/A ARG 433.A NE ASP 468.A OD2 no hydrogen 3.338 N/A SER 435.A N LEU 432.A O no hydrogen 2.903 N/A SER 435.A OG LEU 432.A O no hydrogen 3.032 N/A SER 435.A OG HIS 437.A NE2 no hydrogen 2.713 N/A TYR 436.A N GLU 518.A OE1 no hydrogen 2.951 N/A TYR 436.A OH ASP 439.A OD1 no hydrogen 2.356 N/A HIS 437.A ND1 ASP 550.A OD2 no hydrogen 2.700 N/A HIS 437.A NE2 SER 435.A OG no hydrogen 2.713 N/A ASP 439.A N SER 406.A OG no hydrogen 2.879 N/A THR 440.A OG1 GLU 410.A OE2 no hydrogen 2.878 N/A ALA 443.A N GLU 410.A OE2 no hydrogen 3.428 N/A ALA 445.A N ALA 443.A O no hydrogen 3.450 N/A GLN 446.A NE2 GLY 438.A O no hydrogen 3.105 N/A SER 449.A N THR 452.A OG1 no hydrogen 2.690 N/A THR 452.A N SER 449.A O no hydrogen 3.239 N/A THR 452.A OG1 SER 449.A O no hydrogen 2.759 N/A GLY 453.A N PRO 450.A O no hydrogen 3.136 N/A GLN 456.A N GLY 453.A O no hydrogen 3.270 N/A GLN 457.A N GLY 453.A O no hydrogen 3.224 N/A TYR 460.A N GLN 457.A O no hydrogen 3.258 N/A TYR 460.A OH GLN 446.A O no hydrogen 2.484 N/A THR 461.A N GLU 444.A OE1 no hydrogen 3.003 N/A THR 461.A OG1 GLU 444.A OE1 no hydrogen 3.052 N/A THR 461.A OG1 GLU 444.A OE2 no hydrogen 2.872 N/A GLY 462.A N GLU 444.A OE1 no hydrogen 3.017 N/A ARG 463.A NE GLU 444.A OE2 no hydrogen 3.162 N/A LEU 465.A N VAL 429.A O no hydrogen 2.800 N/A LEU 467.A N ALA 431.A O no hydrogen 3.012 N/A THR 471.A N SER 482.A O no hydrogen 2.998 N/A THR 471.A OG1 SER 482.A O no hydrogen 3.471 N/A PHE 473.A N ASN 480.A O no hydrogen 3.155 N/A LEU 474.A N VAL 668.A O no hydrogen 2.844 N/A SER 475.A N SER 478.A O no hydrogen 3.049 N/A SER 475.A OG ASN 476.A OD1 no hydrogen 3.542 N/A SER 475.A OG GLN 666.A O no hydrogen 2.958 N/A ASN 476.A N SER 660.A O no hydrogen 3.289 N/A SER 478.A N SER 475.A O no hydrogen 3.012 N/A ASN 480.A N PHE 473.A O no hydrogen 3.009 N/A SER 482.A N THR 471.A O no hydrogen 3.024 N/A ARG 485.A NH1 VAL 670.A O no hydrogen 2.587 N/A ARG 485.A NH2 GLU 649.A OE2 no hydrogen 2.164 N/A ILE 488.A N ARG 485.A O no hydrogen 3.408 N/A PHE 489.A N ASP 486.A O no hydrogen 3.225 N/A SER 492.A N ASP 490.A OD1 no hydrogen 3.039 N/A SER 492.A OG ASP 490.A OD1 no hydrogen 3.031 N/A ARG 493.A N ASP 490.A O no hydrogen 3.155 N/A ARG 493.A NH1 ILE 488.A O no hydrogen 3.004 N/A ARG 493.A NH1 ASP 529.A OD1 no hydrogen 2.899 N/A ARG 493.A NH2 ASP 529.A OD1 no hydrogen 2.955 N/A ARG 493.A NH2 ASP 529.A OD2 no hydrogen 2.627 N/A ASP 494.A N LYS 491.A O no hydrogen 2.958 N/A ALA 495.A N SER 492.A O no hydrogen 3.422 N/A SER 496.A N ARG 493.A O no hydrogen 3.427 N/A SER 496.A OG ARG 493.A O no hydrogen 2.290 N/A ARG 500.A N THR 497.A O no hydrogen 2.790 N/A ILE 501.A N THR 497.A O no hydrogen 3.233 N/A TYR 502.A N LEU 498.A O no hydrogen 2.650 N/A TYR 502.A OH ASP 529.A OD2 no hydrogen 2.802 N/A SER 503.A N ALA 499.A O no hydrogen 3.029 N/A ALA 504.A N ARG 500.A O no hydrogen 3.088 N/A TYR 505.A N ILE 501.A O no hydrogen 3.329 N/A LEU 506.A N TYR 502.A O no hydrogen 3.041 N/A SER 507.A N SER 503.A O no hydrogen 3.180 N/A LYS 508.A N ALA 504.A O no hydrogen 2.808 N/A HIS 509.A N LEU 506.A O no hydrogen 3.092 N/A HIS 509.A ND1 TYR 505.A O no hydrogen 2.912 N/A HIS 511.A N VAL 426.A O no hydrogen 2.842 N/A GLY 513.A N LYS 428.A O no hydrogen 2.901 N/A LEU 515.A N PRO 546.A O no hydrogen 2.812 N/A ILE 516.A N ILE 430.A O no hydrogen 3.045 N/A ILE 517.A N ILE 548.A O no hydrogen 3.151 N/A VAL 520.A N GLN 533.A OE1 no hydrogen 3.050 N/A ILE 521.A N PRO 519.A O no hydrogen 2.611 N/A HIS 522.A N HIS 527.A O no hydrogen 2.775 N/A GLY 523.A N GLU 518.A OE2 no hydrogen 2.963 N/A GLY 526.A N GLY 523.A O no hydrogen 3.096 N/A VAL 528.A N VAL 520.A O no hydrogen 2.840 N/A ASP 529.A N PRO 470.A O no hydrogen 3.196 N/A LEU 531.A N ASP 529.A OD1 no hydrogen 3.096 N/A GLN 533.A N ASP 529.A O no hydrogen 3.347 N/A GLN 533.A NE2 GLU 518.A O no hydrogen 3.268 N/A ARG 534.A N PRO 530.A O no hydrogen 2.756 N/A ARG 534.A NE LEU 568.A O no hydrogen 2.507 N/A ARG 534.A NH1 ASP 494.A OD1 no hydrogen 2.621 N/A ARG 534.A NH2 PHE 489.A O no hydrogen 3.365 N/A ARG 534.A NH2 LEU 568.A O no hydrogen 3.307 N/A VAL 535.A N LEU 531.A O no hydrogen 3.022 N/A LEU 536.A N PHE 532.A O no hydrogen 3.016 N/A VAL 537.A N GLN 533.A O no hydrogen 2.890 N/A ASN 538.A N ARG 534.A O no hydrogen 3.045 N/A GLU 539.A N VAL 535.A O no hydrogen 2.844 N/A CYS 540.A N LEU 536.A O no hydrogen 2.883 N/A CYS 540.A SG LEU 536.A O no hydrogen 3.654 N/A ARG 541.A N VAL 537.A O no hydrogen 2.906 N/A ARG 541.A NH1 LYS 571.A O no hydrogen 3.038 N/A ARG 541.A NH2 LYS 571.A O no hydrogen 3.031 N/A ARG 541.A NH2 ASP 573.A OD2 no hydrogen 2.756 N/A ASN 542.A N ASN 538.A O no hydrogen 2.975 N/A LYS 544.A N ARG 541.A O no hydrogen 2.939 N/A ILE 545.A N CYS 540.A O no hydrogen 2.745 N/A ILE 548.A N LEU 515.A O no hydrogen 2.653 N/A PHE 549.A N ILE 574.A O no hydrogen 2.772 N/A ASP 550.A N ILE 517.A O no hydrogen 2.884 N/A GLU 551.A N CYS 576.A O no hydrogen 2.885 N/A VAL 552.A N ASP 550.A OD1 no hydrogen 3.188 N/A THR 554.A OG1 GLU 551.A OE1 no hydrogen 3.343 N/A GLY 555.A N GLU 551.A O no hydrogen 2.788 N/A PHE 556.A N GLU 562.A O no hydrogen 2.730 N/A TRP 557.A N VAL 561.A O no hydrogen 2.890 N/A ARG 558.A NH1 THR 673.A OG1 no hydrogen 2.919 N/A ARG 558.A NH1 CYS 708.A O no hydrogen 2.796 N/A ARG 558.A NH2 TRP 346.A O no hydrogen 3.288 N/A ARG 558.A NH2 GLN 348.A O no hydrogen 3.159 N/A GLY 560.A N TRP 557.A O no hydrogen 3.016 N/A THR 563.A OG1 VAL 391.A O no hydrogen 3.327 N/A THR 564.A N GLU 551.A OE1 no hydrogen 2.858 N/A THR 564.A OG1 GLU 551.A OE1 no hydrogen 2.937 N/A GLU 566.A N THR 563.A O no hydrogen 3.314 N/A LEU 568.A N THR 564.A O no hydrogen 2.869 N/A GLY 569.A N THR 565.A O no hydrogen 2.933 N/A CYS 570.A SG LEU 568.A O no hydrogen 3.879 N/A ASP 573.A N VAL 547.A O no hydrogen 3.022 N/A ILE 574.A N VAL 547.A O no hydrogen 3.002 N/A ALA 575.A N LEU 591.A O no hydrogen 2.974 N/A CYS 576.A N PHE 549.A O no hydrogen 2.925 N/A PHE 577.A N VAL 589.A O no hydrogen 2.901 N/A LEU 581.A N ALA 578.A O no hydrogen 2.699 N/A THR 582.A OG1 LYS 579.A O no hydrogen 3.522 N/A THR 582.A OG1 VAL 585.A O no hydrogen 2.476 N/A GLY 583.A N LEU 580.A O no hydrogen 2.733 N/A ALA 588.A N SER 402.A O no hydrogen 3.269 N/A VAL 589.A N PHE 577.A O no hydrogen 2.970 N/A THR 590.A N TYR 400.A O no hydrogen 2.912 N/A THR 590.A OG1 ALA 408.A O no hydrogen 3.002 N/A LEU 591.A N ALA 575.A O no hydrogen 2.687 N/A ALA 592.A N ARG 398.A O no hydrogen 2.991 N/A THR 593.A N ASP 573.A O no hydrogen 3.040 N/A THR 593.A OG1 TRP 395.A O no hydrogen 3.408 N/A PHE 597.A N THR 593.A O no hydrogen 3.105 N/A ASP 598.A N ASP 594.A O no hydrogen 3.028 N/A SER 599.A N ALA 595.A O no hydrogen 3.265 N/A SER 599.A N VAL 596.A O no hydrogen 3.369 N/A SER 599.A OG VAL 596.A O no hydrogen 2.703 N/A PHE 600.A N PHE 597.A O no hydrogen 2.930 N/A SER 601.A N ASP 598.A O no hydrogen 2.897 N/A LYS 607.A N SER 604.A O no hydrogen 3.100 N/A HIS 611.A NE2 HIS 613.A NE2 no hydrogen 2.922 N/A HIS 613.A NE2 HIS 611.A NE2 no hydrogen 2.922 N/A SER 616.A N HIS 613.A O no hydrogen 3.116 N/A SER 616.A OG HIS 613.A O no hydrogen 2.864 N/A HIS 618.A N TYR 615.A O no hydrogen 3.319 N/A HIS 618.A NE2 PRO 586.A O no hydrogen 3.096 N/A CYS 621.A N HIS 618.A O no hydrogen 3.093 N/A CYS 621.A SG HIS 618.A O no hydrogen 3.482 N/A ALA 622.A N ALA 619.A O no hydrogen 2.874 N/A ALA 624.A N GLY 620.A O no hydrogen 2.784 N/A ALA 625.A N CYS 621.A O no hydrogen 2.813 N/A LYS 626.A N ALA 622.A O no hydrogen 3.032 N/A LYS 626.A NZ GLU 357.A OE1 no hydrogen 3.262 N/A ALA 627.A N THR 623.A O no hydrogen 3.078 N/A ILE 628.A N ALA 624.A O no hydrogen 2.889 N/A GLN 629.A NE2 ALA 625.A O no hydrogen 2.604 N/A TRP 630.A N LYS 626.A O no hydrogen 2.877 N/A PHE 631.A N ALA 627.A O no hydrogen 2.939 N/A LYS 632.A N GLN 629.A O no hydrogen 3.328 N/A GLU 635.A N ASP 633.A OD1 no hydrogen 2.603 N/A THR 636.A OG1 TRP 630.A O no hydrogen 2.917 N/A THR 636.A OG1 ASP 633.A O no hydrogen 3.334 N/A ASN 637.A N ASP 633.A O no hydrogen 2.757 N/A ASN 637.A ND2 PHE 631.A O no hydrogen 2.839 N/A ASN 637.A ND2 PRO 710.A O no hydrogen 3.526 N/A ASN 639.A N ASN 637.A OD1 no hydrogen 3.058 N/A ASN 639.A ND2 PRO 710.A O no hydrogen 3.103 N/A ASN 639.A ND2 THR 712.A O no hydrogen 2.474 N/A ILE 640.A N ASN 637.A O no hydrogen 3.086 N/A THR 641.A N THR 646.A O no hydrogen 2.345 N/A GLN 643.A NE2 SER 642.A OG no hydrogen 3.066 N/A LYS 645.A N THR 641.A O no hydrogen 2.596 N/A THR 646.A OG1 GLY 560.A O no hydrogen 3.305 N/A ARG 648.A N ASN 639.A O no hydrogen 2.633 N/A ARG 648.A NE ASN 639.A OD1 no hydrogen 2.777 N/A ARG 648.A NH2 ASN 639.A OD1 no hydrogen 3.082 N/A VAL 656.A N ASP 652.A O no hydrogen 3.034 N/A GLN 657.A N GLU 653.A O no hydrogen 3.132 N/A GLN 658.A N GLU 654.A O no hydrogen 2.758 N/A ILE 659.A N LEU 655.A O no hydrogen 2.993 N/A SER 660.A N VAL 656.A O no hydrogen 2.923 N/A SER 660.A OG VAL 656.A O no hydrogen 2.803 N/A SER 661.A N GLN 657.A O no hydrogen 2.583 N/A SER 661.A OG GLN 658.A O no hydrogen 2.860 N/A HIS 662.A N GLN 658.A O no hydrogen 3.163 N/A ALA 664.A N HIS 662.A ND1 no hydrogen 3.015 N/A GLN 666.A N GLU 678.A O no hydrogen 2.910 N/A ARG 667.A NE GLU 678.A OE1 no hydrogen 2.838 N/A ARG 667.A NH2 GLY 526.A O no hydrogen 2.861 N/A ARG 667.A NH2 GLU 678.A OE1 no hydrogen 3.153 N/A VAL 668.A N LEU 474.A O no hydrogen 2.970 N/A VAL 669.A N ALA 676.A O no hydrogen 2.984 N/A ILE 671.A N LEU 674.A O no hydrogen 3.168 N/A THR 673.A N ARG 558.A O no hydrogen 2.861 N/A THR 673.A OG1 ARG 558.A O no hydrogen 2.613 N/A THR 673.A OG1 CYS 708.A O no hydrogen 3.559 N/A LEU 674.A N ILE 671.A O no hydrogen 3.151 N/A PHE 675.A N LEU 707.A O no hydrogen 2.946 N/A ALA 676.A N VAL 669.A O no hydrogen 2.919 N/A LEU 677.A N ILE 705.A O no hydrogen 2.915 N/A GLU 678.A N ARG 667.A O no hydrogen 2.995 N/A LEU 679.A N ASN 703.A O no hydrogen 3.067 N/A LYS 686.A N SER 682.A O no hydrogen 2.825 N/A SER 687.A N LEU 683.A O no hydrogen 2.698 N/A LEU 688.A N TYR 684.A O no hydrogen 3.351 N/A LEU 689.A N ALA 685.A O no hydrogen 3.124 N/A ILE 690.A N LYS 686.A O no hydrogen 3.280 N/A ARG 692.A N LEU 689.A O no hydrogen 2.710 N/A GLU 693.A N ILE 690.A O no hydrogen 3.255 N/A ASP 694.A N LEU 691.A O no hydrogen 2.564 N/A GLY 695.A N ARG 692.A O no hydrogen 2.689 N/A ILE 696.A N LEU 691.A O no hydrogen 3.128 N/A PHE 697.A N PHE 339.A O no hydrogen 2.913 N/A THR 698.A OG1 TYR 706.A O no hydrogen 2.995 N/A LEU 701.A N VAL 704.A O no hydrogen 2.897 N/A VAL 704.A N LEU 701.A O no hydrogen 2.840 N/A ILE 705.A N LEU 677.A O no hydrogen 2.841 N/A LEU 707.A N PHE 675.A O no hydrogen 2.753 N/A CYS 708.A SG THR 673.A O no hydrogen 3.839 N/A CYS 708.A SG GLY 709.A O no hydrogen 3.328 N/A GLY 709.A N THR 712.A OG1 no hydrogen 3.014 N/A THR 712.A N GLY 709.A O no hydrogen 3.195 N/A THR 712.A OG1 GLU 322.A OE2 no hydrogen 2.931 N/A THR 712.A OG1 GLY 709.A O no hydrogen 3.275 N/A ILE 716.A N SER 713.A OG no hydrogen 3.287 N/A CYS 717.A N SER 713.A O no hydrogen 3.158 N/A CYS 717.A SG SER 713.A O no hydrogen 3.802 N/A ARG 718.A N PRO 714.A O no hydrogen 2.669 N/A ARG 719.A N GLU 715.A O no hydrogen 3.248 N/A ARG 719.A NH2 ASP 694.A O no hydrogen 2.904 N/A LEU 720.A N ILE 716.A O no hydrogen 3.104 N/A LEU 721.A N CYS 717.A O no hydrogen 2.983 N/A THR 722.A N ARG 718.A O no hydrogen 2.949 N/A THR 722.A OG1 ARG 718.A O no hydrogen 2.891 N/A LYS 723.A N ARG 719.A O no hydrogen 3.079 N/A LEU 724.A N LEU 720.A O no hydrogen 2.971 N/A TYR 725.A N LEU 721.A O no hydrogen 2.791 N/A LYS 726.A N THR 722.A O no hydrogen 2.898 N/A ARG 727.A N LYS 723.A O no hydrogen 3.099 N/A ARG 727.A NE ASP 694.A OD2 no hydrogen 2.836 N/A LEU 728.A N LEU 724.A O no hydrogen 2.913 N/A LEU 728.A N TYR 725.A O no hydrogen 3.173 N/A GLY 729.A N TYR 725.A O no hydrogen 3.334 N/A GLU 730.A N LYS 726.A O no hydrogen 3.471 N/A