Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4pwc_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): PHE 3.A N ASP 2.A OD1 no hydrogen 2.483 N/A GLY 5.A N GLU 1.A O no hydrogen 2.561 N/A CYS 6.A N ASP 2.A O no hydrogen 3.056 N/A LEU 7.A N PHE 3.A O no hydrogen 2.914 N/A VAL 8.A N LEU 4.A O no hydrogen 3.165 N/A LYS 9.A N CYS 6.A O no hydrogen 3.193 N/A GLU 10.A N LEU 7.A O no hydrogen 3.194 N/A ILE 11.A N LEU 7.A O no hydrogen 2.829 N/A LEU 15.A N PRO 12.A O no hydrogen 2.789 N/A LEU 16.A N PRO 13.A O no hydrogen 3.165 N/A TYR 17.A N ILE 48.A O no hydrogen 2.927 N/A ALA 18.A N SER 21.A OG no hydrogen 3.068 N/A SER 21.A N ALA 18.A O no hydrogen 3.007 N/A SER 21.A OG ALA 18.A O no hydrogen 3.353 N/A TYR 24.A N SER 21.A O no hydrogen 3.363 N/A TYR 24.A OH PRO 45.A O no hydrogen 2.794 N/A SER 26.A OG ALA 23.A O no hydrogen 3.187 N/A VAL 27.A N ALA 23.A O no hydrogen 3.027 N/A LEU 28.A N TYR 24.A O no hydrogen 2.884 N/A GLY 29.A N PRO 25.A O no hydrogen 3.010 N/A GLN 30.A N SER 26.A O no hydrogen 2.986 N/A GLN 30.A NE2 VAL 27.A O no hydrogen 3.220 N/A ILE 32.A N GLY 29.A O no hydrogen 3.062 N/A ARG 33.A NE GLY 76.A O no hydrogen 2.849 N/A ARG 33.A NH2 GLY 76.A O no hydrogen 2.811 N/A ASN 34.A ND2 TYR 80.A O no hydrogen 3.648 N/A ASN 34.A ND2 ALA 329.A O no hydrogen 2.890 N/A SER 35.A N PRO 327.A O no hydrogen 2.756 N/A SER 35.A OG LYS 326.A O no hydrogen 2.308 N/A ARG 36.A N ASN 34.A OD1 no hydrogen 3.139 N/A ARG 36.A NH1 ALA 329.A O no hydrogen 2.938 N/A ARG 36.A NH1 GLU 330.A OE1 no hydrogen 3.269 N/A TRP 37.A N ASN 34.A O no hydrogen 2.908 N/A TRP 37.A NE1 TYR 80.A O no hydrogen 3.061 N/A SER 38.A N SER 35.A O no hydrogen 3.259 N/A SER 38.A OG SER 35.A O no hydrogen 3.000 N/A SER 39.A OG ARG 36.A O no hydrogen 3.326 N/A SER 39.A OG ASP 41.A OD1 no hydrogen 2.481 N/A ASN 42.A N SER 39.A O no hydrogen 3.254 N/A ASN 42.A ND2 ARG 36.A O no hydrogen 2.956 N/A ASN 42.A ND2 SER 39.A O no hydrogen 2.926 N/A LYS 44.A NZ SER 39.A O no hydrogen 3.312 N/A LEU 46.A N PHE 93.A O no hydrogen 2.789 N/A ILE 48.A N TYR 17.A O no hydrogen 2.874 N/A ILE 49.A N VAL 95.A O no hydrogen 2.901 N/A THR 50.A N LEU 15.A O no hydrogen 2.904 N/A THR 50.A OG1 LEU 15.A O no hydrogen 3.568 N/A THR 50.A OG1 THR 50.A O no hydrogen 2.495 N/A THR 52.A N HIS 56.A ND1 no hydrogen 3.208 N/A GLN 53.A N HIS 56.A ND1 no hydrogen 3.281 N/A HIS 56.A N GLN 53.A O no hydrogen 2.967 N/A GLN 58.A N VAL 54.A O no hydrogen 2.978 N/A GLN 58.A NE2 GLY 180.A O no hydrogen 3.075 N/A SER 59.A N SER 55.A O no hydrogen 2.965 N/A SER 59.A OG SER 55.A O no hydrogen 3.111 N/A ALA 60.A N HIS 56.A O no hydrogen 2.987 N/A VAL 61.A N ILE 57.A O no hydrogen 3.014 N/A VAL 62.A N GLN 58.A O no hydrogen 2.923 N/A CYS 63.A N SER 59.A O no hydrogen 2.895 N/A CYS 63.A SG SER 59.A O no hydrogen 3.388 N/A GLY 64.A N ALA 60.A O no hydrogen 2.876 N/A ARG 65.A N VAL 61.A O no hydrogen 2.804 N/A ARG 65.A NH1 ALA 178.A O no hydrogen 2.889 N/A ARG 65.A NH1 ASN 179.A OD1 no hydrogen 2.665 N/A ARG 66.A N VAL 62.A O no hydrogen 2.884 N/A HIS 67.A N CYS 63.A O no hydrogen 2.908 N/A THR 68.A N ARG 65.A O no hydrogen 3.395 N/A THR 68.A OG1 HIS 67.A O no hydrogen 2.782 N/A VAL 69.A N GLY 64.A O no hydrogen 2.863 N/A ARG 70.A NE ASP 477.A O no hydrogen 2.928 N/A ARG 70.A NE TYR 478.A O no hydrogen 3.057 N/A ARG 70.A NH1 ASP 444.A OD1 no hydrogen 3.100 N/A ARG 70.A NH1 ASP 444.A OD2 no hydrogen 3.097 N/A ARG 70.A NH2 ASP 444.A OD2 no hydrogen 3.186 N/A ARG 70.A NH2 THR 476.A O no hydrogen 3.256 N/A ARG 70.A NH2 ASP 477.A O no hydrogen 2.876 N/A ARG 72.A N ALA 94.A O no hydrogen 2.850 N/A ARG 72.A NH1 LEU 83.A O no hydrogen 3.380 N/A ARG 72.A NH1 GLU 482.A OE1 no hydrogen 2.837 N/A ARG 72.A NH1 GLU 482.A OE2 no hydrogen 3.445 N/A ARG 72.A NH2 GLU 91.A OE2 no hydrogen 3.408 N/A ARG 72.A NH2 GLU 482.A OE1 no hydrogen 3.233 N/A ARG 72.A NH2 GLU 482.A OE2 no hydrogen 2.875 N/A VAL 73.A N GLU 202.A OE1 no hydrogen 3.144 N/A ARG 74.A N VAL 96.A O no hydrogen 2.788 N/A ARG 74.A NE ASP 97.A OD2 no hydrogen 2.971 N/A ARG 74.A NH1 LEU 28.A O no hydrogen 2.881 N/A ARG 74.A NH2 VAL 27.A O no hydrogen 3.116 N/A ARG 74.A NH2 LEU 28.A O no hydrogen 3.316 N/A ARG 74.A NH2 ASP 97.A OD2 no hydrogen 2.497 N/A SER 75.A OG SER 117.A O no hydrogen 3.515 N/A HIS 78.A NE2 THR 144.A OG1 no hydrogen 2.762 N/A TYR 80.A OH GLN 391.A OE1 no hydrogen 2.794 N/A GLU 81.A N ASP 79.A OD2 no hydrogen 2.973 N/A GLY 82.A N ASP 79.A O no hydrogen 2.799 N/A LEU 83.A N ASP 79.A OD2 no hydrogen 3.052 N/A TYR 85.A N GLY 82.A O no hydrogen 2.951 N/A ARG 86.A N GLY 82.A O no hydrogen 3.092 N/A ARG 86.A NH1 GLU 81.A O no hydrogen 2.440 N/A SER 87.A OG GLN 89.A O no hydrogen 2.469 N/A LEU 88.A N GLU 482.A OE2 no hydrogen 2.847 N/A ALA 94.A N ARG 70.A O no hydrogen 2.853 N/A VAL 95.A N TYR 47.A O no hydrogen 3.099 N/A VAL 96.A N ARG 72.A O no hydrogen 2.998 N/A ASP 97.A N ILE 49.A O no hydrogen 2.872 N/A LEU 98.A N ARG 74.A O no hydrogen 2.784 N/A ASN 99.A N ASP 97.A OD1 no hydrogen 2.846 N/A ASN 99.A ND2 ASP 97.A OD1 no hydrogen 2.732 N/A MET 101.A N LEU 98.A O no hydrogen 2.829 N/A ALA 103.A N ASP 116.A OD2 no hydrogen 2.934 N/A TRP 105.A N TRP 114.A O no hydrogen 2.884 N/A ASP 107.A N THR 112.A O no hydrogen 2.785 N/A ALA 110.A N ASP 107.A OD1 no hydrogen 3.141 N/A ARG 111.A N GLY 108.A O no hydrogen 3.346 N/A THR 112.A N ASP 107.A O no hydrogen 3.292 N/A ALA 113.A N VAL 212.A O no hydrogen 3.003 N/A TRP 114.A N TRP 105.A O no hydrogen 3.008 N/A VAL 115.A N TRP 210.A O no hydrogen 2.755 N/A ASP 116.A N ALA 103.A O no hydrogen 2.935 N/A SER 117.A N VAL 208.A O no hydrogen 2.887 N/A SER 117.A OG VAL 207.A O no hydrogen 2.632 N/A ALA 119.A N ASP 116.A O no hydrogen 3.159 N/A GLN 120.A N GLU 123.A OE1 no hydrogen 2.908 N/A LEU 121.A N VAL 145.A O no hydrogen 2.810 N/A GLY 122.A N PRO 143.A O no hydrogen 2.752 N/A LEU 124.A N GLN 120.A O no hydrogen 3.120 N/A TYR 125.A N LEU 121.A O no hydrogen 2.841 N/A TYR 125.A OH GLY 140.A O no hydrogen 2.687 N/A TYR 126.A N GLY 122.A O no hydrogen 2.925 N/A TYR 126.A OH GLU 315.A OE2 no hydrogen 2.632 N/A ALA 127.A N GLU 123.A O no hydrogen 3.041 N/A ILE 128.A N LEU 124.A O no hydrogen 3.212 N/A TYR 129.A N TYR 125.A O no hydrogen 3.050 N/A LYS 130.A N TYR 126.A O no hydrogen 2.921 N/A ALA 131.A N ILE 128.A O no hydrogen 2.977 N/A SER 132.A N ILE 128.A O no hydrogen 2.907 N/A THR 134.A N SER 132.A OG no hydrogen 3.040 N/A THR 134.A OG1 SER 132.A OG no hydrogen 3.226 N/A ALA 136.A N LEU 215.A O no hydrogen 2.731 N/A ALA 139.A N PHE 137.A O no hydrogen 3.009 N/A GLY 140.A N HIS 150.A NE2 no hydrogen 2.865 N/A CYS 142.A SG HIS 307.A NE2 no hydrogen 3.591 N/A THR 144.A OG1 HIS 78.A NE2 no hydrogen 2.762 N/A VAL 145.A N CYS 142.A O no hydrogen 3.249 N/A VAL 147.A N ALA 119.A O no hydrogen 2.929 N/A GLY 148.A N SER 117.A O no hydrogen 3.032 N/A HIS 150.A N GLY 146.A O no hydrogen 3.275 N/A PHE 151.A N VAL 147.A O no hydrogen 2.956 N/A ALA 152.A N GLY 148.A O no hydrogen 3.389 N/A GLY 153.A N GLY 149.A O no hydrogen 3.063 N/A GLY 154.A N PHE 151.A O no hydrogen 3.120 N/A GLY 155.A N TYR 428.A OH no hydrogen 2.765 N/A LEU 160.A N GLY 157.A O no hydrogen 2.937 N/A ARG 161.A NE TYR 366.A O no hydrogen 2.635 N/A ARG 161.A NH1 LEU 248.A O no hydrogen 3.016 N/A ARG 161.A NH1 PRO 249.A O no hydrogen 2.887 N/A ARG 161.A NH1 LEU 252.A O no hydrogen 3.008 N/A ARG 161.A NH2 PRO 246.A O no hydrogen 2.553 N/A ARG 161.A NH2 LEU 248.A O no hydrogen 2.884 N/A ARG 161.A NH2 TYR 366.A O no hydrogen 3.445 N/A LYS 162.A NZ ASP 251.A OD1 no hydrogen 2.743 N/A TYR 163.A N LEU 159.A O no hydrogen 2.873 N/A TYR 163.A OH PRO 216.A O no hydrogen 2.556 N/A GLY 164.A N LEU 160.A O no hydrogen 2.822 N/A ILE 165.A N GLU 168.A OE2 no hydrogen 2.770 N/A ALA 166.A N GLY 155.A O no hydrogen 2.721 N/A ALA 167.A N GLY 154.A O no hydrogen 2.905 N/A ASN 169.A N ALA 166.A O no hydrogen 2.978 N/A ASN 169.A ND2 TYR 163.A O no hydrogen 3.236 N/A ASN 169.A ND2 ILE 165.A O no hydrogen 2.960 N/A VAL 170.A N ALA 167.A O no hydrogen 3.277 N/A ILE 171.A N GLN 211.A O no hydrogen 2.780 N/A ASP 172.A N GLN 211.A O no hydrogen 3.355 N/A VAL 173.A N ASP 172.A OD1 no hydrogen 2.725 N/A LYS 174.A N ALA 209.A O no hydrogen 2.902 N/A LEU 175.A N HIS 183.A O no hydrogen 2.946 N/A VAL 176.A N ILE 206.A O no hydrogen 2.778 N/A ASP 177.A N LYS 181.A O no hydrogen 3.004 N/A ASN 179.A N ASP 177.A OD1 no hydrogen 2.785 N/A GLY 180.A N ASP 177.A O no hydrogen 2.970 N/A LYS 181.A N ASP 177.A OD1 no hydrogen 2.997 N/A HIS 183.A N LEU 175.A O no hydrogen 2.841 N/A HIS 183.A ND1 SER 187.A O no hydrogen 2.891 N/A HIS 183.A NE2 ASP 177.A OD2 no hydrogen 2.783 N/A ASP 184.A N SER 187.A OG no hydrogen 3.188 N/A LYS 185.A N ASP 172.A OD1 no hydrogen 2.906 N/A LYS 185.A NZ ILE 171.A O no hydrogen 3.227 N/A SER 187.A N ASP 184.A O no hydrogen 3.183 N/A SER 187.A N ASP 184.A OD1 no hydrogen 3.270 N/A SER 187.A OG HIS 183.A ND1 no hydrogen 3.309 N/A SER 187.A OG ASP 184.A OD1 no hydrogen 3.442 N/A HIS 192.A NE2 PHE 204.A O no hydrogen 2.869 N/A PHE 193.A N GLY 189.A O no hydrogen 3.231 N/A TRP 194.A N ASP 190.A O no hydrogen 2.730 N/A TRP 194.A NE1 SER 376.A O no hydrogen 3.045 N/A ALA 195.A N ASP 191.A O no hydrogen 2.739 N/A VAL 196.A N HIS 192.A O no hydrogen 3.102 N/A ARG 197.A NE PHE 193.A O no hydrogen 2.897 N/A ARG 197.A NH1 VAL 170.A O no hydrogen 2.975 N/A ARG 197.A NH2 PHE 193.A O no hydrogen 3.445 N/A GLY 199.A N ALA 195.A O no hydrogen 2.847 N/A GLY 200.A N ALA 152.A O no hydrogen 2.765 N/A SER 203.A N GLY 201.A O no hydrogen 2.707 N/A GLY 205.A N GLU 202.A O no hydrogen 3.272 N/A ILE 206.A N VAL 176.A O no hydrogen 2.985 N/A VAL 208.A N LYS 174.A O no hydrogen 2.605 N/A ALA 209.A N LYS 174.A O no hydrogen 3.442 N/A TRP 210.A N VAL 115.A O no hydrogen 2.767 N/A TRP 210.A NE1 SER 117.A OG no hydrogen 2.780 N/A GLN 211.A N ASP 172.A O no hydrogen 2.626 N/A VAL 212.A N ALA 113.A O no hydrogen 2.751 N/A LYS 213.A N ASN 169.A O no hydrogen 3.168 N/A LEU 214.A N ARG 111.A O no hydrogen 2.746 N/A LEU 215.A N ALA 136.A O no hydrogen 2.878 N/A VAL 217.A N THR 134.A O no hydrogen 3.033 N/A VAL 221.A N MET 297.A O no hydrogen 2.696 N/A THR 222.A N TYR 269.A O no hydrogen 2.868 N/A THR 222.A OG1 GLY 271.A O no hydrogen 2.922 N/A ILE 223.A N ASN 295.A O no hydrogen 3.003 N/A PHE 224.A N ALA 267.A O no hydrogen 3.205 N/A LYS 225.A NZ GLU 266.A OE1 no hydrogen 3.417 N/A LYS 225.A NZ PHE 305.A O no hydrogen 3.174 N/A ILE 226.A N PHE 265.A O no hydrogen 2.986 N/A LYS 228.A N ALA 263.A O no hydrogen 2.808 N/A LYS 228.A NZ LEU 287.A O no hydrogen 3.335 N/A THR 229.A N GLU 232.A OE1 no hydrogen 2.586 N/A THR 229.A OG1 GLU 232.A OE1 no hydrogen 3.151 N/A VAL 230.A N PRO 261.A O no hydrogen 2.939 N/A GLU 232.A N THR 229.A OG1 no hydrogen 3.300 N/A GLY 233.A N VAL 230.A O no hydrogen 2.941 N/A ALA 234.A N THR 229.A O no hydrogen 3.051 N/A ILE 237.A N GLY 233.A O no hydrogen 3.244 N/A ILE 238.A N ALA 234.A O no hydrogen 2.837 N/A ASN 239.A N VAL 235.A O no hydrogen 3.143 N/A LYS 240.A N ASP 236.A O no hydrogen 3.258 N/A TRP 241.A N ILE 237.A O no hydrogen 2.932 N/A TRP 241.A NE1 ILE 254.A O no hydrogen 2.926 N/A GLN 242.A N ILE 238.A O no hydrogen 3.256 N/A GLN 242.A NE2 ASN 239.A O no hydrogen 3.359 N/A GLN 242.A NE2 PHE 340.A O no hydrogen 2.886 N/A VAL 243.A N LYS 240.A O no hydrogen 3.024 N/A VAL 244.A N LYS 240.A O no hydrogen 3.040 N/A ALA 245.A N TRP 241.A O no hydrogen 2.629 N/A GLN 247.A N VAL 244.A O no hydrogen 3.028 N/A LEU 248.A N VAL 244.A O no hydrogen 3.066 N/A LEU 248.A N ALA 245.A O no hydrogen 3.383 N/A LEU 252.A N PRO 249.A O no hydrogen 2.845 N/A MET 253.A N MET 268.A O no hydrogen 2.906 N/A ARG 255.A N GLU 266.A O no hydrogen 2.685 N/A ARG 255.A NE GLU 266.A OE2 no hydrogen 2.919 N/A ARG 255.A NH2 GLU 266.A OE2 no hydrogen 3.043 N/A ILE 256.A N PHE 363.A O no hydrogen 3.008 N/A ILE 257.A N THR 264.A O no hydrogen 2.923 N/A ALA 258.A N MET 361.A O no hydrogen 2.940 N/A LYS 262.A N GLY 260.A O no hydrogen 2.574 N/A ALA 263.A N LYS 228.A O no hydrogen 2.835 N/A THR 264.A N ILE 257.A O no hydrogen 2.783 N/A PHE 265.A N ILE 226.A O no hydrogen 2.814 N/A GLU 266.A N ARG 255.A O no hydrogen 2.702 N/A ALA 267.A N PHE 224.A O no hydrogen 2.819 N/A MET 268.A N MET 253.A O no hydrogen 2.833 N/A TYR 269.A N THR 222.A O no hydrogen 2.756 N/A TYR 269.A OH THR 275.A OG1 no hydrogen 3.069 N/A LEU 270.A N ASP 251.A O no hydrogen 2.951 N/A GLY 271.A N TYR 269.A O no hydrogen 2.873 N/A CYS 273.A N GLU 296.A OE2 no hydrogen 2.675 N/A CYS 273.A SG THR 277.A OG1 no hydrogen 3.672 N/A CYS 273.A SG PRO 291.A O no hydrogen 3.796 N/A THR 275.A N THR 272.A O no hydrogen 3.227 N/A THR 275.A OG1 TYR 269.A OH no hydrogen 3.069 N/A THR 275.A OG1 THR 272.A O no hydrogen 3.192 N/A LEU 276.A N THR 272.A O no hydrogen 2.963 N/A THR 277.A N CYS 273.A O no hydrogen 3.021 N/A THR 277.A OG1 CYS 273.A O no hydrogen 2.859 N/A MET 280.A N LEU 276.A O no hydrogen 2.759 N/A SER 281.A N THR 277.A O no hydrogen 2.821 N/A SER 282.A N PRO 278.A O no hydrogen 2.779 N/A LYS 283.A N LEU 279.A O no hydrogen 2.831 N/A PHE 284.A N MET 280.A O no hydrogen 2.852 N/A GLU 286.A N GLU 286.A OE1 no hydrogen 2.536 N/A LEU 287.A N PHE 284.A O no hydrogen 3.384 N/A GLY 288.A N PRO 285.A O no hydrogen 2.885 N/A ASN 290.A N HIS 293.A ND1 no hydrogen 3.266 N/A ASN 290.A ND2 GLY 288.A O no hydrogen 3.466 N/A SER 292.A N ASN 290.A OD1 no hydrogen 3.323 N/A SER 292.A OG ASN 290.A OD1 no hydrogen 2.265 N/A HIS 293.A N ASN 290.A O no hydrogen 2.970 N/A CYS 294.A N PRO 291.A O no hydrogen 3.217 N/A ASN 295.A N ILE 223.A O no hydrogen 2.828 N/A MET 297.A N VAL 221.A O no hydrogen 3.015 N/A GLN 301.A N SER 298.A OG no hydrogen 3.411 N/A SER 302.A N SER 298.A O no hydrogen 3.143 N/A SER 302.A OG TRP 299.A O no hydrogen 2.419 N/A ILE 303.A N ILE 300.A O no hydrogen 3.240 N/A PHE 305.A N GLN 301.A O no hydrogen 3.423 N/A VAL 306.A N SER 302.A O no hydrogen 2.957 N/A HIS 307.A N ILE 303.A O no hydrogen 3.305 N/A LEU 308.A N PRO 304.A O no hydrogen 2.760 N/A GLY 309.A N PHE 305.A O no hydrogen 2.854 N/A ARG 311.A N ASP 312.A OD1 no hydrogen 3.253 N/A ASP 312.A N ASP 312.A OD1 no hydrogen 2.534 N/A GLU 315.A N GLU 315.A OE1 no hydrogen 2.819 N/A ASP 317.A N ALA 313.A O no hydrogen 2.904 N/A LEU 318.A N LEU 314.A O no hydrogen 3.167 N/A LEU 319.A N GLU 315.A O no hydrogen 3.037 N/A ARG 321.A NE GLU 123.A OE2 no hydrogen 2.791 N/A ARG 321.A NH1 ASN 99.A O no hydrogen 3.068 N/A ARG 321.A NH2 GLY 118.A O no hydrogen 3.169 N/A ARG 321.A NH2 GLU 123.A OE1 no hydrogen 2.716 N/A ARG 321.A NH2 GLU 123.A OE2 no hydrogen 3.258 N/A GLN 322.A N ASN 320.A OD1 no hydrogen 3.154 N/A ASN 323.A ND2 ILE 32.A O no hydrogen 2.820 N/A LYS 326.A N SER 324.A O no hydrogen 3.221 N/A LYS 326.A NZ GLY 29.A O no hydrogen 3.366 N/A PHE 328.A N TRP 396.A O no hydrogen 2.854 N/A ALA 329.A N ASN 34.A OD1 no hydrogen 3.070 N/A GLU 330.A N ASN 394.A O no hydrogen 2.871 N/A LYS 332.A N TYR 392.A O no hydrogen 3.036 N/A LYS 332.A NZ ASP 433.A OD1 no hydrogen 3.310 N/A LYS 332.A NZ ASP 433.A OD2 no hydrogen 2.790 N/A ASP 334.A N ILE 390.A O no hydrogen 2.949 N/A TYR 335.A OH TYR 366.A OH no hydrogen 2.841 N/A VAL 336.A N PHE 388.A O no hydrogen 2.877 N/A TYR 337.A OH GLN 426.A OE1 no hydrogen 3.355 N/A PHE 340.A N GLN 242.A OE1 no hydrogen 2.615 N/A LYS 342.A NZ ASP 236.A OD1 no hydrogen 2.842 N/A THR 343.A OG1 GLU 346.A OE1 no hydrogen 3.532 N/A VAL 344.A N PRO 341.A O no hydrogen 2.886 N/A GLU 346.A N LYS 342.A O no hydrogen 3.123 N/A GLN 347.A N THR 343.A O no hydrogen 3.052 N/A ILE 348.A N VAL 344.A O no hydrogen 2.950 N/A LEU 349.A N TRP 345.A O no hydrogen 3.009 N/A ASN 350.A N GLU 346.A O no hydrogen 2.787 N/A ASN 350.A ND2 GLU 346.A O no hydrogen 3.227 N/A THR 351.A N GLN 347.A O no hydrogen 2.966 N/A THR 351.A OG1 GLN 347.A OE1 no hydrogen 3.205 N/A TRP 352.A N GLN 347.A O no hydrogen 2.838 N/A LEU 353.A N ILE 348.A O no hydrogen 2.976 N/A VAL 354.A N THR 351.A O no hydrogen 3.180 N/A ALA 358.A N LYS 355.A O no hydrogen 3.091 N/A ILE 360.A N VAL 393.A O no hydrogen 2.699 N/A MET 361.A N ALA 258.A O no hydrogen 2.988 N/A ILE 362.A N GLN 391.A O no hydrogen 2.972 N/A PHE 363.A N ILE 256.A O no hydrogen 2.743 N/A ASP 364.A N ASN 389.A O no hydrogen 3.012 N/A TYR 366.A N LEU 387.A O no hydrogen 2.934 N/A TYR 366.A OH TYR 335.A OH no hydrogen 2.841 N/A GLY 367.A N SER 371.A OG no hydrogen 2.909 N/A THR 369.A N ARG 161.A O no hydrogen 3.050 N/A THR 369.A OG1 ARG 161.A O no hydrogen 3.240 N/A THR 369.A OG1 LYS 162.A O no hydrogen 2.797 N/A SER 371.A N GLY 367.A O no hydrogen 3.403 N/A SER 371.A N ALA 368.A O no hydrogen 3.270 N/A SER 371.A OG ARG 383.A O no hydrogen 2.706 N/A ALA 372.A N THR 369.A O no hydrogen 2.923 N/A THR 373.A N THR 369.A O no hydrogen 3.434 N/A THR 373.A OG1 GLU 168.A OE1 no hydrogen 2.752 N/A ALA 377.A N PRO 374.A O no hydrogen 3.122 N/A THR 378.A OG1 PHE 380.A O no hydrogen 3.433 N/A PHE 380.A N THR 378.A OG1 no hydrogen 3.192 N/A ARG 383.A NE PHE 380.A O no hydrogen 3.095 N/A ARG 383.A NH1 GLU 168.A OE2 no hydrogen 2.835 N/A ARG 383.A NH1 ILE 370.A O no hydrogen 3.028 N/A ARG 383.A NH2 GLU 168.A OE2 no hydrogen 3.316 N/A ARG 383.A NH2 THR 378.A OG1 no hydrogen 2.935 N/A VAL 386.A N ARG 383.A O no hydrogen 3.191 N/A LEU 387.A N VAL 336.A O no hydrogen 2.730 N/A PHE 388.A N VAL 336.A O no hydrogen 3.322 N/A ASN 389.A N ASP 364.A O no hydrogen 2.798 N/A ILE 390.A N ASP 334.A O no hydrogen 2.809 N/A GLN 391.A N ILE 362.A O no hydrogen 2.861 N/A TYR 392.A N LYS 332.A O no hydrogen 2.771 N/A TYR 392.A OH ASP 334.A OD2 no hydrogen 2.777 N/A VAL 393.A N ILE 360.A O no hydrogen 2.779 N/A ASN 394.A N GLU 330.A O no hydrogen 2.837 N/A TRP 396.A N PHE 328.A O no hydrogen 2.931 N/A ALA 401.A N ALA 398.A O no hydrogen 3.315 N/A LEU 406.A N ALA 402.A O no hydrogen 3.045 N/A SER 407.A N ALA 403.A O no hydrogen 2.828 N/A SER 407.A OG ASP 411.A OD2 no hydrogen 3.543 N/A TRP 408.A N ALA 404.A O no hydrogen 2.941 N/A TRP 408.A NE1 TRP 352.A O no hydrogen 2.750 N/A SER 409.A N PRO 405.A O no hydrogen 3.084 N/A SER 409.A OG PRO 405.A O no hydrogen 3.346 N/A LYS 410.A N LEU 406.A O no hydrogen 3.128 N/A ASP 411.A N SER 407.A O no hydrogen 2.915 N/A ILE 412.A N TRP 408.A O no hydrogen 2.731 N/A TYR 413.A N SER 409.A O no hydrogen 3.168 N/A TYR 413.A OH SER 333.A O no hydrogen 2.690 N/A ASN 414.A N LYS 410.A O no hydrogen 3.138 N/A TYR 415.A N ASP 411.A O no hydrogen 3.068 N/A MET 416.A N ILE 412.A O no hydrogen 3.005 N/A GLU 417.A N ASN 414.A O no hydrogen 3.299 N/A TYR 419.A N MET 416.A O no hydrogen 2.877 N/A SER 421.A N TYR 335.A O no hydrogen 2.852 N/A LYS 422.A NZ PRO 418.A O no hydrogen 2.750 N/A ARG 425.A NE ASP 334.A OD1 no hydrogen 2.967 N/A ARG 425.A NH1 TYR 413.A O no hydrogen 3.106 N/A ARG 425.A NH2 ASP 334.A OD2 no hydrogen 2.782 N/A ARG 425.A NH2 TYR 413.A O no hydrogen 2.900 N/A GLN 426.A N SER 421.A OG no hydrogen 2.920 N/A GLN 426.A NE2 TYR 337.A OH no hydrogen 3.040 N/A GLN 426.A NE2 HIS 382.A ND1 no hydrogen 2.933 N/A ALA 427.A N LYS 457.A O no hydrogen 2.925 N/A TYR 428.A N SER 333.A OG no hydrogen 3.045 N/A ASN 430.A ND2 HIS 150.A O no hydrogen 2.889 N/A ASN 430.A ND2 TYR 428.A OH no hydrogen 3.017 N/A TYR 431.A N TYR 428.A O no hydrogen 2.777 N/A ARG 432.A NE ASP 79.A OD1 no hydrogen 2.721 N/A ARG 432.A NE ASP 79.A OD2 no hydrogen 3.270 N/A ARG 432.A NH1 GLN 483.A O no hydrogen 3.246 N/A ARG 432.A NH1 GLN 483.A OE1 no hydrogen 3.278 N/A ARG 432.A NH2 ASP 79.A OD1 no hydrogen 3.372 N/A ASP 433.A N TYR 458.A OH no hydrogen 2.875 N/A ILE 434.A N GLU 81.A OE2 no hydrogen 2.631 N/A ASP 435.A N ASP 433.A OD1 no hydrogen 3.033 N/A LEU 436.A N ASP 433.A O no hydrogen 3.055 N/A GLY 437.A N ILE 434.A O no hydrogen 3.054 N/A ASN 439.A N GLU 482.A O no hydrogen 2.809 N/A ASN 439.A ND2 SER 484.A O no hydrogen 2.824 N/A GLU 440.A N SER 450.A OG no hydrogen 2.767 N/A VAL 442.A N VAL 445.A O no hydrogen 2.939 N/A VAL 445.A N VAL 442.A O no hydrogen 3.137 N/A SER 446.A N ASP 477.A OD2 no hydrogen 2.875 N/A SER 446.A OG ASP 477.A OD2 no hydrogen 2.689 N/A THR 447.A N GLU 440.A O no hydrogen 2.979 N/A THR 447.A OG1 SER 450.A OG no hydrogen 2.743 N/A SER 450.A N THR 447.A OG1 no hydrogen 3.172 N/A SER 450.A OG GLU 440.A O no hydrogen 3.483 N/A SER 450.A OG THR 447.A O no hydrogen 3.010 N/A SER 450.A OG THR 447.A OG1 no hydrogen 2.743 N/A GLY 451.A N THR 447.A O no hydrogen 3.042 N/A LYS 452.A N TYR 448.A O no hydrogen 2.998 N/A VAL 453.A N SER 450.A O no hydrogen 3.389 N/A TRP 454.A NE1 ASN 439.A OD1 no hydrogen 3.024 N/A GLY 455.A N GLY 451.A O no hydrogen 2.793 N/A GLN 456.A N LYS 452.A O no hydrogen 3.079 N/A LYS 457.A N TRP 454.A O no hydrogen 2.848 N/A LYS 457.A NZ LEU 436.A O no hydrogen 2.836 N/A TYR 458.A N TRP 454.A O no hydrogen 3.082 N/A TYR 458.A OH GLN 483.A OE1 no hydrogen 2.558 N/A PHE 459.A N GLY 455.A O no hydrogen 2.814 N/A LYS 460.A N GLN 456.A O no hydrogen 2.848 N/A LYS 460.A NZ TYR 337.A OH no hydrogen 3.447 N/A LYS 460.A NZ GLN 426.A OE1 no hydrogen 2.961 N/A ASN 462.A N PHE 459.A O no hydrogen 2.998 N/A ASN 462.A ND2 GLU 375.A O no hydrogen 2.864 N/A ASN 462.A ND2 PRO 379.A O no hydrogen 3.127 N/A PHE 463.A N LYS 460.A O no hydrogen 3.232 N/A ARG 465.A NE ASP 191.A OD1 no hydrogen 3.032 N/A ARG 465.A NH2 ASP 191.A OD1 no hydrogen 2.766 N/A LEU 466.A N ASN 462.A O no hydrogen 3.080 N/A ALA 467.A N PHE 463.A O no hydrogen 2.980 N/A ILE 468.A N GLU 464.A O no hydrogen 2.943 N/A THR 469.A N ARG 465.A O no hydrogen 2.928 N/A THR 469.A OG1 ARG 465.A O no hydrogen 2.717 N/A LYS 470.A N LEU 466.A O no hydrogen 2.886 N/A LYS 470.A NZ SER 203.A O no hydrogen 2.833 N/A LYS 470.A NZ ASP 474.A OD2 no hydrogen 2.755 N/A LYS 470.A NZ PHE 479.A O no hydrogen 2.708 N/A GLY 471.A N ALA 467.A O no hydrogen 2.856 N/A LYS 472.A N ILE 468.A O no hydrogen 3.007 N/A LYS 472.A NZ ASP 191.A OD2 no hydrogen 2.682 N/A VAL 473.A N THR 469.A O no hydrogen 3.055 N/A ASP 474.A N LYS 470.A O no hydrogen 2.711 N/A ASP 477.A N ASP 474.A O no hydrogen 2.924 N/A TYR 478.A N ASP 474.A OD1 no hydrogen 2.939 N/A TYR 478.A OH VAL 69.A O no hydrogen 2.730 N/A PHE 479.A N ASP 474.A OD2 no hydrogen 2.959 N/A ARG 480.A NH1 ASP 444.A O no hydrogen 2.896 N/A ARG 480.A NH1 ASP 477.A OD2 no hydrogen 3.014 N/A ARG 480.A NH2 ASP 444.A OD1 no hydrogen 2.889 N/A ASN 481.A N SER 484.A OG no hydrogen 2.928 N/A GLU 482.A N GLU 482.A OE1 no hydrogen 2.532 N/A GLN 483.A N ASN 481.A OD1 no hydrogen 2.755 N/A GLN 483.A NE2 ASP 433.A O no hydrogen 2.979 N/A GLN 483.A NE2 GLY 437.A O no hydrogen 2.794 N/A SER 484.A OG ASN 481.A O no hydrogen 3.163 N/A ILE 485.A N SER 203.A OG no hydrogen 2.796 N/A LEU 488.A N ALA 467.A O no hydrogen 2.895 N/A