Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3nsm_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ARG 6.A N LEU 17.A O no hydrogen 2.868 N/A TRP 7.A N LEU 28.A O no hydrogen 3.021 N/A TRP 7.A NE1 GLN 565.A O no hydrogen 2.869 N/A SER 8.A N VAL 15.A O no hydrogen 2.974 N/A ASP 10.A N LYS 13.A O no hydrogen 2.881 N/A ASN 11.A ND2 ASP 10.A OD2 no hydrogen 3.260 N/A LYS 13.A N ASP 10.A O no hydrogen 3.095 N/A CYS 14.A N GLU 567.A OE2 no hydrogen 2.927 N/A VAL 15.A N SER 8.A O no hydrogen 2.904 N/A LEU 17.A N ARG 6.A O no hydrogen 2.811 N/A ASN 19.A N VAL 4.A O no hydrogen 3.258 N/A GLU 25.A N SER 23.A OG no hydrogen 3.243 N/A CYS 33.A N SER 29.A O no hydrogen 2.972 N/A LYS 34.A N LEU 30.A O no hydrogen 2.995 N/A LYS 34.A NZ TYR 564.A O no hydrogen 3.083 N/A LYS 34.A NZ GLU 567.A OE1 no hydrogen 2.623 N/A MET 35.A N GLU 31.A O no hydrogen 2.893 N/A PHE 36.A N CYS 33.A O no hydrogen 3.317 N/A CYS 37.A N CYS 33.A O no hydrogen 2.826 N/A ASN 38.A N LYS 34.A O no hydrogen 3.131 N/A TYR 40.A N ASN 38.A OD1 no hydrogen 2.926 N/A GLY 41.A N ASN 38.A O no hydrogen 3.100 N/A LEU 43.A N TYR 40.A O no hydrogen 3.249 N/A TRP 44.A N GLN 162.A OE1 no hydrogen 2.875 N/A TRP 44.A NE1 ALA 520.A O no hydrogen 2.890 N/A ARG 46.A N GLU 524.A OE1 no hydrogen 2.846 N/A ARG 46.A NE PRO 47.A O no hydrogen 3.249 N/A ARG 46.A NH2 PRO 47.A O no hydrogen 2.964 N/A THR 48.A N ASP 183.A OD2 no hydrogen 2.865 N/A THR 48.A OG1 ASP 183.A OD2 no hydrogen 3.010 N/A THR 48.A OG1 LYS 184.A O no hydrogen 2.701 N/A GLU 50.A N SER 182.A OG no hydrogen 2.758 N/A ASP 52.A N ASN 180.A O no hydrogen 3.159 N/A GLY 54.A N ASP 52.A OD1 no hydrogen 3.184 N/A SER 58.A N MET 175.A O no hydrogen 2.763 N/A LYS 59.A NZ THR 103.A OG1 no hydrogen 2.846 N/A ILE 60.A N LEU 173.A O no hydrogen 2.878 N/A ASN 61.A N LYS 105.A O no hydrogen 2.906 N/A SER 64.A N ASN 61.A O no hydrogen 2.917 N/A GLU 66.A N VAL 107.A O no hydrogen 2.817 N/A LYS 68.A N VAL 109.A O no hydrogen 2.663 N/A LEU 70.A N LEU 111.A O no hydrogen 2.979 N/A LYS 71.A NZ GLU 114.A O no hydrogen 3.276 N/A GLY 73.A N ASP 76.A OD2 no hydrogen 2.747 N/A ALA 74.A N ASN 117.A OD1 no hydrogen 3.145 N/A THR 75.A N PRO 116.A O no hydrogen 3.019 N/A THR 75.A OG1 PRO 116.A O no hydrogen 2.817 N/A ASP 76.A N GLY 73.A O no hydrogen 3.373 N/A MET 79.A N THR 75.A O no hydrogen 2.792 N/A GLU 80.A N ASP 76.A O no hydrogen 2.801 N/A ALA 81.A N ASP 77.A O no hydrogen 3.039 N/A ALA 82.A N LEU 78.A O no hydrogen 2.856 N/A ALA 83.A N MET 79.A O no hydrogen 2.850 N/A LYS 84.A N GLU 80.A O no hydrogen 3.027 N/A ARG 85.A N ALA 81.A O no hydrogen 3.089 N/A PHE 86.A N ALA 83.A O no hydrogen 3.127 N/A GLU 88.A N GLU 88.A OE2 no hydrogen 2.790 N/A GLN 89.A N ARG 85.A O no hydrogen 3.266 N/A GLN 89.A NE2 GLU 158.A OE1 no hydrogen 2.812 N/A VAL 90.A N PHE 86.A O no hydrogen 2.990 N/A SER 91.A N LYS 87.A O no hydrogen 2.889 N/A SER 91.A OG LYS 87.A O no hydrogen 2.971 N/A LEU 92.A N GLN 89.A O no hydrogen 3.356 N/A ALA 93.A N VAL 90.A O no hydrogen 2.955 N/A ILE 94.A N SER 91.A O no hydrogen 3.157 N/A ARG 96.A NH2 VAL 549.A O no hydrogen 3.152 N/A SER 98.A N PRO 95.A O no hydrogen 3.093 N/A LYS 101.A N ASP 171.A O no hydrogen 3.017 N/A LYS 101.A NZ ARG 170.A O no hydrogen 2.777 N/A THR 103.A N LYS 101.A O no hydrogen 2.928 N/A LYS 105.A N LYS 59.A O no hydrogen 2.792 N/A ALA 106.A N ASP 139.A O no hydrogen 2.950 N/A VAL 107.A N SER 64.A O no hydrogen 2.706 N/A ASP 108.A N VAL 141.A O no hydrogen 2.951 N/A VAL 109.A N GLU 66.A O no hydrogen 2.804 N/A TYR 110.A N ALA 143.A O no hydrogen 2.597 N/A LEU 111.A N LYS 68.A O no hydrogen 2.816 N/A VAL 112.A N ILE 145.A O no hydrogen 2.833 N/A GLU 114.A N ALA 147.A O no hydrogen 2.859 N/A ASN 115.A N ASN 113.A OD1 no hydrogen 3.368 N/A GLU 118.A N ASN 115.A O no hydrogen 3.179 N/A MET 125.A N SER 122.A O no hydrogen 3.136 N/A SER 128.A N ASP 126.A OD2 no hydrogen 3.094 N/A SER 128.A OG ASP 126.A OD2 no hydrogen 3.107 N/A TYR 129.A N ASP 183.A O no hydrogen 2.920 N/A TYR 129.A OH ASP 183.A OD1 no hydrogen 2.625 N/A GLY 130.A N THR 146.A O no hydrogen 2.791 N/A LEU 131.A N ILE 181.A O no hydrogen 2.564 N/A ARG 132.A N THR 144.A O no hydrogen 3.060 N/A ARG 132.A NE ASN 180.A OD1 no hydrogen 2.821 N/A VAL 133.A N VAL 179.A O no hydrogen 2.842 N/A SER 134.A N ASN 142.A O no hydrogen 3.198 N/A SER 136.A N ARG 140.A O no hydrogen 2.739 N/A ARG 140.A NE ASP 108.A OD2 no hydrogen 2.961 N/A ARG 140.A NH2 ASP 108.A OD1 no hydrogen 2.489 N/A ARG 140.A NH2 ASP 108.A OD2 no hydrogen 3.305 N/A VAL 141.A N ALA 106.A O no hydrogen 2.787 N/A ASN 142.A N SER 134.A O no hydrogen 2.881 N/A ALA 143.A N ASP 108.A O no hydrogen 2.825 N/A THR 144.A N ARG 132.A O no hydrogen 2.862 N/A THR 144.A OG1 ASN 142.A OD1 no hydrogen 2.793 N/A ILE 145.A N TYR 110.A O no hydrogen 2.853 N/A THR 146.A N GLY 130.A O no hydrogen 2.928 N/A ALA 147.A N VAL 112.A O no hydrogen 2.918 N/A SER 149.A OG ASP 126.A O no hydrogen 2.780 N/A PHE 151.A N SER 149.A OG no hydrogen 3.203 N/A GLY 152.A N SER 149.A OG no hydrogen 3.414 N/A MET 153.A N SER 149.A O no hydrogen 3.074 N/A ARG 154.A N PHE 150.A O no hydrogen 2.902 N/A ARG 154.A NE HIS 155.A ND1 no hydrogen 3.520 N/A ARG 154.A NH1 HIS 155.A ND1 no hydrogen 2.950 N/A ARG 154.A NH1 ALA 214.A O no hydrogen 2.872 N/A ARG 154.A NH2 GLU 158.A OE2 no hydrogen 2.767 N/A HIS 155.A N PHE 151.A O no hydrogen 3.209 N/A HIS 155.A NE2 GLU 127.A OE2 no hydrogen 2.942 N/A GLY 156.A N GLY 152.A O no hydrogen 3.058 N/A LEU 157.A N MET 153.A O no hydrogen 3.039 N/A GLU 158.A N ARG 154.A O no hydrogen 3.052 N/A THR 159.A N HIS 155.A O no hydrogen 3.038 N/A THR 159.A OG1 TYR 129.A OH no hydrogen 2.593 N/A THR 159.A OG1 HIS 155.A O no hydrogen 3.383 N/A LEU 160.A N GLY 156.A O no hydrogen 2.893 N/A SER 161.A N LEU 157.A O no hydrogen 3.068 N/A SER 161.A OG LEU 157.A O no hydrogen 3.497 N/A SER 161.A OG GLU 158.A O no hydrogen 2.642 N/A GLN 162.A N GLU 158.A O no hydrogen 3.324 N/A GLN 162.A N THR 159.A O no hydrogen 3.012 N/A GLN 162.A NE2 TRP 44.A O no hydrogen 2.846 N/A LEU 163.A N LEU 160.A O no hydrogen 2.894 N/A VAL 165.A N LEU 174.A O no hydrogen 2.942 N/A ASP 167.A N HIS 172.A O no hydrogen 2.714 N/A ARG 170.A N ASP 167.A OD2 no hydrogen 2.709 N/A ARG 170.A NE ASP 167.A OD1 no hydrogen 3.202 N/A ARG 170.A NH2 ALA 27.A O no hydrogen 2.371 N/A ARG 170.A NH2 ASP 167.A OD1 no hydrogen 3.414 N/A HIS 172.A N ASP 167.A O no hydrogen 3.056 N/A LEU 174.A N VAL 165.A O no hydrogen 2.676 N/A MET 175.A N SER 58.A O no hydrogen 2.955 N/A VAL 176.A N LEU 163.A O no hydrogen 3.022 N/A ARG 177.A N PHE 56.A O no hydrogen 3.103 N/A ARG 177.A NE ASP 178.A OD2 no hydrogen 3.085 N/A ARG 177.A NH2 ASP 178.A OD2 no hydrogen 3.358 N/A VAL 179.A N VAL 133.A O no hydrogen 2.741 N/A ASN 180.A N ASP 52.A O no hydrogen 2.926 N/A ASN 180.A ND2 GLU 50.A OE2 no hydrogen 3.099 N/A ILE 181.A N LEU 131.A O no hydrogen 2.627 N/A SER 182.A N GLU 50.A O no hydrogen 3.167 N/A ASP 183.A N TYR 129.A O no hydrogen 3.038 N/A LYS 184.A N THR 48.A OG1 no hydrogen 3.035 N/A VAL 186.A N TRP 527.A O no hydrogen 2.940 N/A TYR 187.A N LEU 526.A O no hydrogen 3.268 N/A TYR 187.A OH GLU 529.A OE1 no hydrogen 2.677 N/A TYR 189.A N LEU 495.A O no hydrogen 2.888 N/A TYR 189.A OH GLU 498.A OE2 no hydrogen 2.479 N/A ARG 190.A N ASN 219.A OD1 no hydrogen 2.975 N/A ARG 190.A NE LYS 217.A O no hydrogen 3.153 N/A ARG 190.A NH1 GLU 127.A OE1 no hydrogen 3.050 N/A ARG 190.A NH1 GLU 127.A OE2 no hydrogen 2.944 N/A ARG 190.A NH1 LYS 217.A O no hydrogen 2.929 N/A ARG 190.A NH2 GLU 127.A OE1 no hydrogen 2.734 N/A ARG 190.A NH2 TYR 187.A O no hydrogen 2.644 N/A GLY 191.A N GLY 497.A O no hydrogen 3.082 N/A ILE 192.A N THR 220.A O no hydrogen 2.918 N/A LEU 193.A N ALA 499.A O no hydrogen 2.817 N/A LEU 194.A N HIS 222.A O no hydrogen 2.843 N/A ASP 195.A N LEU 501.A O no hydrogen 3.229 N/A THR 196.A N HIS 224.A O no hydrogen 2.926 N/A ALA 197.A N ASP 195.A OD2 no hydrogen 2.986 N/A ARG 198.A N ASP 195.A OD2 no hydrogen 3.046 N/A ARG 198.A NE GLN 229.A OE1 no hydrogen 3.024 N/A ARG 198.A NH1 ASP 195.A OD1 no hydrogen 3.090 N/A ASN 199.A ND2 SER 503.A O no hydrogen 2.825 N/A ASN 199.A ND2 GLU 504.A O no hydrogen 3.530 N/A ASN 199.A ND2 SER 506.A O no hydrogen 3.572 N/A TYR 200.A OH VAL 252.A O no hydrogen 2.821 N/A TYR 201.A N TYR 253.A OH no hydrogen 3.073 N/A TYR 201.A OH SER 503.A OG no hydrogen 2.633 N/A TYR 201.A OH SER 506.A OG no hydrogen 2.574 N/A SER 202.A N THR 508.A OG1 no hydrogen 2.919 N/A SER 202.A OG SER 205.A OG no hydrogen 3.317 N/A SER 205.A N SER 202.A OG no hydrogen 3.203 N/A SER 205.A OG SER 202.A O no hydrogen 2.612 N/A SER 205.A OG SER 202.A OG no hydrogen 3.317 N/A ILE 206.A N SER 202.A O no hydrogen 3.129 N/A LYS 207.A N ILE 203.A O no hydrogen 2.912 N/A LYS 207.A NZ GLU 260.A OE2 no hydrogen 2.563 N/A ARG 208.A N GLU 204.A O no hydrogen 2.978 N/A ARG 208.A NE ASP 512.A OD1 no hydrogen 2.735 N/A ARG 208.A NH2 ASP 512.A OD1 no hydrogen 3.204 N/A THR 209.A N SER 205.A O no hydrogen 3.065 N/A THR 209.A OG1 SER 205.A O no hydrogen 2.722 N/A ILE 210.A N ILE 206.A O no hydrogen 3.097 N/A GLU 211.A N LYS 207.A O no hydrogen 2.963 N/A ALA 212.A N ARG 208.A O no hydrogen 3.109 N/A MET 213.A N THR 209.A O no hydrogen 2.900 N/A ALA 214.A N ILE 210.A O no hydrogen 2.847 N/A ALA 215.A N GLU 211.A O no hydrogen 3.106 N/A VAL 216.A N MET 213.A O no hydrogen 3.086 N/A LYS 217.A N ALA 214.A O no hydrogen 3.225 N/A LYS 217.A NZ THR 159.A OG1 no hydrogen 2.838 N/A LEU 218.A N MET 213.A O no hydrogen 3.019 N/A ASN 219.A N ARG 190.A O no hydrogen 2.907 N/A ASN 219.A ND2 GLU 127.A OE2 no hydrogen 3.225 N/A ASN 219.A ND2 PRO 188.A O no hydrogen 2.698 N/A THR 220.A N ARG 190.A O no hydrogen 3.126 N/A THR 220.A OG1 ASN 219.A OD1 no hydrogen 2.946 N/A PHE 221.A N ARG 271.A O no hydrogen 2.723 N/A HIS 222.A N ILE 192.A O no hydrogen 2.751 N/A TRP 223.A N LEU 273.A O no hydrogen 2.806 N/A TRP 223.A NE1 THR 196.A OG1 no hydrogen 2.902 N/A HIS 224.A N LEU 194.A O no hydrogen 2.928 N/A HIS 224.A ND1 GLU 275.A OE1 no hydrogen 2.736 N/A HIS 224.A NE2 ASP 227.A OD2 no hydrogen 2.631 N/A ASP 227.A N SER 230.A O no hydrogen 3.381 N/A SER 228.A N ASP 227.A OD1 no hydrogen 2.816 N/A SER 228.A OG ASP 227.A OD1 no hydrogen 3.336 N/A GLN 229.A N GLN 229.A OE1 no hydrogen 2.833 N/A GLN 229.A NE2 GLU 306.A OE1 no hydrogen 3.069 N/A SER 230.A OG ALA 197.A O no hydrogen 2.652 N/A PHE 231.A N GLY 245.A O no hydrogen 3.156 N/A VAL 234.A N TYR 253.A O no hydrogen 3.127 N/A THR 235.A OG1 ASP 329.A OD1 no hydrogen 2.525 N/A LYS 237.A N ASP 329.A OD1 no hydrogen 3.052 N/A ARG 238.A N THR 235.A OG1 no hydrogen 3.285 N/A ARG 238.A NE ASP 325.A OD1 no hydrogen 2.587 N/A ARG 238.A NH2 ASP 325.A OD1 no hydrogen 2.754 N/A LEU 241.A N ARG 238.A O no hydrogen 3.060 N/A LYS 243.A N PRO 239.A O no hydrogen 2.959 N/A LYS 243.A NZ TYR 242.A OH no hydrogen 2.971 N/A PHE 244.A N ASN 240.A O no hydrogen 2.817 N/A ALA 246.A N TYR 242.A O no hydrogen 3.021 N/A GLN 250.A N SER 248.A OG no hydrogen 3.244 N/A LYS 251.A N SER 248.A O no hydrogen 3.194 N/A LYS 251.A N SER 248.A OG no hydrogen 3.339 N/A TYR 253.A N PRO 232.A O no hydrogen 2.777 N/A TYR 253.A OH TYR 201.A O no hydrogen 2.588 N/A ALA 257.A N THR 254.A OG1 no hydrogen 3.031 N/A ILE 258.A N THR 254.A O no hydrogen 2.910 N/A ARG 259.A N LYS 255.A O no hydrogen 2.911 N/A ARG 259.A NH2 GLU 332.A OE2 no hydrogen 3.120 N/A GLU 260.A N ALA 256.A O no hydrogen 3.078 N/A VAL 261.A N ALA 257.A O no hydrogen 3.018 N/A VAL 262.A N ILE 258.A O no hydrogen 2.873 N/A ARG 263.A N ARG 259.A O no hydrogen 2.959 N/A ARG 263.A NE GLU 267.A OE2 no hydrogen 2.981 N/A ARG 263.A NH1 ASP 77.A OD1 no hydrogen 3.190 N/A ARG 263.A NH2 ASP 77.A OD1 no hydrogen 3.117 N/A PHE 264.A N GLU 260.A O no hydrogen 2.891 N/A GLY 265.A N VAL 261.A O no hydrogen 2.817 N/A LEU 266.A N VAL 262.A O no hydrogen 2.894 N/A GLU 267.A N ARG 263.A O no hydrogen 2.974 N/A ARG 268.A N GLY 265.A O no hydrogen 2.926 N/A ARG 268.A NH1 PHE 264.A O no hydrogen 3.129 N/A ARG 268.A NH1 GLU 267.A OE1 no hydrogen 2.969 N/A GLY 269.A N LEU 266.A O no hydrogen 3.019 N/A VAL 270.A N GLY 265.A O no hydrogen 2.767 N/A ARG 271.A N ASN 219.A O no hydrogen 2.692 N/A ARG 271.A NE THR 220.A OG1 no hydrogen 3.196 N/A ARG 271.A NH1 ASP 338.A OD1 no hydrogen 2.977 N/A ARG 271.A NH2 THR 220.A OG1 no hydrogen 3.084 N/A LEU 273.A N PHE 221.A O no hydrogen 2.803 N/A GLU 275.A N TRP 223.A O no hydrogen 3.153 N/A PHE 276.A N HIS 341.A O no hydrogen 3.153 N/A GLU 284.A N SER 228.A O no hydrogen 2.959 N/A TRP 286.A N GLY 283.A O no hydrogen 3.175 N/A THR 289.A N TRP 286.A O no hydrogen 3.258 N/A THR 289.A OG1 TRP 286.A O no hydrogen 2.700 N/A LEU 291.A N THR 289.A OG1 no hydrogen 3.129 N/A VAL 293.A N GLN 311.A O no hydrogen 2.726 N/A CYS 294.A SG CYS 351.A O no hydrogen 3.206 N/A LYS 296.A N CYS 309.A O no hydrogen 3.052 N/A ALA 297.A N CYS 294.A O no hydrogen 2.713 N/A TRP 300.A N GLU 298.A OE1 no hydrogen 2.995 N/A SER 302.A N PRO 299.A O no hydrogen 3.064 N/A TYR 303.A N TRP 300.A O no hydrogen 3.088 N/A CYS 304.A N TRP 300.A O no hydrogen 3.041 N/A CYS 304.A SG TRP 300.A O no hydrogen 3.662 N/A CYS 304.A SG GLU 306.A O no hydrogen 3.200 N/A CYS 309.A SG ALA 297.A O no hydrogen 4.045 N/A CYS 309.A SG TRP 300.A O no hydrogen 3.320 N/A GLN 311.A N VAL 293.A O no hydrogen 2.937 N/A LEU 312.A N PRO 279.A O no hydrogen 2.813 N/A ASN 313.A N LEU 291.A O no hydrogen 2.754 N/A ASN 313.A ND2 SER 357.A OG no hydrogen 3.215 N/A THR 315.A N ASN 313.A OD1 no hydrogen 2.934 N/A THR 315.A OG1 ASN 313.A OD1 no hydrogen 2.614 N/A LYS 316.A N ASN 313.A O no hydrogen 3.442 N/A LEU 319.A N LYS 316.A O no hydrogen 3.286 N/A TYR 320.A N ASP 317.A O no hydrogen 3.361 N/A TYR 320.A OH PRO 314.A O no hydrogen 2.593 N/A GLN 321.A N GLU 318.A O no hydrogen 2.872 N/A TYR 322.A N GLU 318.A O no hydrogen 3.115 N/A LEU 323.A N LEU 319.A O no hydrogen 2.922 N/A GLU 324.A N TYR 320.A O no hydrogen 3.056 N/A ASP 325.A N GLN 321.A O no hydrogen 3.186 N/A ILE 326.A N TYR 322.A O no hydrogen 2.819 N/A TYR 327.A N LEU 323.A O no hydrogen 2.788 N/A SER 328.A N GLU 324.A O no hydrogen 2.997 N/A SER 328.A OG GLU 324.A O no hydrogen 2.772 N/A ASP 329.A N ASP 325.A O no hydrogen 2.949 N/A MET 330.A N ILE 326.A O no hydrogen 2.899 N/A ALA 331.A N TYR 327.A O no hydrogen 2.762 N/A GLU 332.A N SER 328.A O no hydrogen 3.049 N/A VAL 333.A N MET 330.A O no hydrogen 3.258 N/A PHE 334.A N MET 330.A O no hydrogen 2.863 N/A THR 337.A OG1 ILE 339.A O no hydrogen 2.619 N/A ASP 338.A N ASP 338.A OD1 no hydrogen 2.558 N/A ILE 339.A N THR 337.A OG1 no hydrogen 3.244 N/A PHE 340.A N PRO 398.A O no hydrogen 3.134 N/A HIS 341.A N PRO 274.A O no hydrogen 3.307 N/A MET 342.A N ILE 400.A O no hydrogen 2.900 N/A GLY 343.A N HIS 341.A ND1 no hydrogen 2.998 N/A GLY 344.A N ALA 278.A O no hydrogen 3.366 N/A SER 348.A OG TYR 303.A O no hydrogen 2.611 N/A SER 348.A OG GLU 349.A OE2 no hydrogen 3.517 N/A ALA 350.A N GLU 349.A OE2 no hydrogen 3.227 N/A CYS 351.A N SER 348.A OG no hydrogen 3.329 N/A CYS 351.A SG VAL 293.A O no hydrogen 3.680 N/A CYS 351.A SG GLN 311.A OE1 no hydrogen 3.658 N/A TRP 352.A NE1 LEU 312.A O no hydrogen 2.922 N/A ASN 353.A N GLU 349.A O no hydrogen 2.916 N/A SER 354.A OG CYS 351.A O no hydrogen 3.100 N/A SER 355.A N TRP 352.A O no hydrogen 3.364 N/A SER 355.A OG SER 357.A OG no hydrogen 3.080 N/A SER 357.A OG SER 355.A OG no hydrogen 3.080 N/A GLN 359.A N SER 355.A O no hydrogen 3.096 N/A GLN 359.A NE2 ASN 353.A OD1 no hydrogen 3.235 N/A ASN 360.A N ASP 356.A O no hydrogen 2.775 N/A PHE 361.A N SER 357.A O no hydrogen 3.067 N/A MET 362.A N ILE 358.A O no hydrogen 3.048 N/A MET 363.A N GLN 359.A O no hydrogen 3.203 N/A GLN 364.A N ASN 360.A O no hydrogen 3.286 N/A ARG 366.A N MET 363.A O no hydrogen 3.277 N/A TRP 367.A N MET 362.A O no hydrogen 2.818 N/A LYS 371.A N SER 373.A OG no hydrogen 2.666 N/A GLU 372.A N ASP 370.A OD1 no hydrogen 2.795 N/A SER 373.A N ASP 370.A OD1 no hydrogen 3.128 N/A SER 373.A OG ASP 370.A OD1 no hydrogen 3.276 N/A LYS 376.A N GLU 372.A O no hydrogen 3.167 N/A LEU 377.A N SER 373.A O no hydrogen 3.038 N/A TRP 378.A N PHE 374.A O no hydrogen 3.122 N/A ASN 379.A N LEU 375.A O no hydrogen 3.035 N/A TYR 380.A N LYS 376.A O no hydrogen 2.852 N/A PHE 381.A N LEU 377.A O no hydrogen 2.824 N/A GLN 382.A N TRP 378.A O no hydrogen 2.895 N/A GLN 382.A NE2 TYR 421.A OH no hydrogen 2.940 N/A GLN 383.A N ASN 379.A O no hydrogen 2.998 N/A LYS 384.A N TYR 380.A O no hydrogen 3.304 N/A LYS 384.A NZ ASP 317.A OD1 no hydrogen 3.111 N/A ALA 385.A N PHE 381.A O no hydrogen 2.776 N/A GLN 386.A N GLN 382.A O no hydrogen 2.736 N/A GLN 386.A NE2 TYR 390.A OH no hydrogen 2.735 N/A ASP 387.A N GLN 383.A O no hydrogen 3.164 N/A LYS 388.A N LYS 384.A O no hydrogen 3.221 N/A LYS 388.A NZ GLU 324.A OE1 no hydrogen 2.827 N/A ALA 389.A N ALA 385.A O no hydrogen 2.918 N/A TYR 390.A N GLN 386.A O no hydrogen 3.082 N/A LYS 391.A N ASP 387.A O no hydrogen 3.165 N/A ALA 392.A N LYS 388.A O no hydrogen 2.833 N/A PHE 393.A N ALA 389.A O no hydrogen 2.988 N/A GLY 394.A N LYS 391.A O no hydrogen 3.127 N/A LYS 395.A N TYR 390.A O no hydrogen 3.208 N/A LYS 396.A NZ ASP 420.A OD1 no hydrogen 3.203 N/A LYS 396.A NZ ASP 420.A OD2 no hydrogen 2.806 N/A LEU 399.A N ASP 420.A O no hydrogen 2.929 N/A ILE 400.A N PHE 340.A O no hydrogen 2.877 N/A LEU 401.A N ILE 422.A O no hydrogen 3.033 N/A TRP 402.A N GLY 343.A O no hydrogen 2.856 N/A THR 403.A N GLN 424.A O no hydrogen 2.897 N/A SER 404.A N THR 407.A OG1 no hydrogen 2.639 N/A SER 404.A OG GLY 344.A O no hydrogen 3.558 N/A SER 404.A OG THR 407.A OG1 no hydrogen 3.386 N/A THR 405.A N GLU 346.A OE1 no hydrogen 2.942 N/A THR 405.A OG1 GLU 346.A OE1 no hydrogen 3.330 N/A THR 405.A OG1 GLU 346.A OE2 no hydrogen 2.696 N/A THR 407.A N SER 404.A O no hydrogen 3.051 N/A THR 407.A OG1 TRP 402.A O no hydrogen 2.972 N/A THR 407.A OG1 SER 404.A O no hydrogen 3.308 N/A THR 407.A OG1 SER 404.A OG no hydrogen 3.386 N/A TYR 409.A N GLN 433.A OE1 no hydrogen 3.073 N/A LYS 410.A N ASN 408.A OD1 no hydrogen 3.063 N/A LYS 410.A NZ TYR 409.A OH no hydrogen 2.937 N/A HIS 411.A N ASN 408.A O no hydrogen 3.039 N/A HIS 411.A NE2 THR 405.A O no hydrogen 2.584 N/A ILE 412.A N ASN 408.A O no hydrogen 2.853 N/A ASP 414.A N HIS 411.A O no hydrogen 2.804 N/A TYR 415.A N ILE 412.A O no hydrogen 3.080 N/A LEU 416.A N ILE 412.A O no hydrogen 2.878 N/A LYS 418.A NZ ASP 419.A OD1 no hydrogen 2.754 N/A ASP 420.A N ASN 417.A O no hydrogen 3.249 N/A TYR 421.A N ASN 417.A O no hydrogen 3.216 N/A ILE 422.A N LEU 399.A O no hydrogen 2.719 N/A ILE 423.A N ARG 443.A O no hydrogen 2.992 N/A GLN 424.A N LEU 401.A O no hydrogen 2.816 N/A VAL 425.A N ILE 445.A O no hydrogen 2.777 N/A TRP 426.A NE1 THR 403.A O no hydrogen 2.979 N/A ASP 431.A N THR 428.A O no hydrogen 3.022 N/A GLN 433.A N ASP 431.A OD2 no hydrogen 2.964 N/A GLN 433.A NE2 ASN 408.A OD1 no hydrogen 2.983 N/A ILE 434.A N ASP 431.A O no hydrogen 3.139 N/A LYS 435.A NZ GLU 439.A OE1 no hydrogen 3.522 N/A GLY 436.A N PRO 432.A O no hydrogen 3.050 N/A LEU 437.A N GLN 433.A O no hydrogen 2.880 N/A LEU 438.A N ILE 434.A O no hydrogen 2.981 N/A GLU 439.A N LYS 435.A O no hydrogen 2.962 N/A LYS 440.A NZ ASP 413.A OD2 no hydrogen 3.541 N/A GLY 441.A N LEU 438.A O no hydrogen 3.129 N/A TYR 442.A N LEU 437.A O no hydrogen 3.303 N/A TYR 442.A OH ASP 413.A OD1 no hydrogen 3.063 N/A ARG 443.A NH1 LYS 418.A O no hydrogen 3.347 N/A ARG 443.A NH1 ASP 419.A O no hydrogen 3.384 N/A LEU 444.A N GLN 493.A O no hydrogen 2.993 N/A ILE 445.A N ILE 423.A O no hydrogen 3.035 N/A MET 446.A N GLY 496.A O no hydrogen 2.982 N/A SER 447.A N VAL 425.A O no hydrogen 2.798 N/A SER 447.A OG GLN 424.A OE1 no hydrogen 3.053 N/A SER 447.A OG GLU 498.A O no hydrogen 2.836 N/A ASN 448.A ND2 THR 427.A O no hydrogen 3.153 N/A TYR 449.A N TRP 426.A O no hydrogen 2.713 N/A ALA 451.A N ASN 448.A O no hydrogen 3.098 N/A LEU 452.A N ASN 448.A O no hydrogen 2.773 N/A PHE 454.A N ALA 500.A O no hydrogen 2.871 N/A CYS 456.A N TYR 453.A O no hydrogen 3.324 N/A CYS 456.A SG TYR 453.A O no hydrogen 3.183 N/A CYS 456.A SG CYS 469.A O no hydrogen 3.423 N/A GLY 457.A N ASN 467.A OD1 no hydrogen 3.057 N/A ALA 460.A N GLY 465.A O no hydrogen 2.911 N/A ASN 466.A ND2 GLY 457.A O no hydrogen 3.443 N/A ASN 466.A ND2 TYR 458.A O no hydrogen 3.268 N/A ASN 467.A N TYR 458.A O no hydrogen 2.766 N/A ASN 467.A ND2 ASP 455.A O no hydrogen 3.045 N/A SER 470.A N ASN 467.A O no hydrogen 3.229 N/A SER 470.A OG ASN 467.A O no hydrogen 2.823 N/A SER 470.A OG ASN 467.A OD1 no hydrogen 3.014 N/A GLN 476.A N GLN 476.A OE1 no hydrogen 2.752 N/A LYS 477.A N GLY 474.A O no hydrogen 3.130 N/A VAL 478.A N GLY 474.A O no hydrogen 3.322 N/A TYR 479.A N TRP 475.A O no hydrogen 2.824 N/A TYR 479.A OH GLU 524.A OE2 no hydrogen 2.495 N/A ASP 480.A N GLN 476.A O no hydrogen 3.157 N/A ASN 481.A ND2 ASN 448.A OD1 no hydrogen 3.000 N/A SER 482.A OG GLU 529.A OE1 no hydrogen 3.064 N/A SER 482.A OG GLU 529.A OE2 no hydrogen 2.713 N/A ALA 484.A N GLU 529.A OE1 no hydrogen 2.937 N/A ILE 486.A N SER 482.A O no hydrogen 3.033 N/A ALA 487.A N PRO 483.A O no hydrogen 2.723 N/A LEU 488.A N ALA 484.A O no hydrogen 2.869 N/A HIS 490.A N ALA 487.A O no hydrogen 3.205 N/A ARG 491.A N LEU 488.A O no hydrogen 3.083 N/A GLN 493.A N HIS 490.A O no hydrogen 2.805 N/A VAL 494.A N ARG 491.A O no hydrogen 3.016 N/A LEU 495.A N LEU 444.A O no hydrogen 2.828 N/A GLY 497.A N TYR 189.A O no hydrogen 3.167 N/A GLU 498.A N MET 446.A O no hydrogen 2.854 N/A ALA 499.A N GLY 191.A O no hydrogen 3.109 N/A ALA 500.A N LEU 452.A O no hydrogen 2.868 N/A LEU 501.A N LEU 193.A O no hydrogen 2.835 N/A SER 503.A N ASP 195.A OD1 no hydrogen 2.907 N/A SER 503.A OG ASP 195.A O no hydrogen 2.601 N/A SER 503.A OG TYR 201.A OH no hydrogen 2.633 N/A SER 503.A OG LEU 501.A O no hydrogen 3.451 N/A GLU 504.A N GLU 504.A OE1 no hydrogen 2.784 N/A SER 506.A N SER 503.A O no hydrogen 3.425 N/A SER 506.A OG TYR 201.A OH no hydrogen 2.574 N/A SER 506.A OG THR 510.A OG1 no hydrogen 2.843 N/A ASP 507.A N THR 510.A OG1 no hydrogen 3.002 N/A THR 508.A OG1 TYR 200.A O no hydrogen 3.379 N/A SER 509.A N ASP 507.A OD1 no hydrogen 2.921 N/A THR 510.A N ASP 507.A O no hydrogen 3.028 N/A THR 510.A OG1 SER 506.A OG no hydrogen 2.843 N/A THR 510.A OG1 ASP 507.A O no hydrogen 3.226 N/A ARG 514.A N THR 510.A O no hydrogen 3.023 N/A LEU 515.A N LEU 511.A O no hydrogen 3.193 N/A TRP 516.A N ASP 512.A O no hydrogen 2.961 N/A ARG 518.A NH1 ILE 473.A O no hydrogen 2.952 N/A ARG 518.A NH2 PHE 454.A O no hydrogen 2.846 N/A ARG 518.A NH2 ARG 514.A O no hydrogen 2.790 N/A ALA 519.A N LEU 515.A O no hydrogen 2.778 N/A ALA 520.A N PRO 517.A O no hydrogen 2.879 N/A ALA 521.A N ARG 518.A O no hydrogen 2.984 N/A ALA 523.A N ALA 519.A O no hydrogen 2.919 N/A GLU 524.A N ALA 520.A O no hydrogen 3.004 N/A ARG 525.A N ALA 521.A O no hydrogen 3.048 N/A ARG 525.A NE TYR 479.A O no hydrogen 2.716 N/A ARG 525.A NH1 GLU 529.A OE2 no hydrogen 2.891 N/A ARG 525.A NH1 PRO 530.A O no hydrogen 2.810 N/A ARG 525.A NH2 TYR 479.A O no hydrogen 2.984 N/A LEU 526.A N LEU 522.A O no hydrogen 2.904 N/A TRP 527.A N ALA 523.A O no hydrogen 2.943 N/A TRP 527.A NE1 ASP 183.A OD2 no hydrogen 2.702 N/A ALA 528.A N GLU 524.A O no hydrogen 2.772 N/A GLU 529.A N ARG 525.A O no hydrogen 2.788 N/A ASP 536.A N SER 533.A O no hydrogen 3.280 N/A ALA 537.A N TRP 534.A O no hydrogen 2.800 N/A ARG 540.A NH1 LEU 43.A O no hydrogen 2.864 N/A ARG 540.A NH1 GLU 524.A OE1 no hydrogen 2.899 N/A ARG 540.A NH1 GLU 524.A OE2 no hydrogen 3.554 N/A ARG 540.A NH2 GLU 524.A OE2 no hydrogen 2.757 N/A MET 541.A N ALA 537.A O no hydrogen 2.807 N/A LEU 542.A N GLU 538.A O no hydrogen 2.935 N/A HIS 543.A N TYR 539.A O no hydrogen 3.186 N/A ILE 544.A N ARG 540.A O no hydrogen 2.902 N/A ARG 545.A N MET 541.A O no hydrogen 3.104 N/A ARG 545.A NE GLU 556.A O no hydrogen 2.687 N/A ARG 545.A NH1 GLU 546.A OE2 no hydrogen 3.232 N/A ARG 545.A NH2 ALA 555.A O no hydrogen 2.893 N/A GLU 546.A N LEU 542.A O no hydrogen 3.440 N/A ARG 547.A N HIS 543.A O no hydrogen 2.967 N/A ARG 547.A NH2 GLN 89.A O no hydrogen 3.150 N/A LEU 548.A N ILE 544.A O no hydrogen 2.930 N/A VAL 549.A N ARG 545.A O no hydrogen 3.096 N/A ARG 550.A N GLU 546.A O no hydrogen 2.989 N/A ARG 550.A NE ILE 94.A O no hydrogen 2.660 N/A ARG 550.A NH1 ARG 550.A O no hydrogen 2.920 N/A ARG 550.A NH2 SER 91.A O no hydrogen 2.877 N/A MET 551.A N ARG 547.A O no hydrogen 3.078 N/A GLY 552.A N VAL 549.A O no hydrogen 2.896 N/A ILE 553.A N LEU 548.A O no hydrogen 3.024 N/A GLN 554.A N ASP 512.A OD2 no hydrogen 2.960 N/A GLU 556.A N TRP 516.A O no hydrogen 2.842 N/A SER 557.A N GLU 556.A OE2 no hydrogen 3.336 N/A CYS 563.A N PRO 560.A O no hydrogen 2.872 N/A GLN 565.A N GLU 561.A O no hydrogen 3.014 N/A ASN 566.A N CYS 563.A O no hydrogen 3.283 N/A TYR 569.A N ASN 566.A O no hydrogen 3.271 N/A