Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1sh3_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): TYR 3.A N ALA 6.A O no hydrogen 2.745 N/A CYS 4.A SG ARG 59.A O no hydrogen 4.037 N/A GLY 5.A N THR 2.A OG1 no hydrogen 3.002 N/A ALA 6.A N TYR 3.A O no hydrogen 2.932 N/A ILE 8.A N GLY 1.A O no hydrogen 3.291 N/A LEU 9.A N THR 286.A O no hydrogen 2.756 N/A SER 13.A N ASP 281.A OD1 no hydrogen 3.177 N/A SER 13.A N ASP 281.A OD2 no hydrogen 2.684 N/A ALA 14.A N ASP 281.A OD1 no hydrogen 3.112 N/A SER 18.A OG LYS 20.A O no hydrogen 3.368 N/A THR 19.A OG1 GLU 419.A OE2 no hydrogen 2.961 N/A LYS 20.A N SER 18.A OG no hydrogen 3.068 N/A THR 21.A N HIS 418.A O no hydrogen 3.017 N/A THR 21.A OG1 ASP 162.A OD1 no hydrogen 2.669 N/A THR 21.A OG1 ASP 162.A OD2 no hydrogen 3.127 N/A LYS 22.A N ASP 162.A OD2 no hydrogen 2.757 N/A PHE 23.A N THR 21.A OG1 no hydrogen 3.257 N/A TRP 24.A N THR 413.A O no hydrogen 2.846 N/A TRP 24.A NE1 PRO 416.A O no hydrogen 2.695 N/A ARG 25.A N GLU 423.A O no hydrogen 3.362 N/A ARG 25.A NE TYR 411.A O no hydrogen 2.971 N/A ARG 25.A NH1 ALA 29.A O no hydrogen 2.902 N/A ARG 25.A NH2 ALA 29.A O no hydrogen 2.870 N/A SER 26.A N TYR 411.A O no hydrogen 2.684 N/A SER 26.A OG MET 410.A O no hydrogen 2.552 N/A SER 26.A OG GLU 460.A OE1 no hydrogen 3.233 N/A THR 28.A N GLU 463.A OE2 no hydrogen 3.166 N/A THR 28.A OG1 GLU 463.A OE1 no hydrogen 2.432 N/A ALA 29.A N SER 27.A OG no hydrogen 2.987 N/A THR 35.A N PRO 32.A O no hydrogen 3.024 N/A THR 35.A OG1 PRO 32.A O no hydrogen 2.874 N/A GLU 37.A N VAL 165.A O no hydrogen 3.065 N/A ALA 39.A N GLU 163.A O no hydrogen 2.821 N/A TYR 40.A OH PRO 52.A O no hydrogen 2.271 N/A LEU 41.A N ASP 45.A OD2 no hydrogen 2.956 N/A ASP 45.A N GLY 42.A O no hydrogen 3.000 N/A ARG 47.A N ASP 45.A OD1 no hydrogen 2.769 N/A ARG 47.A NE ASP 45.A OD1 no hydrogen 3.160 N/A ARG 47.A NH1 GLU 37.A OE1 no hydrogen 3.155 N/A ARG 47.A NH1 PRO 38.A O no hydrogen 2.809 N/A ARG 47.A NH2 PRO 38.A O no hydrogen 2.592 N/A ARG 47.A NH2 ALA 39.A O no hydrogen 3.181 N/A ARG 47.A NH2 ASP 45.A OD2 no hydrogen 3.306 N/A VAL 48.A N ASP 45.A O no hydrogen 3.208 N/A GLN 56.A N SER 53.A OG no hydrogen 3.009 N/A VAL 57.A N SER 53.A O no hydrogen 2.957 N/A MET 58.A N LEU 54.A O no hydrogen 2.807 N/A ARG 59.A N GLN 55.A O no hydrogen 2.976 N/A ARG 59.A NE TYR 3.A OH no hydrogen 3.067 N/A ASP 60.A N GLN 56.A O no hydrogen 3.305 N/A GLN 61.A N MET 58.A O no hydrogen 3.012 N/A LEU 62.A N ARG 59.A O no hydrogen 2.833 N/A PHE 65.A N LEU 62.A O no hydrogen 2.969 N/A THR 66.A N LYS 63.A O no hydrogen 3.146 N/A THR 66.A OG1 CYS 4.A O no hydrogen 2.904 N/A THR 66.A OG1 LYS 63.A O no hydrogen 3.361 N/A ARG 69.A NE GLU 67.A O no hydrogen 3.363 N/A ARG 69.A NH1 SER 243.A O no hydrogen 2.646 N/A ARG 69.A NH1 GLN 245.A O no hydrogen 2.774 N/A ARG 69.A NH2 PRO 64.A O no hydrogen 3.146 N/A ARG 69.A NH2 GLU 67.A O no hydrogen 3.031 N/A ARG 69.A NH2 SER 243.A O no hydrogen 3.199 N/A LYS 74.A N GLU 318.A OE2 no hydrogen 3.457 N/A VAL 77.A N LYS 74.A O no hydrogen 2.730 N/A LEU 78.A N LYS 74.A O no hydrogen 2.960 N/A GLU 79.A N PRO 75.A O no hydrogen 3.257 N/A ALA 80.A N SER 76.A O no hydrogen 3.112 N/A ALA 81.A N VAL 77.A O no hydrogen 2.787 N/A LYS 82.A N LEU 78.A O no hydrogen 2.972 N/A LYS 82.A NZ GLU 79.A OE2 no hydrogen 3.454 N/A LYS 83.A N GLU 79.A O no hydrogen 3.057 N/A THR 84.A N ALA 80.A O no hydrogen 3.070 N/A THR 84.A OG1 ALA 80.A O no hydrogen 3.424 N/A THR 84.A OG1 ASP 325.A OD1 no hydrogen 2.592 N/A ILE 85.A N ALA 81.A O no hydrogen 3.013 N/A ILE 86.A N LYS 82.A O no hydrogen 2.926 N/A ASN 87.A N LYS 83.A O no hydrogen 2.911 N/A VAL 88.A N THR 84.A O no hydrogen 2.953 N/A LEU 89.A N ILE 85.A O no hydrogen 2.813 N/A GLU 90.A N ILE 86.A O no hydrogen 2.626 N/A GLN 91.A N ASN 87.A O no hydrogen 2.941 N/A GLN 91.A N VAL 88.A O no hydrogen 2.934 N/A THR 92.A N LEU 89.A O no hydrogen 2.943 N/A THR 92.A OG1 VAL 88.A O no hydrogen 2.853 N/A ILE 93.A N LEU 89.A O no hydrogen 3.008 N/A ASP 94.A N GLU 200.A OE2 no hydrogen 2.627 N/A SER 100.A OG GLN 103.A OE1 no hydrogen 3.152 N/A GLN 103.A N SER 100.A OG no hydrogen 3.135 N/A ALA 104.A N SER 100.A O no hydrogen 2.599 N/A CYS 105.A N PHE 101.A O no hydrogen 2.825 N/A CYS 105.A SG PHE 101.A O no hydrogen 3.419 N/A ALA 106.A N ALA 102.A O no hydrogen 3.078 N/A SER 107.A N ALA 104.A O no hydrogen 3.350 N/A LEU 108.A N CYS 105.A O no hydrogen 3.286 N/A LYS 110.A NZ CYS 105.A O no hydrogen 3.123 N/A LYS 110.A NZ LEU 108.A O no hydrogen 2.727 N/A THR 111.A N ASP 109.A OD1 no hydrogen 2.818 N/A THR 111.A OG1 ASP 109.A OD1 no hydrogen 2.647 N/A THR 111.A OG1 ASP 109.A OD2 no hydrogen 3.035 N/A THR 112.A OG1 ASP 109.A O no hydrogen 3.280 N/A SER 114.A N MET 120.A O no hydrogen 2.717 N/A SER 114.A OG GLY 115.A O no hydrogen 3.297 N/A SER 114.A OG MET 120.A O no hydrogen 3.403 N/A GLY 115.A N SER 113.A OG no hydrogen 3.190 N/A HIS 119.A N GLY 115.A O no hydrogen 2.932 N/A MET 120.A N SER 114.A OG no hydrogen 3.141 N/A LYS 122.A N THR 112.A O no hydrogen 3.094 N/A LYS 122.A NZ ASP 109.A O no hydrogen 2.963 N/A LYS 122.A NZ THR 112.A OG1 no hydrogen 2.776 N/A LYS 122.A NZ SER 113.A O no hydrogen 3.148 N/A ASN 123.A N LYS 110.A O no hydrogen 2.901 N/A CYS 125.A N LYS 122.A O no hydrogen 3.196 N/A ASN 127.A N SER 130.A O no hydrogen 3.068 N/A GLU 129.A N ASN 127.A OD1 no hydrogen 2.894 N/A SER 130.A N ASN 127.A OD1 no hydrogen 2.935 N/A ASP 137.A N GLY 133.A O no hydrogen 3.287 N/A GLN 138.A N LYS 134.A O no hydrogen 3.096 N/A GLN 138.A NE2 HIS 116.A O no hydrogen 2.990 N/A ALA 139.A N LEU 135.A O no hydrogen 2.930 N/A SER 140.A N ALA 136.A O no hydrogen 3.061 N/A SER 140.A OG ASP 137.A O no hydrogen 3.523 N/A LYS 141.A N ASP 137.A O no hydrogen 3.016 N/A ALA 142.A N GLN 138.A O no hydrogen 3.184 N/A ASN 143.A N ALA 139.A O no hydrogen 2.994 N/A LEU 144.A N SER 140.A O no hydrogen 2.880 N/A MET 145.A N LYS 141.A O no hydrogen 2.712 N/A PHE 146.A N ALA 142.A O no hydrogen 2.818 N/A GLU 147.A N ASN 143.A O no hydrogen 3.048 N/A GLU 147.A N LEU 144.A O no hydrogen 2.945 N/A GLU 148.A N LEU 144.A O no hydrogen 3.201 N/A LYS 150.A N MET 145.A O no hydrogen 3.063 N/A LYS 150.A NZ GLU 148.A OE2 no hydrogen 3.389 N/A ASN 151.A ND2 ASP 273.A OD1 no hydrogen 2.431 N/A ASN 151.A ND2 ASP 273.A OD2 no hydrogen 3.219 N/A MET 152.A N ASP 273.A OD2 no hydrogen 2.860 N/A VAL 155.A N ASP 183.A OD1 no hydrogen 3.015 N/A TYR 156.A N VAL 279.A O no hydrogen 2.685 N/A THR 157.A N GLY 181.A O no hydrogen 2.591 N/A THR 157.A OG1 HIS 119.A NE2 no hydrogen 3.324 N/A GLY 158.A N ASP 281.A O no hydrogen 2.952 N/A ALA 159.A N LEU 179.A O no hydrogen 2.767 N/A LYS 161.A N ARG 177.A O no hydrogen 2.700 N/A LYS 161.A NZ GLU 163.A OE1 no hydrogen 3.372 N/A VAL 165.A N GLU 37.A O no hydrogen 2.733 N/A LYS 169.A N LYS 166.A O no hydrogen 3.184 N/A ILE 170.A N THR 167.A O no hydrogen 2.727 N/A TYR 171.A N THR 167.A O no hydrogen 3.261 N/A TYR 171.A OH GLU 37.A OE1 no hydrogen 2.618 N/A TYR 171.A OH GLU 37.A OE2 no hydrogen 3.313 N/A GLY 172.A N ASP 168.A O no hydrogen 2.814 N/A LYS 175.A N LYS 169.A O no hydrogen 3.420 N/A LYS 176.A NZ TYR 40.A O no hydrogen 3.124 N/A LEU 178.A N GLN 61.A OE1 no hydrogen 3.244 N/A LEU 179.A N ALA 159.A O no hydrogen 2.669 N/A TRP 180.A N SER 295.A O no hydrogen 3.039 N/A GLY 181.A N THR 157.A O no hydrogen 2.734 N/A LEU 184.A N SER 114.A O no hydrogen 2.848 N/A THR 186.A N ASP 183.A OD2 no hydrogen 2.996 N/A THR 186.A OG1 ASP 183.A OD1 no hydrogen 2.717 N/A THR 186.A OG1 ASP 183.A OD2 no hydrogen 2.925 N/A MET 187.A N ASP 183.A O no hydrogen 2.935 N/A ILE 188.A N LEU 184.A O no hydrogen 2.987 N/A ARG 189.A N ALA 185.A O no hydrogen 2.977 N/A ARG 189.A NH1 ASP 273.A OD2 no hydrogen 2.948 N/A ARG 189.A NH2 ASP 273.A OD2 no hydrogen 3.272 N/A CYS 190.A N THR 186.A O no hydrogen 2.807 N/A ALA 191.A N MET 187.A O no hydrogen 3.266 N/A ARG 192.A N ILE 188.A O no hydrogen 3.032 N/A ARG 192.A NE TRP 99.A O no hydrogen 3.095 N/A ARG 192.A NH1 ASN 143.A OD1 no hydrogen 2.841 N/A ARG 192.A NH1 GLU 147.A OE2 no hydrogen 2.864 N/A ALA 193.A N ARG 189.A O no hydrogen 3.094 N/A PHE 194.A N CYS 190.A O no hydrogen 3.053 N/A GLY 195.A N ALA 191.A O no hydrogen 2.939 N/A MET 198.A N PHE 194.A O no hydrogen 2.561 N/A ASP 199.A N GLY 195.A O no hydrogen 2.859 N/A GLU 200.A N GLY 196.A O no hydrogen 3.095 N/A LEU 201.A N LEU 197.A O no hydrogen 2.914 N/A LYS 202.A N ASP 199.A O no hydrogen 3.099 N/A LYS 202.A NZ GLU 501.A OE2 no hydrogen 3.137 N/A THR 203.A N ASP 199.A O no hydrogen 3.369 N/A HIS 204.A N LEU 201.A O no hydrogen 3.050 N/A CYS 205.A N LYS 202.A O no hydrogen 3.409 N/A CYS 205.A SG LYS 202.A O no hydrogen 3.640 N/A LEU 208.A N HIS 204.A O no hydrogen 2.928 N/A ARG 211.A N PHE 335.A O no hydrogen 2.903 N/A ARG 211.A NE SER 334.A OG no hydrogen 2.641 N/A ARG 211.A NH1 CYS 205.A O no hydrogen 3.199 N/A ARG 211.A NH1 VAL 206.A O no hydrogen 2.839 N/A ARG 211.A NH2 PHE 333.A O no hydrogen 2.924 N/A MET 214.A N ARG 211.A O no hydrogen 3.006 N/A ASN 215.A N ASP 219.A OD2 no hydrogen 2.951 N/A ASN 215.A ND2 PHE 498.A O no hydrogen 3.240 N/A GLU 218.A N ASN 215.A O no hydrogen 3.071 N/A GLU 218.A N ASN 215.A OD1 no hydrogen 2.670 N/A ASP 219.A N ASN 215.A O no hydrogen 2.739 N/A GLY 220.A N ASN 215.A O no hydrogen 3.428 N/A ILE 223.A N ASP 219.A O no hydrogen 2.887 N/A PHE 224.A N GLY 220.A O no hydrogen 2.797 N/A GLU 225.A N PRO 221.A O no hydrogen 3.100 N/A ARG 226.A N ILE 222.A O no hydrogen 3.081 N/A HIS 227.A N ILE 223.A O no hydrogen 2.992 N/A HIS 227.A ND1 SER 343.A OG no hydrogen 2.768 N/A HIS 227.A NE2 SER 334.A OG no hydrogen 2.899 N/A SER 228.A N PHE 224.A O no hydrogen 2.937 N/A SER 228.A OG GLU 225.A O no hydrogen 2.498 N/A ARG 229.A N ARG 226.A O no hydrogen 3.378 N/A TYR 230.A N HIS 227.A O no hydrogen 3.307 N/A ARG 231.A N ASP 345.A OD1 no hydrogen 3.250 N/A TYR 232.A N THR 344.A O no hydrogen 2.947 N/A HIS 233.A N SER 377.A O no hydrogen 2.898 N/A HIS 233.A ND1 SER 343.A OG no hydrogen 2.670 N/A TYR 234.A N VAL 342.A O no hydrogen 3.110 N/A ALA 236.A N GLU 340.A OE2 no hydrogen 2.669 N/A ASP 237.A N ASP 235.A OD1 no hydrogen 2.852 N/A SER 239.A N LYS 363.A O no hydrogen 2.755 N/A SER 239.A OG THR 365.A OG1 no hydrogen 3.025 N/A TRP 241.A NE1 ASN 304.A OD1 no hydrogen 2.783 N/A SER 243.A OG ARG 240.A O no hydrogen 2.595 N/A THR 244.A N TRP 241.A O no hydrogen 2.718 N/A THR 244.A OG1 ARG 240.A O no hydrogen 3.470 N/A THR 244.A OG1 TRP 241.A O no hydrogen 2.501 N/A GLN 245.A N ASP 242.A O no hydrogen 3.334 N/A GLN 245.A NE2 TRP 241.A O no hydrogen 3.402 N/A GLN 246.A NE2 LYS 71.A O no hydrogen 3.299 N/A GLN 246.A NE2 TYR 360.A O no hydrogen 3.085 N/A ARG 247.A N GLU 291.A OE1 no hydrogen 2.925 N/A ARG 247.A NE GLY 292.A O no hydrogen 2.862 N/A ARG 247.A NH1 LEU 275.A O no hydrogen 3.144 N/A ARG 247.A NH1 SER 278.A OG no hydrogen 2.995 N/A ARG 247.A NH2 SER 278.A OG no hydrogen 3.178 N/A ARG 247.A NH2 GLU 291.A O no hydrogen 3.421 N/A ARG 247.A NH2 GLY 292.A O no hydrogen 2.866 N/A LEU 250.A N GLN 246.A O no hydrogen 2.975 N/A ALA 251.A N ARG 247.A O no hydrogen 2.578 N/A ALA 252.A N ALA 248.A O no hydrogen 3.332 N/A ALA 253.A N VAL 249.A O no hydrogen 3.071 N/A LEU 254.A N LEU 250.A O no hydrogen 3.034 N/A GLU 255.A N ALA 251.A O no hydrogen 2.851 N/A ILE 256.A N ALA 252.A O no hydrogen 3.288 N/A MET 257.A N ALA 253.A O no hydrogen 3.283 N/A VAL 258.A N LEU 254.A O no hydrogen 2.667 N/A LYS 259.A N GLU 255.A O no hydrogen 2.952 N/A PHE 260.A N ILE 256.A O no hydrogen 3.277 N/A SER 261.A N MET 257.A O no hydrogen 2.850 N/A SER 261.A N VAL 258.A O no hydrogen 3.150 N/A SER 261.A OG VAL 258.A O no hydrogen 2.330 N/A SER 262.A OG GLU 263.A OE1 no hydrogen 2.703 N/A LEU 266.A N GLU 263.A O no hydrogen 3.028 N/A ALA 267.A N GLU 263.A O no hydrogen 2.863 N/A GLN 268.A N PRO 264.A O no hydrogen 2.785 N/A VAL 269.A N LEU 266.A O no hydrogen 3.276 N/A ALA 271.A N ALA 267.A O no hydrogen 2.980 N/A GLU 272.A N GLN 268.A O no hydrogen 3.077 N/A ASP 273.A N VAL 269.A O no hydrogen 3.030 N/A LEU 274.A N VAL 270.A O no hydrogen 2.781 N/A LEU 275.A N ALA 271.A O no hydrogen 3.184 N/A SER 276.A N GLU 272.A O no hydrogen 3.098 N/A SER 276.A OG ASP 273.A O no hydrogen 2.607 N/A SER 278.A N ILE 289.A O no hydrogen 2.864 N/A VAL 280.A N ILE 287.A O no hydrogen 2.977 N/A ASP 281.A N TYR 156.A O no hydrogen 2.667 N/A VAL 282.A N PHE 285.A O no hydrogen 3.044 N/A GLY 283.A N ASP 281.A OD1 no hydrogen 2.866 N/A ASP 284.A N ASP 284.A OD1 no hydrogen 2.200 N/A THR 286.A N GLY 10.A O no hydrogen 2.589 N/A THR 286.A OG1 GLY 10.A O no hydrogen 3.529 N/A THR 286.A OG1 PRO 11.A O no hydrogen 2.664 N/A ILE 287.A N VAL 280.A O no hydrogen 2.920 N/A SER 288.A N PRO 7.A O no hydrogen 3.168 N/A ILE 289.A N SER 278.A O no hydrogen 2.840 N/A GLY 292.A N GLU 291.A OE1 no hydrogen 3.274 N/A LEU 293.A N ASP 242.A O no hydrogen 2.898 N/A SER 295.A OG LEU 178.A O no hydrogen 3.259 N/A THR 300.A N VAL 297.A O no hydrogen 2.849 N/A THR 300.A OG1 VAL 297.A O no hydrogen 2.442 N/A GLN 302.A NE2 MET 198.A O no hydrogen 3.065 N/A TRP 303.A NE1 LEU 250.A O no hydrogen 3.090 N/A ASN 304.A N THR 300.A O no hydrogen 2.960 N/A ASN 304.A ND2 ASP 242.A OD1 no hydrogen 3.497 N/A SER 305.A N SER 301.A O no hydrogen 3.048 N/A SER 305.A OG SER 301.A O no hydrogen 2.660 N/A ILE 306.A N GLN 302.A O no hydrogen 2.901 N/A ALA 307.A N TRP 303.A O no hydrogen 3.188 N/A HIS 308.A N ASN 304.A O no hydrogen 2.771 N/A HIS 308.A ND1 GLY 337.A O no hydrogen 2.660 N/A HIS 308.A NE2 GLU 340.A OE1 no hydrogen 2.570 N/A TRP 309.A N SER 305.A O no hydrogen 2.662 N/A TRP 309.A NE1 GLN 328.A OE1 no hydrogen 2.820 N/A LEU 310.A N ILE 306.A O no hydrogen 2.792 N/A LEU 311.A N ALA 307.A O no hydrogen 2.857 N/A THR 312.A N HIS 308.A O no hydrogen 3.019 N/A THR 312.A OG1 HIS 308.A O no hydrogen 3.072 N/A LEU 313.A N TRP 309.A O no hydrogen 3.072 N/A CYS 314.A N LEU 310.A O no hydrogen 3.045 N/A CYS 314.A SG LEU 310.A O no hydrogen 3.346 N/A ALA 315.A N LEU 311.A O no hydrogen 2.684 N/A LEU 316.A N THR 312.A O no hydrogen 2.709 N/A SER 317.A N LEU 313.A O no hydrogen 2.847 N/A SER 317.A OG LEU 322.A O no hydrogen 2.635 N/A GLU 318.A N CYS 314.A O no hydrogen 2.686 N/A VAL 319.A N ALA 315.A O no hydrogen 3.074 N/A THR 320.A N SER 317.A O no hydrogen 3.235 N/A ASN 321.A N SER 317.A O no hydrogen 2.733 N/A LEU 322.A N SER 317.A O no hydrogen 3.384 N/A ILE 327.A N SER 323.A O no hydrogen 3.136 N/A GLN 328.A N PRO 324.A O no hydrogen 2.695 N/A GLN 328.A NE2 GLN 328.A O no hydrogen 3.399 N/A ALA 329.A N ASP 325.A O no hydrogen 2.740 N/A ASN 330.A N ILE 327.A O no hydrogen 3.028 N/A ASN 330.A ND2 ILE 326.A O no hydrogen 2.880 N/A SER 331.A N GLN 328.A O no hydrogen 3.371 N/A SER 331.A OG ILE 327.A O no hydrogen 2.916 N/A SER 331.A OG THR 344.A OG1 no hydrogen 2.802 N/A LEU 332.A N SER 343.A O no hydrogen 2.866 N/A SER 334.A N ILE 341.A O no hydrogen 2.923 N/A SER 334.A OG HIS 227.A NE2 no hydrogen 2.899 N/A PHE 335.A N PRO 209.A O no hydrogen 2.752 N/A TYR 336.A N ASP 339.A O no hydrogen 2.933 N/A GLY 337.A N SER 305.A OG no hydrogen 2.923 N/A ASP 339.A N TYR 336.A O no hydrogen 3.140 N/A ILE 341.A N SER 334.A O no hydrogen 2.962 N/A VAL 342.A N TYR 234.A O no hydrogen 3.192 N/A SER 343.A N LEU 332.A O no hydrogen 3.095 N/A SER 343.A OG HIS 227.A ND1 no hydrogen 2.768 N/A SER 343.A OG HIS 233.A ND1 no hydrogen 2.670 N/A THR 344.A N TYR 232.A O no hydrogen 2.936 N/A THR 344.A OG1 ASN 330.A O no hydrogen 3.318 N/A THR 344.A OG1 SER 331.A OG no hydrogen 2.802 N/A ASP 345.A N ASN 330.A O no hydrogen 2.923 N/A ILE 346.A N THR 344.A OG1 no hydrogen 3.099 N/A GLU 351.A N ASP 349.A OD1 no hydrogen 3.051 N/A LYS 352.A N ASP 349.A OD1 no hydrogen 3.503 N/A LEU 353.A N ASP 349.A O no hydrogen 2.962 N/A THR 354.A N PRO 350.A O no hydrogen 2.934 N/A THR 354.A OG1 PRO 350.A O no hydrogen 3.041 N/A ALA 355.A N GLU 351.A O no hydrogen 2.777 N/A LYS 356.A N LYS 352.A O no hydrogen 2.951 N/A LYS 356.A NZ GLU 318.A OE1 no hydrogen 2.697 N/A LYS 356.A NZ GLU 359.A OE1 no hydrogen 2.664 N/A LEU 357.A N LEU 353.A O no hydrogen 2.944 N/A LYS 358.A N THR 354.A O no hydrogen 3.181 N/A GLU 359.A N ALA 355.A O no hydrogen 3.079 N/A GLU 359.A N LYS 356.A O no hydrogen 3.000 N/A TYR 360.A N LYS 356.A O no hydrogen 3.185 N/A TYR 360.A OH GLU 318.A OE2 no hydrogen 2.712 N/A GLY 361.A N LYS 358.A O no hydrogen 3.108 N/A LEU 362.A N LEU 357.A O no hydrogen 3.218 N/A THR 365.A N ALA 236.A O no hydrogen 2.676 N/A THR 365.A N ASP 237.A O no hydrogen 3.074 N/A LYS 369.A N ARG 366.A O no hydrogen 2.878 N/A THR 370.A OG1 ASP 368.A OD1 no hydrogen 2.875 N/A LEU 374.A N THR 354.A OG1 no hydrogen 2.855 N/A SER 377.A N HIS 233.A O no hydrogen 2.794 N/A SER 377.A OG ASP 379.A O no hydrogen 3.226 N/A ASP 379.A N SER 377.A OG no hydrogen 3.113 N/A GLY 382.A N VAL 390.A O no hydrogen 2.967 N/A LEU 383.A N LEU 380.A O no hydrogen 2.990 N/A THR 384.A OG1 ARG 388.A O no hydrogen 3.475 N/A PHE 385.A N ARG 388.A O no hydrogen 2.924 N/A LEU 386.A N ASP 339.A OD2 no hydrogen 2.845 N/A ARG 388.A N PHE 385.A O no hydrogen 2.689 N/A ARG 388.A NH2 ASP 502.A OD1 no hydrogen 3.333 N/A ARG 388.A NH2 ASP 502.A OD2 no hydrogen 3.219 N/A THR 389.A N LYS 400.A O no hydrogen 2.686 N/A VAL 390.A N LEU 383.A O no hydrogen 2.887 N/A THR 391.A N PHE 398.A O no hydrogen 2.898 N/A THR 391.A OG1 THR 389.A O no hydrogen 3.057 N/A ARG 392.A N ASN 381.A OD1 no hydrogen 3.150 N/A ASP 393.A N GLY 396.A O no hydrogen 3.184 N/A ALA 395.A N ASP 393.A OD1 no hydrogen 3.146 N/A GLY 396.A N ASP 393.A OD1 no hydrogen 3.211 N/A PHE 398.A N THR 391.A O no hydrogen 2.971 N/A LYS 400.A N THR 389.A O no hydrogen 3.135 N/A LYS 400.A NZ LEU 444.A O no hydrogen 3.528 N/A GLU 402.A N ARG 387.A O no hydrogen 3.519 N/A GLN 403.A NE2 HIS 445.A ND1 no hydrogen 2.934 N/A SER 405.A OG GLU 402.A O no hydrogen 3.538 N/A ILE 406.A N GLU 402.A O no hydrogen 3.258 N/A LEU 407.A N GLN 403.A O no hydrogen 2.827 N/A ARG 408.A N SER 404.A O no hydrogen 2.794 N/A GLN 409.A N SER 405.A O no hydrogen 3.338 N/A GLN 409.A N ILE 406.A O no hydrogen 2.918 N/A GLN 409.A NE2 SER 405.A O no hydrogen 3.429 N/A MET 410.A N LEU 407.A O no hydrogen 2.722 N/A TYR 411.A N ARG 408.A O no hydrogen 3.233 N/A TRP 412.A N ARG 408.A O no hydrogen 3.181 N/A TRP 412.A NE1 TYR 36.A O no hydrogen 2.942 N/A THR 413.A N TRP 24.A O no hydrogen 2.916 N/A THR 413.A OG1 ARG 414.A O no hydrogen 3.363 N/A GLY 415.A N LYS 22.A O no hydrogen 2.778 N/A HIS 418.A N THR 21.A O no hydrogen 3.135 N/A HIS 418.A ND1 GLU 423.A OE1 no hydrogen 2.711 N/A HIS 418.A NE2 PHE 23.A O no hydrogen 2.751 N/A SER 422.A N ASP 420.A OD1 no hydrogen 3.002 N/A SER 422.A OG ASP 420.A OD1 no hydrogen 2.893 N/A SER 422.A OG ASP 420.A OD2 no hydrogen 3.119 N/A GLU 423.A N ASP 420.A O no hydrogen 3.003 N/A MET 425.A N ARG 25.A O no hydrogen 2.937 N/A ARG 431.A N HIS 428.A O no hydrogen 3.286 N/A ARG 431.A NE GLU 460.A OE2 no hydrogen 2.838 N/A ARG 431.A NH1 GLN 409.A O no hydrogen 3.091 N/A ARG 431.A NH1 GLN 434.A OE1 no hydrogen 3.055 N/A ARG 431.A NH2 GLN 409.A O no hydrogen 2.920 N/A ARG 431.A NH2 GLU 460.A OE1 no hydrogen 3.048 N/A ARG 431.A NH2 GLU 460.A OE2 no hydrogen 3.396 N/A GLN 434.A N GLN 430.A O no hydrogen 3.395 N/A GLN 434.A NE2 GLN 409.A OE1 no hydrogen 2.967 N/A LEU 435.A N ARG 431.A O no hydrogen 2.944 N/A MET 436.A N PRO 432.A O no hydrogen 3.067 N/A SER 437.A N ILE 433.A O no hydrogen 3.183 N/A SER 437.A OG ILE 433.A O no hydrogen 3.357 N/A SER 437.A OG GLN 434.A O no hydrogen 2.589 N/A LEU 438.A N GLN 434.A O no hydrogen 2.779 N/A LEU 439.A N LEU 435.A O no hydrogen 2.808 N/A GLY 440.A N MET 436.A O no hydrogen 2.873 N/A GLU 441.A N SER 437.A O no hydrogen 2.964 N/A ALA 442.A N LEU 438.A O no hydrogen 2.691 N/A ALA 443.A N LEU 439.A O no hydrogen 2.811 N/A ALA 443.A N GLY 440.A O no hydrogen 2.914 N/A LEU 444.A N GLU 441.A O no hydrogen 3.270 N/A HIS 445.A N ALA 442.A O no hydrogen 3.070 N/A HIS 445.A NE2 LEU 401.A O no hydrogen 2.874 N/A TYR 450.A N GLY 446.A O no hydrogen 3.292 N/A TYR 450.A OH PRO 471.A O no hydrogen 2.543 N/A SER 451.A N PRO 447.A O no hydrogen 2.897 N/A ILE 453.A N PHE 449.A O no hydrogen 2.939 N/A SER 454.A N TYR 450.A O no hydrogen 2.723 N/A SER 454.A OG TYR 450.A O no hydrogen 2.992 N/A LYS 455.A N SER 451.A O no hydrogen 2.830 N/A LEU 456.A N LYS 452.A O no hydrogen 3.058 N/A VAL 457.A N ILE 453.A O no hydrogen 2.902 N/A ILE 458.A N SER 454.A O no hydrogen 2.933 N/A ALA 459.A N LYS 455.A O no hydrogen 3.023 N/A GLU 460.A N LEU 456.A O no hydrogen 2.969 N/A LEU 461.A N VAL 457.A O no hydrogen 3.016 N/A LYS 462.A N ILE 458.A O no hydrogen 2.645 N/A GLU 463.A N ALA 459.A O no hydrogen 3.281 N/A GLY 464.A N LEU 461.A O no hydrogen 3.290 N/A GLY 465.A N LYS 462.A O no hydrogen 3.027 N/A MET 466.A N LEU 461.A O no hydrogen 2.828 N/A ARG 472.A NH1 GLU 489.A OE2 no hydrogen 3.115 N/A GLN 473.A NE2 ALA 443.A O no hydrogen 3.163 N/A GLU 474.A N GLU 474.A OE1 no hydrogen 3.254 N/A MET 476.A N ARG 472.A O no hydrogen 3.290 N/A PHE 477.A N GLN 473.A O no hydrogen 2.695 N/A ARG 478.A N GLU 474.A O no hydrogen 2.996 N/A ARG 478.A NH1 ASP 484.A OD2 no hydrogen 3.240 N/A TRP 479.A N PRO 475.A O no hydrogen 2.850 N/A TRP 479.A NE1 PRO 496.A O no hydrogen 3.339 N/A MET 480.A N MET 476.A O no hydrogen 2.858 N/A ARG 481.A N PHE 477.A O no hydrogen 2.887 N/A ARG 481.A NE ASP 393.A OD1 no hydrogen 3.184 N/A ARG 481.A NE ASP 393.A OD2 no hydrogen 2.877 N/A ARG 481.A NH2 ASP 393.A OD1 no hydrogen 3.470 N/A SER 483.A N TRP 479.A O no hydrogen 2.992 N/A ASP 484.A N ARG 478.A O no hydrogen 3.030 N/A SER 486.A N ASP 484.A OD1 no hydrogen 3.041 N/A SER 486.A OG ASP 484.A OD1 no hydrogen 2.881 N/A SER 486.A OG ASP 484.A OD2 no hydrogen 3.307 N/A TRP 488.A N LEU 485.A O no hydrogen 3.204 N/A TRP 488.A NE1 ASP 491.A O no hydrogen 3.174 N/A ASN 493.A N ASP 491.A OD1 no hydrogen 3.021 N/A LEU 494.A N ASP 491.A O no hydrogen 3.124 N/A ALA 495.A N ARG 492.A O no hydrogen 3.208 N/A