Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 6mrg_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LYS 5.A NZ SER 126.A O no hydrogen 3.166 N/A ARG 7.A N ARG 3.A O no hydrogen 2.742 N/A GLY 8.A N GLN 4.A O no hydrogen 3.213 N/A ALA 9.A N LYS 5.A O no hydrogen 2.673 N/A ALA 10.A N ALA 6.A O no hydrogen 3.145 N/A THR 11.A N ARG 7.A O no hydrogen 3.290 N/A THR 11.A OG1 ARG 7.A O no hydrogen 2.870 N/A ARG 12.A N GLY 8.A O no hydrogen 3.216 N/A ARG 12.A NH2 GLU 129.A OE1 no hydrogen 3.294 N/A ALA 13.A N ALA 9.A O no hydrogen 3.034 N/A ARG 14.A N ALA 10.A O no hydrogen 2.968 N/A GLN 15.A N THR 11.A O no hydrogen 3.147 N/A LYS 16.A N ARG 12.A O no hydrogen 2.865 N/A LYS 16.A NZ GLU 129.A OE2 no hydrogen 2.845 N/A GLN 17.A N ALA 13.A O no hydrogen 2.873 N/A GLN 17.A NE2 ASN 81.A OD1 no hydrogen 3.278 N/A GLN 17.A NE2 VAL 83.A O no hydrogen 2.864 N/A ARG 18.A N ARG 14.A O no hydrogen 2.709 N/A ARG 18.A NE GLN 15.A OE1 no hydrogen 2.842 N/A ARG 18.A NH1 GLN 15.A OE1 no hydrogen 2.893 N/A ALA 19.A N GLN 15.A O no hydrogen 2.800 N/A SER 20.A N LYS 16.A O no hydrogen 2.932 N/A SER 20.A OG LYS 16.A O no hydrogen 3.309 N/A LEU 21.A N GLN 17.A O no hydrogen 3.000 N/A GLU 22.A N ARG 18.A O no hydrogen 2.829 N/A THR 23.A N ALA 19.A O no hydrogen 2.906 N/A THR 23.A OG1 ALA 19.A O no hydrogen 2.708 N/A MET 24.A N SER 20.A O no hydrogen 2.805 N/A ASP 25.A N LEU 21.A O no hydrogen 2.974 N/A LYS 26.A N GLU 22.A O no hydrogen 3.025 N/A LYS 26.A NZ GLU 22.A OE1 no hydrogen 3.131 N/A ALA 27.A N THR 23.A O no hydrogen 2.854 N/A VAL 28.A N MET 24.A O no hydrogen 3.071 N/A GLN 29.A N ASP 25.A O no hydrogen 2.972 N/A ARG 30.A N LYS 26.A O no hydrogen 3.253 N/A PHE 31.A N ALA 27.A O no hydrogen 3.205 N/A ARG 32.A N VAL 28.A O no hydrogen 3.050 N/A ARG 32.A NH2 GLU 75.A OE2 no hydrogen 3.258 N/A LEU 33.A N GLN 29.A O no hydrogen 3.241 N/A LEU 38.A N PRO 36.A O no hydrogen 2.967 N/A LEU 43.A N ASP 39.A O no hydrogen 3.073 N/A LEU 44.A N SER 40.A O no hydrogen 2.977 N/A THR 45.A N GLU 41.A O no hydrogen 3.118 N/A THR 45.A OG1 GLU 41.A O no hydrogen 2.508 N/A LEU 46.A N ALA 42.A O no hydrogen 3.057 N/A LEU 46.A N LEU 43.A O no hydrogen 3.094 N/A LEU 51.A N PRO 47.A O no hydrogen 3.049 N/A VAL 52.A N LEU 48.A O no hydrogen 2.889 N/A GLN 53.A N LEU 49.A O no hydrogen 3.167 N/A LYS 54.A N GLN 50.A O no hydrogen 3.275 N/A LYS 54.A NZ GLU 59.A OE2 no hydrogen 2.522 N/A LEU 55.A N LEU 51.A O no hydrogen 2.941 N/A GLN 56.A N VAL 52.A O no hydrogen 2.729 N/A GLN 56.A NE2 ARG 99.A O no hydrogen 2.937 N/A SER 57.A N GLN 53.A O no hydrogen 2.905 N/A SER 57.A OG GLN 53.A O no hydrogen 3.155 N/A GLU 59.A N LYS 54.A O no hydrogen 2.728 N/A LEU 60.A N LYS 54.A O no hydrogen 3.311 N/A GLU 63.A N GLU 63.A OE1 no hydrogen 2.667 N/A ALA 64.A N SER 61.A OG no hydrogen 3.382 N/A VAL 65.A N SER 61.A O no hydrogen 3.371 N/A PHE 66.A N PRO 62.A O no hydrogen 2.842 N/A PHE 67.A N GLU 63.A O no hydrogen 2.708 N/A THR 68.A N ALA 64.A O no hydrogen 2.868 N/A THR 68.A OG1 ALA 64.A O no hydrogen 2.511 N/A TYR 69.A N VAL 65.A O no hydrogen 3.231 N/A LEU 70.A N PHE 66.A O no hydrogen 2.702 N/A GLY 71.A N PHE 67.A O no hydrogen 3.370 N/A LYS 72.A N THR 68.A O no hydrogen 3.131 N/A ALA 73.A N TYR 69.A O no hydrogen 2.890 N/A TRP 74.A N LEU 70.A O no hydrogen 3.303 N/A GLU 75.A N GLY 71.A O no hydrogen 3.013 N/A VAL 76.A N LYS 72.A O no hydrogen 2.834 N/A ASN 77.A N ALA 73.A O no hydrogen 2.899 N/A LYS 78.A N GLU 75.A O no hydrogen 3.147 N/A THR 80.A OG1 VAL 76.A O no hydrogen 2.673 N/A ASN 81.A N ASN 77.A O no hydrogen 2.865 N/A ASN 81.A ND2 PHE 170.A O no hydrogen 2.856 N/A ASN 81.A ND2 GLN 172.A O no hydrogen 2.782 N/A CYS 82.A N ASN 77.A OD1 no hydrogen 2.894 N/A CYS 82.A SG THR 80.A OG1 no hydrogen 3.541 N/A CYS 82.A SG GLY 189.A O no hydrogen 3.834 N/A VAL 83.A N ASN 77.A OD1 no hydrogen 3.271 N/A THR 84.A N HIS 153.A O no hydrogen 2.760 N/A SER 85.A N HIS 153.A O no hydrogen 3.381 N/A SER 85.A OG TYR 86.A O no hydrogen 3.325 N/A SER 85.A OG HIS 119.A ND1 no hydrogen 3.056 N/A TYR 86.A N SER 20.A OG no hydrogen 3.024 N/A TYR 86.A OH GLU 91.A OE2 no hydrogen 3.025 N/A LEU 87.A N PHE 151.A O no hydrogen 2.805 N/A THR 88.A N TYR 86.A O no hydrogen 2.650 N/A THR 88.A OG1 ASP 89.A OD1 no hydrogen 2.128 N/A THR 88.A OG1 HIS 119.A NE2 no hydrogen 2.954 N/A CYS 90.A N LEU 87.A O no hydrogen 3.034 N/A CYS 90.A SG LEU 87.A O no hydrogen 3.414 N/A CYS 90.A SG PHE 151.A O no hydrogen 4.043 N/A THR 92.A N ASP 89.A O no hydrogen 2.682 N/A THR 92.A OG1 ASP 89.A O no hydrogen 3.186 N/A GLN 93.A N ASP 89.A O no hydrogen 3.166 N/A GLN 93.A NE2 LYS 144.A O no hydrogen 3.590 N/A LEU 94.A N CYS 90.A O no hydrogen 2.941 N/A SER 95.A OG THR 92.A O no hydrogen 2.729 N/A GLN 96.A N THR 92.A O no hydrogen 3.312 N/A GLY 101.A N PRO 98.A O no hydrogen 3.109 N/A LEU 102.A N GLN 146.A OE1 no hydrogen 3.359 N/A LEU 103.A N GLN 146.A O no hydrogen 2.911 N/A TYR 104.A N GLY 101.A O no hydrogen 3.267 N/A GLY 105.A N GLY 147.A O no hydrogen 2.913 N/A VAL 106.A N LEU 103.A O no hydrogen 3.004 N/A VAL 108.A N VAL 149.A O no hydrogen 3.212 N/A SER 109.A N LEU 201.A O no hydrogen 3.155 N/A SER 109.A OG GLU 190.A OE1 no hydrogen 2.627 N/A SER 109.A OG GLU 190.A OE2 no hydrogen 3.226 N/A SER 109.A OG SER 199.A OG no hydrogen 3.241 N/A SER 109.A OG LEU 201.A O no hydrogen 3.489 N/A LEU 110.A N VAL 152.A O no hydrogen 2.951 N/A LYS 111.A N LEU 203.A O no hydrogen 3.242 N/A LYS 111.A NZ SER 186.A OG no hydrogen 2.635 N/A LYS 111.A NZ SER 187.A OG no hydrogen 3.220 N/A LYS 111.A NZ THR 205.A O no hydrogen 3.542 N/A LYS 111.A NZ THR 205.A OG1 no hydrogen 2.613 N/A PHE 114.A N LYS 111.A O no hydrogen 3.218 N/A SER 115.A OG SER 133.A OG no hydrogen 3.317 N/A SER 115.A OG GLY 234.A O no hydrogen 2.638 N/A TYR 116.A OH ASP 89.A OD2 no hydrogen 2.828 N/A LYS 117.A N ASP 136.A OD1 no hydrogen 2.645 N/A GLY 118.A N SER 133.A O no hydrogen 2.951 N/A HIS 119.A N TYR 116.A O no hydrogen 3.085 N/A HIS 119.A NE2 THR 88.A OG1 no hydrogen 2.954 N/A SER 121.A OG GLU 112.A O no hydrogen 2.924 N/A THR 122.A N GLU 112.A OE2 no hydrogen 3.107 N/A THR 122.A OG1 GLU 112.A OE1 no hydrogen 2.990 N/A THR 122.A OG1 GLU 112.A OE2 no hydrogen 2.752 N/A LEU 123.A N GLU 112.A OE1 no hydrogen 2.633 N/A GLY 124.A N THR 122.A OG1 no hydrogen 2.933 N/A LEU 125.A N THR 122.A O no hydrogen 3.103 N/A SER 126.A N ASP 364.A OD2 no hydrogen 2.903 N/A ASN 128.A N LEU 125.A O no hydrogen 3.295 N/A ASN 128.A ND2 THR 122.A O no hydrogen 2.973 N/A GLU 129.A N SER 126.A O no hydrogen 3.055 N/A GLY 130.A N ASP 120.A OD2 no hydrogen 3.322 N/A MET 131.A N ASP 120.A OD1 no hydrogen 2.675 N/A SER 133.A N HIS 119.A O no hydrogen 3.185 N/A SER 133.A OG HIS 119.A O no hydrogen 3.545 N/A CYS 137.A N SER 115.A O no hydrogen 2.958 N/A CYS 137.A SG SER 115.A O no hydrogen 3.656 N/A VAL 138.A N SER 233.A O no hydrogen 3.084 N/A GLN 141.A N CYS 137.A O no hydrogen 3.154 N/A GLN 141.A NE2 ASP 136.A O no hydrogen 3.082 N/A VAL 142.A N VAL 138.A O no hydrogen 3.139 N/A LEU 143.A N VAL 139.A O no hydrogen 2.861 N/A LYS 144.A N VAL 140.A O no hydrogen 2.859 N/A LYS 144.A NZ ASP 89.A OD2 no hydrogen 3.566 N/A LYS 144.A NZ TYR 116.A OH no hydrogen 2.973 N/A LYS 144.A NZ ASP 136.A OD2 no hydrogen 3.331 N/A LEU 145.A N GLN 141.A O no hydrogen 2.741 N/A GLN 146.A N VAL 142.A O no hydrogen 2.742 N/A GLN 146.A N LEU 143.A O no hydrogen 3.063 N/A GLN 146.A NE2 ALA 265.A O no hydrogen 2.866 N/A GLY 147.A N LYS 144.A O no hydrogen 3.213 N/A ALA 148.A N LEU 143.A O no hydrogen 2.999 N/A VAL 149.A N VAL 106.A O no hydrogen 2.826 N/A PHE 151.A N VAL 108.A O no hydrogen 3.182 N/A HIS 153.A N SER 85.A O no hydrogen 3.003 N/A HIS 153.A NE2 PHE 114.A O no hydrogen 2.699 N/A THR 154.A N LEU 110.A O no hydrogen 2.866 N/A THR 154.A OG1 LEU 110.A O no hydrogen 3.449 N/A THR 154.A OG1 GLU 190.A OE2 no hydrogen 2.578 N/A ASN 155.A N CYS 82.A O no hydrogen 3.310 N/A ASN 155.A ND2 GLY 171.A O no hydrogen 3.238 N/A ASN 155.A ND2 THR 173.A OG1 no hydrogen 2.792 N/A GLN 158.A N SER 166.A O no hydrogen 2.995 N/A GLN 158.A NE2 GLY 124.A O no hydrogen 3.478 N/A GLN 158.A NE2 PHE 365.A O no hydrogen 2.810 N/A SER 159.A N LEU 123.A O no hydrogen 2.838 N/A SER 159.A OG GLN 158.A O no hydrogen 2.460 N/A MET 160.A N PRO 157.A O no hydrogen 2.665 N/A PHE 161.A N SER 159.A OG no hydrogen 3.285 N/A TYR 163.A OH ALA 456.A O no hydrogen 2.757 N/A ASP 164.A N SER 162.A OG no hydrogen 3.220 N/A SER 166.A OG ASP 367.A OD1 no hydrogen 2.744 N/A SER 166.A OG ASP 367.A OD2 no hydrogen 3.450 N/A ASN 167.A N GLY 171.A O no hydrogen 3.251 N/A ASN 167.A ND2 ASN 155.A OD1 no hydrogen 2.701 N/A ASN 167.A ND2 VAL 156.A O no hydrogen 2.756 N/A LEU 169.A N ASN 167.A OD1 no hydrogen 2.983 N/A PHE 170.A N ASN 167.A OD1 no hydrogen 2.800 N/A GLY 171.A N ASN 167.A O no hydrogen 2.768 N/A THR 173.A N CYS 165.A O no hydrogen 2.977 N/A THR 173.A OG1 ASN 81.A O no hydrogen 2.638 N/A MET 174.A N THR 80.A O no hydrogen 2.952 N/A ASN 175.A N LYS 181.A O no hydrogen 3.177 N/A ASN 175.A ND2 SER 182.A O no hydrogen 2.924 N/A ASN 175.A ND2 PHE 217.A O no hydrogen 3.128 N/A TRP 177.A N ASN 175.A OD1 no hydrogen 3.141 N/A LYS 178.A N ASN 175.A O no hydrogen 3.302 N/A LYS 178.A NZ ASN 510.A O no hydrogen 2.790 N/A LYS 181.A N LYS 178.A O no hydrogen 2.963 N/A LYS 181.A NZ ALA 447.A O no hydrogen 3.047 N/A LYS 181.A NZ ASP 449.A OD1 no hydrogen 3.385 N/A LYS 181.A NZ ALA 507.A O no hydrogen 2.847 N/A LYS 181.A NZ LYS 509.A O no hydrogen 2.742 N/A LYS 181.A NZ SER 511.A OG no hydrogen 2.712 N/A SER 182.A N LEU 448.A O no hydrogen 2.826 N/A SER 182.A OG ASP 164.A OD1 no hydrogen 2.705 N/A GLY 184.A N SER 182.A OG no hydrogen 3.164 N/A SER 186.A N SER 210.A OG no hydrogen 2.704 N/A SER 186.A OG MET 160.A O no hydrogen 3.281 N/A SER 186.A OG SER 210.A OG no hydrogen 2.861 N/A SER 187.A N SER 210.A O no hydrogen 3.193 N/A SER 187.A OG THR 205.A O no hydrogen 3.323 N/A SER 187.A OG SER 210.A O no hydrogen 2.713 N/A GLY 189.A N ASN 155.A O no hydrogen 3.305 N/A GLY 191.A N SER 187.A O no hydrogen 3.232 N/A ALA 192.A N GLY 188.A O no hydrogen 2.874 N/A LEU 193.A N GLY 189.A O no hydrogen 3.056 N/A ILE 194.A N GLU 190.A O no hydrogen 2.779 N/A GLY 195.A N GLY 191.A O no hydrogen 2.651 N/A SER 196.A N LEU 193.A O no hydrogen 3.393 N/A SER 196.A OG ALA 192.A O no hydrogen 2.986 N/A SER 196.A OG LEU 193.A O no hydrogen 3.316 N/A GLY 197.A N ILE 194.A O no hydrogen 3.073 N/A GLY 198.A N LEU 193.A O no hydrogen 2.695 N/A SER 199.A OG SER 109.A OG no hydrogen 3.241 N/A SER 199.A OG LEU 201.A O no hydrogen 2.860 N/A GLY 202.A N MET 252.A O no hydrogen 2.938 N/A LEU 203.A N SER 109.A O no hydrogen 3.201 N/A GLY 204.A N GLY 250.A O no hydrogen 2.966 N/A ASP 206.A N SER 248.A O no hydrogen 2.665 N/A GLY 209.A N ASP 206.A OD1 no hydrogen 2.488 N/A SER 210.A OG SER 186.A OG no hydrogen 2.861 N/A ILE 211.A N ASP 206.A OD2 no hydrogen 2.651 N/A ARG 212.A N ASP 206.A OD2 no hydrogen 3.311 N/A ARG 212.A NE ASP 206.A OD2 no hydrogen 3.298 N/A ARG 212.A NH1 THR 463.A O no hydrogen 3.068 N/A ARG 212.A NH1 GLN 519.A OE1 no hydrogen 2.905 N/A ARG 212.A NH2 ASP 206.A OD1 no hydrogen 3.350 N/A ARG 212.A NH2 THR 463.A O no hydrogen 2.987 N/A PHE 213.A N GLY 209.A O no hydrogen 2.755 N/A SER 215.A N ILE 211.A O no hydrogen 3.284 N/A SER 215.A OG ILE 211.A O no hydrogen 2.690 N/A SER 215.A OG CYS 221.A O no hydrogen 3.447 N/A ALA 216.A N ARG 212.A O no hydrogen 2.956 N/A PHE 217.A N PHE 213.A O no hydrogen 2.807 N/A CYS 218.A N PRO 214.A O no hydrogen 3.019 N/A CYS 218.A SG PRO 183.A O no hydrogen 3.037 N/A GLY 219.A N ALA 216.A O no hydrogen 3.313 N/A ILE 220.A N SER 215.A O no hydrogen 2.693 N/A CYS 221.A N ALA 253.A O no hydrogen 2.809 N/A CYS 221.A SG ARG 254.A O no hydrogen 3.904 N/A GLY 222.A N VAL 475.A O no hydrogen 3.440 N/A LEU 223.A N PRO 251.A O no hydrogen 3.225 N/A LYS 224.A N ALA 473.A O no hydrogen 2.808 N/A LYS 224.A NZ LYS 224.A O no hydrogen 3.404 N/A LYS 224.A NZ PRO 225.A O no hydrogen 2.947 N/A LYS 224.A NZ PHE 471.A O no hydrogen 2.647 N/A THR 226.A N GLU 527.A OE2 no hydrogen 2.600 N/A THR 226.A OG1 GLU 527.A OE2 no hydrogen 2.470 N/A GLY 227.A N ASP 470.A OD1 no hydrogen 2.804 N/A ASN 228.A ND2 THR 277.A O no hydrogen 3.374 N/A ARG 229.A N THR 226.A O no hydrogen 2.925 N/A ARG 229.A NH1 LEU 281.A O no hydrogen 3.334 N/A ARG 229.A NH1 GLU 528.A OE2 no hydrogen 3.357 N/A SER 231.A OG ASP 275.A OD2 no hydrogen 2.636 N/A LYS 232.A NZ GLN 246.A OE1 no hydrogen 2.964 N/A SER 233.A N SER 231.A OG no hydrogen 3.303 N/A LEU 235.A N LYS 232.A O no hydrogen 3.217 N/A LYS 236.A N CYS 113.A O no hydrogen 2.809 N/A GLY 237.A N TYR 240.A OH no hydrogen 2.883 N/A CYS 238.A SG SER 159.A O no hydrogen 3.952 N/A GLN 242.A NE2 VAL 245.A O no hydrogen 2.824 N/A VAL 245.A N GLN 242.A OE1 no hydrogen 2.883 N/A SER 248.A N ASP 206.A O no hydrogen 3.039 N/A SER 248.A OG PRO 225.A O no hydrogen 2.654 N/A GLY 250.A N GLY 204.A O no hydrogen 3.112 N/A MET 252.A N GLY 202.A O no hydrogen 2.751 N/A ALA 253.A N CYS 221.A O no hydrogen 3.137 N/A ARG 254.A NH1 TYR 69.A OH no hydrogen 3.133 N/A VAL 256.A N GLU 538.A OE2 no hydrogen 2.872 N/A SER 258.A N ASP 255.A OD1 no hydrogen 2.809 N/A SER 258.A OG ASP 255.A OD1 no hydrogen 2.891 N/A SER 258.A OG ASP 255.A OD2 no hydrogen 3.406 N/A ALA 260.A N VAL 256.A O no hydrogen 3.072 N/A LEU 261.A N GLU 257.A O no hydrogen 2.856 N/A CYS 262.A N SER 258.A O no hydrogen 2.965 N/A LEU 263.A N LEU 259.A O no hydrogen 3.134 N/A LYS 264.A N ALA 260.A O no hydrogen 3.137 N/A LYS 264.A NZ GLU 285.A OE1 no hydrogen 3.137 N/A ALA 265.A N LEU 261.A O no hydrogen 2.965 N/A LEU 266.A N CYS 262.A O no hydrogen 2.920 N/A LEU 267.A N LEU 263.A O no hydrogen 2.745 N/A CYS 268.A N LEU 266.A O no hydrogen 2.608 N/A CYS 268.A SG ALA 265.A O no hydrogen 3.624 N/A CYS 268.A SG LEU 266.A O no hydrogen 3.305 N/A PHE 272.A N CYS 268.A O no hydrogen 3.321 N/A THR 273.A N GLU 269.A O no hydrogen 2.957 N/A THR 273.A OG1 GLU 269.A O no hydrogen 2.566 N/A LEU 274.A N HIS 270.A O no hydrogen 2.795 N/A ASP 275.A N LEU 271.A O no hydrogen 2.742 N/A THR 277.A N ASP 275.A OD1 no hydrogen 3.283 N/A THR 277.A OG1 ASP 275.A OD1 no hydrogen 2.436 N/A THR 277.A OG1 ASP 275.A OD2 no hydrogen 3.310 N/A VAL 278.A N ASP 275.A O no hydrogen 3.364 N/A LEU 281.A N PRO 279.A O no hydrogen 2.645 N/A ARG 284.A N GLU 528.A OE2 no hydrogen 3.419 N/A ARG 284.A NH1 TRP 525.A O no hydrogen 3.535 N/A ARG 284.A NH2 GLN 526.A OE1 no hydrogen 3.433 N/A TYR 288.A N ARG 284.A O no hydrogen 3.428 N/A TYR 288.A OH GLU 257.A OE1 no hydrogen 2.581 N/A ARG 289.A N GLU 285.A O no hydrogen 3.022 N/A ARG 289.A NH1 GLU 257.A OE1 no hydrogen 3.477 N/A ARG 289.A NH1 GLU 257.A OE2 no hydrogen 3.547 N/A ARG 289.A NH2 GLU 257.A OE1 no hydrogen 3.499 N/A SER 290.A N VAL 287.A O no hydrogen 3.159 N/A ARG 292.A N SER 290.A OG no hydrogen 3.286 N/A ARG 295.A N ASP 437.A OD2 no hydrogen 3.119 N/A ARG 295.A NE ASN 435.A O no hydrogen 3.326 N/A ARG 295.A NH2 MET 434.A O no hydrogen 3.367 N/A VAL 296.A N THR 328.A O no hydrogen 2.833 N/A GLY 297.A N VAL 438.A O no hydrogen 3.067 N/A TYR 298.A N ILE 330.A O no hydrogen 2.848 N/A TYR 299.A OH TYR 466.A OH no hydrogen 2.575 N/A THR 301.A OG1 TYR 495.A OH no hydrogen 2.661 N/A ASP 302.A N TYR 462.A OH no hydrogen 3.326 N/A ASN 303.A N THR 301.A OG1 no hydrogen 2.870 N/A TYR 304.A N ASP 302.A OD1 no hydrogen 2.956 N/A TYR 304.A OH GLU 342.A OE2 no hydrogen 3.001 N/A THR 305.A N ASP 302.A OD1 no hydrogen 2.927 N/A THR 305.A OG1 SER 461.A OG no hydrogen 2.866 N/A SER 308.A OG GLY 445.A O no hydrogen 2.827 N/A MET 311.A N SER 308.A OG no hydrogen 3.014 N/A ARG 312.A N SER 308.A O no hydrogen 2.952 N/A ARG 313.A N PRO 309.A O no hydrogen 2.776 N/A ARG 313.A NE ASP 485.A OD1 no hydrogen 3.421 N/A ARG 313.A NE ASP 485.A OD2 no hydrogen 3.112 N/A ARG 313.A NH1 THR 479.A OG1 no hydrogen 3.123 N/A ARG 313.A NH1 THR 480.A O no hydrogen 3.160 N/A ARG 313.A NH1 ASP 485.A OD2 no hydrogen 3.040 N/A ARG 313.A NH2 GLU 317.A OE2 no hydrogen 3.170 N/A ARG 313.A NH2 THR 479.A OG1 no hydrogen 3.244 N/A ALA 314.A N ALA 310.A O no hydrogen 2.796 N/A LEU 315.A N MET 311.A O no hydrogen 2.925 N/A ILE 316.A N ARG 312.A O no hydrogen 3.082 N/A GLU 317.A N ARG 313.A O no hydrogen 2.837 N/A THR 318.A N ALA 314.A O no hydrogen 3.261 N/A THR 318.A OG1 ALA 314.A O no hydrogen 2.691 N/A LYS 319.A N LEU 315.A O no hydrogen 2.992 N/A GLN 320.A N ILE 316.A O no hydrogen 2.946 N/A ARG 321.A N GLU 317.A O no hydrogen 3.051 N/A LEU 322.A N THR 318.A O no hydrogen 2.757 N/A GLU 323.A N LYS 319.A O no hydrogen 3.093 N/A ALA 324.A N GLN 320.A O no hydrogen 3.076 N/A ALA 325.A N ARG 321.A O no hydrogen 3.155 N/A GLY 326.A N GLU 323.A O no hydrogen 2.950 N/A HIS 327.A N LEU 322.A O no hydrogen 3.155 N/A HIS 327.A ND1 LEU 322.A O no hydrogen 3.200 N/A THR 328.A N LEU 294.A O no hydrogen 2.776 N/A ILE 330.A N VAL 296.A O no hydrogen 2.871 N/A PHE 332.A N TYR 298.A O no hydrogen 2.990 N/A ASN 335.A ND2 SER 426.A OG no hydrogen 2.733 N/A ASN 336.A ND2 ASN 335.A OD1 no hydrogen 3.023 N/A TYR 339.A OH GLU 419.A OE1 no hydrogen 2.601 N/A ALA 340.A N ASN 336.A O no hydrogen 3.211 N/A LEU 341.A N ILE 337.A O no hydrogen 3.027 N/A GLU 342.A N PRO 338.A O no hydrogen 2.779 N/A VAL 343.A N TYR 339.A O no hydrogen 2.909 N/A LEU 344.A N TYR 339.A O no hydrogen 2.950 N/A SER 345.A N ALA 340.A O no hydrogen 2.705 N/A SER 345.A OG ALA 340.A O no hydrogen 2.744 N/A THR 346.A N LEU 341.A O no hydrogen 3.195 N/A THR 346.A OG1 LEU 341.A O no hydrogen 2.651 N/A GLY 347.A N VAL 343.A O no hydrogen 3.210 N/A GLY 348.A N LEU 344.A O no hydrogen 2.678 N/A LEU 349.A N SER 345.A O no hydrogen 2.988 N/A PHE 350.A N THR 346.A O no hydrogen 3.008 N/A SER 351.A OG GLY 347.A O no hydrogen 2.591 N/A SER 351.A OG GLY 348.A O no hydrogen 2.973 N/A GLY 353.A N PHE 350.A O no hydrogen 2.729 N/A GLY 354.A N ASP 352.A OD1 no hydrogen 2.945 N/A SER 356.A N ASP 352.A OD2 no hydrogen 2.768 N/A SER 356.A OG ASP 352.A OD2 no hydrogen 2.726 N/A LEU 358.A N GLY 354.A O no hydrogen 2.799 N/A GLN 359.A N ARG 355.A O no hydrogen 3.295 N/A GLN 359.A N SER 356.A O no hydrogen 3.223 N/A ASN 360.A N PHE 357.A O no hydrogen 3.072 N/A ASN 360.A ND2 CYS 238.A O no hydrogen 3.104 N/A ASN 360.A ND2 PHE 357.A O no hydrogen 2.791 N/A PHE 361.A N LEU 358.A O no hydrogen 2.848 N/A LYS 362.A N GLN 359.A O no hydrogen 3.183 N/A LYS 362.A NZ GLN 359.A OE1 no hydrogen 2.826 N/A ASP 364.A N PHE 361.A O no hydrogen 3.074 N/A ASP 367.A N GLN 158.A OE1 no hydrogen 2.872 N/A CYS 369.A N ASP 367.A OD2 no hydrogen 2.993 N/A CYS 369.A SG SER 166.A O no hydrogen 3.639 N/A CYS 369.A SG ASP 367.A OD2 no hydrogen 3.177 N/A LEU 370.A N ASP 367.A O no hydrogen 3.075 N/A GLY 371.A N PRO 368.A O no hydrogen 2.904 N/A LEU 373.A N LEU 370.A O no hydrogen 3.344 N/A ILE 376.A N ASP 372.A O no hydrogen 2.689 N/A LEU 377.A N LEU 373.A O no hydrogen 2.767 N/A ARG 378.A N ILE 374.A O no hydrogen 2.929 N/A LEU 379.A N LEU 375.A O no hydrogen 3.227 N/A LEU 379.A N ILE 376.A O no hydrogen 3.177 N/A LYS 384.A N PRO 380.A O no hydrogen 3.225 N/A LYS 384.A NZ GLY 353.A O no hydrogen 3.301 N/A LYS 384.A NZ LEU 377.A O no hydrogen 3.492 N/A LYS 384.A NZ MET 405.A O no hydrogen 2.791 N/A ARG 385.A N SER 381.A O no hydrogen 3.074 N/A LEU 386.A N TRP 382.A O no hydrogen 2.997 N/A LEU 387.A N PHE 383.A O no hydrogen 2.967 N/A SER 388.A N LYS 384.A O no hydrogen 2.837 N/A SER 388.A OG ALA 399.A O no hydrogen 2.849 N/A LEU 389.A N ARG 385.A O no hydrogen 3.033 N/A LEU 390.A N LEU 386.A O no hydrogen 3.078 N/A LEU 391.A N LEU 387.A O no hydrogen 3.027 N/A LYS 392.A N SER 388.A O no hydrogen 2.896 N/A LEU 394.A N LEU 391.A O no hydrogen 2.748 N/A PHE 395.A N LEU 391.A O no hydrogen 2.590 N/A ARG 397.A NE ASP 498.A OD2 no hydrogen 3.306 N/A ARG 397.A NH2 ASP 498.A OD1 no hydrogen 3.291 N/A ALA 399.A N PHE 395.A O no hydrogen 2.877 N/A ALA 400.A N PRO 396.A O no hydrogen 2.750 N/A PHE 401.A N ARG 397.A O no hydrogen 3.396 N/A LEU 402.A N LEU 398.A O no hydrogen 3.149 N/A ASN 403.A N ALA 399.A O no hydrogen 2.889 N/A ASN 404.A N ALA 400.A O no hydrogen 3.322 N/A ASN 404.A N PHE 401.A O no hydrogen 3.210 N/A ASN 404.A ND2 ALA 400.A O no hydrogen 2.724 N/A MET 405.A N LEU 402.A O no hydrogen 3.363 N/A ARG 408.A N SER 351.A O no hydrogen 3.229 N/A ARG 408.A NE SER 351.A O no hydrogen 3.193 N/A ARG 408.A NH2 ASN 404.A O no hydrogen 3.140 N/A ARG 408.A NH2 ARG 406.A O no hydrogen 3.268 N/A LEU 413.A N SER 409.A O no hydrogen 3.067 N/A TRP 414.A N ALA 410.A O no hydrogen 3.009 N/A LYS 415.A N GLU 411.A O no hydrogen 3.122 N/A LYS 415.A NZ GLU 419.A OE2 no hydrogen 3.328 N/A LEU 416.A N LYS 412.A O no hydrogen 2.941 N/A GLN 417.A N.A LEU 413.A O no hydrogen 2.823 N/A GLN 417.A N.B LEU 413.A O no hydrogen 2.816 N/A GLN 417.A NE2.A GLN 417.A O.A no hydrogen 2.673 N/A HIS 418.A N TRP 414.A O no hydrogen 3.017 N/A GLU 419.A N LYS 415.A O no hydrogen 3.137 N/A ILE 420.A N LEU 416.A O no hydrogen 3.111 N/A GLU 421.A N GLN 417.A O.A no hydrogen 3.277 N/A GLU 421.A N GLN 417.A O.B no hydrogen 3.333 N/A MET 422.A N HIS 418.A O no hydrogen 2.893 N/A TYR 423.A N GLU 419.A O no hydrogen 2.744 N/A TYR 423.A OH ASN 335.A O no hydrogen 2.851 N/A ARG 424.A N ILE 420.A O no hydrogen 2.928 N/A ARG 424.A NE LEU 469.A O no hydrogen 2.999 N/A ARG 424.A NH1 ASP 470.A O no hydrogen 3.389 N/A GLN 425.A N GLU 421.A O no hydrogen 3.112 N/A SER 426.A N MET 422.A O no hydrogen 2.719 N/A VAL 427.A N TYR 423.A O no hydrogen 2.950 N/A ILE 428.A N ARG 424.A O no hydrogen 3.094 N/A ALA 429.A N GLN 425.A O no hydrogen 2.923 N/A GLN 430.A N SER 426.A O no hydrogen 3.336 N/A TRP 431.A N VAL 427.A O no hydrogen 3.027 N/A LYS 432.A N ILE 428.A O no hydrogen 2.897 N/A ALA 433.A N ALA 429.A O no hydrogen 3.005 N/A MET 434.A N GLN 430.A O no hydrogen 3.272 N/A ASN 435.A N LYS 432.A O no hydrogen 2.989 N/A LEU 436.A N TRP 431.A O no hydrogen 3.260 N/A ASP 437.A N ARG 295.A O no hydrogen 2.844 N/A VAL 438.A N ARG 295.A O no hydrogen 3.458 N/A LEU 439.A N VAL 521.A O no hydrogen 2.830 N/A LEU 440.A N GLY 297.A O no hydrogen 2.726 N/A ASP 449.A N ALA 507.A O no hydrogen 3.087 N/A LEU 450.A N SER 180.A O no hydrogen 3.324 N/A ASN 451.A N ASP 164.A OD2 no hydrogen 2.682 N/A THR 452.A OG1 ASP 449.A O no hydrogen 2.539 N/A ARG 455.A N THR 452.A O no hydrogen 3.036 N/A ALA 456.A N PRO 453.A O no hydrogen 3.339 N/A VAL 460.A N THR 457.A O no hydrogen 3.243 N/A SER 461.A N GLY 458.A O no hydrogen 2.860 N/A SER 461.A OG ASP 302.A OD2 no hydrogen 2.694 N/A SER 461.A OG THR 305.A OG1 no hydrogen 2.866 N/A SER 461.A OG GLY 458.A O no hydrogen 3.221 N/A TYR 462.A OH THR 305.A O no hydrogen 2.650 N/A THR 463.A N VAL 460.A O no hydrogen 3.073 N/A THR 463.A OG1 GLY 208.A O no hydrogen 2.796 N/A THR 463.A OG1 VAL 460.A O no hydrogen 2.981 N/A MET 464.A N VAL 460.A O no hydrogen 2.921 N/A TYR 466.A N THR 463.A O no hydrogen 2.967 N/A TYR 466.A OH TYR 299.A OH no hydrogen 2.575 N/A ASN 467.A ND2 ASP 206.A O no hydrogen 3.664 N/A ASN 467.A ND2 ASP 206.A OD1 no hydrogen 3.499 N/A CYS 468.A N MET 464.A O no hydrogen 2.913 N/A CYS 468.A SG ALA 340.A O no hydrogen 3.828 N/A CYS 468.A SG SER 345.A OG no hydrogen 3.351 N/A LEU 469.A N LEU 465.A O no hydrogen 2.810 N/A ASP 470.A N ASN 467.A O no hydrogen 3.266 N/A PHE 471.A N TYR 466.A O no hydrogen 3.022 N/A ALA 473.A N LYS 224.A O no hydrogen 2.840 N/A GLY 474.A N CYS 520.A O no hydrogen 2.911 N/A VAL 475.A N GLY 222.A O no hydrogen 2.964 N/A VAL 476.A N VAL 518.A O no hydrogen 3.102 N/A VAL 478.A N VAL 516.A O no hydrogen 3.106 N/A THR 479.A N VAL 516.A O no hydrogen 3.287 N/A VAL 481.A N LEU 514.A O no hydrogen 2.776 N/A THR 482.A N ASP 485.A OD2 no hydrogen 3.128 N/A ASP 485.A N THR 482.A OG1 no hydrogen 2.984 N/A ASP 486.A N THR 482.A O no hydrogen 3.037 N/A ALA 487.A N ALA 483.A O no hydrogen 2.910 N/A GLN 488.A N GLU 484.A O no hydrogen 3.129 N/A MET 489.A N ASP 485.A O no hydrogen 3.248 N/A MET 489.A N ASP 486.A O no hydrogen 3.349 N/A GLU 490.A N ALA 487.A O no hydrogen 3.073 N/A LEU 491.A N GLN 488.A O no hydrogen 2.992 N/A TYR 492.A N MET 489.A O no hydrogen 3.286 N/A TYR 492.A OH MET 306.A O no hydrogen 2.529 N/A TYR 495.A OH THR 301.A OG1 no hydrogen 2.661 N/A PHE 496.A N ASP 501.A OD2 no hydrogen 2.966 N/A GLY 497.A N ASP 501.A OD2 no hydrogen 2.756 N/A ILE 502.A N ASP 498.A O no hydrogen 3.225 N/A ILE 503.A N ILE 499.A O no hydrogen 2.845 N/A LEU 504.A N TRP 500.A O no hydrogen 3.159 N/A LYS 505.A N ASP 501.A O no hydrogen 2.884 N/A LYS 505.A NZ TYR 492.A O no hydrogen 3.386 N/A LYS 506.A N ILE 502.A O no hydrogen 3.259 N/A ALA 507.A N ILE 503.A O no hydrogen 2.810 N/A MET 508.A N LEU 504.A O no hydrogen 2.923 N/A LYS 509.A N LYS 506.A O no hydrogen 2.939 N/A LYS 509.A NZ GLU 490.A OE1 no hydrogen 2.279 N/A LYS 509.A NZ GLU 490.A OE2 no hydrogen 2.547 N/A SER 511.A N ASP 486.A OD1 no hydrogen 3.023 N/A SER 511.A OG MET 508.A O no hydrogen 2.661 N/A SER 511.A OG LYS 509.A O no hydrogen 3.077 N/A GLY 513.A N VAL 481.A O no hydrogen 2.747 N/A LEU 514.A N SER 511.A O no hydrogen 3.007 N/A VAL 516.A N THR 479.A O no hydrogen 2.894 N/A VAL 518.A N VAL 476.A O no hydrogen 3.068 N/A GLN 519.A N THR 441.A O no hydrogen 2.891 N/A GLN 519.A NE2 TYR 462.A O no hydrogen 2.795 N/A CYS 520.A N GLY 474.A O no hydrogen 2.723 N/A VAL 521.A N LEU 439.A O no hydrogen 2.956 N/A ALA 522.A N PRO 472.A O no hydrogen 3.162 N/A TRP 525.A N THR 226.A OG1 no hydrogen 3.044 N/A GLN 526.A N LEU 523.A O no hydrogen 3.237 N/A GLU 527.A N GLU 527.A OE1 no hydrogen 2.674 N/A CYS 530.A N GLN 526.A O no hydrogen 3.099 N/A CYS 530.A SG PRO 472.A O no hydrogen 3.400 N/A CYS 530.A SG CYS 520.A O no hydrogen 3.433 N/A LEU 531.A N GLU 527.A O no hydrogen 2.952 N/A ARG 532.A N GLU 528.A O no hydrogen 3.138 N/A ARG 532.A NH1 ARG 292.A O no hydrogen 2.519 N/A ARG 532.A NH2 GLU 536.A OE1 no hydrogen 3.387 N/A PHE 533.A N LEU 529.A O no hydrogen 2.987 N/A MET 534.A N CYS 530.A O no hydrogen 2.926 N/A ARG 535.A N LEU 531.A O no hydrogen 2.728 N/A ARG 535.A NH1 TYR 288.A O no hydrogen 3.169 N/A ARG 535.A NH1 SER 290.A O no hydrogen 3.157 N/A GLU 536.A N ARG 532.A O no hydrogen 3.036 N/A VAL 537.A N PHE 533.A O no hydrogen 3.021 N/A GLU 538.A N MET 534.A O no hydrogen 2.871 N/A GLN 539.A N ARG 535.A O no hydrogen 3.006 N/A LEU 540.A N GLU 536.A O no hydrogen 3.051 N/A MET 541.A N VAL 537.A O no hydrogen 3.066 N/A THR 542.A N GLU 538.A O no hydrogen 3.302 N/A THR 542.A OG1 GLN 539.A O no hydrogen 3.094 N/A