Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3sgh_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): SER 3.A OG ASN 4.A OD1 no hydrogen 3.190 N/A ASN 4.A N PRO 1.A O no hydrogen 2.912 N/A LEU 5.A N ALA 2.A O no hydrogen 2.873 N/A LEU 6.A N SER 3.A O no hydrogen 3.192 N/A SER 7.A N ASN 4.A O no hydrogen 3.281 N/A THR 8.A OG1.B LEU 5.A O no hydrogen 3.555 N/A ASN 10.A N THR 8.A O no hydrogen 3.075 N/A ASN 10.A ND2 THR 8.A O no hydrogen 2.968 N/A TYR 12.A N PHE 9.A O no hydrogen 3.128 N/A TYR 12.A OH THR 90.A OG1 no hydrogen 2.798 N/A CYS 14.A N ASN 10.A O no hydrogen 2.899 N/A CYS 14.A SG ASN 10.A O no hydrogen 3.515 N/A GLN 16.A NE2 ASN 18.A OD1 no hydrogen 3.113 N/A ASN 18.A N GLN 16.A OE1 no hydrogen 2.847 N/A ALA 19.A N GLN 16.A OE1 no hydrogen 3.032 N/A CYS 20.A N GLN 16.A O no hydrogen 2.733 N/A CYS 20.A SG GLN 290.A OE1 no hydrogen 3.732 N/A GLN 21.A N GLN 17.A O no hydrogen 3.040 N/A GLN 21.A NE2 GLU 225.A OE1 no hydrogen 2.835 N/A GLU 22.A N ASN 18.A O no hydrogen 2.872 N/A ILE 23.A N ALA 19.A O no hydrogen 2.907 N/A ASN 24.A N CYS 20.A O no hydrogen 2.717 N/A ASN 24.A ND2 ALA 13.A O no hydrogen 3.041 N/A CYS 25.A N GLN 21.A O no hydrogen 2.976 N/A CYS 25.A SG CYS 20.A O no hydrogen 3.664 N/A TRP 26.A NE1 SER 59.A OG no hydrogen 2.857 N/A SER 28.A OG.A VAL 33.A O no hydrogen 2.948 N/A SER 28.A OG.B SER 263.A OG no hydrogen 3.309 N/A PHE 29.A N TRP 26.A O no hydrogen 2.902 N/A SER 30.A N ALA 27.A O no hydrogen 2.881 N/A SER 30.A OG PRO 396.A O no hydrogen 2.656 N/A GLY 31.A N SER 28.A O no hydrogen 2.991 N/A GLN 32.A NE2 CYS 392.A O no hydrogen 3.037 N/A THR 34.A N ARG 227.A O no hydrogen 2.864 N/A THR 34.A OG1 VAL 261.A O no hydrogen 2.768 N/A THR 36.A N.A GLU 225.A O no hydrogen 2.988 N/A THR 36.A N.B GLU 225.A O no hydrogen 2.945 N/A ASN 38.A ND2 PRO 269.A O no hydrogen 2.894 N/A ASN 38.A ND2 GLU 270.A OE2 no hydrogen 3.404 N/A PHE 41.A N ASN 38.A O no hydrogen 2.806 N/A GLY 42.A N ASN 38.A OD1 no hydrogen 3.028 N/A LYS 43.A NZ ALA 266.A O no hydrogen 2.818 N/A LYS 43.A NZ GLU 415.A OE2 no hydrogen 3.228 N/A ASN 44.A N PHE 41.A O no hydrogen 3.131 N/A TYR 48.A N ILE 45.A O no hydrogen 3.194 N/A TYR 48.A OH SER 265.A O no hydrogen 2.621 N/A TYR 49.A N PHE 46.A O no hydrogen 2.788 N/A ASN 50.A N ILE 45.A O no hydrogen 3.080 N/A ASN 50.A ND2 ASN 44.A OD1 no hydrogen 2.709 N/A HIS 55.A N SER 52.A OG no hydrogen 3.042 N/A ASN 56.A N SER 52.A O no hydrogen 2.813 N/A ASN 56.A ND2 ASP 57.A OD1 no hydrogen 2.871 N/A ASN 56.A ND2 ARG 430.A O no hydrogen 2.951 N/A ASP 57.A N GLU 53.A O no hydrogen 2.846 N/A SER 58.A N HIS 55.A O no hydrogen 3.265 N/A SER 58.A OG GLY 54.A O no hydrogen 2.908 N/A SER 58.A OG HIS 55.A O no hydrogen 3.549 N/A GLY 61.A N ASP 57.A O no hydrogen 3.376 N/A ARG 62.A N SER 58.A O no hydrogen 2.892 N/A ARG 62.A NE GLU 22.A OE1 no hydrogen 2.904 N/A ARG 62.A NH1 TYR 66.A OH no hydrogen 3.544 N/A ARG 62.A NH2 GLU 22.A OE1 no hydrogen 3.349 N/A ARG 62.A NH2 GLU 22.A OE2 no hydrogen 3.129 N/A LEU 63.A N SER 59.A O no hydrogen 2.921 N/A TYR 64.A N TRP 60.A O no hydrogen 2.900 N/A TYR 64.A OH PRO 105.A O no hydrogen 3.374 N/A GLY 65.A N GLY 61.A O no hydrogen 2.946 N/A TYR 66.A N ARG 62.A O no hydrogen 3.160 N/A ILE 67.A N LEU 63.A O no hydrogen 3.131 N/A TYR 68.A N TYR 64.A O no hydrogen 2.959 N/A PHE 71.A N ILE 67.A O no hydrogen 2.886 N/A LEU 73.A N PRO 69.A O no hydrogen 3.086 N/A VAL 74.A N SER 70.A O no hydrogen 2.884 N/A GLU 75.A N PHE 71.A O no hydrogen 2.870 N/A ASN 76.A N PHE 72.A O no hydrogen 2.911 N/A SER 77.A N LEU 73.A O no hydrogen 3.017 N/A THR 78.A N VAL 74.A O no hydrogen 2.904 N/A THR 78.A OG1 VAL 74.A O no hydrogen 2.718 N/A THR 78.A OG1 GLU 75.A O no hydrogen 3.430 N/A GLU 79.A N ASN 76.A O no hydrogen 3.273 N/A LYS 80.A N GLU 75.A O no hydrogen 3.182 N/A LYS 81.A N THR 78.A O no hydrogen 3.213 N/A LYS 81.A NZ GLU 79.A O no hydrogen 2.807 N/A TYR 85.A OH GLU 75.A OE2 no hydrogen 2.740 N/A ALA 86.A N GLY 82.A O no hydrogen 3.006 N/A GLN 88.A N TYR 85.A O no hydrogen 2.912 N/A LEU 89.A N ALA 86.A O no hydrogen 2.888 N/A THR 90.A OG1 TYR 12.A OH no hydrogen 2.798 N/A ARG 91.A N ALA 87.A O no hydrogen 2.966 N/A ARG 91.A NE TYR 68.A OH no hydrogen 2.841 N/A ARG 91.A NH2 TYR 68.A OH no hydrogen 3.231 N/A ARG 91.A NH2 TYR 106.A O no hydrogen 3.149 N/A VAL 92.A N GLN 88.A O no hydrogen 2.894 N/A TYR 93.A N LEU 89.A O no hydrogen 2.877 N/A GLY 94.A N THR 90.A O no hydrogen 3.059 N/A GLN 95.A NE2 TYR 93.A O no hydrogen 2.885 N/A LEU 96.A N TYR 93.A O no hydrogen 3.392 N/A LEU 97.A N GLY 94.A O no hydrogen 3.124 N/A SER 99.A N GLN 95.A O no hydrogen 2.980 N/A SER 99.A OG GLN 95.A O no hydrogen 2.812 N/A LEU 100.A N LEU 96.A O no hydrogen 3.052 N/A LEU 100.A N LEU 97.A O no hydrogen 3.063 N/A GLN 101.A N LEU 97.A O no hydrogen 2.924 N/A GLN 101.A NE2 PRO 103.A O no hydrogen 2.922 N/A GLY 102.A N ALA 98.A O no hydrogen 2.939 N/A TYR 106.A OH ASP 129.A OD2 no hydrogen 2.699 N/A THR 107.A N ASP 118.A OD2 no hydrogen 2.880 N/A THR 107.A OG1 ASP 118.A OD1 no hydrogen 2.529 N/A THR 107.A OG1 ASP 118.A OD2 no hydrogen 3.211 N/A GLN 108.A NE2.A THR 107.A OG1 no hydrogen 3.005 N/A GLU 112.A N LYS 109.A O no hydrogen 3.072 N/A ALA 115.A N THR 113.A O no hydrogen 2.791 N/A TYR 117.A OH GLU 435.A OE1 no hydrogen 2.545 N/A ASP 118.A N ILE 104.A O no hydrogen 2.926 N/A GLN 121.A NE2 GLU 181.A OE2 no hydrogen 2.853 N/A THR 122.A N ASN 119.A OD1 no hydrogen 2.934 N/A THR 122.A OG1 ASN 119.A OD1 no hydrogen 2.824 N/A VAL 123.A N ASN 119.A O no hydrogen 3.003 N/A TRP 124.A N GLU 120.A O no hydrogen 2.976 N/A HIS 125.A N GLN 121.A O no hydrogen 3.005 N/A HIS 125.A NE2 GLU 181.A OE1 no hydrogen 2.635 N/A ALA 126.A N THR 122.A O no hydrogen 2.854 N/A ASP 128.A N HIS 125.A O no hydrogen 2.945 N/A ASP 129.A N ALA 126.A O no hydrogen 3.017 N/A ASP 131.A N PHE 127.A O no hydrogen 2.818 N/A ASN 132.A N ASP 128.A O no hydrogen 3.158 N/A ASN 132.A ND2 GLN 88.A OE1 no hydrogen 2.717 N/A ALA 133.A N ASP 129.A O no hydrogen 2.994 N/A ILE 134.A N LEU 130.A O no hydrogen 2.901 N/A THR 135.A N ASP 131.A O no hydrogen 2.978 N/A THR 135.A OG1 ASP 131.A O no hydrogen 3.032 N/A ILE 136.A N ASN 132.A O no hydrogen 3.262 N/A LEU 137.A N ALA 133.A O no hydrogen 2.853 N/A LYS 138.A N ILE 134.A O no hydrogen 2.923 N/A SER 139.A N THR 135.A O no hydrogen 3.370 N/A ALA 140.A N ILE 136.A O no hydrogen 3.028 N/A ALA 141.A N LEU 137.A O no hydrogen 2.858 N/A THR 142.A N SER 139.A O no hydrogen 3.191 N/A THR 142.A OG1 SER 139.A O no hydrogen 2.709 N/A PHE 143.A N ALA 140.A O no hydrogen 3.083 N/A GLY 144.A N ALA 141.A O no hydrogen 3.230 N/A ASN 146.A N GLY 158.A O no hydrogen 2.943 N/A GLN 147.A NE2 VAL 145.A O no hydrogen 3.008 N/A LEU 149.A N ASN 146.A OD1 no hydrogen 3.022 N/A ALA 150.A N ASN 146.A O no hydrogen 2.990 N/A VAL 152.A N LEU 149.A O no hydrogen 3.167 N/A GLN 154.A N GLN 154.A OE1 no hydrogen 2.882 N/A GLN 154.A NE2 ASP 206.A OD1 no hydrogen 2.922 N/A PHE 155.A N ASP 153.A OD1 no hydrogen 2.918 N/A TYR 156.A N ASP 153.A OD1 no hydrogen 2.997 N/A TYR 156.A OH ASP 202.A O no hydrogen 2.647 N/A LYS 157.A N ASP 153.A O no hydrogen 2.944 N/A GLY 158.A N ASP 153.A OD2 no hydrogen 2.743 N/A ASP 159.A N TYR 156.A O no hydrogen 3.037 N/A CYS 160.A SG GLY 158.A O no hydrogen 3.824 N/A SER 161.A N ASP 159.A OD1 no hydrogen 2.886 N/A SER 161.A OG.B ASP 159.A OD1 no hydrogen 2.305 N/A SER 161.A OG.B ASP 159.A OD2 no hydrogen 3.371 N/A LYS 162.A N ASP 159.A O no hydrogen 3.093 N/A LYS 162.A N ASP 159.A OD1 no hydrogen 3.392 N/A LYS 162.A NZ GLY 201.A O no hydrogen 3.023 N/A TRP 163.A N ASP 159.A O no hydrogen 3.203 N/A TRP 163.A NE1 ASP 153.A OD2 no hydrogen 2.818 N/A LEU 164.A N CYS 160.A O no hydrogen 2.875 N/A LYS 165.A N SER 161.A O no hydrogen 3.288 N/A LYS 165.A NZ ASP 202.A OD1 no hydrogen 2.917 N/A PHE 166.A N LYS 162.A O no hydrogen 2.938 N/A ALA 167.A N TRP 163.A O no hydrogen 2.762 N/A ASN 168.A N LEU 164.A O no hydrogen 2.966 N/A ASN 168.A ND2 LEU 164.A O no hydrogen 3.150 N/A ASN 168.A ND2 GLY 196.A O no hydrogen 3.600 N/A THR 169.A N LYS 165.A O no hydrogen 2.897 N/A THR 169.A OG1 LYS 165.A O no hydrogen 2.752 N/A LEU 170.A N PHE 166.A O no hydrogen 2.868 N/A LYS 171.A N ALA 167.A O no hydrogen 2.900 N/A LYS 171.A NZ ASP 131.A OD1 no hydrogen 2.578 N/A LYS 171.A NZ GLU 191.A OE1 no hydrogen 2.877 N/A LEU 172.A N ASN 168.A O no hydrogen 2.868 N/A ARG 173.A N THR 169.A O no hydrogen 2.808 N/A ARG 173.A NE GLU 296.A OE2 no hydrogen 2.812 N/A ARG 173.A NH1 TYR 93.A OH no hydrogen 3.077 N/A ARG 173.A NH2 GLU 296.A OE1 no hydrogen 2.837 N/A ARG 173.A NH2 GLU 296.A OE2 no hydrogen 3.491 N/A ILE 175.A N LEU 172.A O no hydrogen 2.939 N/A ARG 176.A N ARG 173.A O no hydrogen 2.937 N/A ARG 176.A NH1 SER 99.A OG no hydrogen 2.893 N/A SER 178.A N ILE 175.A O no hydrogen 3.123 N/A SER 178.A OG ILE 175.A O no hydrogen 2.604 N/A GLU 181.A N ILE 177.A O no hydrogen 2.831 N/A ALA 185.A N GLU 181.A O no hydrogen 2.866 N/A GLN 186.A N PRO 182.A O no hydrogen 3.065 N/A GLN 186.A NE2 GLN 190.A OE1 no hydrogen 2.898 N/A THR 187.A N GLU 183.A O no hydrogen 3.101 N/A THR 187.A OG1 GLU 183.A O no hydrogen 3.308 N/A LYS 188.A N TYR 184.A O no hydrogen 3.090 N/A ALA 189.A N ALA 185.A O no hydrogen 2.846 N/A GLN 190.A N GLN 186.A O no hydrogen 2.903 N/A GLU 191.A N THR 187.A O no hydrogen 3.054 N/A ALA 192.A N LYS 188.A O no hydrogen 2.879 N/A VAL 193.A N ALA 189.A O no hydrogen 2.902 N/A LEU 194.A N GLN 190.A O no hydrogen 3.029 N/A GLY 195.A N GLU 191.A O no hydrogen 2.818 N/A GLY 196.A N ALA 192.A O no hydrogen 2.995 N/A SER 199.A N ASP 202.A OD2 no hydrogen 3.087 N/A SER 199.A OG.A ASP 202.A OD2 no hydrogen 3.479 N/A ASP 202.A N SER 199.A O no hydrogen 2.846 N/A SER 203.A N VAL 200.A O no hydrogen 3.175 N/A SER 203.A OG VAL 200.A O no hydrogen 3.364 N/A SER 203.A OG GLU 328.A OE1 no hydrogen 2.716 N/A SER 203.A OG GLU 328.A OE2 no hydrogen 3.471 N/A TYR 205.A OH GLU 328.A OE2 no hydrogen 2.526 N/A ASP 206.A N GLN 290.A O no hydrogen 2.815 N/A THR 207.A OG1 GLN 154.A O no hydrogen 2.605 N/A ASN 209.A N ASP 206.A O no hydrogen 2.929 N/A ASN 209.A ND2 LEU 288.A O no hydrogen 2.968 N/A GLY 210.A N ASP 206.A OD1 no hydrogen 2.946 N/A GLY 211.A N THR 208.A OG1 no hydrogen 3.284 N/A ILE 212.A N ASN 209.A O no hydrogen 3.034 N/A ASN 213.A N THR 208.A O no hydrogen 2.825 N/A ASN 213.A ND2 GLY 211.A O no hydrogen 3.302 N/A ASN 215.A N LYS 286.A O no hydrogen 2.787 N/A ASN 215.A ND2 ILE 282.A O no hydrogen 3.173 N/A ASN 215.A ND2 ASP 285.A O no hydrogen 3.301 N/A ASN 215.A ND2 LEU 288.A O no hydrogen 2.974 N/A GLY 216.A N GLN 290.A OE1 no hydrogen 2.799 N/A ALA 218.A N ASN 215.A OD1 no hydrogen 2.786 N/A VAL 220.A N GLY 216.A O no hydrogen 2.932 N/A SER 221.A N TYR 217.A O no hydrogen 2.753 N/A GLY 222.A N ALA 218.A O no hydrogen 2.999 N/A TRP 223.A N ILE 219.A O no hydrogen 3.276 N/A TRP 223.A N VAL 220.A O no hydrogen 3.208 N/A GLU 225.A N VAL 220.A O no hydrogen 2.925 N/A ARG 227.A N THR 34.A O no hydrogen 2.946 N/A ARG 227.A NE ALA 275.A O no hydrogen 3.107 N/A ARG 227.A NH1 SER 221.A O no hydrogen 2.881 N/A ARG 227.A NH1 VAL 226.A O no hydrogen 2.871 N/A ARG 227.A NH2 ALA 275.A O no hydrogen 2.891 N/A ALA 228.A N SER 278.A O no hydrogen 2.908 N/A ASN 229.A N GLN 32.A O no hydrogen 2.975 N/A ASN 229.A ND2 VAL 33.A O no hydrogen 2.967 N/A ALA 230.A N VAL 261.A O no hydrogen 2.932 N/A CYS 231.A N ASN 229.A OD1 no hydrogen 2.819 N/A LEU 232.A N GLY 31.A O no hydrogen 2.954 N/A VAL 233.A N ASN 229.A O no hydrogen 3.256 N/A SER 234.A N ALA 230.A O no hydrogen 2.928 N/A SER 234.A OG ALA 230.A O no hydrogen 2.754 N/A TYR 235.A N CYS 231.A O no hydrogen 3.032 N/A ASN 236.A ND2 TYR 258.A O no hydrogen 2.935 N/A GLY 237.A N SER 234.A O no hydrogen 3.084 N/A TYR 238.A N TYR 235.A O no hydrogen 3.143 N/A TYR 238.A OH ILE 367.A O no hydrogen 2.655 N/A ASN 239.A N ASN 236.A O no hydrogen 3.086 N/A ARG 242.A N ASP 240.A OD1 no hydrogen 2.923 N/A ARG 242.A NE ASP 240.A OD1 no hydrogen 2.911 N/A ARG 242.A NH1 SER 325.A OG no hydrogen 2.764 N/A ARG 242.A NH2 ASP 240.A OD1 no hydrogen 3.528 N/A ARG 242.A NH2 ASP 240.A OD2 no hydrogen 2.853 N/A ARG 242.A NH2 GLN 387.A OE1 no hydrogen 3.169 N/A ARG 243.A N ASP 240.A O no hydrogen 3.037 N/A ARG 243.A NE ASP 240.A O no hydrogen 2.972 N/A ARG 243.A NH1 ASN 236.A OD1 no hydrogen 2.934 N/A ALA 245.A N ARG 242.A O no hydrogen 2.931 N/A TYR 246.A N ARG 243.A O no hydrogen 3.003 N/A TYR 246.A OH ILE 390.A O no hydrogen 2.701 N/A PHE 247.A N ARG 243.A O no hydrogen 2.911 N/A THR 248.A N LYS 279.A O no hydrogen 3.054 N/A GLN 250.A N GLY 257.A O no hydrogen 2.893 N/A GLN 250.A NE2 THR 253.A O no hydrogen 3.591 N/A GLN 250.A NE2 THR 253.A OG1 no hydrogen 3.043 N/A GLN 250.A NE2 GLY 256.A O no hydrogen 2.942 N/A THR 251.A N ASN 276.A O no hydrogen 2.826 N/A THR 253.A N GLN 250.A OE1 no hydrogen 3.012 N/A ALA 255.A N THR 253.A OG1 no hydrogen 3.195 N/A VAL 259.A N SER 278.A OG no hydrogen 3.063 N/A VAL 261.A N ALA 228.A O no hydrogen 2.808 N/A ARG 262.A NE PRO 412.A O no hydrogen 3.430 N/A ARG 262.A NH1 ASN 359.A O no hydrogen 3.007 N/A ARG 262.A NH2 PRO 412.A O no hydrogen 2.853 N/A SER 265.A OG GLU 267.A O no hydrogen 2.666 N/A ALA 266.A N ASN 359.A OD1 no hydrogen 2.744 N/A GLU 267.A N GLU 267.A OE1 no hydrogen 2.774 N/A TYR 274.A OH GLU 267.A OE2 no hydrogen 2.462 N/A ALA 275.A N THR 272.A O no hydrogen 3.378 N/A ASN 276.A ND2 GLN 252.A OE1 no hydrogen 3.061 N/A TYR 277.A N TYR 274.A O no hydrogen 3.206 N/A TYR 277.A OH ASP 350.A OD1 no hydrogen 2.585 N/A SER 278.A N VAL 259.A O no hydrogen 2.993 N/A SER 278.A OG THR 248.A O no hydrogen 2.673 N/A SER 278.A OG VAL 259.A O no hydrogen 3.401 N/A LYS 279.A N THR 248.A OG1 no hydrogen 2.971 N/A PHE 281.A N TYR 246.A O no hydrogen 2.873 N/A ALA 283.A N LEU 280.A O no hydrogen 3.031 N/A THR 284.A N PHE 281.A O no hydrogen 2.850 N/A THR 284.A OG1 PHE 281.A O no hydrogen 2.596 N/A THR 287.A N ASP 285.A OD1 no hydrogen 3.102 N/A THR 287.A OG1 ASP 285.A OD1 no hydrogen 2.697 N/A THR 287.A OG1 ASP 285.A OD2 no hydrogen 3.503 N/A LEU 288.A N ASP 285.A O no hydrogen 3.018 N/A GLN 290.A N ASN 209.A OD1 no hydrogen 2.984 N/A GLN 290.A NE2 CYS 14.A O no hydrogen 3.246 N/A VAL 292.A N SER 204.A O no hydrogen 2.762 N/A TYR 293.A OH TYR 393.A O no hydrogen 2.545 N/A ALA 294.A N SER 203.A OG no hydrogen 2.881 N/A GLU 296.A N TYR 293.A O no hydrogen 2.970 N/A ALA 297.A N ALA 294.A O no hydrogen 3.069 N/A PHE 299.A N ALA 295.A O no hydrogen 3.048 N/A LEU 300.A N GLU 296.A O no hydrogen 2.839 N/A ARG 301.A N ALA 297.A O no hydrogen 3.188 N/A ARG 301.A NE ALA 297.A O no hydrogen 3.045 N/A ARG 301.A NH1 GLU 198.A OE1 no hydrogen 3.435 N/A ARG 301.A NH1 GLU 198.A OE2 no hydrogen 2.797 N/A ARG 301.A NH2 GLU 198.A OE1 no hydrogen 2.951 N/A ALA 302.A N ALA 298.A O no hydrogen 2.879 N/A GLU 303.A N PHE 299.A O no hydrogen 3.118 N/A GLY 304.A N LEU 300.A O no hydrogen 2.911 N/A ALA 305.A N ARG 301.A O no hydrogen 2.823 N/A LEU 306.A N ALA 302.A O no hydrogen 3.034 N/A LYS 307.A N GLU 303.A O no hydrogen 3.057 N/A LYS 307.A N GLY 304.A O no hydrogen 3.062 N/A LYS 307.A NZ SER 178.A OG no hydrogen 3.184 N/A GLY 308.A N ALA 305.A O no hydrogen 2.986 N/A TRP 309.A N GLY 304.A O no hydrogen 3.012 N/A ASN 310.A N GLN 190.A OE1 no hydrogen 2.887 N/A THR 316.A N ASP 313.A OD1 no hydrogen 2.880 N/A THR 316.A OG1 ASP 313.A OD1 no hydrogen 2.633 N/A PHE 317.A N ASP 313.A O no hydrogen 3.146 N/A TYR 318.A N ALA 314.A O no hydrogen 2.800 N/A TYR 318.A OH ILE 369.A O no hydrogen 2.559 N/A GLU 319.A N LYS 315.A O no hydrogen 2.977 N/A LYS 320.A N THR 316.A O no hydrogen 2.954 N/A LYS 320.A NZ GLU 198.A O no hydrogen 2.977 N/A LYS 320.A NZ GLU 198.A OE1 no hydrogen 3.316 N/A GLY 321.A N PHE 317.A O no hydrogen 2.826 N/A VAL 322.A N TYR 318.A O no hydrogen 3.009 N/A ARG 323.A N GLU 319.A O no hydrogen 2.957 N/A ARG 323.A NH1 ASP 335.A OD1 no hydrogen 2.438 N/A ARG 323.A NH2 ASP 335.A OD1 no hydrogen 2.801 N/A LEU 324.A N LYS 320.A O no hydrogen 2.826 N/A SER 325.A N GLY 321.A O no hydrogen 2.985 N/A PHE 326.A N VAL 322.A O no hydrogen 3.081 N/A GLU 327.A N ARG 323.A O no hydrogen 2.899 N/A GLU 328.A N LEU 324.A O no hydrogen 2.746 N/A PHE 329.A N SER 325.A O no hydrogen 3.323 N/A PHE 329.A N PHE 326.A O no hydrogen 3.186 N/A GLY 330.A N GLU 327.A O no hydrogen 3.059 N/A VAL 331.A N PHE 326.A O no hydrogen 2.952 N/A TYR 337.A N GLY 333.A O no hydrogen 3.026 N/A LEU 338.A N ALA 334.A O no hydrogen 2.822 N/A ALA 339.A N ASP 336.A O no hydrogen 3.168 N/A ASP 340.A N TYR 337.A O no hydrogen 3.077 N/A THR 342.A N ASP 340.A OD1 no hydrogen 2.878 N/A THR 342.A OG1 ASP 340.A OD1 no hydrogen 3.434 N/A SER 343.A N ASP 340.A OD1 no hydrogen 2.859 N/A SER 343.A OG ASP 340.A OD1 no hydrogen 3.329 N/A SER 343.A OG ASP 340.A OD2 no hydrogen 2.649 N/A GLY 346.A N SER 234.A O no hydrogen 2.933 N/A TYR 348.A N TYR 361.A O no hydrogen 2.860 N/A TYR 348.A OH GLY 260.A O no hydrogen 2.727 N/A ASP 350.A N ASN 360.A OD1 no hydrogen 2.842 N/A HIS 356.A ND1 ASP 350.A OD2 no hydrogen 2.770 N/A ASN 359.A N HIS 356.A O no hydrogen 2.882 N/A ASN 359.A ND2 GLU 267.A OE1 no hydrogen 3.109 N/A ASN 359.A ND2 ASP 350.A OD2 no hydrogen 3.184 N/A ASN 360.A N THR 357.A O no hydrogen 3.052 N/A TYR 361.A N TYR 348.A O no hydrogen 2.982 N/A ASN 363.A N ASN 347.A OD1 no hydrogen 2.879 N/A ASN 363.A ND2 GLY 346.A O no hydrogen 2.934 N/A SER 365.A N ASN 363.A OD1 no hydrogen 2.897 N/A SER 365.A OG GLU 382.A OE2 no hydrogen 2.608 N/A ILE 367.A N SER 365.A OG no hydrogen 3.322 N/A LYS 370.A N ASP 340.A O no hydrogen 2.955 N/A TRP 371.A NE1 ASP 373.A OD1 no hydrogen 3.073 N/A ALA 375.A N GLU 372.A O no hydrogen 3.203 N/A LYS 379.A N ASP 376.A OD1 no hydrogen 2.993 N/A LYS 380.A N ASP 376.A O no hydrogen 2.947 N/A LYS 380.A NZ ASP 373.A O no hydrogen 3.058 N/A LEU 381.A N ASP 377.A O no hydrogen 2.939 N/A GLU 382.A N ALA 378.A O no hydrogen 2.973 N/A ARG 383.A N LYS 379.A O no hydrogen 2.888 N/A ARG 383.A NE THR 368.A O no hydrogen 2.859 N/A ARG 383.A NH2 THR 368.A O no hydrogen 3.246 N/A ARG 383.A NH2 THR 368.A OG1 no hydrogen 2.974 N/A VAL 384.A N LYS 380.A O no hydrogen 3.039 N/A LEU 385.A N LEU 381.A O no hydrogen 2.888 N/A THR 386.A N GLU 382.A O no hydrogen 2.805 N/A THR 386.A OG1 GLU 382.A O no hydrogen 2.680 N/A GLN 387.A N ARG 383.A O no hydrogen 3.182 N/A GLN 387.A NE2 TYR 337.A OH no hydrogen 2.955 N/A LYS 388.A N VAL 384.A O no hydrogen 2.865 N/A LYS 388.A NZ ASP 401.A OD1 no hydrogen 3.540 N/A LYS 388.A NZ ASP 401.A OD2 no hydrogen 2.900 N/A TRP 389.A N LEU 385.A O no hydrogen 2.926 N/A TRP 389.A NE1 SER 30.A O no hydrogen 2.735 N/A ILE 390.A N THR 386.A O no hydrogen 3.000 N/A ALA 391.A N GLN 387.A O no hydrogen 2.903 N/A CYS 392.A N LYS 388.A O no hydrogen 2.880 N/A CYS 392.A SG LYS 388.A O no hydrogen 3.407 N/A TYR 393.A OH TYR 246.A O no hydrogen 2.661 N/A ASP 395.A N GLN 32.A OE1 no hydrogen 2.849 N/A TRP 399.A N SER 30.A OG no hydrogen 2.902 N/A TRP 399.A NE1 GLN 426.A O no hydrogen 3.087 N/A ASP 401.A N ASN 397.A O no hydrogen 2.910 N/A PHE 402.A N GLY 398.A O no hydrogen 2.876 N/A ARG 403.A N TRP 399.A O no hydrogen 2.966 N/A ARG 403.A NE TRP 399.A O no hydrogen 3.285 N/A ARG 403.A NH1 SER 99.A O no hydrogen 3.063 N/A ARG 403.A NH1 ARG 427.A O no hydrogen 2.892 N/A ARG 403.A NH2 SER 99.A O no hydrogen 2.910 N/A ARG 404.A N ALA 400.A O no hydrogen 2.924 N/A ARG 404.A NH1 GLU 303.A OE1 no hydrogen 3.557 N/A ARG 404.A NH1 GLU 303.A OE2 no hydrogen 2.785 N/A ARG 404.A NH2 GLU 303.A OE1 no hydrogen 2.902 N/A ARG 404.A NH2 GLU 303.A OE2 no hydrogen 3.562 N/A ARG 404.A NH2 ASP 401.A OD1 no hydrogen 3.046 N/A THR 405.A N ASP 401.A O no hydrogen 2.817 N/A THR 405.A OG1 ASP 401.A O no hydrogen 2.784 N/A GLY 406.A N PHE 402.A O no hydrogen 2.862 N/A TYR 407.A N THR 405.A OG1 no hydrogen 2.981 N/A ARG 409.A NE GLU 382.A OE2 no hydrogen 2.909 N/A ARG 409.A NH2 GLU 382.A OE1 no hydrogen 3.007 N/A ILE 410.A N PRO 408.A O no hydrogen 2.921 N/A ALA 413.A N TYR 49.A OH no hydrogen 2.958 N/A THR 414.A N GLY 264.A O no hydrogen 2.906 N/A THR 414.A OG1 GLY 264.A O no hydrogen 2.668 N/A SER 416.A OG ASN 417.A O no hydrogen 2.860 N/A SER 416.A OG CYS 420.A O no hydrogen 2.807 N/A ASN 417.A ND2 ASN 50.A OD1 no hydrogen 3.091 N/A ASP 419.A N ASN 417.A OD1 no hydrogen 2.837 N/A CYS 420.A N ASN 417.A O no hydrogen 3.197 N/A CYS 420.A SG ASN 417.A OD1 no hydrogen 3.684 N/A ARG 424.A N ASN 421.A OD1 no hydrogen 2.867 N/A ARG 424.A NH1 ASP 459.A OD2 no hydrogen 3.190 N/A ARG 424.A NH2 ASP 459.A OD2 no hydrogen 2.775 N/A GLY 425.A N ASN 421.A O no hydrogen 2.810 N/A GLN 426.A NE2 ARG 428.A O no hydrogen 2.908 N/A ARG 427.A N ASN 456.A O no hydrogen 2.798 N/A ARG 427.A NE ASP 459.A OD1 no hydrogen 2.736 N/A ARG 427.A NH1 ARG 424.A O no hydrogen 2.811 N/A ARG 427.A NH2 ARG 403.A O no hydrogen 3.256 N/A ARG 427.A NH2 ASP 459.A OD1 no hydrogen 3.087 N/A ARG 428.A N ASN 456.A O no hydrogen 3.277 N/A ARG 428.A NE GLN 101.A O no hydrogen 3.027 N/A ARG 428.A NH1 ASP 454.A OD1 no hydrogen 2.764 N/A ARG 428.A NH1 SER 455.A O no hydrogen 3.070 N/A ARG 428.A NH2 GLN 101.A O no hydrogen 2.939 N/A ARG 428.A NH2 ASP 454.A OD1 no hydrogen 3.119 N/A LEU 429.A N LEU 100.A O no hydrogen 2.811 N/A ARG 430.A N ASN 56.A OD1 no hydrogen 3.034 N/A ARG 430.A NE ASN 456.A OD1 no hydrogen 2.940 N/A PHE 431.A N ASP 454.A OD1 no hydrogen 3.076 N/A THR 432.A OG1 SER 434.A OG no hydrogen 3.300 N/A ARG 433.A N ASP 57.A OD2 no hydrogen 2.862 N/A ARG 433.A NE GLU 53.A OE1 no hydrogen 2.553 N/A ARG 433.A NH2 GLU 53.A OE2 no hydrogen 2.799 N/A SER 434.A OG THR 432.A OG1 no hydrogen 3.300 N/A GLU 435.A N THR 432.A O no hydrogen 3.132 N/A GLU 435.A N THR 432.A OG1 no hydrogen 3.178 N/A TYR 436.A N THR 432.A O no hydrogen 3.134 N/A TYR 436.A OH ASP 454.A OD2 no hydrogen 2.559 N/A ASN 437.A N ARG 433.A O no hydrogen 2.945 N/A ASN 438.A N SER 434.A O no hydrogen 2.916 N/A ASN 438.A ND2 SER 434.A O no hydrogen 3.075 N/A ASN 439.A N GLU 435.A O no hydrogen 2.801 N/A ASN 439.A ND2 ALA 115.A O no hydrogen 3.037 N/A ASN 439.A ND2 GLU 435.A OE1 no hydrogen 2.981 N/A LYS 440.A NZ GLU 444.A OE2 no hydrogen 2.824 N/A ASN 442.A ND2 ASN 439.A OD1 no hydrogen 2.977 N/A VAL 443.A N ASN 439.A O no hydrogen 2.981 N/A GLU 444.A N LYS 440.A O no hydrogen 2.980 N/A ALA 445.A N ALA 441.A O no hydrogen 3.115 N/A ALA 446.A N ASN 442.A O no hydrogen 2.963 N/A VAL 447.A N VAL 443.A O no hydrogen 3.141 N/A SER 448.A N ALA 445.A O no hydrogen 3.129 N/A SER 448.A OG.A ALA 445.A O no hydrogen 2.784 N/A SER 450.A OG ASP 459.A O no hydrogen 2.670 N/A GLY 452.A N LEU 449.A O no hydrogen 2.982 N/A LYS 453.A N ASN 451.A OD1 no hydrogen 3.083 N/A LYS 453.A NZ ASP 419.A OD1 no hydrogen 3.438 N/A LYS 453.A NZ ASP 419.A OD2 no hydrogen 2.811 N/A SER 455.A N LYS 453.A O no hydrogen 2.955 N/A SER 455.A OG ASP 419.A OD2 no hydrogen 2.774 N/A ASN 456.A ND2 TYR 49.A O no hydrogen 2.959 N/A GLY 457.A N SER 455.A OG no hydrogen 2.964 N/A THR 458.A N SER 455.A O no hydrogen 3.314 N/A THR 458.A OG1 ASN 451.A OD1 no hydrogen 2.743 N/A THR 458.A OG1 LYS 453.A O no hydrogen 2.874 N/A TRP 461.A N GLU 120.A OE1 no hydrogen 2.879 N/A ALA 463.A N LEU 460.A O no hydrogen 3.033 N/A LYS 464.A NZ LEU 460.A O no hydrogen 3.060 N/A LYS 464.A NZ TRP 461.A O no hydrogen 3.135 N/A LYS 464.A NZ ALA 463.A O no hydrogen 2.798 N/A LYS 464.A NZ TYR 469.A OXT no hydrogen 2.759 N/A GLY 467.A N LYS 464.A O no hydrogen 2.886 N/A THR 468.A N ASN 466.A OD1 no hydrogen 2.999 N/A THR 468.A OG1 ASN 466.A OD1 no hydrogen 2.583 N/A TYR 469.A OH ARG 404.A O no hydrogen 2.603 N/A