Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3vsm_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ASN 1.A ND2 GLY 181.A O no hydrogen 2.729 N/A LEU 5.A N ASN 1.A O no hydrogen 3.071 N/A GLN 6.A N ILE 2.A O no hydrogen 2.928 N/A ASN 7.A N GLN 3.A O no hydrogen 2.760 N/A PHE 8.A N GLU 4.A O no hydrogen 3.105 N/A GLU 9.A N LEU 5.A O no hydrogen 3.090 N/A ARG 10.A N GLN 6.A O no hydrogen 3.024 N/A TRP 11.A N ASN 7.A O no hydrogen 2.928 N/A PHE 12.A N PHE 8.A O no hydrogen 2.719 N/A LYS 13.A N GLU 9.A O no hydrogen 3.021 N/A LYS 13.A NZ ASN 130.A OD1 no hydrogen 2.761 N/A ASN 14.A N ARG 10.A O no hydrogen 2.995 N/A ASN 15.A N TRP 11.A O no hydrogen 3.043 N/A SER 19.A N ASN 15.A O no hydrogen 2.731 N/A SER 19.A OG TYR 238.A OH no hydrogen 3.030 N/A PHE 20.A N LEU 16.A O no hydrogen 2.804 N/A SER 21.A N SER 17.A O no hydrogen 3.075 N/A SER 21.A OG TYR 18.A O no hydrogen 2.616 N/A GLN 22.A N SER 19.A O no hydrogen 2.978 N/A GLN 22.A NE2 ASN 285.A O no hydrogen 3.197 N/A LYS 23.A N PHE 20.A O no hydrogen 3.155 N/A LYS 23.A NZ GLU 120.A OE1 no hydrogen 2.737 N/A LYS 26.A NZ PHE 20.A O no hydrogen 3.049 N/A LYS 26.A NZ LYS 23.A O no hydrogen 2.814 N/A ARG 32.A NH1 ASP 41.A O no hydrogen 3.278 N/A ASN 35.A N VAL 39.A O no hydrogen 2.801 N/A ASN 35.A ND2 ASP 41.A OD1 no hydrogen 2.873 N/A ASN 37.A N ASN 35.A OD1 no hydrogen 2.751 N/A THR 38.A N ASN 35.A OD1 no hydrogen 3.080 N/A THR 38.A OG1 PHE 40.A O no hydrogen 2.628 N/A PHE 40.A N THR 38.A O no hydrogen 2.629 N/A ASP 41.A N ASN 33.A O no hydrogen 2.846 N/A SER 44.A N ASP 51.A OD2 no hydrogen 2.693 N/A TRP 46.A NE1 ASN 37.A O no hydrogen 2.720 N/A THR 47.A N SER 44.A O no hydrogen 3.238 N/A THR 47.A OG1 SER 44.A O no hydrogen 3.418 N/A SER 48.A N SER 44.A O no hydrogen 2.814 N/A ASP 51.A N SER 48.A OG no hydrogen 3.214 N/A PHE 52.A N SER 48.A O no hydrogen 2.973 N/A GLY 53.A N VAL 49.A O no hydrogen 2.801 N/A THR 54.A N PRO 50.A O no hydrogen 3.018 N/A THR 54.A OG1 PRO 50.A O no hydrogen 3.266 N/A VAL 55.A N ASP 51.A O no hydrogen 2.913 N/A CYS 56.A N PHE 52.A O no hydrogen 2.879 N/A CYS 56.A SG PHE 52.A O no hydrogen 3.471 N/A HIS 57.A N GLY 53.A O no hydrogen 2.919 N/A THR 58.A N THR 54.A O no hydrogen 2.868 N/A THR 58.A OG1 THR 54.A O no hydrogen 2.681 N/A LEU 59.A N VAL 55.A O no hydrogen 3.001 N/A ILE 60.A N CYS 56.A O no hydrogen 3.146 N/A GLY 61.A N HIS 57.A O no hydrogen 2.826 N/A TYR 62.A N THR 58.A O no hydrogen 2.858 N/A TYR 62.A OH ARG 32.A O no hydrogen 2.702 N/A CYS 63.A N LEU 59.A O no hydrogen 2.899 N/A CYS 63.A SG LEU 59.A O no hydrogen 3.402 N/A VAL 64.A N ILE 60.A O no hydrogen 3.064 N/A ARG 65.A N GLY 61.A O no hydrogen 3.086 N/A ARG 65.A NE ASP 71.A OD1 no hydrogen 3.384 N/A ARG 65.A NE ASP 71.A OD2 no hydrogen 2.866 N/A ARG 65.A NH1 PRO 30.A O no hydrogen 2.740 N/A ARG 65.A NH2 ASP 71.A OD1 no hydrogen 3.305 N/A TYR 66.A N TYR 62.A O no hydrogen 2.952 N/A ASN 67.A N CYS 63.A O no hydrogen 3.029 N/A ASN 68.A N ARG 65.A O no hydrogen 3.180 N/A SER 70.A N ASN 68.A OD1 no hydrogen 3.381 N/A SER 70.A OG ASN 68.A OD1 no hydrogen 3.563 N/A ASP 71.A N ASN 68.A O no hydrogen 2.847 N/A LEU 73.A N ASP 71.A OD1 no hydrogen 2.732 N/A TYR 74.A N ASP 71.A O no hydrogen 3.163 N/A GLN 75.A N TYR 66.A O no hydrogen 2.877 N/A ASN 76.A N LEU 73.A O no hydrogen 3.135 N/A LEU 79.A N ASN 76.A OD1 no hydrogen 3.045 N/A ALA 80.A N ASN 76.A O no hydrogen 2.989 N/A TYR 81.A N PRO 77.A O no hydrogen 3.010 N/A ASN 82.A N GLU 78.A O no hydrogen 2.888 N/A LEU 83.A N LEU 79.A O no hydrogen 2.834 N/A ILE 84.A N ALA 80.A O no hydrogen 3.135 N/A ASN 85.A N TYR 81.A O no hydrogen 2.827 N/A GLY 86.A N ASN 82.A O no hydrogen 2.857 N/A LEU 87.A N LEU 83.A O no hydrogen 3.049 N/A ARG 88.A N ILE 84.A O no hydrogen 2.935 N/A ARG 88.A NE GLU 137.A OE2 no hydrogen 2.705 N/A ARG 88.A NH2 GLU 137.A OE1 no hydrogen 2.759 N/A ARG 88.A NH2 GLU 137.A OE2 no hydrogen 3.468 N/A ILE 89.A N ASN 85.A O no hydrogen 2.973 N/A ILE 90.A N GLY 86.A O no hydrogen 3.108 N/A CYS 91.A N LEU 87.A O no hydrogen 2.927 N/A CYS 91.A SG LEU 87.A O no hydrogen 3.296 N/A SER 92.A N ARG 88.A O no hydrogen 2.993 N/A SER 92.A OG ILE 89.A O no hydrogen 2.607 N/A LYS 93.A N ILE 90.A O no hydrogen 2.983 N/A LEU 94.A N CYS 91.A O no hydrogen 3.360 N/A GLN 101.A N MET 157.A O no hydrogen 2.696 N/A TRP 105.A NE1 PRO 45.A O no hydrogen 2.812 N/A ASP 110.A N PRO 107.A O no hydrogen 3.268 N/A TYR 112.A OH GLU 25.A OE1 no hydrogen 2.940 N/A TYR 112.A OH GLU 25.A OE2 no hydrogen 2.882 N/A PHE 114.A N TRP 111.A O no hydrogen 3.205 N/A THR 115.A N TRP 111.A O no hydrogen 3.249 N/A THR 115.A OG1 SER 156.A OG no hydrogen 2.695 N/A MET 118.A N HIS 113.A O no hydrogen 2.555 N/A VAL 121.A N THR 117.A O no hydrogen 3.114 N/A PHE 122.A N MET 118.A O no hydrogen 3.162 N/A MET 123.A N PRO 119.A O no hydrogen 3.034 N/A ASN 124.A N GLU 120.A O no hydrogen 2.895 N/A ILE 125.A N VAL 121.A O no hydrogen 2.987 N/A THR 126.A N PHE 122.A O no hydrogen 3.074 N/A THR 126.A OG1 PHE 122.A O no hydrogen 2.758 N/A THR 126.A OG1 THR 142.A OG1 no hydrogen 2.825 N/A ILE 127.A N MET 123.A O no hydrogen 3.028 N/A VAL 128.A N ASN 124.A O no hydrogen 3.023 N/A LEU 129.A N ILE 125.A O no hydrogen 3.205 N/A ASN 130.A N ILE 127.A O no hydrogen 2.960 N/A ASN 130.A ND2 GLU 9.A OE1 no hydrogen 2.934 N/A THR 132.A N LEU 129.A O no hydrogen 3.039 N/A THR 132.A OG1 LEU 129.A O no hydrogen 2.739 N/A HIS 134.A N THR 132.A OG1 no hydrogen 3.053 N/A TYR 135.A N THR 132.A O no hydrogen 3.270 N/A TYR 135.A OH GLU 9.A OE2 no hydrogen 2.650 N/A ALA 138.A N HIS 134.A O no hydrogen 2.982 N/A ALA 139.A N TYR 135.A O no hydrogen 2.771 N/A SER 140.A N ASP 136.A O no hydrogen 2.872 N/A SER 140.A OG ASP 136.A O no hydrogen 2.863 N/A LEU 141.A N GLU 137.A O no hydrogen 2.794 N/A THR 142.A N ALA 138.A O no hydrogen 2.924 N/A THR 142.A OG1 PHE 122.A O no hydrogen 3.554 N/A THR 142.A OG1 THR 126.A OG1 no hydrogen 2.825 N/A THR 142.A OG1 ALA 138.A O no hydrogen 2.905 N/A ARG 143.A N ALA 139.A O no hydrogen 2.835 N/A ARG 143.A NH1 SER 140.A OG no hydrogen 3.011 N/A ARG 143.A NH2 LEU 179.A O no hydrogen 3.088 N/A TYR 144.A N SER 140.A O no hydrogen 2.970 N/A TYR 144.A OH ASP 96.A OD1 no hydrogen 2.520 N/A TRP 145.A N LEU 141.A O no hydrogen 2.896 N/A LEU 146.A N THR 142.A O no hydrogen 3.002 N/A GLY 147.A N ARG 143.A O no hydrogen 3.291 N/A LEU 148.A N TYR 144.A O no hydrogen 3.203 N/A LEU 148.A N TRP 145.A O no hydrogen 3.172 N/A TYR 149.A N TRP 145.A O no hydrogen 2.816 N/A TYR 149.A OH PRO 95.A O no hydrogen 2.683 N/A LEU 150.A N LEU 146.A O no hydrogen 2.686 N/A VAL 154.A N THR 152.A OG1 no hydrogen 3.200 N/A ASN 155.A ND2 THR 152.A OG1 no hydrogen 2.627 N/A SER 156.A N TRP 159.A O no hydrogen 2.979 N/A SER 156.A OG THR 115.A OG1 no hydrogen 2.695 N/A SER 156.A OG TYR 149.A O no hydrogen 2.705 N/A TRP 159.A N SER 156.A O no hydrogen 3.075 N/A ARG 161.A N VAL 154.A O no hydrogen 2.760 N/A SER 166.A N THR 162.A O no hydrogen 3.104 N/A SER 166.A OG ALA 163.A O no hydrogen 2.788 N/A MET 167.A N ALA 163.A O no hydrogen 3.146 N/A ARG 168.A N GLY 164.A O no hydrogen 3.090 N/A ARG 168.A NE GLU 120.A OE2 no hydrogen 2.665 N/A ARG 168.A NH1 GLU 25.A OE2 no hydrogen 2.623 N/A ARG 168.A NH2 GLU 120.A OE1 no hydrogen 2.976 N/A ARG 168.A NH2 GLU 120.A OE2 no hydrogen 3.378 N/A MET 169.A N ASN 165.A O no hydrogen 3.054 N/A GLY 170.A N SER 166.A O no hydrogen 2.972 N/A VAL 171.A N ARG 168.A O no hydrogen 3.406 N/A TYR 173.A N MET 169.A O no hydrogen 3.033 N/A TYR 173.A OH GLU 190.A OE1 no hydrogen 2.486 N/A THR 174.A N GLY 170.A O no hydrogen 2.863 N/A THR 174.A OG1 GLY 170.A O no hydrogen 2.765 N/A TYR 175.A N VAL 171.A O no hydrogen 3.208 N/A TYR 175.A OH GLU 9.A OE2 no hydrogen 2.558 N/A SER 176.A N PRO 172.A O no hydrogen 2.876 N/A SER 176.A OG TYR 173.A O no hydrogen 2.596 N/A GLN 177.A N TYR 173.A O no hydrogen 3.073 N/A GLN 177.A NE2 GLU 190.A OE2 no hydrogen 2.891 N/A MET 178.A N THR 174.A O no hydrogen 3.013 N/A LEU 179.A N TYR 175.A O no hydrogen 2.930 N/A ARG 180.A N SER 176.A O no hydrogen 3.150 N/A ARG 180.A NH1 SER 176.A OG no hydrogen 2.892 N/A ARG 180.A NH1 GLN 177.A OE1 no hydrogen 2.893 N/A ARG 180.A NH2 ARG 143.A O no hydrogen 3.006 N/A GLY 181.A N MET 178.A O no hydrogen 3.081 N/A TYR 182.A N GLN 177.A O no hydrogen 3.124 N/A LEU 184.A N GLU 4.A OE1 no hydrogen 2.845 N/A GLN 186.A N SER 183.A OG no hydrogen 3.176 N/A GLN 186.A NE2 SER 183.A OG no hydrogen 3.398 N/A ILE 187.A N SER 183.A O no hydrogen 2.950 N/A ARG 188.A N LEU 184.A O no hydrogen 2.905 N/A GLN 189.A N GLN 186.A O no hydrogen 3.103 N/A GLU 190.A N ILE 187.A O no hydrogen 2.974 N/A GLN 194.A N GLU 190.A O no hydrogen 2.940 N/A GLU 195.A N GLN 191.A O no hydrogen 3.094 N/A ILE 196.A N GLY 192.A O no hydrogen 3.185 N/A LEU 197.A N ILE 193.A O no hydrogen 2.846 N/A ASN 198.A N GLN 194.A O no hydrogen 3.123 N/A ASN 198.A ND2 GLN 194.A O no hydrogen 3.158 N/A THR 199.A N GLU 195.A O no hydrogen 2.982 N/A THR 199.A OG1 GLU 195.A O no hydrogen 3.113 N/A ILE 200.A N ILE 196.A O no hydrogen 2.830 N/A VAL 205.A N LEU 211.A O no hydrogen 2.817 N/A GLY 210.A N ILE 218.A O no hydrogen 2.879 N/A HIS 212.A N ILE 216.A O no hydrogen 3.049 N/A SER 215.A N HIS 212.A O no hydrogen 2.803 N/A SER 215.A OG GLY 252.A O no hydrogen 3.188 N/A TYR 217.A N TYR 226.A OH no hydrogen 3.393 N/A TYR 217.A OH ASP 219.A OD2 no hydrogen 2.817 N/A ILE 218.A N GLY 210.A O no hydrogen 2.921 N/A ASP 219.A N VAL 223.A O no hydrogen 2.865 N/A HIS 220.A N ASP 219.A OD1 no hydrogen 2.800 N/A HIS 220.A ND1 GLU 324.A OE2 no hydrogen 2.642 N/A ILE 221.A N ASN 209.A OD1 no hydrogen 2.689 N/A VAL 223.A N ASP 219.A O no hydrogen 2.944 N/A ARG 224.A NE SER 299.A O no hydrogen 2.941 N/A ARG 224.A NH1 ALA 321.A O no hydrogen 2.987 N/A ARG 224.A NH2 SER 299.A O no hydrogen 2.895 N/A ALA 225.A N TYR 217.A O no hydrogen 3.291 N/A TYR 226.A N VAL 271.A O no hydrogen 2.878 N/A TYR 226.A OH ALA 256.A O no hydrogen 2.726 N/A ILE 230.A N TYR 226.A O no hydrogen 2.762 N/A ASN 231.A N GLY 227.A O no hydrogen 3.201 N/A SER 232.A OG TYR 228.A O no hydrogen 3.565 N/A TYR 233.A OH PHE 286.A O no hydrogen 3.242 N/A THR 235.A N SER 232.A O no hydrogen 3.006 N/A THR 235.A OG1 SER 232.A O no hydrogen 2.691 N/A PHE 236.A N TYR 233.A O no hydrogen 3.055 N/A TYR 238.A OH SER 19.A OG no hydrogen 3.030 N/A TYR 239.A N THR 235.A O no hydrogen 3.220 N/A TYR 239.A OH MET 167.A O no hydrogen 2.614 N/A THR 240.A N PHE 236.A O no hydrogen 2.943 N/A THR 240.A OG1 PHE 236.A O no hydrogen 3.230 N/A TYR 241.A N ALA 237.A O no hydrogen 2.989 N/A TYR 242.A N TYR 238.A O no hydrogen 2.799 N/A TYR 242.A OH VAL 171.A O no hydrogen 2.799 N/A PHE 243.A N TYR 239.A O no hydrogen 2.795 N/A GLY 244.A N THR 240.A O no hydrogen 2.912 N/A VAL 247.A N GLY 244.A O no hydrogen 3.470 N/A ASN 249.A N ALA 201.A O no hydrogen 3.000 N/A ASN 249.A ND2 PHE 202.A O no hydrogen 2.853 N/A THR 250.A N ILE 248.A O no hydrogen 2.843 N/A GLY 252.A N ASN 249.A OD1 no hydrogen 3.007 N/A LEU 253.A N ASN 249.A O no hydrogen 2.936 N/A THR 254.A N THR 250.A O no hydrogen 2.890 N/A THR 254.A OG1 THR 250.A O no hydrogen 2.879 N/A ARG 255.A N VAL 251.A O no hydrogen 3.061 N/A ARG 255.A NH1 ASN 259.A OD1 no hydrogen 2.848 N/A ARG 255.A NH2 GLU 258.A OE1 no hydrogen 2.883 N/A ARG 255.A NH2 ASN 259.A OD1 no hydrogen 3.018 N/A ALA 256.A N GLY 252.A O no hydrogen 2.919 N/A ILE 257.A N LEU 253.A O no hydrogen 3.035 N/A GLU 258.A N THR 254.A O no hydrogen 2.906 N/A ASN 259.A N ARG 255.A O no hydrogen 2.859 N/A ASN 259.A ND2 SER 215.A O no hydrogen 3.000 N/A VAL 260.A N ILE 257.A O no hydrogen 3.246 N/A GLY 261.A N ILE 257.A O no hydrogen 2.823 N/A SER 262.A OG VAL 266.A O no hydrogen 2.755 N/A GLY 265.A N SER 262.A O no hydrogen 2.926 N/A VAL 267.A N LEU 278.A O no hydrogen 2.836 N/A VAL 268.A N TYR 310.A OH no hydrogen 2.925 N/A VAL 271.A N VAL 268.A O no hydrogen 3.303 N/A MET 272.A N PRO 269.A O no hydrogen 3.007 N/A SER 273.A OG ASN 275.A OD1 no hydrogen 2.784 N/A ARG 274.A NE ASP 326.A OD2 no hydrogen 2.818 N/A ARG 274.A NH1 TYR 228.A OH no hydrogen 3.062 N/A ARG 274.A NH1 GLU 324.A OE1 no hydrogen 2.876 N/A GLY 276.A N SER 273.A O no hydrogen 3.140 N/A THR 277.A OG1 TYR 279.A O no hydrogen 3.318 N/A LEU 278.A N ASN 351.A OD1 no hydrogen 2.995 N/A TYR 279.A N THR 277.A OG1 no hydrogen 3.259 N/A SER 280.A N GLY 265.A O no hydrogen 2.876 N/A VAL 282.A N SER 280.A OG no hydrogen 3.239 N/A ILE 283.A N SER 280.A OG no hydrogen 3.083 N/A ASN 285.A N VAL 282.A O no hydrogen 2.775 N/A ASN 285.A ND2 SER 21.A O no hydrogen 2.914 N/A PHE 286.A N ILE 283.A O no hydrogen 3.182 N/A TYR 289.A OH ILE 283.A O no hydrogen 2.779 N/A ALA 292.A N LEU 305.A O no hydrogen 2.989 N/A HIS 294.A N THR 303.A O no hydrogen 2.717 N/A SER 295.A OG ASP 297.A OD1 no hydrogen 3.202 N/A ALA 296.A N VAL 301.A O no hydrogen 2.870 N/A TYR 298.A N ASP 214.A OD2 no hydrogen 2.792 N/A TYR 298.A OH SER 622.A O no hydrogen 2.488 N/A SER 299.A N ASP 214.A OD2 no hydrogen 2.611 N/A SER 299.A OG ASP 214.A OD1 no hydrogen 2.587 N/A SER 299.A OG ASP 214.A OD2 no hydrogen 3.285 N/A LYS 300.A N ALA 296.A O no hydrogen 2.927 N/A LYS 300.A NZ ASP 297.A O no hydrogen 2.786 N/A LYS 300.A NZ THR 391.A O no hydrogen 2.824 N/A LYS 300.A NZ GLU 582.A OE2 no hydrogen 2.698 N/A VAL 301.A N ALA 296.A O no hydrogen 3.204 N/A LEU 302.A N VAL 313.A O no hydrogen 3.041 N/A THR 303.A N HIS 294.A O no hydrogen 2.958 N/A THR 303.A OG1 ASN 259.A O no hydrogen 2.561 N/A THR 303.A OG1 SER 312.A OG no hydrogen 2.893 N/A LYS 304.A N GLY 311.A O no hydrogen 2.741 N/A LYS 304.A NZ THR 398.A O no hydrogen 2.857 N/A LYS 304.A NZ ASP 424.A OD1 no hydrogen 2.660 N/A LEU 305.A N ALA 292.A O no hydrogen 2.964 N/A SER 306.A N TYR 309.A O no hydrogen 2.938 N/A SER 306.A OG THR 308.A OG1 no hydrogen 3.214 N/A SER 306.A OG TYR 309.A O no hydrogen 3.506 N/A THR 308.A N SER 306.A OG no hydrogen 3.023 N/A THR 308.A OG1 SER 306.A OG no hydrogen 3.214 N/A THR 308.A OG1 HIS 425.A ND1 no hydrogen 2.897 N/A TYR 309.A N SER 306.A OG no hydrogen 2.991 N/A TYR 309.A OH TYR 423.A O no hydrogen 2.721 N/A TYR 310.A N TRP 343.A O no hydrogen 3.003 N/A TYR 310.A OH VAL 260.A O no hydrogen 2.495 N/A GLY 311.A N LYS 304.A O no hydrogen 2.959 N/A SER 312.A OG LEU 302.A O no hydrogen 3.152 N/A SER 312.A OG THR 303.A OG1 no hydrogen 2.893 N/A VAL 313.A N LEU 302.A O no hydrogen 2.888 N/A GLY 315.A N LYS 300.A O no hydrogen 2.675 N/A VAL 316.A N THR 391.A OG1 no hydrogen 2.990 N/A ASN 318.A N GLY 389.A O no hydrogen 3.217 N/A ARG 319.A N THR 317.A OG1 no hydrogen 3.168 N/A ARG 319.A NH1 GLU 582.A OE1 no hydrogen 2.759 N/A ARG 319.A NH1 GLU 582.A OE2 no hydrogen 3.338 N/A ARG 319.A NH2 TYR 298.A O no hydrogen 2.954 N/A ARG 319.A NH2 GLU 582.A OE2 no hydrogen 2.778 N/A LEU 320.A N THR 317.A O no hydrogen 3.211 N/A ALA 321.A N ASP 222.A O no hydrogen 2.861 N/A TYR 322.A N PHE 384.A O no hydrogen 2.842 N/A TYR 322.A OH GLU 410.A OE1 no hydrogen 2.495 N/A TYR 323.A OH GLN 332.A OE1 no hydrogen 3.176 N/A SER 325.A N GLN 382.A O no hydrogen 2.861 N/A SER 325.A OG ILE 374.A O no hydrogen 3.018 N/A ASP 326.A N ASN 329.A O no hydrogen 2.937 N/A THR 328.A N ASP 326.A OD1 no hydrogen 2.799 N/A ASN 329.A N ASP 326.A OD1 no hydrogen 2.681 N/A ILE 331.A N GLN 332.A OE1 no hydrogen 3.029 N/A GLN 332.A N TYR 323.A OH no hydrogen 3.083 N/A GLN 332.A NE2 ASN 275.A O no hydrogen 2.905 N/A TRP 336.A N GLN 332.A O no hydrogen 3.043 N/A THR 337.A N ALA 333.A O no hydrogen 2.904 N/A THR 337.A N PRO 334.A O no hydrogen 3.332 N/A THR 337.A OG1 ALA 333.A O no hydrogen 2.786 N/A THR 337.A OG1 PRO 334.A O no hydrogen 3.342 N/A MET 338.A N PRO 334.A O no hydrogen 2.860 N/A ARG 340.A N SER 361.A O.A no hydrogen 2.878 N/A ARG 340.A N SER 361.A O.B no hydrogen 2.785 N/A ARG 340.A NE SER 418.A OG no hydrogen 3.106 N/A ARG 340.A NH1 THR 337.A O no hydrogen 3.267 N/A ARG 340.A NH1 ALA 339.A O no hydrogen 3.098 N/A ARG 340.A NH2 THR 337.A O no hydrogen 3.521 N/A ARG 340.A NH2 SER 418.A OG no hydrogen 3.202 N/A ARG 341.A NE ILE 342.A O no hydrogen 2.765 N/A ARG 341.A NH1 GLU 360.A OE2 no hydrogen 2.977 N/A TRP 343.A N TYR 310.A O no hydrogen 2.805 N/A ASN 344.A ND2 GLY 482.A O no hydrogen 2.800 N/A ARG 345.A N THR 308.A O no hydrogen 2.893 N/A ARG 345.A NE GLU 264.A OE1 no hydrogen 2.958 N/A ARG 345.A NE GLU 264.A OE2 no hydrogen 3.249 N/A ARG 345.A NH1 SER 306.A O no hydrogen 2.878 N/A ARG 345.A NH2 GLU 264.A OE2 no hydrogen 2.984 N/A ARG 346.A N ASN 344.A OD1 no hydrogen 2.920 N/A GLY 347.A N ASN 344.A O no hydrogen 2.861 N/A ARG 348.A N ASN 481.A OD1 no hydrogen 2.769 N/A ASN 351.A ND2 THR 277.A OG1 no hydrogen 2.856 N/A TYR 352.A N ASN 351.A OD1 no hydrogen 2.885 N/A TYR 352.A OH GLU 360.A OE1 no hydrogen 2.679 N/A ASN 353.A N THR 356.A OG1 no hydrogen 2.947 N/A ASN 355.A N ASN 353.A OD1 no hydrogen 2.864 N/A THR 356.A N ASN 353.A O no hydrogen 2.955 N/A THR 356.A OG1 ASN 353.A O no hydrogen 3.463 N/A VAL 357.A N ASN 353.A O no hydrogen 2.913 N/A PHE 359.A N THR 356.A O no hydrogen 3.028 N/A SER 361.A N.A GLU 360.A OE2 no hydrogen 2.869 N/A SER 361.A N.B GLU 360.A OE2 no hydrogen 2.855 N/A SER 361.A OG.A ARG 340.A O no hydrogen 3.025 N/A SER 361.A OG.A VAL 450.A O no hydrogen 2.759 N/A SER 361.A OG.A TYR 528.A OH no hydrogen 2.898 N/A SER 361.A OG.B VAL 450.A O no hydrogen 2.712 N/A GLY 362.A N ILE 449.A O no hydrogen 2.818 N/A ILE 363.A N GLU 360.A O no hydrogen 3.103 N/A LEU 365.A N ARG 447.A O no hydrogen 2.672 N/A GLN 366.A NE2 MET 411.A O no hydrogen 3.054 N/A SER 367.A OG ASN 369.A OD1 no hydrogen 3.203 N/A GLY 370.A N SER 367.A OG no hydrogen 3.125 N/A ILE 371.A N ASN 369.A OD1 no hydrogen 2.968 N/A ARG 373.A NH1 ASN 330.A OD1 no hydrogen 2.710 N/A ILE 374.A N ASN 330.A O no hydrogen 2.800 N/A SER 376.A OG THR 378.A O no hydrogen 3.569 N/A SER 376.A OG SER 380.A O no hydrogen 2.528 N/A GLY 377.A N GLN 382.A OE1 no hydrogen 2.669 N/A THR 378.A N SER 376.A OG no hydrogen 3.428 N/A THR 378.A OG1 SER 376.A OG no hydrogen 3.281 N/A THR 378.A OG1 THR 381.A O no hydrogen 2.738 N/A SER 380.A N THR 378.A OG1 no hydrogen 3.081 N/A GLN 382.A N SER 325.A O no hydrogen 2.932 N/A SER 383.A OG ASP 222.A OD1 no hydrogen 2.751 N/A SER 383.A OG ASP 222.A OD2 no hydrogen 3.485 N/A PHE 384.A N TYR 323.A O no hydrogen 2.855 N/A ARG 385.A NE ASP 222.A OD2 no hydrogen 2.745 N/A ARG 385.A NH1 ASN 318.A O no hydrogen 3.093 N/A ILE 388.A N LYS 407.A O no hydrogen 3.358 N/A GLN 390.A N TYR 405.A O no hydrogen 2.939 N/A THR 391.A OG1 VAL 316.A O no hydrogen 2.704 N/A ALA 392.A N LEU 403.A O no hydrogen 2.856 N/A ALA 394.A N ALA 401.A O no hydrogen 2.956 N/A LYS 395.A N GLN 627.A OE1 no hydrogen 3.047 N/A LYS 395.A NZ SER 295.A OG no hydrogen 2.893 N/A THR 396.A N ALA 399.A O no hydrogen 2.814 N/A THR 396.A OG1 ALA 399.A O no hydrogen 3.432 N/A THR 396.A OG1 GLU 571.A OE1 no hydrogen 2.616 N/A THR 398.A N GLU 571.A OE1 no hydrogen 2.900 N/A THR 398.A OG1 GLU 571.A OE1 no hydrogen 3.465 N/A THR 398.A OG1 GLU 571.A OE2 no hydrogen 2.633 N/A GLY 400.A N PHE 422.A O no hydrogen 3.020 N/A ALA 401.A N ALA 394.A O no hydrogen 2.744 N/A ILE 402.A N THR 420.A O no hydrogen 2.861 N/A LEU 403.A N ALA 392.A O no hydrogen 2.792 N/A VAL 404.A N SER 418.A O no hydrogen 2.882 N/A TYR 405.A N GLN 390.A O no hydrogen 2.800 N/A ALA 406.A N PHE 416.A O no hydrogen 3.184 N/A LYS 407.A N ILE 388.A O no hydrogen 3.059 N/A PHE 408.A N LEU 414.A O no hydrogen 2.815 N/A GLU 410.A N GLU 410.A OE1 no hydrogen 2.749 N/A MET 411.A N PHE 408.A O no hydrogen 3.148 N/A ASN 412.A ND2 GLN 366.A OE1 no hydrogen 2.857 N/A ASN 412.A ND2 SER 440.A OG no hydrogen 2.804 N/A ASN 413.A N ALA 409.A O no hydrogen 3.481 N/A LEU 414.A N MET 411.A O no hydrogen 3.080 N/A GLN 415.A N GLY 435.A O no hydrogen 2.753 N/A PHE 416.A N ALA 406.A O no hydrogen 3.069 N/A LYS 417.A N TYR 432.A O no hydrogen 2.935 N/A LYS 417.A NZ GLU 548.A OE2 no hydrogen 2.689 N/A SER 418.A N VAL 404.A O no hydrogen 2.732 N/A CYS 419.A N LEU 430.A O no hydrogen 2.741 N/A THR 420.A N ILE 402.A O no hydrogen 2.970 N/A THR 420.A OG1 GLN 429.A OE1 no hydrogen 2.580 N/A LEU 421.A N PHE 428.A O no hydrogen 2.931 N/A PHE 422.A N GLY 400.A O no hydrogen 2.787 N/A TYR 423.A N GLY 426.A O no hydrogen 2.953 N/A TYR 423.A OH ASP 537.A OD2 no hydrogen 2.750 N/A HIS 425.A ND1 THR 308.A OG1 no hydrogen 2.897 N/A GLY 426.A N TYR 423.A O no hydrogen 2.833 N/A MET 427.A N LEU 530.A O no hydrogen 2.841 N/A PHE 428.A N LEU 421.A O no hydrogen 2.836 N/A GLN 429.A N TYR 528.A O no hydrogen 2.829 N/A GLN 429.A NE2 SER 418.A OG no hydrogen 3.108 N/A LEU 430.A N CYS 419.A O no hydrogen 2.844 N/A TYR 431.A N ALA 526.A O no hydrogen 2.913 N/A TYR 431.A OH MET 338.A O no hydrogen 3.380 N/A TYR 431.A OH GLY 362.A O no hydrogen 2.726 N/A TYR 432.A N LYS 417.A O no hydrogen 2.950 N/A TYR 432.A OH GLU 548.A OE2 no hydrogen 2.573 N/A ILE 434.A N ALA 524.A O no hydrogen 2.894 N/A GLY 435.A N GLN 415.A O no hydrogen 2.871 N/A VAL 436.A N MET 519.A O no hydrogen 3.085 N/A GLU 437.A N ASN 412.A O no hydrogen 3.148 N/A SER 440.A OG GLU 437.A O no hydrogen 2.629 N/A LEU 441.A N TYR 520.A OH no hydrogen 2.859 N/A THR 444.A N LEU 441.A O no hydrogen 2.942 N/A THR 444.A OG1 LEU 441.A O no hydrogen 3.064 N/A THR 444.A OG1 ASN 442.A O no hydrogen 3.197 N/A ARG 447.A N LEU 365.A O no hydrogen 3.122 N/A ARG 447.A NE GLU 511.A OE2 no hydrogen 3.048 N/A ARG 447.A NH1 ASN 445.A O no hydrogen 3.101 N/A ARG 447.A NH2 GLU 511.A OE2 no hydrogen 3.237 N/A VAL 448.A N GLN 512.A O no hydrogen 2.873 N/A ILE 449.A N ILE 363.A O no hydrogen 2.895 N/A VAL 450.A N VAL 510.A O no hydrogen 2.774 N/A LEU 451.A N VAL 510.A O no hydrogen 3.105 N/A ARG 453.A N GLU 508.A O no hydrogen 2.976 N/A ARG 453.A NE GLU 508.A OE1 no hydrogen 2.745 N/A ARG 453.A NH2 GLU 508.A OE1 no hydrogen 2.947 N/A THR 455.A N SER 506.A O no hydrogen 2.818 N/A THR 455.A OG1 SER 505.A O no hydrogen 3.035 N/A SER 456.A N ASP 454.A OD1 no hydrogen 2.945 N/A SER 456.A OG ASP 454.A OD1 no hydrogen 2.682 N/A VAL 457.A N ASP 454.A O no hydrogen 3.287 N/A THR 459.A N VAL 457.A O no hydrogen 3.166 N/A THR 459.A OG1 ASP 461.A OD2 no hydrogen 2.670 N/A ASP 461.A N THR 459.A OG1 no hydrogen 3.393 N/A PHE 464.A N GLU 508.A OE1 no hydrogen 2.752 N/A GLU 465.A N GLU 508.A OE2 no hydrogen 3.112 N/A ALA 466.A N SER 463.A OG no hydrogen 3.120 N/A GLN 467.A N SER 463.A O no hydrogen 2.914 N/A GLN 467.A NE2 LEU 462.A O no hydrogen 2.954 N/A GLN 467.A NE2 THR 479.A O no hydrogen 2.845 N/A ARG 468.A N PHE 464.A O no hydrogen 2.921 N/A ARG 468.A NE ASN 473.A OD1 no hydrogen 2.923 N/A ARG 468.A NH1 SER 475.A OG no hydrogen 2.893 N/A ARG 468.A NH1 LEU 498.A O no hydrogen 2.780 N/A ILE 469.A N GLU 465.A O no hydrogen 2.994 N/A ASN 470.A N.A ALA 466.A O no hydrogen 2.887 N/A ASN 470.A N.B ALA 466.A O no hydrogen 2.911 N/A ASN 471.A N GLN 467.A O no hydrogen 2.923 N/A ASN 471.A ND2 SER 474.A O no hydrogen 3.229 N/A ASN 473.A N ILE 469.A O no hydrogen 3.486 N/A SER 474.A N ARG 468.A O no hydrogen 3.092 N/A SER 474.A N ASN 471.A O no hydrogen 3.129 N/A GLU 476.A N SER 474.A OG no hydrogen 3.166 N/A GLY 477.A N CYS 485.A O no hydrogen 2.815 N/A THR 478.A N SER 475.A O no hydrogen 3.163 N/A THR 478.A OG1 SER 475.A O no hydrogen 2.643 N/A THR 479.A N GLN 467.A OE1 no hydrogen 2.854 N/A THR 479.A OG1 GLY 477.A O no hydrogen 3.320 N/A PHE 480.A N VAL 483.A O no hydrogen 2.811 N/A ASN 481.A N ASP 461.A OD2 no hydrogen 3.033 N/A ASN 481.A ND2 ARG 348.A O no hydrogen 2.771 N/A VAL 483.A N PHE 480.A O no hydrogen 3.001 N/A VAL 484.A N ASN 531.A O no hydrogen 2.801 N/A CYS 485.A N THR 478.A O no hydrogen 2.900 N/A CYS 485.A SG SER 475.A O no hydrogen 4.034 N/A CYS 485.A SG THR 478.A O no hydrogen 3.722 N/A HIS 486.A N LYS 529.A O no hydrogen 2.962 N/A ARG 487.A N GLU 476.A OE1 no hydrogen 2.945 N/A ARG 487.A NE VAL 495.A O no hydrogen 2.951 N/A ARG 487.A NE PRO 496.A O no hydrogen 3.218 N/A ARG 487.A NH1 VAL 495.A O no hydrogen 2.803 N/A VAL 488.A N CYS 527.A O no hydrogen 3.141 N/A ILE 493.A N ILE 490.A O no hydrogen 2.907 N/A THR 499.A N GLU 511.A O no hydrogen 2.946 N/A THR 499.A OG1 GLU 511.A O no hydrogen 3.470 N/A ARG 501.A N LEU 509.A O no hydrogen 2.976 N/A ARG 501.A NE GLU 511.A OE1 no hydrogen 3.478 N/A ARG 501.A NE GLU 511.A OE2 no hydrogen 2.786 N/A ARG 501.A NH1 LEU 368.A O no hydrogen 2.922 N/A ARG 501.A NH2 GLU 511.A OE1 no hydrogen 3.069 N/A ASN 504.A ND2 ASN 355.A O no hydrogen 3.063 N/A SER 506.A N ASN 504.A OD1 no hydrogen 2.873 N/A VAL 507.A N ASN 504.A O no hydrogen 3.463 N/A GLU 508.A N ARG 453.A O no hydrogen 3.068 N/A LEU 509.A N ARG 501.A O no hydrogen 2.802 N/A VAL 510.A N LEU 451.A O no hydrogen 2.865 N/A GLU 511.A N THR 499.A O no hydrogen 2.807 N/A GLN 512.A N VAL 448.A O no hydrogen 2.838 N/A GLN 512.A NE2 CYS 527.A O no hydrogen 2.871 N/A ILE 514.A N GLY 446.A O no hydrogen 2.851 N/A SER 515.A OG THR 518.A OG1 no hydrogen 2.859 N/A GLN 517.A N GLN 517.A OE1 no hydrogen 2.854 N/A THR 518.A N SER 515.A OG no hydrogen 3.314 N/A THR 518.A OG1 SER 515.A O no hydrogen 3.003 N/A THR 518.A OG1 SER 515.A OG no hydrogen 2.859 N/A MET 519.A N SER 515.A O no hydrogen 3.214 N/A TYR 520.A N PHE 516.A O no hydrogen 2.912 N/A THR 521.A N GLN 517.A O no hydrogen 3.304 N/A THR 521.A OG1 GLN 517.A O no hydrogen 3.469 N/A THR 521.A OG1 THR 518.A O no hydrogen 3.201 N/A THR 521.A OG1 THR 523.A OG1 no hydrogen 2.756 N/A ALA 522.A N MET 519.A O no hydrogen 3.144 N/A THR 523.A N THR 518.A O no hydrogen 2.873 N/A THR 523.A OG1 THR 518.A O no hydrogen 3.336 N/A THR 523.A OG1 THR 521.A OG1 no hydrogen 2.756 N/A ALA 524.A N ILE 434.A O no hydrogen 3.315 N/A SER 525.A OG ASN 494.A O no hydrogen 2.639 N/A ALA 526.A N TYR 431.A O no hydrogen 2.965 N/A CYS 527.A N GLN 512.A OE1 no hydrogen 2.943 N/A CYS 527.A SG GLN 429.A O no hydrogen 3.504 N/A CYS 527.A SG VAL 488.A O no hydrogen 3.410 N/A TYR 528.A N GLN 429.A O no hydrogen 2.980 N/A TYR 528.A OH ARG 340.A O no hydrogen 3.066 N/A TYR 528.A OH SER 361.A OG.A no hydrogen 2.898 N/A LYS 529.A N HIS 486.A O no hydrogen 2.831 N/A LYS 529.A NZ ASP 537.A O no hydrogen 3.245 N/A LYS 529.A NZ ASP 537.A OD1 no hydrogen 2.634 N/A LEU 530.A N MET 427.A O no hydrogen 2.887 N/A ASN 531.A N VAL 484.A O no hydrogen 2.788 N/A VAL 532.A N HIS 425.A O no hydrogen 3.095 N/A GLU 533.A N GLY 482.A O no hydrogen 2.941 N/A HIS 535.A N VAL 532.A O no hydrogen 2.951 N/A LEU 539.A N ASP 537.A OD1 no hydrogen 3.027 N/A ARG 540.A N.A ASN 553.A O no hydrogen 2.995 N/A ARG 540.A N.B ASN 553.A O no hydrogen 2.998 N/A ARG 540.A NH1.A LEU 539.A O no hydrogen 2.809 N/A PHE 542.A N TYR 551.A O no hydrogen 2.860 N/A ARG 543.A NE ASP 547.A OD1 no hydrogen 2.681 N/A ARG 543.A NH2 ASP 547.A OD1 no hydrogen 3.550 N/A VAL 544.A N ASN 549.A O no hydrogen 2.898 N/A GLU 548.A N SER 546.A OG no hydrogen 3.261 N/A ASN 549.A N SER 546.A O no hydrogen 3.040 N/A ASN 549.A ND2 VAL 544.A O no hydrogen 2.802 N/A ASN 549.A ND2 SER 597.A OG no hydrogen 2.915 N/A ILE 550.A N PHE 562.A O no hydrogen 2.797 N/A TYR 551.A N PHE 542.A O no hydrogen 2.882 N/A VAL 552.A N ALA 560.A O no hydrogen 2.863 N/A ASN 553.A N ARG 540.A O.A no hydrogen 2.866 N/A ASN 553.A N ARG 540.A O.B no hydrogen 2.984 N/A VAL 554.A N VAL 558.A O no hydrogen 2.973 N/A GLY 555.A N ASN 553.A OD1 no hydrogen 2.951 N/A VAL 558.A N ASN 556.A OD1 no hydrogen 3.382 N/A LYS 559.A N LYS 570.A O no hydrogen 3.027 N/A LYS 559.A NZ ILE 598.A O no hydrogen 2.893 N/A LYS 559.A NZ GLU 600.A OE2 no hydrogen 2.729 N/A ALA 560.A N VAL 552.A O no hydrogen 2.846 N/A LEU 561.A N MET 568.A O no hydrogen 2.793 N/A PHE 562.A N ILE 550.A O no hydrogen 2.859 N/A ASN 563.A N TRP 566.A O no hydrogen 2.839 N/A TRP 566.A N ASN 563.A O no hydrogen 2.868 N/A VAL 567.A N MET 578.A O no hydrogen 2.891 N/A MET 568.A N LEU 561.A O no hydrogen 2.886 N/A VAL 569.A N SER 576.A O no hydrogen 2.994 N/A LYS 570.A N LYS 559.A O no hydrogen 2.856 N/A LYS 570.A NZ GLU 600.A OE1 no hydrogen 3.525 N/A LYS 570.A NZ GLU 600.A OE2 no hydrogen 2.878 N/A GLU 571.A N LYS 574.A O no hydrogen 2.937 N/A ASN 573.A ND2 ILE 632.A O no hydrogen 3.115 N/A LYS 574.A N GLU 571.A O no hydrogen 2.962 N/A VAL 575.A N PHE 630.A O no hydrogen 2.943 N/A SER 576.A N VAL 569.A O no hydrogen 2.970 N/A SER 576.A OG GLN 627.A OE1 no hydrogen 2.692 N/A PHE 577.A N PHE 628.A O no hydrogen 2.883 N/A MET 578.A N VAL 567.A O no hydrogen 3.000 N/A ALA 580.A N PRO 565.A O no hydrogen 2.691 N/A ASN 581.A N SER 579.A OG no hydrogen 2.988 N/A GLU 582.A N SER 579.A O no hydrogen 2.836 N/A ILE 586.A N PHE 617.A O no hydrogen 2.795 N/A PHE 588.A N ASN 615.A O no hydrogen 2.813 N/A ILE 591.A N PRO 587.A O no hydrogen 3.432 N/A MET 592.A N PHE 588.A O no hydrogen 2.945 N/A ASN 593.A N SER 589.A O no hydrogen 2.850 N/A SER 594.A N VAL 590.A O no hydrogen 2.929 N/A SER 594.A OG VAL 590.A O no hydrogen 2.754 N/A PHE 595.A N ILE 591.A O no hydrogen 2.958 N/A THR 596.A N MET 592.A O no hydrogen 2.946 N/A THR 596.A OG1 MET 592.A O no hydrogen 3.048 N/A SER 597.A N ASN 593.A O no hydrogen 2.938 N/A SER 597.A OG ASN 593.A O no hydrogen 3.170 N/A ILE 598.A N SER 594.A O no hydrogen 3.131 N/A GLY 599.A N THR 596.A O no hydrogen 3.051 N/A GLU 600.A N PHE 595.A O no hydrogen 2.823 N/A LEU 603.A N GLU 600.A O no hydrogen 3.155 N/A SER 606.A N GLU 631.A O no hydrogen 2.890 N/A SER 608.A N ILE 629.A O no hydrogen 2.786 N/A ASN 609.A ND2 GLN 627.A O no hydrogen 2.804 N/A CYS 610.A SG ASN 609.A OD1 no hydrogen 3.772 N/A CYS 610.A SG ILE 629.A O no hydrogen 3.993 N/A PHE 611.A N LYS 618.A O no hydrogen 2.847 N/A TYR 613.A N GLY 616.A O no hydrogen 2.833 N/A GLY 616.A N TYR 613.A O no hydrogen 3.004 N/A PHE 617.A N ILE 586.A O no hydrogen 2.937 N/A LYS 618.A N PHE 611.A O no hydrogen 2.788 N/A LEU 619.A N THR 584.A O no hydrogen 3.010 N/A ASN 620.A N ASN 609.A O no hydrogen 2.865 N/A THR 623.A N ASN 621.A OD1 no hydrogen 2.981 N/A THR 623.A OG1 ASN 621.A OD1 no hydrogen 2.710 N/A LEU 626.A N ASP 297.A OD2 no hydrogen 2.808 N/A GLN 627.A NE2 ASP 297.A OD1 no hydrogen 3.031 N/A PHE 628.A N PHE 577.A O no hydrogen 2.794 N/A ILE 629.A N ASN 609.A OD1 no hydrogen 2.766 N/A PHE 630.A N VAL 575.A O no hydrogen 2.807 N/A GLU 631.A N SER 606.A O no hydrogen 2.822 N/A ILE 632.A N ASN 573.A O no hydrogen 2.844 N/A VAL 633.A N GLN 604.A O no hydrogen 3.037 N/A