Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 5gxh_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ARG 4.A N LYS 659.A O no hydrogen 3.005 N/A ARG 4.A NH1 THR 367.A O no hydrogen 3.076 N/A ARG 4.A NH1 ASN 373.A O no hydrogen 2.762 N/A ARG 4.A NH2 THR 367.A O no hydrogen 3.412 N/A THR 5.A N TYR 374.A OH no hydrogen 2.943 N/A THR 5.A OG1 HIS 658.A ND1 no hydrogen 2.875 N/A LEU 6.A N VAL 657.A O no hydrogen 2.830 N/A SER 9.A N LEU 336.A O no hydrogen 2.886 N/A SER 9.A OG SER 335.A OG no hydrogen 2.847 N/A ASN 11.A N ALA 29.A O no hydrogen 2.912 N/A ASN 11.A ND2 ARG 31.A O no hydrogen 3.173 N/A ASN 11.A ND2 VAL 65.A O no hydrogen 2.790 N/A CYS 14.A SG TRP 12.A O no hydrogen 3.539 N/A CYS 14.A SG SER 66.A O no hydrogen 3.497 N/A ARG 16.A NH1 LEU 113.A O no hydrogen 3.002 N/A ARG 16.A NH1 LEU 155.A O no hydrogen 2.857 N/A ARG 16.A NH2 LEU 155.A O no hydrogen 3.091 N/A ARG 16.A NH2 THR 156.A OG1 no hydrogen 3.118 N/A CYS 17.A N ASN 297.A OD1 no hydrogen 2.755 N/A CYS 17.A SG ASN 11.A O no hydrogen 3.712 N/A CYS 17.A SG ASN 297.A OD1 no hydrogen 3.855 N/A SER 18.A OG.A ASN 297.A OD1 no hydrogen 2.933 N/A SER 18.A OG.B ASN 297.A OD1 no hydrogen 2.849 N/A ASP 19.A N GLY 27.A O no hydrogen 3.014 N/A VAL 21.A N LEU 25.A O no hydrogen 2.931 N/A GLY 23.A N GLN 302.A O no hydrogen 3.145 N/A GLY 24.A N VAL 39.A O no hydrogen 3.014 N/A LEU 25.A N VAL 21.A O no hydrogen 3.146 N/A PHE 26.A N VAL 37.A O no hydrogen 2.954 N/A GLY 27.A N ASP 19.A O no hydrogen 2.863 N/A PHE 28.A N PHE 35.A O no hydrogen 2.939 N/A ALA 29.A N CYS 17.A O no hydrogen 2.842 N/A ALA 30.A N SER 33.A O no hydrogen 2.867 N/A ARG 31.A N ASN 11.A OD1 no hydrogen 2.849 N/A SER 33.A N ALA 30.A O no hydrogen 2.994 N/A SER 33.A OG GLU 57.A OE2 no hydrogen 2.682 N/A VAL 34.A N LEU 58.A O no hydrogen 3.251 N/A PHE 35.A N PHE 28.A O no hydrogen 2.927 N/A LEU 36.A N GLY 56.A O no hydrogen 2.904 N/A VAL 37.A N PHE 26.A O no hydrogen 2.782 N/A ARG 38.A N ARG 53.A O no hydrogen 2.809 N/A VAL 39.A N GLY 24.A O no hydrogen 2.986 N/A GLY 40.A N PRO 51.A O no hydrogen 2.776 N/A ALA 43.A N GLY 40.A O no hydrogen 3.052 N/A SER 46.A OG.A THR 49.A OG1 no hydrogen 2.828 N/A THR 49.A N SER 46.A O.A no hydrogen 3.183 N/A THR 49.A OG1 SER 46.A O.A no hydrogen 2.654 N/A THR 49.A OG1 SER 46.A OG.A no hydrogen 2.828 N/A PHE 52.A N PRO 50.A O no hydrogen 2.832 N/A ARG 53.A N ARG 38.A O no hydrogen 2.833 N/A ARG 53.A NE ALA 43.A O no hydrogen 2.919 N/A ARG 53.A NH2 ALA 43.A O no hydrogen 2.726 N/A ILE 55.A N LEU 36.A O no hydrogen 2.813 N/A LEU 58.A N VAL 34.A O no hydrogen 2.749 N/A HIS 61.A ND1 ASP 86.A OD2 no hydrogen 2.799 N/A HIS 61.A NE2 THR 82.A OG1 no hydrogen 2.771 N/A THR 62.A N ASP 86.A OD2 no hydrogen 3.064 N/A ARG 64.A NE ASP 85.A OD2 no hydrogen 2.924 N/A ARG 64.A NH2 ASP 85.A OD1 no hydrogen 2.899 N/A ARG 64.A NH2 ASP 85.A OD2 no hydrogen 3.498 N/A VAL 65.A N ARG 31.A O no hydrogen 3.037 N/A SER 66.A N SER 83.A O no hydrogen 2.888 N/A SER 66.A OG SER 83.A OG no hydrogen 2.913 N/A PHE 68.A N ARG 16.A O no hydrogen 3.057 N/A THR 69.A N ALA 81.A O no hydrogen 2.999 N/A THR 69.A OG1 PHE 70.A O no hydrogen 3.507 N/A PHE 70.A N ASP 19.A OD2 no hydrogen 2.718 N/A SER 71.A N LEU 79.A O no hydrogen 2.946 N/A HIS 72.A NE2.A ALA 20.A O no hydrogen 2.694 N/A HIS 72.A NE2.B ASP 19.A OD2 no hydrogen 2.771 N/A HIS 73.A N SER 71.A OG no hydrogen 3.250 N/A HIS 73.A NE2 SER 116.A O no hydrogen 2.837 N/A GLN 76.A N HIS 73.A O no hydrogen 2.949 N/A ASN 78.A ND2 ASP 93.A OD1 no hydrogen 2.995 N/A LEU 79.A N GLN 76.A O no hydrogen 3.026 N/A CYS 80.A N TRP 92.A O no hydrogen 3.042 N/A ALA 81.A N THR 69.A O no hydrogen 2.820 N/A THR 82.A N LYS 90.A O no hydrogen 2.957 N/A THR 82.A OG1 HIS 61.A NE2 no hydrogen 2.771 N/A SER 83.A N GLY 67.A O no hydrogen 3.053 N/A SER 83.A OG SER 66.A OG no hydrogen 2.913 N/A SER 84.A N THR 88.A O no hydrogen 3.158 N/A SER 84.A OG GLU 63.A O no hydrogen 2.997 N/A SER 84.A OG ARG 64.A O no hydrogen 3.079 N/A ASP 85.A N ARG 64.A O no hydrogen 2.839 N/A ASP 86.A N SER 84.A OG no hydrogen 2.947 N/A GLY 87.A N SER 84.A O no hydrogen 2.985 N/A THR 88.A N ASP 86.A OD1 no hydrogen 2.937 N/A THR 88.A OG1 ASP 86.A OD1 no hydrogen 2.520 N/A VAL 89.A N HIS 103.A O no hydrogen 2.957 N/A LYS 90.A N THR 82.A O no hydrogen 2.889 N/A LYS 90.A NZ THR 88.A OG1 no hydrogen 3.046 N/A LYS 90.A NZ GLU 102.A OE2 no hydrogen 3.002 N/A ILE 91.A N THR 101.A O no hydrogen 2.843 N/A TRP 92.A N CYS 80.A O no hydrogen 2.785 N/A TRP 92.A NE1 THR 82.A OG1 no hydrogen 2.759 N/A ASP 93.A N THR 98.A O no hydrogen 3.058 N/A VAL 94.A N ASN 78.A O no hydrogen 2.896 N/A GLU 95.A N ASP 93.A OD1 no hydrogen 2.945 N/A THR 96.A OG1 ASP 93.A O no hydrogen 3.390 N/A THR 96.A OG1 THR 98.A OG1 no hydrogen 2.508 N/A THR 98.A OG1 THR 96.A OG1 no hydrogen 2.508 N/A VAL 100.A N ILE 91.A O no hydrogen 2.718 N/A HIS 103.A N VAL 89.A O no hydrogen 2.895 N/A LEU 105.A N HIS 103.A ND1 no hydrogen 3.128 N/A HIS 106.A ND1 ASP 127.A OD2 no hydrogen 2.715 N/A HIS 106.A NE2 SER 125.A OG no hydrogen 2.757 N/A SER 111.A N GLY 126.A O no hydrogen 2.795 N/A SER 111.A OG ILE 152.A O no hydrogen 2.597 N/A THR 112.A N GLY 126.A O no hydrogen 3.346 N/A HIS 114.A N VAL 124.A O no hydrogen 2.746 N/A TRP 115.A N THR 69.A OG1 no hydrogen 3.081 N/A TRP 115.A NE1 LYS 120.A O no hydrogen 2.973 N/A SER 116.A N LEU 122.A O no hydrogen 2.906 N/A ARG 118.A N SER 116.A OG no hydrogen 3.082 N/A VAL 119.A N SER 116.A OG no hydrogen 2.917 N/A LEU 122.A N VAL 119.A O no hydrogen 3.345 N/A ILE 123.A N TYR 135.A O no hydrogen 2.873 N/A VAL 124.A N HIS 114.A O no hydrogen 2.968 N/A SER 125.A N PHE 133.A O no hydrogen 2.897 N/A SER 125.A OG HIS 106.A NE2 no hydrogen 2.757 N/A GLY 126.A N THR 112.A O no hydrogen 2.993 N/A ASP 127.A N VAL 131.A O no hydrogen 2.853 N/A GLU 128.A N THR 109.A O no hydrogen 2.915 N/A LYS 129.A N ASP 127.A OD1 no hydrogen 2.947 N/A GLY 130.A N ASP 127.A O no hydrogen 3.023 N/A VAL 131.A N ASP 127.A OD1 no hydrogen 3.054 N/A VAL 132.A N LEU 145.A O no hydrogen 2.927 N/A PHE 133.A N SER 125.A O no hydrogen 2.944 N/A CYS 134.A N GLN 143.A O no hydrogen 2.758 N/A TYR 135.A N ILE 123.A O no hydrogen 2.859 N/A TRP 136.A N ASP 141.A O no hydrogen 2.843 N/A PHE 137.A N ASP 121.A O no hydrogen 2.972 N/A ASN 138.A N ASP 121.A OD2 no hydrogen 3.045 N/A ARG 139.A N TRP 136.A O no hydrogen 3.311 N/A ARG 139.A NE ASP 121.A OD2 no hydrogen 3.273 N/A ARG 139.A NH2 ASP 121.A OD1 no hydrogen 2.717 N/A ASP 141.A N TRP 136.A O no hydrogen 3.329 N/A GLN 143.A N CYS 134.A O no hydrogen 2.906 N/A LEU 145.A N VAL 132.A O no hydrogen 2.752 N/A ARG 150.A N GLU 148.A O no hydrogen 2.881 N/A THR 151.A OG1 GLU 128.A O no hydrogen 2.735 N/A ILE 152.A N ASP 127.A O no hydrogen 3.468 N/A PHE 153.A N GLY 168.A O no hydrogen 2.881 N/A CYS 154.A N GLY 168.A O no hydrogen 3.148 N/A CYS 154.A SG ILE 196.A O no hydrogen 3.706 N/A THR 156.A N ALA 166.A O no hydrogen 2.916 N/A THR 156.A OG1 ILE 199.A O no hydrogen 2.827 N/A CYS 157.A N HIS 114.A ND1 no hydrogen 2.982 N/A SER 158.A N LEU 164.A O no hydrogen 2.984 N/A HIS 160.A N SER 158.A OG no hydrogen 2.988 N/A HIS 160.A NE2 CYS 202.A O no hydrogen 3.061 N/A HIS 161.A N SER 158.A OG no hydrogen 3.000 N/A ASP 163.A N HIS 161.A ND1 no hydrogen 3.124 N/A LEU 164.A N HIS 161.A O no hydrogen 3.244 N/A VAL 165.A N ILE 177.A O no hydrogen 3.056 N/A ALA 166.A N THR 156.A O no hydrogen 2.959 N/A ILE 167.A N VAL 175.A O no hydrogen 2.843 N/A GLY 168.A N CYS 154.A O no hydrogen 2.859 N/A TYR 169.A N ILE 173.A O no hydrogen 2.892 N/A LYS 170.A N THR 151.A O no hydrogen 2.979 N/A GLY 172.A N TYR 169.A O no hydrogen 3.085 N/A ILE 173.A N ASP 171.A OD1 no hydrogen 3.159 N/A VAL 175.A N ILE 167.A O no hydrogen 2.998 N/A ILE 176.A N HIS 187.A O no hydrogen 2.897 N/A ILE 177.A N VAL 165.A O no hydrogen 2.837 N/A ASP 178.A N GLU 184.A O no hydrogen 2.945 N/A ILE 179.A N ASP 163.A O no hydrogen 2.759 N/A SER 180.A N ASP 178.A OD1 no hydrogen 2.806 N/A SER 180.A OG ASP 178.A OD1 no hydrogen 2.479 N/A LYS 181.A N ASP 178.A O no hydrogen 3.049 N/A GLY 183.A N ASP 178.A O no hydrogen 2.992 N/A GLU 184.A N LYS 181.A O no hydrogen 3.005 N/A ILE 186.A N ILE 176.A O no hydrogen 2.708 N/A HIS 187.A N ILE 176.A O no hydrogen 3.318 N/A ARG 188.A NH1 GLU 148.A OE2 no hydrogen 3.086 N/A ARG 188.A NH2 GLU 148.A OE2 no hydrogen 2.661 N/A LEU 189.A N VAL 174.A O no hydrogen 2.847 N/A HIS 192.A ND1 ASP 217.A OD2 no hydrogen 2.906 N/A HIS 192.A NE2 THR 213.A OG1 no hydrogen 2.634 N/A ASP 193.A N ASP 217.A OD2 no hydrogen 3.152 N/A GLU 195.A N ASP 194.A OD1 no hydrogen 2.773 N/A ILE 196.A N TYR 169.A O no hydrogen 3.190 N/A HIS 197.A N GLY 214.A O no hydrogen 2.835 N/A HIS 197.A NE2 GLU 195.A OE1 no hydrogen 2.861 N/A SER 198.A OG.B LEU 247.A O no hydrogen 2.700 N/A ALA 200.A N ALA 212.A O no hydrogen 2.816 N/A TRP 201.A NE1 THR 156.A O no hydrogen 2.956 N/A CYS 202.A N TYR 210.A O no hydrogen 2.995 N/A CYS 202.A SG LEU 204.A O no hydrogen 3.685 N/A GLY 206.A N GLY 208.A O no hydrogen 3.225 N/A CYS 209.A N GLU 207.A OE2 no hydrogen 2.921 N/A LEU 211.A N TRP 223.A O no hydrogen 3.082 N/A ALA 212.A N ALA 200.A O no hydrogen 2.745 N/A THR 213.A N ARG 221.A O no hydrogen 2.839 N/A THR 213.A OG1 HIS 192.A NE2 no hydrogen 2.634 N/A THR 213.A OG1 ARG 221.A O no hydrogen 3.455 N/A GLY 214.A N SER 198.A O no hydrogen 2.957 N/A SER 215.A N THR 219.A O no hydrogen 3.301 N/A SER 215.A OG ASP 194.A O no hydrogen 3.035 N/A SER 215.A OG GLU 195.A O no hydrogen 2.954 N/A LYS 216.A N GLU 195.A O no hydrogen 2.963 N/A ASP 217.A N SER 215.A OG no hydrogen 3.008 N/A GLN 218.A N SER 215.A O no hydrogen 2.922 N/A GLN 218.A NE2 LYS 216.A O no hydrogen 3.491 N/A THR 219.A N ASP 217.A OD1 no hydrogen 3.049 N/A THR 219.A OG1 ASP 217.A OD1 no hydrogen 2.695 N/A THR 219.A OG1 ASP 217.A OD2 no hydrogen 3.520 N/A ILE 220.A N LEU 234.A O no hydrogen 2.828 N/A ARG 221.A N THR 213.A O no hydrogen 2.965 N/A ARG 221.A NE HIS 192.A ND1 no hydrogen 3.380 N/A ARG 221.A NE THR 219.A OG1 no hydrogen 3.207 N/A ILE 222.A N MET 232.A O no hydrogen 2.892 N/A TRP 223.A N LEU 211.A O no hydrogen 2.812 N/A TRP 223.A NE1 THR 213.A OG1 no hydrogen 2.759 N/A SER 224.A N ARG 229.A O no hydrogen 2.889 N/A SER 224.A OG GLU 207.A OE1 no hydrogen 2.907 N/A SER 224.A OG GLU 207.A OE2 no hydrogen 3.327 N/A CYS 225.A N CYS 209.A O no hydrogen 3.075 N/A CYS 225.A SG CYS 209.A O no hydrogen 3.215 N/A SER 226.A N GLU 207.A OE2 no hydrogen 3.083 N/A SER 226.A OG GLU 207.A OE1 no hydrogen 2.516 N/A SER 226.A OG GLU 207.A OE2 no hydrogen 3.317 N/A SER 226.A OG SER 224.A OG no hydrogen 3.229 N/A ARG 227.A N SER 224.A OG no hydrogen 3.014 N/A ARG 229.A N SER 224.A O no hydrogen 3.116 N/A VAL 231.A N ILE 222.A O no hydrogen 2.758 N/A MET 232.A N ILE 222.A O no hydrogen 3.296 N/A LEU 234.A N ILE 220.A O no hydrogen 2.767 N/A LEU 236.A N GLN 218.A O no hydrogen 3.006 N/A ARG 242.A NE GLU 267.A OE2 no hydrogen 2.983 N/A ARG 242.A NH1 GLU 267.A OE1 no hydrogen 2.971 N/A ARG 242.A NH1 PHE 282.A O no hydrogen 3.068 N/A ARG 242.A NH1 SER 283.A O no hydrogen 3.401 N/A ARG 242.A NH2 SER 283.A O no hydrogen 2.826 N/A LEU 247.A N HIS 197.A ND1 no hydrogen 3.080 N/A THR 248.A N SER 262.A OG no hydrogen 2.860 N/A THR 248.A OG1 PHE 296.A O no hydrogen 3.403 N/A LEU 249.A N SER 198.A OG.A no hydrogen 3.180 N/A HIS 250.A N VAL 260.A O no hydrogen 2.816 N/A TRP 251.A NE1 PRO 256.A O no hydrogen 2.908 N/A GLN 255.A N PRO 252.A O no hydrogen 3.331 N/A GLN 258.A N GLN 255.A O no hydrogen 2.901 N/A LEU 259.A N TRP 271.A O no hydrogen 3.074 N/A VAL 260.A N HIS 250.A O no hydrogen 2.800 N/A SER 261.A N LEU 269.A O no hydrogen 2.908 N/A SER 261.A OG SER 262.A O no hydrogen 2.876 N/A SER 262.A N THR 248.A O no hydrogen 3.047 N/A SER 262.A OG TRP 246.A O no hydrogen 2.816 N/A CYS 263.A SG PRO 237.A O no hydrogen 3.718 N/A GLY 266.A N CYS 263.A O no hydrogen 3.029 N/A GLU 267.A N PHE 264.A O no hydrogen 3.483 N/A LEU 269.A N SER 261.A O no hydrogen 2.889 N/A GLN 270.A N THR 280.A O no hydrogen 2.778 N/A TRP 271.A N LEU 259.A O no hydrogen 2.777 N/A TRP 271.A NE1 SER 261.A OG no hydrogen 2.914 N/A ASP 272.A N LYS 278.A O no hydrogen 3.061 N/A LEU 273.A N THR 257.A O no hydrogen 2.765 N/A THR 274.A N ASP 272.A OD1 no hydrogen 2.897 N/A THR 274.A OG1 ASP 272.A OD1 no hydrogen 2.638 N/A GLN 275.A N ASP 272.A OD1 no hydrogen 3.457 N/A ARG 277.A NE LYS 235.A O no hydrogen 2.834 N/A ARG 277.A NH2 LYS 235.A O no hydrogen 2.752 N/A LYS 278.A NZ TYR 279.A O no hydrogen 3.497 N/A THR 280.A N GLN 270.A O no hydrogen 2.723 N/A PHE 282.A N LEU 268.A O no hydrogen 2.908 N/A SER 283.A N LEU 327.A O no hydrogen 2.741 N/A ASN 290.A ND2 ARG 242.A O no hydrogen 3.430 N/A ASN 290.A ND2 HIS 291.A O no hydrogen 2.999 N/A HIS 291.A ND1 ASP 316.A OD1 no hydrogen 3.232 N/A HIS 291.A ND1 ASP 316.A OD2 no hydrogen 2.946 N/A HIS 291.A NE2 SER 312.A OG no hydrogen 2.742 N/A SER 292.A N ASP 316.A OD2 no hydrogen 2.969 N/A ILE 294.A N GLU 243.A OE1 no hydrogen 3.171 N/A PHE 296.A N THR 313.A O no hydrogen 2.885 N/A ASN 297.A ND2 CYS 14.A O no hydrogen 2.978 N/A ASN 297.A ND2 PHE 296.A O no hydrogen 2.729 N/A CYS 299.A N LEU 311.A O no hydrogen 2.828 N/A CYS 299.A SG.A SER 18.A OG.A no hydrogen 3.072 N/A LEU 301.A N LEU 309.A O no hydrogen 2.971 N/A THR 303.A N LYS 307.A O no hydrogen 2.965 N/A THR 303.A OG1 ASP 305.A OD1 no hydrogen 2.415 N/A GLU 304.A N GLY 23.A O no hydrogen 2.866 N/A ASP 306.A N THR 303.A O no hydrogen 2.949 N/A LYS 307.A N THR 303.A OG1 no hydrogen 3.067 N/A LEU 309.A N LEU 301.A O no hydrogen 2.838 N/A LEU 310.A N TRP 322.A O no hydrogen 2.844 N/A LEU 311.A N CYS 299.A O no hydrogen 2.842 N/A SER 312.A N LYS 320.A O no hydrogen 2.837 N/A SER 312.A OG HIS 291.A NE2 no hydrogen 2.742 N/A SER 312.A OG LYS 320.A O no hydrogen 3.457 N/A THR 313.A N ASN 297.A O no hydrogen 3.081 N/A SER 314.A OG ARG 293.A O no hydrogen 2.916 N/A SER 314.A OG ILE 294.A O no hydrogen 2.912 N/A MET 315.A N ILE 294.A O no hydrogen 2.873 N/A ASP 316.A N SER 314.A OG no hydrogen 2.917 N/A ARG 317.A N SER 314.A O no hydrogen 3.074 N/A ARG 317.A NH1 SER 9.A OG no hydrogen 3.125 N/A ASP 318.A N ASP 316.A OD1 no hydrogen 2.981 N/A VAL 319.A N LEU 333.A O no hydrogen 2.862 N/A LYS 320.A N SER 312.A O no hydrogen 2.968 N/A LYS 320.A NZ GLN 289.A O no hydrogen 2.895 N/A LYS 320.A NZ GLN 289.A OE1.A no hydrogen 3.401 N/A LYS 320.A NZ THR 332.A OG1 no hydrogen 2.752 N/A CYS 321.A N TRP 331.A O no hydrogen 2.899 N/A TRP 322.A N LEU 310.A O no hydrogen 2.740 N/A TRP 322.A NE1 SER 312.A OG no hydrogen 2.847 N/A ASP 323.A N GLU 328.A O no hydrogen 3.023 N/A ILE 324.A N GLN 308.A O no hydrogen 3.094 N/A ALA 325.A N ASP 323.A OD1 no hydrogen 2.942 N/A THR 326.A N ASP 323.A O no hydrogen 3.245 N/A LEU 327.A N ASP 323.A O no hydrogen 2.704 N/A GLU 328.A N THR 326.A OG1 no hydrogen 3.311 N/A CYS 329.A SG CYS 321.A O no hydrogen 3.824 N/A CYS 329.A SG TRP 331.A O no hydrogen 3.395 N/A CYS 329.A SG THR 332.A OG1 no hydrogen 3.568 N/A SER 330.A N CYS 321.A O no hydrogen 2.687 N/A TRP 331.A N CYS 321.A O no hydrogen 3.416 N/A LEU 333.A N VAL 319.A O no hydrogen 2.770 N/A SER 335.A OG SER 9.A OG no hydrogen 2.847 N/A SER 335.A OG ARG 317.A O no hydrogen 2.494 N/A LEU 336.A N PRO 7.A O no hydrogen 2.887 N/A GLY 337.A N ASP 359.A OD2 no hydrogen 2.819 N/A ALA 340.A N ALA 652.A O no hydrogen 3.120 N/A TYR 341.A N GLY 356.A O no hydrogen 2.858 N/A ALA 344.A N ALA 354.A O no hydrogen 2.928 N/A SER 346.A N SER 352.A O no hydrogen 2.879 N/A SER 347.A OG.B PRO 394.A O no hydrogen 2.822 N/A VAL 348.A N SER 346.A OG no hydrogen 2.943 N/A ASP 349.A N SER 346.A OG no hydrogen 2.943 N/A SER 352.A N ASP 349.A O no hydrogen 2.995 N/A LEU 353.A N TRP 365.A O no hydrogen 2.975 N/A ALA 354.A N ALA 344.A O no hydrogen 2.757 N/A ILE 355.A N ARG 363.A O no hydrogen 2.840 N/A GLY 356.A N SER 342.A O no hydrogen 2.861 N/A GLY 358.A N PHE 339.A O no hydrogen 2.931 N/A GLY 360.A N VAL 357.A O no hydrogen 3.401 N/A MET 361.A N ASP 359.A OD1 no hydrogen 3.277 N/A ILE 362.A N PHE 379.A O no hydrogen 2.915 N/A ARG 363.A N ILE 355.A O no hydrogen 3.107 N/A ARG 363.A NH1 ASP 359.A OD1 no hydrogen 2.847 N/A ARG 363.A NH1 ASP 359.A OD2 no hydrogen 3.405 N/A ARG 363.A NH1 MET 361.A O no hydrogen 3.017 N/A ARG 363.A NH2 SER 335.A O no hydrogen 3.035 N/A ARG 363.A NH2 ASP 359.A OD2 no hydrogen 2.774 N/A VAL 364.A N LYS 377.A O no hydrogen 2.824 N/A TRP 365.A N LEU 353.A O no hydrogen 2.831 N/A TRP 365.A NE1 ASN 373.A O no hydrogen 3.218 N/A ASN 366.A N ASP 375.A O no hydrogen 2.772 N/A ASN 366.A ND2 ASP 375.A OD2 no hydrogen 3.526 N/A THR 367.A N GLY 351.A O no hydrogen 3.159 N/A THR 367.A OG1 GLY 351.A O no hydrogen 2.741 N/A SER 369.A N ASN 366.A O no hydrogen 3.204 N/A SER 369.A OG ASP 375.A OD2 no hydrogen 3.378 N/A TYR 374.A N ASN 372.A OD1 no hydrogen 2.850 N/A TYR 374.A OH THR 5.A O no hydrogen 3.341 N/A LYS 377.A N VAL 364.A O no hydrogen 2.920 N/A PHE 379.A N ILE 362.A O no hydrogen 2.871 N/A GLN 381.A NE2 ASN 417.A O no hydrogen 2.813 N/A VAL 383.A N TRP 380.A O no hydrogen 3.104 N/A SER 385.A OG ASP 406.A OD2 no hydrogen 3.296 N/A LYS 386.A N ASP 405.A OD1.B no hydrogen 3.159 N/A VAL 387.A N VAL 357.A O no hydrogen 3.159 N/A THR 388.A N GLY 403.A O no hydrogen 2.964 N/A THR 388.A OG1 GLY 403.A O no hydrogen 3.419 N/A THR 388.A OG1 VAL 431.A O no hydrogen 2.793 N/A ALA 389.A N GLY 403.A O no hydrogen 3.354 N/A CYS 391.A N ALA 401.A O no hydrogen 2.954 N/A CYS 391.A SG TRP 392.A O no hydrogen 3.780 N/A CYS 391.A SG LEU 434.A O no hydrogen 3.789 N/A TRP 392.A NE1 ALA 344.A O no hydrogen 2.953 N/A HIS 393.A N CYS 399.A O no hydrogen 2.898 N/A THR 395.A N HIS 393.A ND1 no hydrogen 3.160 N/A LYS 396.A N HIS 393.A ND1 no hydrogen 3.083 N/A CYS 399.A N LYS 396.A O no hydrogen 3.334 N/A LEU 400.A N TYR 412.A O no hydrogen 2.868 N/A ALA 401.A N CYS 391.A O no hydrogen 3.005 N/A PHE 402.A N GLY 410.A O no hydrogen 2.886 N/A GLY 403.A N ALA 389.A O no hydrogen 2.893 N/A THR 404.A N LYS 408.A O no hydrogen 2.948 N/A THR 404.A OG1 SER 385.A OG no hydrogen 3.427 N/A THR 404.A OG1 ASP 406.A OD1 no hydrogen 2.617 N/A ASP 405.A N LYS 386.A O no hydrogen 2.882 N/A ASP 406.A N THR 404.A OG1 no hydrogen 3.255 N/A GLY 407.A N THR 404.A O no hydrogen 3.042 N/A LYS 408.A N THR 404.A OG1 no hydrogen 3.205 N/A LYS 408.A NZ GLY 382.A O no hydrogen 2.942 N/A LYS 408.A NZ VAL 383.A O no hydrogen 2.747 N/A GLY 410.A N PHE 402.A O no hydrogen 2.915 N/A LEU 411.A N GLN 421.A O no hydrogen 2.840 N/A TYR 412.A N LEU 400.A O no hydrogen 2.742 N/A TYR 412.A OH GLN 381.A O no hydrogen 2.511 N/A THR 414.A N GLY 398.A O no hydrogen 2.798 N/A THR 414.A OG1 GLY 398.A O no hydrogen 3.396 N/A TYR 415.A N ASP 413.A OD1 no hydrogen 2.947 N/A TYR 415.A OH ASP 349.A OD1 no hydrogen 3.288 N/A TYR 415.A OH ASP 349.A OD2 no hydrogen 2.628 N/A SER 416.A N ASP 413.A O no hydrogen 3.090 N/A SER 416.A OG ASP 413.A O no hydrogen 3.045 N/A LYS 418.A N SER 416.A OG no hydrogen 3.095 N/A GLN 421.A N LEU 411.A O no hydrogen 3.001 N/A SER 423.A N VAL 409.A O no hydrogen 2.839 N/A SER 423.A OG THR 425.A O no hydrogen 2.900 N/A SER 423.A OG HIS 460.A ND1 no hydrogen 3.304 N/A SER 424.A N LEU 465.A O no hydrogen 3.318 N/A SER 424.A OG.A SER 466.A O no hydrogen 2.674 N/A SER 424.A OG.B SER 466.A O no hydrogen 2.598 N/A THR 425.A N SER 423.A OG no hydrogen 3.230 N/A HIS 427.A N GLY 407.A O no hydrogen 2.873 N/A HIS 427.A ND1 GLU 454.A OE2 no hydrogen 2.792 N/A HIS 427.A NE2 SER 450.A OG no hydrogen 2.708 N/A LYS 429.A N GLU 454.A OE1 no hydrogen 3.055 N/A THR 430.A OG1 ASP 405.A O no hydrogen 3.369 N/A THR 430.A OG1 ASP 405.A OD1.A no hydrogen 2.569 N/A VAL 431.A N THR 404.A O no hydrogen 3.017 N/A TYR 432.A N CYS 451.A O no hydrogen 2.915 N/A THR 433.A OG1 GLU 491.A OE1 no hydrogen 2.501 N/A ALA 435.A N TYR 449.A O no hydrogen 2.959 N/A TRP 436.A NE1 CYS 391.A O no hydrogen 3.232 N/A GLY 437.A N ALA 447.A O no hydrogen 3.031 N/A VAL 440.A N GLN 459.A OE1 no hydrogen 2.892 N/A MET 443.A N VAL 440.A O no hydrogen 2.990 N/A ALA 447.A N GLY 437.A O no hydrogen 2.777 N/A LEU 448.A N HIS 460.A O no hydrogen 3.073 N/A TYR 449.A N ALA 435.A O no hydrogen 2.706 N/A TYR 449.A OH PRO 438.A O no hydrogen 2.626 N/A SER 450.A N LEU 458.A O no hydrogen 2.842 N/A SER 450.A OG HIS 427.A NE2 no hydrogen 2.708 N/A SER 450.A OG HIS 460.A NE2 no hydrogen 2.755 N/A CYS 451.A N THR 433.A O no hydrogen 2.987 N/A CYS 451.A SG GLY 452.A O no hydrogen 3.982 N/A CYS 451.A SG HIS 489.A O no hydrogen 3.306 N/A GLY 452.A N ILE 456.A O no hydrogen 3.126 N/A GLY 453.A N THR 430.A O no hydrogen 2.757 N/A GLU 454.A N GLU 454.A OE1 no hydrogen 2.758 N/A GLY 455.A N GLY 452.A O no hydrogen 2.907 N/A ILE 456.A N GLU 454.A OE2 no hydrogen 3.409 N/A LEU 458.A N SER 450.A O no hydrogen 2.876 N/A GLN 459.A N PHE 470.A O no hydrogen 2.866 N/A GLN 459.A NE2 VAL 440.A O no hydrogen 3.033 N/A HIS 460.A N LEU 448.A O no hydrogen 2.859 N/A HIS 460.A NE2 SER 450.A OG no hydrogen 2.755 N/A TRP 463.A N ASN 461.A OD1 no hydrogen 2.794 N/A LYS 464.A N ASN 461.A O no hydrogen 2.954 N/A GLY 467.A N LYS 464.A O no hydrogen 3.021 N/A PHE 470.A N GLN 459.A O no hydrogen 2.996 N/A ILE 472.A N VAL 457.A O no hydrogen 3.054 N/A ASN 473.A N ASP 471.A OD1 no hydrogen 2.865 N/A LYS 474.A N ASP 471.A O no hydrogen 3.379 N/A ILE 476.A N ILE 472.A O no hydrogen 3.010 N/A ARG 477.A N ASN 473.A O no hydrogen 2.885 N/A ARG 477.A NH1 ILE 482.A O no hydrogen 2.858 N/A ARG 477.A NH1 TYR 484.A O no hydrogen 3.297 N/A ARG 477.A NH2 TYR 484.A O no hydrogen 2.989 N/A ASP 478.A N LYS 474.A O no hydrogen 2.971 N/A THR 479.A N LEU 475.A O no hydrogen 2.839 N/A THR 479.A OG1 LEU 475.A O no hydrogen 3.110 N/A THR 479.A OG1 ASN 517.A O no hydrogen 2.729 N/A ASN 480.A N ILE 476.A O no hydrogen 3.085 N/A ASN 480.A ND2 ILE 476.A O no hydrogen 2.851 N/A ASN 480.A ND2 LEU 518.A O no hydrogen 2.985 N/A ILE 482.A N ARG 477.A O no hydrogen 3.108 N/A LYS 483.A NZ SER 481.A O no hydrogen 3.294 N/A HIS 489.A N GLY 455.A O no hydrogen 3.099 N/A HIS 489.A ND1 ASN 505.A OD1 no hydrogen 2.671 N/A HIS 489.A NE2 ASN 473.A OD1 no hydrogen 2.774 N/A THR 490.A N GLY 504.A O no hydrogen 2.729 N/A THR 490.A OG1 VAL 531.A O no hydrogen 2.742 N/A GLU 491.A N GLY 504.A O no hydrogen 3.311 N/A SER 493.A N ALA 502.A O no hydrogen 2.935 N/A SER 493.A OG ILE 534.A O no hydrogen 3.371 N/A LYS 495.A N ILE 500.A O no hydrogen 2.826 N/A LYS 495.A NZ ASP 497.A OD2 no hydrogen 2.875 N/A GLY 498.A N LYS 495.A O no hydrogen 2.879 N/A LYS 499.A N ASP 497.A OD1 no hydrogen 3.028 N/A MET 501.A N PHE 513.A O no hydrogen 2.938 N/A ALA 502.A N SER 493.A O no hydrogen 2.823 N/A LEU 503.A N GLU 511.A O no hydrogen 2.868 N/A GLY 504.A N GLU 491.A O no hydrogen 2.882 N/A ASN 505.A N SER 509.A O no hydrogen 2.954 N/A ASN 505.A ND2 SER 509.A O no hydrogen 3.598 N/A ASN 505.A ND2 SER 509.A OG no hydrogen 3.074 N/A ASN 505.A ND2 GLU 511.A OE1 no hydrogen 3.210 N/A GLU 506.A N VAL 488.A O no hydrogen 2.848 N/A GLY 508.A N ASN 505.A O no hydrogen 3.028 N/A SER 509.A N ASP 507.A OD1 no hydrogen 2.948 N/A SER 509.A OG ASP 507.A OD1 no hydrogen 2.721 N/A ILE 510.A N ILE 524.A O no hydrogen 2.994 N/A GLU 511.A N LEU 503.A O no hydrogen 2.862 N/A ILE 512.A N CYS 522.A O no hydrogen 2.932 N/A PHE 513.A N MET 501.A O no hydrogen 2.905 N/A GLN 514.A N LYS 519.A O no hydrogen 2.912 N/A GLN 514.A NE2 SER 571.A OG no hydrogen 2.942 N/A ILE 515.A N LYS 499.A O no hydrogen 3.087 N/A LEU 520.A N ASN 480.A OD1 no hydrogen 2.837 N/A ILE 521.A N ILE 512.A O no hydrogen 2.842 N/A CYS 522.A SG VAL 576.A O no hydrogen 3.802 N/A THR 523.A N VAL 576.A O no hydrogen 2.937 N/A ILE 524.A N ILE 510.A O no hydrogen 2.768 N/A GLN 525.A N ILE 578.A O no hydrogen 2.871 N/A GLN 526.A NE2 THR 579.A O no hydrogen 3.050 N/A HIS 527.A NE2 SER 552.A OG no hydrogen 2.722 N/A VAL 531.A N ASN 505.A O no hydrogen 3.223 N/A ASN 532.A N GLY 553.A O no hydrogen 2.778 N/A ASN 532.A ND2 ASN 555.A OD1 no hydrogen 2.862 N/A ASN 532.A ND2 ILE 592.A O no hydrogen 3.052 N/A THR 533.A N GLY 553.A O no hydrogen 3.149 N/A ILE 534.A N GLU 491.A OE2 no hydrogen 3.017 N/A SER 535.A N ALA 551.A O no hydrogen 2.986 N/A TRP 536.A NE1 SER 493.A O no hydrogen 3.259 N/A HIS 537.A N LEU 549.A O no hydrogen 3.015 N/A HIS 537.A ND1 HIS 538.A O no hydrogen 2.852 N/A HIS 538.A NE2 HIS 601.A O no hydrogen 2.942 N/A HIS 540.A N HIS 538.A ND1 no hydrogen 3.215 N/A HIS 540.A NE2 PRO 599.A O no hydrogen 2.815 N/A SER 542.A N ASP 602.A OD1 no hydrogen 2.887 N/A SER 542.A OG ASP 602.A OD2 no hydrogen 2.477 N/A LEU 546.A N GLN 543.A O no hydrogen 3.453 N/A SER 547.A N PRO 544.A O no hydrogen 3.225 N/A SER 547.A OG PRO 544.A O no hydrogen 3.168 N/A TYR 548.A N GLU 545.A O no hydrogen 3.141 N/A TYR 548.A OH GLU 569.A OE2 no hydrogen 3.294 N/A LEU 549.A N LEU 546.A O no hydrogen 2.993 N/A MET 550.A N HIS 562.A O no hydrogen 2.806 N/A ALA 551.A N SER 535.A O no hydrogen 2.863 N/A SER 552.A N TYR 560.A O no hydrogen 2.881 N/A SER 552.A OG HIS 527.A NE2 no hydrogen 2.722 N/A GLY 553.A N THR 533.A O no hydrogen 2.912 N/A SER 554.A OG HIS 527.A ND1 no hydrogen 3.099 N/A ASN 555.A N LEU 530.A O no hydrogen 3.033 N/A ASN 556.A N SER 554.A OG no hydrogen 3.081 N/A ILE 559.A N LEU 585.A O no hydrogen 3.030 N/A TYR 560.A N SER 552.A O no hydrogen 3.212 N/A VAL 561.A N ARG 583.A O no hydrogen 2.878 N/A HIS 562.A N MET 550.A O no hydrogen 2.885 N/A HIS 562.A NE2 GLN 526.A OE1 no hydrogen 2.914 N/A LEU 564.A N TYR 548.A O no hydrogen 2.921 N/A LYS 565.A N ASN 563.A OD1 no hydrogen 3.057 N/A ILE 568.A N LEU 564.A O no hydrogen 3.019 N/A GLU 569.A N LYS 565.A O no hydrogen 2.805 N/A SER 570.A N THR 566.A O no hydrogen 3.079 N/A SER 570.A OG THR 566.A O no hydrogen 3.534 N/A SER 570.A OG VAL 567.A O no hydrogen 3.308 N/A SER 571.A N ILE 568.A O no hydrogen 3.370 N/A VAL 576.A N ILE 521.A O no hydrogen 3.018 N/A ILE 578.A N THR 523.A O no hydrogen 2.873 N/A TYR 582.A N VAL 561.A O no hydrogen 2.868 N/A ARG 583.A N VAL 561.A O no hydrogen 3.098 N/A ARG 583.A NE LEU 620.A O no hydrogen 2.926 N/A ARG 583.A NH1 TYR 582.A O no hydrogen 2.810 N/A THR 584.A N GLU 622.A OE2 no hydrogen 2.796 N/A LEU 585.A N ILE 559.A O no hydrogen 2.750 N/A HIS 588.A ND1 ASP 611.A OD2 no hydrogen 2.801 N/A HIS 588.A NE2 SER 607.A OG no hydrogen 2.734 N/A THR 589.A N ASP 611.A OD2 no hydrogen 3.063 N/A LYS 591.A NZ ASN 532.A OD1 no hydrogen 3.146 N/A LYS 591.A NZ ASN 555.A OD1 no hydrogen 2.847 N/A ILE 592.A N SER 554.A O no hydrogen 3.123 N/A THR 593.A N ALA 608.A O no hydrogen 2.995 N/A THR 593.A OG1 ALA 608.A O no hydrogen 3.333 N/A THR 593.A OG1 LEU 635.A O no hydrogen 2.795 N/A VAL 595.A N THR 533.A OG1 no hydrogen 3.000 N/A ALA 596.A N VAL 606.A O no hydrogen 2.935 N/A TRP 597.A NE1 SER 535.A O no hydrogen 2.922 N/A SER 598.A N ARG 604.A O no hydrogen 2.657 N/A SER 598.A OG HIS 601.A ND1 no hydrogen 2.627 N/A HIS 600.A N SER 598.A OG no hydrogen 2.902 N/A HIS 600.A NE2 SER 641.A O no hydrogen 3.145 N/A HIS 601.A ND1 SER 598.A OG no hydrogen 2.627 N/A GLY 603.A N HIS 537.A NE2 no hydrogen 2.978 N/A LEU 605.A N TRP 617.A O no hydrogen 3.024 N/A VAL 606.A N ALA 596.A O no hydrogen 2.801 N/A SER 607.A N GLN 615.A O no hydrogen 2.846 N/A SER 607.A OG HIS 588.A NE2 no hydrogen 2.734 N/A SER 607.A OG GLN 615.A O no hydrogen 3.306 N/A ALA 608.A N SER 594.A O no hydrogen 2.798 N/A SER 609.A N THR 613.A O no hydrogen 3.157 N/A SER 609.A OG ALA 590.A O no hydrogen 3.153 N/A SER 609.A OG LYS 591.A O no hydrogen 3.088 N/A TYR 610.A N LYS 591.A O no hydrogen 2.904 N/A ASP 611.A N SER 609.A OG no hydrogen 3.003 N/A GLY 612.A N SER 609.A O no hydrogen 3.056 N/A THR 613.A N ASP 611.A OD1 no hydrogen 2.968 N/A THR 613.A OG1 ASP 611.A OD1 no hydrogen 2.834 N/A ALA 614.A N PHE 628.A O no hydrogen 3.106 N/A GLN 615.A N SER 607.A O no hydrogen 2.940 N/A GLN 615.A NE2 VAL 616.A O no hydrogen 2.848 N/A GLN 615.A NE2 SER 668.A O no hydrogen 2.940 N/A VAL 616.A N CYS 626.A O no hydrogen 2.824 N/A TRP 617.A N LEU 605.A O no hydrogen 2.760 N/A TRP 617.A NE1 SER 607.A OG no hydrogen 2.886 N/A ASP 618.A N GLU 623.A O no hydrogen 2.835 N/A ALA 619.A N GLY 603.A O no hydrogen 2.781 N/A ARG 621.A N ASP 618.A O no hydrogen 3.212 N/A ARG 621.A N ASP 618.A OD1 no hydrogen 3.192 N/A GLU 622.A N ALA 619.A O no hydrogen 3.146 N/A GLU 623.A N ASP 618.A O no hydrogen 2.964 N/A LEU 625.A N VAL 616.A O no hydrogen 2.730 N/A CYS 626.A N VAL 616.A O no hydrogen 3.461 N/A CYS 626.A SG THR 662.A O no hydrogen 3.267 N/A ASN 627.A N HIS 667.A O no hydrogen 3.019 N/A ASN 627.A ND2 THR 613.A OG1 no hydrogen 3.077 N/A ASN 627.A ND2 GLN 615.A OE1 no hydrogen 2.812 N/A PHE 628.A N ALA 614.A O no hydrogen 2.836 N/A ARG 629.A NE ASN 627.A OD1 no hydrogen 2.844 N/A ARG 629.A NH2 ARG 669.A O no hydrogen 2.876 N/A HIS 631.A ND1 ASP 654.A OD2 no hydrogen 3.020 N/A HIS 631.A NE2 SER 650.A OG no hydrogen 2.728 N/A GLN 632.A N ASP 654.A OD2 no hydrogen 2.961 N/A GLY 633.A N ASP 654.A OD2 no hydrogen 3.179 N/A ARG 634.A N ASP 653.A OD1 no hydrogen 2.722 N/A ARG 634.A NE ASP 653.A OD2 no hydrogen 2.989 N/A ARG 634.A NH1 ASP 653.A OD2 no hydrogen 3.445 N/A LEU 635.A N SER 609.A O no hydrogen 3.255 N/A LEU 636.A N GLY 651.A O no hydrogen 2.935 N/A CYS 637.A N GLY 651.A O no hydrogen 3.380 N/A CYS 637.A SG ALA 340.A O no hydrogen 3.295 N/A ALA 639.A N TYR 649.A O no hydrogen 2.772 N/A TRP 640.A NE1.A PRO 645.A O no hydrogen 2.969 N/A TRP 640.A NE1.B ALA 596.A O no hydrogen 3.049 N/A SER 641.A N CYS 647.A O no hydrogen 2.820 N/A SER 641.A OG ASP 644.A O no hydrogen 2.728 N/A SER 641.A OG CYS 647.A O no hydrogen 3.042 N/A ASP 644.A N SER 641.A OG no hydrogen 3.192 N/A ASP 646.A N ASP 644.A OD1 no hydrogen 3.020 N/A CYS 647.A N ASP 644.A O no hydrogen 2.977 N/A CYS 647.A SG.A TRP 660.A O no hydrogen 3.718 N/A CYS 647.A SG.B ASP 644.A OD2 no hydrogen 2.456 N/A ILE 648.A N TRP 660.A O no hydrogen 2.936 N/A TYR 649.A N ALA 639.A O no hydrogen 2.963 N/A SER 650.A N HIS 658.A O no hydrogen 2.941 N/A SER 650.A OG HIS 631.A NE2 no hydrogen 2.728 N/A GLY 651.A N CYS 637.A O no hydrogen 2.940 N/A ALA 652.A N CYS 656.A O no hydrogen 3.231 N/A ASP 653.A N ARG 634.A O no hydrogen 2.970 N/A PHE 655.A N ALA 652.A O no hydrogen 3.313 N/A CYS 656.A N ASP 654.A OD1 no hydrogen 3.029 N/A CYS 656.A SG ASP 654.A O no hydrogen 3.642 N/A VAL 657.A N LEU 6.A O no hydrogen 3.099 N/A HIS 658.A N SER 650.A O no hydrogen 2.942 N/A HIS 658.A ND1 THR 5.A OG1 no hydrogen 2.875 N/A LYS 659.A N ARG 4.A O no hydrogen 2.765 N/A TRP 660.A N ILE 648.A O no hydrogen 2.859 N/A TRP 660.A NE1 SER 650.A OG no hydrogen 3.076 N/A THR 662.A N ASP 646.A O no hydrogen 2.721 N/A THR 662.A OG1 ASP 646.A O no hydrogen 3.512 N/A THR 662.A OG1 ASP 646.A OD1 no hydrogen 2.244 N/A SER 663.A N ASP 646.A OD1 no hydrogen 2.732 N/A SER 663.A OG ASP 646.A OD1 no hydrogen 3.553 N/A SER 663.A OG ASP 646.A OD2 no hydrogen 2.586 N/A MET 664.A N LEU 661.A O no hydrogen 3.080 N/A GLN 665.A N THR 662.A O no hydrogen 3.220 N/A GLN 665.A NE2 LEU 661.A O no hydrogen 3.005 N/A