Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 6qkr_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): MET 1.A N GLU 3.A OE1 no hydrogen 2.895 N/A MET 1.A N GLU 3.A OE2 no hydrogen 3.331 N/A TYR 2.A OH ASP 314.A OD1 no hydrogen 2.829 N/A ASN 4.A N GLU 317.A OE2 no hydrogen 3.172 N/A LEU 5.A N GLU 317.A OE1 no hydrogen 2.818 N/A CYS 6.A N TYR 2.A O no hydrogen 3.013 N/A CYS 6.A SG TYR 2.A O no hydrogen 3.268 N/A LYS 7.A N ASN 4.A O no hydrogen 3.456 N/A ILE 9.A N VAL 16.A O no hydrogen 2.886 N/A LYS 10.A NZ ASN 13.A O no hydrogen 3.009 N/A ILE 11.A N HIS 14.A O no hydrogen 2.884 N/A HIS 14.A N ILE 11.A O no hydrogen 3.149 N/A VAL 16.A N ILE 9.A O no hydrogen 2.699 N/A ASN 18.A ND2 GLY 52.A O no hydrogen 2.872 N/A ARG 19.A N LEU 5.A O no hydrogen 2.971 N/A ARG 19.A NE LYS 7.A O no hydrogen 2.969 N/A ARG 19.A NE PRO 8.A O no hydrogen 3.176 N/A ARG 19.A NH1 ASP 326.A O no hydrogen 2.803 N/A ARG 19.A NH2 PRO 8.A O no hydrogen 3.325 N/A MET 20.A N ASN 18.A OD1 no hydrogen 2.817 N/A LYS 21.A N TRP 328.A O no hydrogen 2.914 N/A LYS 21.A NZ GLU 178.A OE1 no hydrogen 2.887 N/A LYS 21.A NZ GLU 329.A OE2 no hydrogen 2.773 N/A TYR 22.A N ILE 55.A O no hydrogen 2.818 N/A ALA 23.A N MET 330.A O no hydrogen 2.890 N/A THR 25.A OG1 TYR 22.A OH no hydrogen 2.726 N/A THR 25.A OG1 ALA 23.A O no hydrogen 2.947 N/A ASN 28.A ND2 VAL 366.A O no hydrogen 3.145 N/A ASN 28.A ND2 ALA 370.A O no hydrogen 3.016 N/A PHE 29.A N ASP 27.A OD1 no hydrogen 3.102 N/A ASP 31.A N ASN 36.A O no hydrogen 2.887 N/A LYS 33.A N ASP 31.A OD1 no hydrogen 3.037 N/A LYS 33.A NZ ASP 31.A OD1 no hydrogen 2.767 N/A LYS 33.A NZ ASP 31.A OD2 no hydrogen 2.986 N/A ASN 34.A ND2 ASP 31.A OD2 no hydrogen 3.463 N/A GLY 35.A N ASP 31.A O no hydrogen 2.921 N/A ASN 36.A N ASN 34.A OD1 no hydrogen 3.016 N/A GLU 41.A N ILE 38.A O no hydrogen 3.007 N/A ILE 42.A N ILE 38.A O no hydrogen 3.161 N/A GLU 43.A N ASP 39.A O no hydrogen 2.964 N/A TYR 44.A N ARG 40.A O no hydrogen 3.158 N/A TYR 44.A OH TYR 22.A OH no hydrogen 2.561 N/A LEU 45.A N GLU 41.A O no hydrogen 3.120 N/A ARG 46.A N ILE 42.A O no hydrogen 2.882 N/A ARG 46.A NE GLU 43.A OE1 no hydrogen 2.768 N/A ARG 46.A NH1 GLU 43.A OE2 no hydrogen 2.891 N/A GLU 47.A N GLU 43.A O no hydrogen 3.156 N/A ARG 48.A NE TYR 44.A O no hydrogen 3.059 N/A ARG 48.A NH1 GLY 334.A O no hydrogen 2.794 N/A ARG 48.A NH1 ILE 335.A O no hydrogen 3.167 N/A ARG 48.A NH2 TYR 44.A O no hydrogen 3.331 N/A ALA 49.A N LEU 45.A O no hydrogen 3.066 N/A LYS 50.A N ARG 46.A O no hydrogen 2.807 N/A GLY 51.A N GLU 47.A O no hydrogen 2.862 N/A GLY 52.A N ALA 49.A O no hydrogen 3.343 N/A GLY 54.A N ASN 18.A OD1 no hydrogen 3.130 N/A GLY 54.A N MET 20.A O no hydrogen 2.962 N/A ILE 55.A N MET 20.A O no hydrogen 3.471 N/A VAL 56.A N MET 98.A O no hydrogen 3.031 N/A VAL 57.A N TYR 22.A O no hydrogen 3.013 N/A SER 58.A N ILE 100.A O no hydrogen 2.864 N/A SER 58.A OG GLN 59.A O no hydrogen 2.897 N/A GLN 59.A NE2 GLU 41.A OE2 no hydrogen 2.990 N/A GLY 61.A N GLN 102.A O no hydrogen 3.027 N/A TYR 62.A N MET 74.A O no hydrogen 2.981 N/A HIS 64.A NE2 ILE 121.A O no hydrogen 3.028 N/A LEU 66.A N HIS 64.A ND1 no hydrogen 3.216 N/A GLY 67.A N HIS 64.A O no hydrogen 2.863 N/A LYS 68.A N ILE 65.A O no hydrogen 3.055 N/A LYS 68.A NZ THR 32.A O no hydrogen 3.088 N/A LYS 68.A NZ VAL 71.A O no hydrogen 3.206 N/A GLY 69.A N GLN 73.A OE1 no hydrogen 2.784 N/A TYR 70.A OH TYR 185.A OH no hydrogen 2.669 N/A VAL 71.A N ASP 369.A OD1 no hydrogen 2.974 N/A GLY 72.A N ASN 28.A OD1 no hydrogen 2.932 N/A GLN 73.A N TYR 70.A O no hydrogen 3.112 N/A GLN 73.A NE2 GLY 60.A O no hydrogen 2.894 N/A GLN 73.A NE2 MET 104.A O no hydrogen 3.063 N/A MET 74.A N GLN 59.A OE1 no hydrogen 2.883 N/A GLY 75.A N GLY 35.A O no hydrogen 2.801 N/A LEU 76.A N TYR 62.A O no hydrogen 2.949 N/A VAL 77.A N HIS 81.A ND1 no hydrogen 3.160 N/A GLU 78.A N HIS 81.A ND1 no hydrogen 3.164 N/A HIS 81.A N GLU 78.A O no hydrogen 3.094 N/A HIS 81.A NE2 ASN 34.A O no hydrogen 2.785 N/A LEU 82.A N GLU 79.A O no hydrogen 3.205 N/A LEU 85.A N HIS 81.A O no hydrogen 3.283 N/A LYS 86.A N LEU 82.A O no hydrogen 3.067 N/A LYS 87.A N PRO 83.A O no hydrogen 3.136 N/A LEU 88.A N GLY 84.A O no hydrogen 3.029 N/A ALA 89.A N LEU 85.A O no hydrogen 3.094 N/A ASP 90.A N LYS 86.A O no hydrogen 3.022 N/A ALA 91.A N LYS 87.A O no hydrogen 3.117 N/A ILE 92.A N LEU 88.A O no hydrogen 3.211 N/A ASN 93.A N ALA 89.A O no hydrogen 2.833 N/A ASN 93.A ND2 GLY 173.A O no hydrogen 3.100 N/A ALA 94.A N ASP 90.A O no hydrogen 3.028 N/A GLU 95.A N ILE 92.A O no hydrogen 3.206 N/A GLY 96.A N ASN 93.A O no hydrogen 2.887 N/A MET 98.A N GLY 54.A O no hydrogen 2.800 N/A SER 99.A OG ASN 93.A OD1 no hydrogen 2.743 N/A ILE 100.A N VAL 56.A O no hydrogen 3.053 N/A GLY 101.A N GLY 176.A O no hydrogen 2.935 N/A GLN 102.A N SER 58.A OG no hydrogen 2.889 N/A GLN 102.A NE2 GLU 178.A OE2 no hydrogen 2.902 N/A ILE 103.A N GLU 178.A O no hydrogen 3.057 N/A MET 104.A N GLY 61.A O no hydrogen 2.794 N/A THR 106.A N GLY 67.A O no hydrogen 2.993 N/A THR 106.A OG1 GLY 67.A O no hydrogen 2.677 N/A GLY 107.A N HIS 105.A ND1 no hydrogen 3.037 N/A ARG 108.A N ASP 189.A OD2 no hydrogen 3.039 N/A ARG 108.A NH1 GLU 273.A OE1 no hydrogen 2.975 N/A ARG 108.A NH2 GLU 273.A OE1 no hydrogen 3.332 N/A ARG 108.A NH2 GLU 273.A OE2 no hydrogen 2.686 N/A TYR 109.A N THR 106.A O no hydrogen 2.907 N/A TYR 109.A OH GLU 273.A OE1 no hydrogen 2.623 N/A GLY 110.A N GLY 107.A O no hydrogen 2.963 N/A HIS 111.A N LYS 68.A O no hydrogen 2.983 N/A HIS 111.A ND1 GLY 69.A O no hydrogen 3.241 N/A HIS 113.A NE2.B GLU 114.A OE2 no hydrogen 2.783 N/A GLU 114.A N HIS 111.A O no hydrogen 2.870 N/A TYR 115.A N ALA 112.A O no hydrogen 2.930 N/A ILE 117.A N ALA 112.A O no hydrogen 3.186 N/A ALA 120.A N VAL 127.A O no hydrogen 3.062 N/A ALA 122.A N LYS 125.A O no hydrogen 2.834 N/A GLY 123.A N GLU 157.A OE1 no hydrogen 2.764 N/A LYS 125.A N ALA 122.A O no hydrogen 3.274 N/A VAL 127.A N ALA 120.A O no hydrogen 2.754 N/A GLY 133.A N ARG 148.A O no hydrogen 3.063 N/A SER 139.A OG ILE 141.A O no hydrogen 3.199 N/A SER 139.A OG GLU 273.A OE2 no hydrogen 2.750 N/A ILE 141.A N SER 139.A OG no hydrogen 3.238 N/A ARG 143.A NH1 PHE 367.A O no hydrogen 2.930 N/A ARG 143.A NH2 PHE 367.A O no hydrogen 3.173 N/A TYR 144.A N ILE 141.A O no hydrogen 3.312 N/A CYS 147.A N MET 137.A O no hydrogen 2.890 N/A CYS 147.A SG THR 135.A O no hydrogen 3.185 N/A CYS 147.A SG MET 137.A O no hydrogen 3.552 N/A ARG 148.A N PRO 131.A O no hydrogen 2.887 N/A ARG 148.A NH1 GLU 154.A OE1 no hydrogen 3.399 N/A ARG 148.A NH1 GLU 154.A OE2 no hydrogen 2.908 N/A ARG 148.A NH2 GLU 154.A OE1 no hydrogen 2.867 N/A MET 150.A N GLY 133.A O no hydrogen 3.140 N/A THR 151.A N GLU 154.A OE2 no hydrogen 2.972 N/A THR 151.A OG1 GLU 154.A OE2 no hydrogen 3.534 N/A GLU 154.A N THR 151.A OG1 no hydrogen 3.243 N/A ILE 155.A N THR 151.A O no hydrogen 3.092 N/A GLU 156.A N PRO 152.A O no hydrogen 2.947 N/A GLU 157.A N GLU 153.A O no hydrogen 2.970 N/A GLN 158.A N GLU 154.A O no hydrogen 3.005 N/A GLN 158.A NE2 THR 63.A OG1 no hydrogen 2.574 N/A ILE 159.A N ILE 155.A O no hydrogen 3.369 N/A GLN 160.A N GLU 156.A O no hydrogen 3.208 N/A ALA 161.A N GLU 157.A O no hydrogen 2.854 N/A HIS 162.A N GLN 158.A O no hydrogen 2.909 N/A HIS 162.A ND1 GLN 158.A O no hydrogen 2.780 N/A ILE 163.A N ILE 159.A O no hydrogen 3.085 N/A VAL 164.A N GLN 160.A O no hydrogen 3.021 N/A ALA 165.A N ALA 161.A O no hydrogen 2.962 N/A ALA 166.A N HIS 162.A O no hydrogen 3.100 N/A ARG 167.A N ILE 163.A O no hydrogen 2.983 N/A ARG 167.A NE GLU 223.A OE1 no hydrogen 3.488 N/A ARG 167.A NE GLU 223.A OE2 no hydrogen 3.333 N/A ARG 167.A NH2 GLU 223.A OE1 no hydrogen 3.431 N/A MET 168.A N VAL 164.A O no hydrogen 2.888 N/A PHE 169.A N ALA 165.A O no hydrogen 3.102 N/A LYS 170.A N ALA 166.A O no hydrogen 3.043 N/A LYS 170.A NZ VAL 224.A O no hydrogen 3.525 N/A GLN 171.A N ARG 167.A O no hydrogen 2.959 N/A THR 172.A N PHE 169.A O no hydrogen 3.203 N/A THR 172.A OG1 MET 168.A O no hydrogen 2.690 N/A THR 172.A OG1 PHE 169.A O no hydrogen 3.075 N/A GLY 173.A N LYS 170.A O no hydrogen 3.357 N/A TRP 174.A N PHE 169.A O no hydrogen 3.159 N/A TRP 174.A NE1 LEU 85.A O no hydrogen 2.911 N/A LYS 175.A N SER 99.A OG no hydrogen 2.964 N/A VAL 177.A N PRO 229.A O no hydrogen 3.176 N/A GLU 178.A N GLY 101.A O no hydrogen 2.793 N/A VAL 179.A N VAL 231.A O no hydrogen 3.072 N/A CYS 180.A N ILE 103.A O no hydrogen 3.231 N/A ALA 181.A N ARG 233.A O no hydrogen 3.083 N/A VAL 183.A N ASN 235.A OD1 no hydrogen 3.132 N/A TYR 185.A N ILE 182.A O no hydrogen 2.931 N/A TYR 185.A OH TYR 70.A OH no hydrogen 2.669 N/A LEU 186.A N HIS 105.A O no hydrogen 3.089 N/A ASP 189.A N TYR 185.A O no hydrogen 2.861 N/A PHE 190.A N LEU 186.A O no hydrogen 3.205 N/A LEU 191.A N ILE 187.A O no hydrogen 2.884 N/A SER 192.A N ALA 188.A O no hydrogen 2.973 N/A ARG 193.A N ASN 244.A OD1 no hydrogen 3.241 N/A ARG 193.A NH1 GLY 243.A O no hydrogen 2.874 N/A ARG 193.A NH2 GLU 248.A OE1 no hydrogen 2.787 N/A TRP 194.A N SER 192.A OG no hydrogen 2.959 N/A THR 195.A OG1 ASP 189.A O no hydrogen 2.683 N/A THR 195.A OG1 SER 192.A O no hydrogen 3.341 N/A ASN 196.A N SER 192.A O no hydrogen 2.998 N/A ASN 196.A ND2 PHE 190.A O no hydrogen 2.771 N/A ASN 196.A ND2 TRP 202.A O no hydrogen 2.875 N/A LYS 197.A N THR 135.A OG1 no hydrogen 2.873 N/A LYS 197.A NZ ARG 193.A O no hydrogen 2.849 N/A ARG 198.A N ASN 196.A OD1 no hydrogen 3.091 N/A ARG 198.A NE ASP 200.A OD1 no hydrogen 3.011 N/A ARG 198.A NH1 PRO 134.A O no hydrogen 2.770 N/A ARG 198.A NH1 MET 150.A O no hydrogen 3.114 N/A ARG 198.A NH2 ASP 200.A OD2 no hydrogen 2.792 N/A TRP 202.A N ASP 200.A OD1 no hydrogen 3.255 N/A ASN 208.A N SER 205.A OG no hydrogen 3.231 N/A ASN 208.A ND2 GLY 203.A O no hydrogen 2.936 N/A ARG 209.A N SER 205.A O no hydrogen 3.053 N/A ARG 209.A NE GLY 204.A O no hydrogen 3.115 N/A ARG 209.A NH2 GLY 204.A O no hydrogen 3.546 N/A ALA 210.A N LEU 206.A O no hydrogen 2.910 N/A ARG 211.A N ASN 208.A O no hydrogen 3.212 N/A ARG 211.A NE LYS 201.A O no hydrogen 2.774 N/A ARG 211.A NH2 ASN 208.A OD1 no hydrogen 2.863 N/A ILE 214.A N ALA 210.A O no hydrogen 2.892 N/A GLU 215.A N ARG 211.A O no hydrogen 2.841 N/A ILE 216.A N PHE 212.A O no hydrogen 2.954 N/A LEU 217.A N LEU 213.A O no hydrogen 2.847 N/A LYS 218.A N ILE 214.A O no hydrogen 2.847 N/A LYS 218.A NZ GLU 215.A OE2 no hydrogen 3.102 N/A GLY 219.A N GLU 215.A O no hydrogen 2.891 N/A ILE 220.A N ILE 216.A O no hydrogen 2.962 N/A ARG 221.A N LEU 217.A O no hydrogen 2.903 N/A ARG 221.A NH1 GLY 225.A O no hydrogen 2.839 N/A ARG 221.A NH1 TYR 228.A O no hydrogen 2.738 N/A ARG 221.A NH2 ARG 261.A O no hydrogen 2.739 N/A ARG 221.A NH2 ASP 263.A OD2 no hydrogen 3.410 N/A LYS 222.A N LYS 218.A O no hydrogen 3.107 N/A GLU 223.A N GLY 219.A O no hydrogen 3.245 N/A VAL 224.A N ILE 220.A O no hydrogen 2.952 N/A GLY 225.A N ARG 221.A O no hydrogen 2.939 N/A TYR 228.A OH TRP 174.A O no hydrogen 2.725 N/A LEU 230.A N ASP 263.A OD2 no hydrogen 2.811 N/A VAL 231.A N VAL 177.A O no hydrogen 2.811 N/A MET 232.A N LEU 264.A O no hydrogen 3.046 N/A ARG 233.A N VAL 179.A O no hydrogen 2.895 N/A ARG 233.A NE SER 266.A OG no hydrogen 2.795 N/A ARG 233.A NH2 SER 266.A OG no hydrogen 3.373 N/A ARG 233.A NH2 GLU 329.A OE1 no hydrogen 3.207 N/A LEU 234.A N SER 266.A O no hydrogen 3.027 N/A ASN 235.A ND2 THR 237.A O no hydrogen 3.098 N/A ASN 235.A ND2 GLY 270.A O no hydrogen 3.033 N/A SER 236.A N THR 268.A O no hydrogen 2.745 N/A SER 236.A OG THR 268.A O no hydrogen 2.814 N/A THR 237.A OG1 ASP 246.A OD1 no hydrogen 3.002 N/A ILE 240.A N ASP 238.A OD1 no hydrogen 2.956 N/A GLY 243.A N ILE 240.A O no hydrogen 3.336 N/A ASN 244.A N ASP 238.A OD2 no hydrogen 2.936 N/A ASN 244.A ND2 LEU 191.A O no hydrogen 2.932 N/A THR 245.A N GLU 248.A OE2 no hydrogen 3.389 N/A GLU 248.A N THR 245.A OG1 no hydrogen 3.073 N/A TYR 249.A N THR 245.A O no hydrogen 3.259 N/A TYR 249.A OH ASP 238.A OD2 no hydrogen 2.844 N/A ILE 250.A N ASP 246.A O no hydrogen 3.333 N/A GLU 251.A N GLU 247.A O no hydrogen 2.945 N/A ILE 252.A N GLU 248.A O no hydrogen 2.963 N/A ALA 253.A N TYR 249.A O no hydrogen 2.926 N/A LYS 254.A N ILE 250.A O no hydrogen 2.917 N/A LYS 254.A NZ ALA 298.A O no hydrogen 2.974 N/A MET 255.A N GLU 251.A O no hydrogen 3.051 N/A CYS 256.A N ILE 252.A O no hydrogen 2.989 N/A CYS 256.A SG ILE 252.A O no hydrogen 3.268 N/A GLU 257.A N ALA 253.A O no hydrogen 3.038 N/A ALA 258.A N LYS 254.A O no hydrogen 3.166 N/A ALA 259.A N MET 255.A O no hydrogen 3.158 N/A ALA 259.A N CYS 256.A O no hydrogen 3.276 N/A VAL 260.A N CYS 256.A O no hydrogen 3.025 N/A ARG 261.A NE ASP 263.A OD1 no hydrogen 2.705 N/A ARG 261.A NH1 ASP 226.A O no hydrogen 2.700 N/A ARG 261.A NH2 ASP 226.A O no hydrogen 3.196 N/A ARG 261.A NH2 ASP 263.A OD1 no hydrogen 3.056 N/A ASP 263.A N LEU 230.A O no hydrogen 2.811 N/A PHE 265.A N PRO 303.A O no hydrogen 2.918 N/A SER 266.A N MET 232.A O no hydrogen 2.818 N/A SER 266.A OG GLU 329.A OE1 no hydrogen 2.646 N/A SER 266.A OG GLU 329.A OE2 no hydrogen 3.292 N/A ILE 267.A N CYS 305.A O no hydrogen 3.077 N/A THR 268.A N LEU 234.A O no hydrogen 3.072 N/A THR 268.A OG1 LEU 234.A O no hydrogen 3.519 N/A GLY 270.A N THR 237.A O no hydrogen 2.902 N/A TRP 271.A N SER 274.A OG no hydrogen 3.055 N/A HIS 272.A N VAL 183.A O no hydrogen 3.174 N/A HIS 272.A NE2 TYR 185.A OH no hydrogen 3.169 N/A SER 274.A N TRP 271.A O no hydrogen 2.932 N/A SER 274.A OG ASP 238.A O no hydrogen 2.729 N/A SER 274.A OG LEU 239.A O no hydrogen 2.907 N/A SER 274.A OG TRP 271.A O no hydrogen 3.218 N/A THR 280.A OG1 GLU 282.A OE1 no hydrogen 2.749 N/A GLU 282.A N THR 280.A OG1 no hydrogen 3.371 N/A LYS 283.A N THR 280.A O no hydrogen 3.115 N/A ARG 284.A N ASP 287.A OD2 no hydrogen 2.800 N/A ASP 287.A N ARG 284.A O no hydrogen 3.082 N/A TRP 288.A NE1 ALA 278.A O no hydrogen 3.181 N/A LEU 289.A N GLY 286.A O no hydrogen 3.350 N/A LEU 291.A N TRP 288.A O no hydrogen 3.163 N/A ASP 293.A N LEU 289.A O no hydrogen 3.268 N/A ASN 294.A N HIS 290.A O no hydrogen 3.161 N/A TRP 295.A N LEU 291.A O no hydrogen 3.274 N/A LYS 296.A N ALA 292.A O no hydrogen 2.980 N/A LYS 296.A NZ ASP 326.A OD2 no hydrogen 2.660 N/A LYS 297.A N ASP 293.A O no hydrogen 2.901 N/A ALA 298.A N ASN 294.A O no hydrogen 3.050 N/A GLY 299.A N LYS 296.A O no hydrogen 3.151 N/A ILE 300.A N TRP 295.A O no hydrogen 3.327 N/A LYS 301.A N GLU 257.A OE1 no hydrogen 2.849 N/A ALA 302.A N GLU 257.A OE2 no hydrogen 2.873 N/A ILE 304.A N ASP 326.A OD2 no hydrogen 2.772 N/A CYS 305.A N PHE 265.A O no hydrogen 2.975 N/A CYS 305.A SG PHE 265.A O no hydrogen 3.823 N/A ARG 309.A NE LYS 283.A O no hydrogen 2.765 N/A ARG 309.A NH1 ASP 446.A OD2 no hydrogen 3.139 N/A ARG 309.A NH2 LYS 283.A O no hydrogen 3.472 N/A ARG 309.A NH2 TYR 445.A OH no hydrogen 2.736 N/A ARG 309.A NH2 ASP 446.A OD2 no hydrogen 2.813 N/A ASN 311.A ND2 CYS 355.A O no hydrogen 2.803 N/A ASN 311.A ND2 ASP 446.A OD2 no hydrogen 3.235 N/A GLN 312.A NE2 GLU 449.A OE2 no hydrogen 3.021 N/A VAL 315.A N GLN 312.A O no hydrogen 3.138 N/A ALA 316.A N GLN 312.A O no hydrogen 3.231 N/A GLU 317.A N PRO 313.A O no hydrogen 2.918 N/A LYS 318.A N ASP 314.A O no hydrogen 3.325 N/A ALA 319.A N VAL 315.A O no hydrogen 3.133 N/A VAL 320.A N ALA 316.A O no hydrogen 2.922 N/A ALA 321.A N GLU 317.A O no hydrogen 2.792 N/A GLU 322.A N LYS 318.A O no hydrogen 2.849 N/A GLY 323.A N VAL 320.A O no hydrogen 2.990 N/A ARG 324.A N ALA 319.A O no hydrogen 2.824 N/A ARG 324.A NH2 ASP 293.A OD1 no hydrogen 3.392 N/A ARG 324.A NH2 ASP 293.A OD2 no hydrogen 3.125 N/A ASP 326.A N ILE 304.A O no hydrogen 2.778 N/A ILE 327.A N ILE 304.A O no hydrogen 3.237 N/A TRP 328.A N ARG 19.A O no hydrogen 2.698 N/A TRP 328.A NE1 MET 310.A O no hydrogen 2.784 N/A GLU 329.A N MET 306.A O no hydrogen 3.401 N/A MET 330.A N LYS 21.A O no hydrogen 2.975 N/A CYS 331.A SG THR 25.A OG1 no hydrogen 3.227 N/A ARG 332.A NH1 ILE 279.A O no hydrogen 2.806 N/A ARG 332.A NH1 ASN 359.A OD1 no hydrogen 2.871 N/A ARG 332.A NH2 ILE 279.A O no hydrogen 2.972 N/A GLY 334.A N CYS 331.A O no hydrogen 2.845 N/A ILE 335.A N CYS 331.A O no hydrogen 3.010 N/A ILE 335.A N ARG 332.A O no hydrogen 2.839 N/A ALA 336.A N ARG 332.A O no hydrogen 2.943 N/A ASP 337.A N PRO 333.A O no hydrogen 3.006 N/A TYR 339.A N ASP 337.A OD1 no hydrogen 3.075 N/A LEU 340.A N ASP 337.A O no hydrogen 3.152 N/A LYS 342.A N GLY 51.A O no hydrogen 3.051 N/A LYS 343.A N TYR 339.A O no hydrogen 3.036 N/A LYS 343.A NZ ASP 337.A OD1 no hydrogen 3.285 N/A LYS 343.A NZ ASP 337.A OD2 no hydrogen 2.768 N/A LYS 343.A NZ ASP 351.A O no hydrogen 2.803 N/A VAL 344.A N LEU 340.A O no hydrogen 2.906 N/A CYS 345.A N PRO 341.A O no hydrogen 3.047 N/A CYS 345.A SG PRO 341.A O no hydrogen 3.569 N/A GLU 346.A N LYS 342.A O no hydrogen 3.076 N/A GLY 347.A N VAL 344.A O no hydrogen 3.203 N/A ARG 348.A N LYS 343.A O no hydrogen 2.797 N/A ARG 348.A NE GLU 346.A OE1 no hydrogen 2.821 N/A ARG 348.A NH1 ASP 351.A OD2 no hydrogen 2.929 N/A ARG 348.A NH2 GLU 346.A OE1 no hydrogen 3.316 N/A GLU 350.A N GLU 350.A OE1 no hydrogen 2.811 N/A ASP 351.A N ARG 348.A O no hydrogen 3.063 N/A ILE 352.A N PRO 349.A O no hydrogen 3.206 N/A VAL 353.A N ASP 337.A OD2 no hydrogen 2.887 N/A ASN 359.A ND2 ASN 562.A OD1 no hydrogen 2.949 N/A TYR 364.A N ASN 359.A O no hydrogen 2.960 N/A TYR 365.A N GLN 360.A O no hydrogen 3.174 N/A VAL 366.A N CYS 362.A O no hydrogen 3.196 N/A PHE 367.A N PHE 363.A O no hydrogen 3.045 N/A ILE 368.A N TYR 364.A O no hydrogen 2.984 N/A ASP 369.A N VAL 366.A O no hydrogen 3.118 N/A ALA 370.A N TYR 365.A O no hydrogen 2.713 N/A MET 372.A N ASP 27.A O no hydrogen 2.959 N/A GLY 373.A N GLY 361.A O no hydrogen 2.788 N/A ASN 377.A ND2 ILE 335.A O no hydrogen 3.022 N/A ARG 379.A N ASN 377.A OD1 no hydrogen 3.073 N/A ARG 379.A NE GLU 47.A OE2 no hydrogen 3.125 N/A ARG 379.A NH1 TYR 652.A OH no hydrogen 3.058 N/A ARG 379.A NH2 GLU 47.A OE1 no hydrogen 2.820 N/A VAL 380.A N ASN 377.A O no hydrogen 3.182 N/A GLY 381.A N GLU 383.A OE1 no hydrogen 3.049 N/A ASN 382.A N ARG 379.A O no hydrogen 2.782 N/A ASN 382.A ND2 PRO 378.A O no hydrogen 2.819 N/A GLU 383.A N GLU 383.A OE1 no hydrogen 2.894 N/A ASP 385.A N ASN 382.A O no hydrogen 2.957 N/A ALA 387.A N ASP 385.A OD1 no hydrogen 3.112 N/A TYR 388.A N ASP 385.A O no hydrogen 3.038 N/A ALA 389.A N PRO 386.A O no hydrogen 3.221 N/A ALA 393.A N ARG 418.A O no hydrogen 2.809 N/A LYS 397.A N HIS 420.A ND1 no hydrogen 2.898 N/A LYS 397.A NZ GLU 631.A OE1 no hydrogen 2.768 N/A LYS 397.A NZ ARG 659.A O no hydrogen 2.776 N/A LYS 398.A N ASP 482.A OD2 no hydrogen 2.761 N/A LYS 398.A NZ GLU 479.A O no hydrogen 2.845 N/A LYS 398.A NZ GLU 479.A OE2 no hydrogen 3.185 N/A VAL 399.A N ASP 421.A O no hydrogen 2.783 N/A LEU 400.A N VAL 483.A O no hydrogen 2.846 N/A VAL 401.A N THR 423.A O no hydrogen 2.828 N/A VAL 402.A N VAL 485.A O no hydrogen 2.780 N/A GLY 403.A N MET 425.A O no hydrogen 2.825 N/A ALA 404.A N GLU 426.A OE1 no hydrogen 2.804 N/A MET 409.A N GLY 405.A O no hydrogen 2.892 N/A GLU 410.A N PRO 406.A O no hydrogen 3.051 N/A CYS 411.A N SER 407.A O no hydrogen 3.097 N/A ALA 412.A N GLY 408.A O no hydrogen 2.923 N/A ARG 413.A N MET 409.A O no hydrogen 2.956 N/A ARG 413.A NE GLU 410.A OE2 no hydrogen 3.138 N/A ARG 413.A NH2 GLU 410.A OE1 no hydrogen 3.236 N/A LEU 414.A N GLU 410.A O no hydrogen 3.154 N/A ALA 415.A N CYS 411.A O no hydrogen 2.973 N/A ALA 416.A N ALA 412.A O no hydrogen 2.949 N/A VAL 417.A N ARG 413.A O no hydrogen 2.936 N/A ARG 418.A N LEU 414.A O no hydrogen 3.004 N/A ARG 418.A NE GLY 655.A O no hydrogen 2.974 N/A ARG 418.A NH1 ILE 658.A O no hydrogen 3.137 N/A ARG 418.A NH2 GLY 655.A O no hydrogen 2.776 N/A ARG 418.A NH2 ILE 658.A O no hydrogen 2.543 N/A GLY 419.A N ALA 416.A O no hydrogen 2.942 N/A HIS 420.A N ALA 415.A O no hydrogen 2.903 N/A HIS 420.A NE2 ILE 658.A O no hydrogen 3.272 N/A ASP 421.A N LYS 397.A O no hydrogen 2.981 N/A THR 423.A N VAL 399.A O no hydrogen 2.961 N/A ILE 424.A N LYS 464.A O no hydrogen 2.875 N/A MET 425.A N VAL 401.A O no hydrogen 2.878 N/A GLU 426.A N LYS 466.A O no hydrogen 2.812 N/A SER 428.A N GLU 426.A OE2 no hydrogen 3.007 N/A SER 428.A OG GLU 426.A OE2 no hydrogen 2.691 N/A SER 428.A OG SER 430.A O no hydrogen 2.890 N/A SER 430.A OG ASP 429.A OD1 no hydrogen 3.200 N/A GLY 432.A N ALA 404.A O no hydrogen 2.765 N/A VAL 435.A N GLY 432.A O no hydrogen 2.898 N/A LEU 437.A N GLU 434.A O no hydrogen 3.186 N/A GLY 438.A N GLU 434.A O no hydrogen 2.884 N/A VAL 439.A N VAL 435.A O no hydrogen 3.120 N/A LYS 440.A N LEU 437.A O no hydrogen 3.293 N/A LYS 440.A NZ LEU 512.A O no hydrogen 2.827 N/A SER 441.A N GLY 438.A O no hydrogen 2.953 N/A SER 441.A OG GLN 533.A O no hydrogen 2.727 N/A LEU 444.A N SER 441.A O no hydrogen 3.097 N/A TYR 445.A OH ALA 281.A O no hydrogen 2.706 N/A TRP 447.A N LEU 444.A O no hydrogen 2.930 N/A ALA 448.A N TYR 445.A O no hydrogen 3.283 N/A GLU 449.A N ASP 446.A O no hydrogen 3.238 N/A THR 450.A N TRP 447.A O no hydrogen 2.959 N/A ILE 451.A N TRP 447.A O no hydrogen 3.133 N/A ARG 452.A N ALA 448.A O no hydrogen 2.971 N/A ARG 452.A NE GLU 449.A OE1 no hydrogen 3.417 N/A ARG 452.A NH1 GLU 350.A O no hydrogen 2.732 N/A ARG 452.A NH1 ILE 352.A O no hydrogen 2.766 N/A ARG 452.A NH2 ILE 352.A O no hydrogen 3.307 N/A ARG 452.A NH2 GLU 449.A OE1 no hydrogen 2.766 N/A TYR 453.A N GLU 449.A O no hydrogen 2.945 N/A TYR 454.A N THR 450.A O no hydrogen 3.105 N/A TYR 454.A OH GLU 410.A OE2 no hydrogen 2.631 N/A LYS 455.A N ILE 451.A O no hydrogen 2.932 N/A ALA 456.A N ARG 452.A O no hydrogen 3.046 N/A GLN 457.A N TYR 453.A O no hydrogen 2.971 N/A GLN 457.A NE2 ASP 351.A OD1 no hydrogen 2.879 N/A GLN 457.A NE2 TYR 453.A O no hydrogen 3.562 N/A ILE 458.A N TYR 454.A O no hydrogen 2.948 N/A ASP 459.A N LYS 455.A O no hydrogen 3.410 N/A LYS 460.A N ALA 456.A O no hydrogen 3.208 N/A LYS 460.A NZ GLU 350.A OE2 no hydrogen 2.796 N/A LYS 460.A NZ ASP 351.A OD1 no hydrogen 3.026 N/A LYS 460.A NZ ASP 351.A OD2 no hydrogen 3.014 N/A LEU 461.A N GLN 457.A O no hydrogen 2.979 N/A ILE 463.A N ILE 458.A O no hydrogen 3.190 N/A LYS 464.A N VAL 422.A O no hydrogen 2.962 N/A LYS 464.A NZ ASP 421.A OD1 no hydrogen 2.791 N/A LYS 466.A N ILE 424.A O no hydrogen 2.774 N/A LYS 466.A NZ GLU 479.A OE1 no hydrogen 2.908 N/A ASN 468.A N SER 428.A O no hydrogen 2.777 N/A THR 469.A N GLU 426.A O no hydrogen 2.830 N/A THR 469.A OG1 LEU 467.A O no hydrogen 2.683 N/A THR 472.A N SER 475.A OG no hydrogen 2.919 N/A THR 472.A OG1 SER 475.A OG no hydrogen 3.275 N/A SER 475.A N THR 472.A OG1 no hydrogen 3.083 N/A SER 475.A OG THR 472.A O no hydrogen 3.191 N/A SER 475.A OG THR 472.A OG1 no hydrogen 3.275 N/A ILE 476.A N THR 472.A O no hydrogen 3.009 N/A LYS 477.A N ALA 473.A O no hydrogen 3.119 N/A ALA 478.A N ASP 474.A O no hydrogen 2.926 N/A GLU 479.A N SER 475.A O no hydrogen 3.053 N/A ALA 480.A N ILE 476.A O no hydrogen 2.855 N/A ASP 482.A N LYS 398.A O no hydrogen 2.841 N/A VAL 483.A N LYS 398.A O no hydrogen 3.138 N/A LEU 484.A N GLU 631.A O no hydrogen 2.824 N/A VAL 485.A N LEU 400.A O no hydrogen 2.832 N/A ILE 486.A N TYR 633.A O no hydrogen 2.735 N/A ALA 487.A N VAL 402.A O no hydrogen 2.751 N/A THR 488.A OG1 ASP 617.A O no hydrogen 2.689 N/A GLY 490.A N GLU 434.A OE1 no hydrogen 3.432 N/A LYS 491.A N ASP 615.A O no hydrogen 2.773 N/A SER 493.A N GLY 613.A O no hydrogen 2.997 N/A SER 493.A OG GLY 613.A O no hydrogen 3.112 N/A ARG 494.A NH1 ASP 501.A OD1 no hydrogen 2.806 N/A ILE 497.A N PRO 495.A O no hydrogen 2.960 N/A ILE 500.A N ILE 497.A O no hydrogen 3.153 N/A ASN 502.A N GLY 499.A O no hydrogen 3.170 N/A ASN 502.A ND2 ASP 588.A OD1 no hydrogen 2.969 N/A ILE 504.A N ASN 502.A OD1 no hydrogen 3.051 N/A VAL 505.A N ASN 502.A O no hydrogen 3.031 N/A THR 506.A N VAL 608.A O no hydrogen 2.935 N/A THR 506.A OG1 ASN 507.A O no hydrogen 3.530 N/A ASN 507.A N THR 506.A OG1 no hydrogen 2.736 N/A ASP 510.A N ASN 507.A OD1 no hydrogen 3.242 N/A ILE 511.A N ASN 507.A O no hydrogen 3.188 N/A LEU 512.A N VAL 508.A O no hydrogen 3.139 N/A GLU 513.A N PHE 509.A O no hydrogen 2.904 N/A GLY 514.A N ILE 511.A O no hydrogen 3.395 N/A LYS 515.A N ASP 510.A O no hydrogen 2.915 N/A LYS 515.A NZ GLU 513.A OE1 no hydrogen 3.254 N/A LYS 515.A NZ GLU 513.A OE2 no hydrogen 3.389 N/A LYS 517.A NZ GLY 514.A O no hydrogen 3.552 N/A GLY 519.A N ASN 607.A OD1 no hydrogen 2.823 N/A ASP 520.A N ASP 606.A OD2 no hydrogen 2.965 N/A LYS 521.A N ASP 606.A OD2 no hydrogen 2.722 N/A LYS 521.A NZ GLU 604.A OE1 no hydrogen 3.450 N/A LYS 521.A NZ GLU 604.A OE2 no hydrogen 3.532 N/A VAL 522.A N GLU 544.A O no hydrogen 2.801 N/A VAL 523.A N ASN 607.A O no hydrogen 2.976 N/A PHE 524.A N THR 546.A O no hydrogen 2.870 N/A ILE 525.A N VAL 609.A O no hydrogen 2.815 N/A GLY 526.A N LEU 548.A O no hydrogen 2.758 N/A GLY 527.A N GLU 549.A OE1 no hydrogen 2.772 N/A ASN 528.A ND2 ALA 611.A O no hydrogen 2.922 N/A GLU 529.A N ASP 557.A OD1 no hydrogen 2.751 N/A SER 531.A N ASN 528.A OD1 no hydrogen 3.104 N/A SER 531.A OG GLY 526.A O no hydrogen 2.675 N/A ILE 532.A N ASN 528.A O no hydrogen 2.931 N/A GLN 533.A N GLU 529.A O no hydrogen 2.953 N/A THR 534.A N ILE 530.A O no hydrogen 2.963 N/A THR 534.A OG1 ILE 530.A O no hydrogen 2.834 N/A ALA 535.A N SER 531.A O no hydrogen 2.813 N/A GLU 536.A N ILE 532.A O no hydrogen 2.824 N/A TYR 537.A N GLN 533.A O no hydrogen 3.125 N/A VAL 538.A N THR 534.A O no hydrogen 3.034 N/A ALA 539.A N ALA 535.A O no hydrogen 2.835 N/A GLU 540.A N GLU 536.A O no hydrogen 3.040 N/A GLN 541.A N VAL 538.A O no hydrogen 3.202 N/A GLY 542.A N ALA 539.A O no hydrogen 3.093 N/A LYS 543.A NZ GLY 519.A O no hydrogen 2.807 N/A GLU 544.A N ASP 520.A O no hydrogen 2.718 N/A THR 546.A N VAL 522.A O no hydrogen 3.251 N/A VAL 547.A N LYS 576.A O no hydrogen 2.916 N/A LEU 548.A N PHE 524.A O no hydrogen 2.740 N/A GLU 549.A N MET 578.A O no hydrogen 2.788 N/A LYS 550.A NZ GLU 612.A OE1 no hydrogen 3.310 N/A GLY 551.A N GLU 549.A OE2 no hydrogen 2.908 N/A CYS 555.A N GLY 527.A O no hydrogen 2.652 N/A VAL 558.A N CYS 555.A O no hydrogen 3.119 N/A ASN 559.A ND2 CYS 358.A O no hydrogen 3.068 N/A PHE 561.A N ASN 559.A OD1 no hydrogen 3.013 N/A ASN 562.A N ASN 559.A O no hydrogen 3.005 N/A ASN 562.A N ASN 559.A OD1 no hydrogen 3.194 N/A ASN 562.A ND2 CYS 358.A O no hydrogen 2.821 N/A ILE 563.A N ASN 559.A O no hydrogen 3.089 N/A HIS 566.A N ASN 562.A O no hydrogen 3.137 N/A HIS 566.A ND1 GLU 536.A OE1 no hydrogen 2.719 N/A ARG 567.A N ILE 563.A O no hydrogen 3.087 N/A ARG 568.A N LEU 564.A O no hydrogen 2.941 N/A ARG 568.A NE PRO 275.A O no hydrogen 3.394 N/A ARG 568.A NH1 GLU 282.A OE2 no hydrogen 3.534 N/A ARG 568.A NH2 PRO 275.A O no hydrogen 2.895 N/A LEU 569.A N GLN 565.A O no hydrogen 3.050 N/A MET 570.A N HIS 566.A O no hydrogen 2.832 N/A ALA 571.A N ARG 567.A O no hydrogen 3.084 N/A LYS 572.A N ARG 568.A O no hydrogen 3.069 N/A LEU 573.A N LEU 569.A O no hydrogen 2.899 N/A ASN 574.A N ALA 571.A O no hydrogen 2.850 N/A MET 575.A N MET 570.A O no hydrogen 2.907 N/A LYS 576.A N VAL 545.A O no hydrogen 2.932 N/A LYS 576.A NZ GLU 544.A OE2 no hydrogen 2.748 N/A MET 578.A N VAL 547.A O no hydrogen 2.918 N/A ASN 580.A N GLY 551.A O no hydrogen 2.930 N/A VAL 581.A N GLU 549.A O no hydrogen 3.374 N/A THR 582.A N SER 594.A O no hydrogen 2.912 N/A ASN 584.A N GLU 592.A O no hydrogen 2.888 N/A ASN 584.A ND2 SER 594.A OG no hydrogen 2.834 N/A GLU 585.A N GLU 592.A O no hydrogen 3.465 N/A ILE 586.A N GLU 498.A O no hydrogen 2.845 N/A ASN 587.A N GLY 590.A O no hydrogen 2.770 N/A ASN 587.A ND2 GLU 592.A OE1 no hydrogen 2.938 N/A ASP 589.A N ASN 587.A OD1 no hydrogen 3.026 N/A GLY 590.A N ASN 587.A O no hydrogen 3.137 N/A GLY 590.A N ASN 587.A OD1 no hydrogen 3.124 N/A VAL 591.A N ILE 603.A O no hydrogen 2.987 N/A GLU 592.A N GLU 585.A O no hydrogen 2.870 N/A ILE 593.A N VAL 601.A O no hydrogen 2.828 N/A SER 594.A N THR 582.A O no hydrogen 3.116 N/A SER 594.A OG ASP 600.A OD2 no hydrogen 3.310 N/A THR 595.A N LYS 599.A O no hydrogen 2.878 N/A THR 595.A OG1 LYS 599.A O no hydrogen 3.543 N/A GLY 598.A N THR 595.A O no hydrogen 3.119 N/A LYS 599.A N THR 595.A OG1 no hydrogen 2.965 N/A VAL 601.A N ILE 593.A O no hydrogen 2.796 N/A THR 602.A OG1 GLU 592.A OE2 no hydrogen 2.700 N/A ILE 603.A N VAL 591.A O no hydrogen 2.769 N/A ALA 605.A N ASP 589.A O no hydrogen 3.037 N/A ASP 606.A N LYS 521.A O no hydrogen 2.748 N/A ASN 607.A N LYS 521.A O no hydrogen 3.458 N/A VAL 608.A N ILE 504.A O no hydrogen 2.996 N/A VAL 609.A N VAL 523.A O no hydrogen 2.836 N/A VAL 610.A N THR 506.A O no hydrogen 3.154 N/A ALA 611.A N ILE 525.A O no hydrogen 2.863 N/A ASP 615.A N LYS 491.A O no hydrogen 2.779 N/A ASP 617.A N GLY 489.A O no hydrogen 2.915 N/A LYS 622.A N ASP 618.A O no hydrogen 3.001 N/A ALA 623.A N ALA 619.A O no hydrogen 2.895 N/A VAL 624.A N LEU 620.A O no hydrogen 2.836 N/A GLU 631.A N ASP 482.A O no hydrogen 3.232 N/A TYR 633.A N LEU 484.A O no hydrogen 2.844 N/A TYR 633.A OH GLU 631.A OE2 no hydrogen 2.719 N/A ILE 635.A N ILE 486.A O no hydrogen 2.963 N/A GLY 636.A N ASP 650.A OD2 no hydrogen 3.148 N/A CYS 638.A SG ILE 486.A O no hydrogen 3.209 N/A CYS 638.A SG ILE 635.A O no hydrogen 3.379 N/A ALA 639.A N GLY 636.A O no hydrogen 3.162 N/A GLY 640.A N ASP 637.A O no hydrogen 3.028 N/A ARG 642.A N ASP 637.A OD1 no hydrogen 2.952 N/A LYS 643.A N GLU 646.A OE2 no hydrogen 3.011 N/A LYS 643.A NZ GLU 529.A OE2 no hydrogen 2.760 N/A LYS 643.A NZ ASP 557.A O no hydrogen 3.411 N/A GLU 646.A N GLU 646.A OE2 no hydrogen 2.860 N/A ALA 647.A N LYS 643.A O no hydrogen 3.174 N/A ILE 648.A N LEU 644.A O no hydrogen 2.983 N/A HIS 649.A N TYR 645.A O no hydrogen 3.001 N/A HIS 649.A NE2 CYS 374.A O no hydrogen 2.744 N/A ASP 650.A N GLU 646.A O no hydrogen 2.828 N/A GLY 651.A N ALA 647.A O no hydrogen 3.052 N/A TYR 652.A N ILE 648.A O no hydrogen 3.051 N/A TYR 652.A OH TYR 388.A O no hydrogen 2.668 N/A LYS 653.A N HIS 649.A O no hydrogen 3.000 N/A MET 654.A N ASP 650.A O no hydrogen 2.900 N/A GLY 655.A N GLY 651.A O no hydrogen 2.924 N/A VAL 656.A N TYR 652.A O no hydrogen 3.062 N/A LYS 657.A N LYS 653.A O no hydrogen 3.336 N/A LYS 657.A N MET 654.A O no hydrogen 3.152 N/A