Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1tk0_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): MET 1.A N GLU 49.A OE2 no hydrogen 2.961 N/A ILE 2.A N LEU 55.A O no hydrogen 2.862 N/A VAL 3.A N TYR 24.A O no hydrogen 2.795 N/A SER 4.A N VAL 57.A O no hydrogen 2.757 N/A SER 4.A OG VAL 22.A O no hydrogen 2.745 N/A SER 4.A OG TYR 42.A OH no hydrogen 2.639 N/A ASP 5.A N VAL 22.A O no hydrogen 3.363 N/A ILE 6.A N ASP 65.A OD2 no hydrogen 3.222 N/A GLU 7.A N CYS 20.A O no hydrogen 2.796 N/A ASN 9.A N LYS 17.A O no hydrogen 2.941 N/A ASN 9.A ND2 THR 16.A OG1 no hydrogen 2.921 N/A SER 14.A N LEU 11.A O no hydrogen 3.127 N/A THR 16.A N ASN 9.A OD1 no hydrogen 2.877 N/A LYS 17.A N ASN 9.A OD1 no hydrogen 2.824 N/A PHE 18.A N GLN 76.A OE1 no hydrogen 2.910 N/A HIS 19.A N GLU 7.A O no hydrogen 2.747 N/A HIS 19.A NE2 TRP 154.A O no hydrogen 2.906 N/A CYS 20.A N GLU 7.A O no hydrogen 3.124 N/A CYS 20.A SG ASN 165.A OD1 no hydrogen 3.409 N/A GLY 21.A N TYR 34.A O no hydrogen 2.924 N/A VAL 22.A N ASP 5.A O no hydrogen 3.099 N/A ILE 23.A N VAL 32.A O no hydrogen 2.974 N/A TYR 24.A N VAL 3.A O no hydrogen 2.815 N/A ASP 25.A N GLU 30.A O no hydrogen 3.211 N/A TYR 26.A N MET 1.A O no hydrogen 3.055 N/A TYR 26.A OH GLU 177.A OE2 no hydrogen 2.703 N/A SER 27.A N ASP 25.A OD1 no hydrogen 2.892 N/A SER 27.A OG ASP 25.A OD1 no hydrogen 2.748 N/A THR 28.A N ASP 25.A O no hydrogen 3.346 N/A THR 28.A OG1 ASP 25.A O no hydrogen 3.374 N/A ALA 29.A N ASP 25.A O no hydrogen 2.686 N/A GLU 30.A N THR 28.A OG1 no hydrogen 3.384 N/A VAL 32.A N ILE 23.A O no hydrogen 2.920 N/A TYR 34.A N GLY 21.A O no hydrogen 2.847 N/A ARG 35.A N ASP 38.A OD2 no hydrogen 3.022 N/A ARG 35.A NE GLU 159.A OE2 no hydrogen 2.940 N/A ARG 35.A NH2 GLU 159.A OE1 no hydrogen 3.190 N/A ARG 35.A NH2 GLU 159.A OE2 no hydrogen 3.465 N/A ASP 38.A N ARG 35.A O no hydrogen 2.771 N/A PHE 39.A N PRO 36.A O no hydrogen 3.512 N/A TYR 42.A N ASP 38.A O no hydrogen 2.890 N/A TYR 42.A OH SER 4.A OG no hydrogen 2.639 N/A LEU 43.A N PHE 39.A O no hydrogen 3.027 N/A ASP 44.A N GLY 40.A O no hydrogen 2.948 N/A ALA 45.A N ALA 41.A O no hydrogen 2.970 N/A LEU 46.A N TYR 42.A O no hydrogen 3.125 N/A GLU 47.A N LEU 43.A O no hydrogen 2.974 N/A ALA 48.A N ASP 44.A O no hydrogen 2.898 N/A GLU 49.A N ALA 45.A O no hydrogen 3.337 N/A VAL 50.A N LEU 46.A O no hydrogen 3.240 N/A ALA 51.A N GLU 47.A O no hydrogen 2.897 N/A ARG 52.A N ALA 48.A O no hydrogen 3.119 N/A ARG 52.A NE ALA 48.A O no hydrogen 3.501 N/A GLY 53.A N VAL 50.A O no hydrogen 3.064 N/A GLY 54.A N GLU 49.A O no hydrogen 2.817 N/A LEU 55.A N GLU 49.A OE2 no hydrogen 2.996 N/A ILE 56.A N ASN 87.A O no hydrogen 2.862 N/A VAL 57.A N ILE 2.A O no hydrogen 2.813 N/A PHE 58.A N ILE 89.A O no hydrogen 3.036 N/A HIS 59.A ND1 THR 91.A OG1 no hydrogen 2.658 N/A ASN 60.A N ASP 90.A OD1 no hydrogen 2.822 N/A HIS 62.A N ASP 90.A OD2 no hydrogen 3.097 N/A LYS 63.A NZ GLU 222.A OE2 no hydrogen 2.970 N/A LYS 63.A NZ SER 407.A OG no hydrogen 3.191 N/A LYS 63.A NZ VAL 408.A O no hydrogen 3.520 N/A TYR 64.A N ASN 60.A O no hydrogen 3.069 N/A TYR 64.A OH ALA 10.A O no hydrogen 2.831 N/A VAL 66.A N GLY 61.A O no hydrogen 2.974 N/A ALA 68.A N TYR 64.A O no hydrogen 2.810 N/A LEU 69.A N ASP 65.A O no hydrogen 2.915 N/A THR 70.A N VAL 66.A O no hydrogen 3.217 N/A THR 70.A OG1 VAL 66.A O no hydrogen 3.479 N/A THR 70.A OG1 PHE 81.A O no hydrogen 2.590 N/A LYS 71.A N PRO 67.A O no hydrogen 3.007 N/A LYS 71.A NZ LEU 12.A O no hydrogen 2.900 N/A LEU 72.A N ALA 68.A O no hydrogen 2.765 N/A ALA 73.A N LEU 69.A O no hydrogen 2.794 N/A LYS 74.A N THR 70.A O no hydrogen 3.267 N/A LYS 74.A NZ ASN 78.A OD1 no hydrogen 2.524 N/A LEU 75.A N LYS 71.A O no hydrogen 3.063 N/A GLN 76.A N LEU 72.A O no hydrogen 2.836 N/A LEU 77.A N ALA 73.A O no hydrogen 3.109 N/A ARG 79.A N ALA 73.A O no hydrogen 2.862 N/A ARG 79.A NH1 ASP 44.A OD1 no hydrogen 3.288 N/A ARG 79.A NH2 GLY 40.A O no hydrogen 3.196 N/A ARG 79.A NH2 ASP 44.A OD1 no hydrogen 2.994 N/A HIS 82.A NE2 GLU 80.A OE1 no hydrogen 2.736 N/A GLU 86.A N GLU 86.A OE1 no hydrogen 2.695 N/A ASN 87.A N PRO 84.A O no hydrogen 3.032 N/A ASN 87.A ND2 GLY 54.A O no hydrogen 3.113 N/A CYS 88.A N ARG 85.A O no hydrogen 3.024 N/A CYS 88.A SG PRO 84.A O no hydrogen 3.548 N/A ILE 89.A N ILE 56.A O no hydrogen 2.912 N/A ASP 90.A N HIS 212.A NE2 no hydrogen 3.024 N/A THR 91.A N PHE 58.A O no hydrogen 3.046 N/A THR 91.A OG1 PHE 58.A O no hydrogen 3.527 N/A THR 91.A OG1 HIS 59.A ND1 no hydrogen 2.658 N/A LEU 92.A N ASP 90.A OD1 no hydrogen 2.715 N/A VAL 93.A N ASP 90.A OD1 no hydrogen 3.217 N/A LEU 94.A N ASP 90.A O no hydrogen 2.923 N/A SER 95.A N THR 91.A O no hydrogen 2.828 N/A SER 95.A OG THR 91.A O no hydrogen 2.473 N/A ARG 96.A N LEU 92.A O no hydrogen 2.923 N/A ARG 96.A NE ASP 104.A OD2 no hydrogen 2.762 N/A ARG 96.A NH2 ASP 104.A OD1 no hydrogen 3.005 N/A ARG 96.A NH2 ASP 104.A OD2 no hydrogen 3.440 N/A ARG 96.A NH2 ASP 106.A OD1 no hydrogen 3.107 N/A LEU 97.A N VAL 93.A O no hydrogen 3.108 N/A LEU 97.A N LEU 94.A O no hydrogen 3.076 N/A ILE 98.A N LEU 94.A O no hydrogen 2.905 N/A HIS 99.A N SER 95.A O no hydrogen 2.704 N/A LEU 102.A N HIS 99.A O no hydrogen 3.141 N/A ASP 106.A N ASP 104.A OD1 no hydrogen 2.780 N/A GLY 108.A N THR 105.A OG1 no hydrogen 3.167 N/A LEU 110.A N THR 105.A O no hydrogen 3.013 N/A LYS 114.A N ARG 111.A O no hydrogen 3.207 N/A LEU 115.A N SER 112.A O no hydrogen 3.398 N/A TRP 122.A N GLU 120.A OE2 no hydrogen 3.022 N/A GLY 123.A N GLU 120.A OE1 no hydrogen 2.699 N/A TYR 124.A N GLU 120.A O no hydrogen 2.893 N/A ARG 125.A N ALA 121.A O no hydrogen 2.955 N/A LEU 126.A N TRP 122.A O no hydrogen 2.981 N/A GLY 127.A N GLY 123.A O no hydrogen 2.950 N/A GLU 128.A N TYR 124.A O no hydrogen 2.993 N/A GLU 128.A N ARG 125.A O no hydrogen 2.972 N/A MET 129.A N LEU 126.A O no hydrogen 3.367 N/A GLU 132.A N GLU 128.A O no hydrogen 2.805 N/A TYR 133.A N MET 129.A O no hydrogen 2.727 N/A TYR 133.A OH GLU 153.A O no hydrogen 2.678 N/A LYS 134.A N LYS 130.A O no hydrogen 2.863 N/A ASP 135.A N GLY 131.A O no hydrogen 3.076 N/A ASP 136.A N GLU 132.A O no hydrogen 3.303 N/A PHE 137.A N TYR 133.A O no hydrogen 3.023 N/A LYS 138.A N LYS 134.A O no hydrogen 2.858 N/A ARG 139.A N ASP 135.A O no hydrogen 2.916 N/A MET 140.A N ASP 136.A O no hydrogen 2.854 N/A LEU 141.A N PHE 137.A O no hydrogen 3.080 N/A GLU 142.A N LYS 138.A O no hydrogen 3.091 N/A GLN 144.A N LEU 141.A O no hydrogen 2.501 N/A TYR 148.A OH ASP 150.A O no hydrogen 3.261 N/A TYR 148.A OH GLU 153.A OE1 no hydrogen 2.539 N/A MET 152.A N VAL 149.A O no hydrogen 3.060 N/A GLU 153.A N GLU 153.A OE1 no hydrogen 2.762 N/A TRP 155.A N MET 152.A O no hydrogen 3.164 N/A ASN 158.A ND2 TYR 133.A OH no hydrogen 3.108 N/A ASN 158.A ND2 ASN 156.A O no hydrogen 3.611 N/A GLU 160.A N ASN 158.A OD1 no hydrogen 2.958 N/A MET 161.A N ASN 158.A O no hydrogen 3.116 N/A MET 161.A N ASN 158.A OD1 no hydrogen 2.874 N/A MET 162.A N ASN 158.A O no hydrogen 3.187 N/A ASP 163.A N GLU 159.A O no hydrogen 3.119 N/A TYR 164.A N GLU 160.A O no hydrogen 3.145 N/A TYR 164.A OH ASP 136.A OD1 no hydrogen 2.661 N/A TYR 164.A OH ASP 136.A OD2 no hydrogen 3.023 N/A ASN 165.A N MET 161.A O no hydrogen 2.983 N/A ASN 165.A ND2 ASP 5.A O no hydrogen 3.122 N/A VAL 166.A N MET 162.A O no hydrogen 3.005 N/A GLN 167.A N ASP 163.A O no hydrogen 2.923 N/A ASP 168.A N TYR 164.A O no hydrogen 2.860 N/A VAL 169.A N ASN 165.A O no hydrogen 3.329 N/A VAL 170.A N VAL 166.A O no hydrogen 3.104 N/A VAL 171.A N GLN 167.A O no hydrogen 2.896 N/A THR 172.A N ASP 168.A O no hydrogen 2.737 N/A THR 172.A OG1 ASP 168.A O no hydrogen 2.718 N/A LYS 173.A N VAL 169.A O no hydrogen 2.794 N/A LYS 173.A NZ GLU 177.A OE1 no hydrogen 3.295 N/A LYS 173.A NZ GLU 177.A OE2 no hydrogen 2.709 N/A ALA 174.A N VAL 170.A O no hydrogen 3.072 N/A LEU 175.A N VAL 171.A O no hydrogen 2.887 N/A LEU 176.A N THR 172.A O no hydrogen 2.849 N/A GLU 177.A N LYS 173.A O no hydrogen 3.103 N/A LYS 178.A N ALA 174.A O no hydrogen 3.038 N/A LYS 178.A NZ GLU 120.A OE2 no hydrogen 2.740 N/A LEU 179.A N LEU 175.A O no hydrogen 2.979 N/A LEU 180.A N LEU 176.A O no hydrogen 2.834 N/A SER 181.A N GLU 177.A O no hydrogen 3.142 N/A SER 181.A OG LYS 178.A O no hydrogen 2.672 N/A ASP 182.A N LEU 179.A O no hydrogen 3.045 N/A HIS 184.A N ASP 182.A OD1 no hydrogen 2.882 N/A HIS 184.A NE2 GLY 580.A O no hydrogen 2.661 N/A TYR 185.A N ASP 182.A O no hydrogen 2.918 N/A PHE 186.A N ASP 182.A O no hydrogen 2.914 N/A ILE 190.A N PRO 187.A O no hydrogen 3.265 N/A THR 193.A N ASP 191.A OD1 no hydrogen 2.994 N/A THR 193.A OG1 ASP 191.A OD1 no hydrogen 2.646 N/A ASP 194.A N ASP 191.A O no hydrogen 2.984 N/A TYR 197.A N GLY 53.A O no hydrogen 3.052 N/A PHE 200.A N GLY 196.A O no hydrogen 3.108 N/A TRP 201.A N TYR 197.A O no hydrogen 3.105 N/A TRP 201.A NE1 GLU 86.A O no hydrogen 2.705 N/A SER 202.A N THR 198.A O no hydrogen 2.993 N/A SER 202.A OG THR 198.A O no hydrogen 2.876 N/A GLU 203.A N THR 199.A O no hydrogen 2.881 N/A SER 204.A OG PHE 200.A O no hydrogen 2.768 N/A SER 204.A OG TRP 201.A O no hydrogen 3.522 N/A LEU 205.A N TYR 185.A O no hydrogen 2.954 N/A VAL 208.A N LEU 205.A O no hydrogen 2.984 N/A ILE 210.A N GLU 206.A O no hydrogen 3.074 N/A GLU 211.A N ALA 207.A O no hydrogen 2.898 N/A HIS 212.A N VAL 208.A O no hydrogen 3.315 N/A HIS 212.A ND1 VAL 208.A O no hydrogen 2.857 N/A ARG 213.A N ASP 209.A O no hydrogen 3.044 N/A ARG 213.A NE ASP 209.A OD1 no hydrogen 3.192 N/A ARG 213.A NE ASP 209.A OD2 no hydrogen 3.236 N/A ARG 213.A NH1 GLU 613.A OE2 no hydrogen 3.520 N/A ALA 214.A N ILE 210.A O no hydrogen 2.920 N/A ALA 215.A N GLU 211.A O no hydrogen 2.946 N/A TRP 216.A N HIS 212.A O no hydrogen 3.053 N/A LEU 217.A N ARG 213.A O no hydrogen 3.029 N/A LEU 218.A N ALA 214.A O no hydrogen 2.864 N/A ALA 219.A N ALA 215.A O no hydrogen 2.939 N/A LYS 220.A N TRP 216.A O no hydrogen 3.395 N/A LYS 220.A NZ HIS 622.A O no hydrogen 2.979 N/A GLN 221.A N LEU 217.A O no hydrogen 2.969 N/A GLU 222.A N LEU 218.A O no hydrogen 2.912 N/A ARG 223.A N ALA 219.A O no hydrogen 3.033 N/A ASN 224.A N LYS 220.A O no hydrogen 2.920 N/A ASN 224.A ND2 HIS 622.A NE2 no hydrogen 3.153 N/A ASN 224.A ND2 TYR 630.A O no hydrogen 2.937 N/A GLY 225.A N GLN 221.A O no hydrogen 2.935 N/A PHE 226.A N ILE 404.A O no hydrogen 2.859 N/A PHE 228.A N GLY 402.A O no hydrogen 2.965 N/A ASP 229.A N ALA 442.A O no hydrogen 2.787 N/A THR 230.A N PHE 228.A O no hydrogen 3.119 N/A ALA 232.A N ASP 229.A OD1 no hydrogen 3.144 N/A ILE 233.A N ASP 229.A O no hydrogen 3.312 N/A GLU 234.A N THR 230.A O no hydrogen 2.966 N/A GLU 235.A N LYS 231.A O no hydrogen 3.010 N/A LEU 236.A N ALA 232.A O no hydrogen 2.952 N/A TYR 237.A N ILE 233.A O no hydrogen 2.806 N/A TYR 237.A OH GLU 389.A OE2 no hydrogen 2.460 N/A VAL 238.A N GLU 234.A O no hydrogen 3.139 N/A GLU 239.A N GLU 235.A O no hydrogen 3.151 N/A LEU 240.A N LEU 236.A O no hydrogen 2.869 N/A ALA 241.A N TYR 237.A O no hydrogen 2.813 N/A ALA 242.A N VAL 238.A O no hydrogen 2.911 N/A ARG 243.A N GLU 239.A O no hydrogen 3.135 N/A ARG 243.A NE GLU 376.A OE2 no hydrogen 2.546 N/A ARG 243.A NH2 GLU 376.A OE1 no hydrogen 3.109 N/A ARG 243.A NH2 GLU 376.A OE2 no hydrogen 3.186 N/A ARG 244.A N LEU 240.A O no hydrogen 2.828 N/A ARG 244.A NH1 GLN 381.A OE1 no hydrogen 2.610 N/A ARG 244.A NH1 GLU 389.A OE1 no hydrogen 2.958 N/A ARG 244.A NH2 GLU 389.A OE2 no hydrogen 2.797 N/A SER 245.A N ALA 241.A O no hydrogen 2.970 N/A SER 245.A OG ALA 241.A O no hydrogen 3.266 N/A GLU 246.A N ALA 242.A O no hydrogen 3.039 N/A LEU 247.A N ARG 243.A O no hydrogen 2.947 N/A LEU 248.A N ARG 244.A O no hydrogen 2.877 N/A ARG 249.A N SER 245.A O no hydrogen 2.952 N/A ARG 249.A NE GLU 246.A OE1 no hydrogen 3.112 N/A ARG 249.A NH2 GLU 246.A OE2 no hydrogen 3.025 N/A LYS 250.A N GLU 246.A O no hydrogen 3.069 N/A LEU 251.A N LEU 247.A O no hydrogen 2.832 N/A THR 252.A N LEU 248.A O no hydrogen 2.765 N/A THR 252.A OG1 LEU 248.A O no hydrogen 2.551 N/A THR 252.A OG1 ARG 249.A O no hydrogen 3.072 N/A GLU 253.A N LYS 250.A O no hydrogen 3.131 N/A THR 254.A N LYS 250.A O no hydrogen 3.053 N/A THR 254.A OG1 LYS 250.A O no hydrogen 3.356 N/A THR 254.A OG1 GLU 366.A OE2 no hydrogen 2.629 N/A PHE 255.A N LEU 251.A O no hydrogen 2.723 N/A SER 257.A OG HIS 319.A NE2 no hydrogen 2.711 N/A TRP 258.A N VAL 320.A O no hydrogen 3.030 N/A GLN 260.A N GLU 318.A O no hydrogen 3.047 N/A LYS 262.A N PRO 316.A O no hydrogen 2.857 N/A LYS 262.A NZ GLU 318.A OE1 no hydrogen 3.343 N/A LYS 262.A NZ GLU 318.A OE2 no hydrogen 3.398 N/A THR 265.A N ILE 283.A O no hydrogen 3.202 N/A GLU 266.A N ILE 283.A O no hydrogen 3.159 N/A CYS 269.A SG MET 267.A O no hydrogen 3.935 N/A HIS 270.A N LYS 275.A O no hydrogen 2.885 N/A LEU 277.A N PHE 268.A O no hydrogen 2.734 N/A TYR 280.A N LEU 277.A O no hydrogen 3.133 N/A ARG 282.A NH2 PRO 278.A O no hydrogen 2.687 N/A ILE 283.A N GLU 266.A O no hydrogen 2.831 N/A LYS 284.A N TYR 314.A O no hydrogen 3.085 N/A THR 285.A N GLU 266.A OE1 no hydrogen 2.667 N/A THR 285.A OG1 GLU 266.A OE2 no hydrogen 2.676 N/A GLY 290.A N ASP 304.A OD1 no hydrogen 3.449 N/A LYS 293.A N GLU 302.A O no hydrogen 2.819 N/A CYS 301.A SG LYS 293.A O no hydrogen 3.841 N/A ASP 304.A N ILE 291.A O no hydrogen 2.817 N/A ARG 306.A N ASP 304.A OD2 no hydrogen 2.854 N/A ALA 310.A N GLY 289.A O no hydrogen 3.062 N/A GLY 311.A N PRO 286.A O no hydrogen 3.267 N/A ALA 312.A N VAL 309.A O no hydrogen 3.072 N/A GLU 318.A N GLN 260.A O no hydrogen 2.788 N/A HIS 319.A NE2 SER 257.A OG no hydrogen 2.711 N/A VAL 320.A N TRP 258.A O no hydrogen 2.796 N/A ASN 323.A N HIS 329.A ND1 no hydrogen 2.902 N/A SER 325.A N ASN 323.A OD1 no hydrogen 2.757 N/A SER 326.A N ASN 323.A O no hydrogen 2.824 N/A HIS 329.A N SER 326.A OG no hydrogen 3.074 N/A ILE 330.A N SER 326.A O no hydrogen 3.048 N/A GLN 331.A N ARG 327.A O no hydrogen 2.922 N/A GLN 331.A NE2 ASP 328.A O no hydrogen 2.898 N/A LYS 332.A N ASP 328.A O no hydrogen 2.843 N/A LYS 332.A NZ GLU 336.A OE2 no hydrogen 3.344 N/A LYS 333.A N HIS 329.A O no hydrogen 2.986 N/A LYS 333.A NZ GLY 256.A O no hydrogen 2.807 N/A LEU 334.A N ILE 330.A O no hydrogen 3.038 N/A GLN 335.A N GLN 331.A O no hydrogen 3.134 N/A GLN 335.A NE2 GLN 331.A OE1 no hydrogen 2.888 N/A GLU 336.A N LYS 332.A O no hydrogen 3.100 N/A ALA 337.A N LEU 334.A O no hydrogen 2.969 N/A GLY 338.A N GLN 335.A O no hydrogen 2.860 N/A TRP 339.A N LEU 334.A O no hydrogen 3.011 N/A THR 345.A N ALA 349.A O no hydrogen 2.593 N/A THR 345.A OG1 ALA 349.A O no hydrogen 3.168 N/A LYS 347.A N THR 345.A O no hydrogen 2.569 N/A GLY 348.A N THR 345.A O no hydrogen 2.936 N/A ALA 349.A N THR 345.A OG1 no hydrogen 3.182 N/A VAL 351.A N LYS 343.A O no hydrogen 3.031 N/A VAL 356.A N ASP 353.A OD1 no hydrogen 3.109 N/A LEU 357.A N ASP 353.A O no hydrogen 3.189 N/A GLU 358.A N ASP 354.A O no hydrogen 3.069 N/A GLY 359.A N VAL 356.A O no hydrogen 2.703 N/A VAL 360.A N LEU 357.A O no hydrogen 3.136 N/A ARG 361.A NH1 GLU 358.A O no hydrogen 3.195 N/A ARG 361.A NH1 VAL 360.A O no hydrogen 2.689 N/A VAL 362.A N GLN 368.A OE1 no hydrogen 2.837 N/A LYS 367.A N ASP 364.A OD2 no hydrogen 2.992 N/A GLN 368.A N ASP 364.A O no hydrogen 2.901 N/A GLN 368.A NE2 VAL 360.A O no hydrogen 3.470 N/A GLN 368.A NE2 GLN 368.A O no hydrogen 3.134 N/A ALA 369.A N PRO 365.A O no hydrogen 3.077 N/A ALA 370.A N GLU 366.A O no hydrogen 2.862 N/A ILE 371.A N LYS 367.A O no hydrogen 3.264 N/A ASP 372.A N ALA 369.A O no hydrogen 3.192 N/A ILE 374.A N ALA 370.A O no hydrogen 2.927 N/A LYS 375.A N ILE 371.A O no hydrogen 3.178 N/A LYS 375.A NZ GLU 358.A OE1 no hydrogen 2.841 N/A GLU 376.A N ASP 372.A O no hydrogen 3.071 N/A TYR 377.A N LEU 373.A O no hydrogen 2.873 N/A LEU 378.A N ILE 374.A O no hydrogen 2.961 N/A MET 379.A N LYS 375.A O no hydrogen 3.155 N/A ILE 380.A N GLU 376.A O no hydrogen 2.801 N/A GLN 381.A N TYR 377.A O no hydrogen 2.948 N/A GLN 381.A NE2 GLN 381.A O no hydrogen 3.058 N/A LYS 382.A N LEU 378.A O no hydrogen 3.028 N/A ARG 383.A N MET 379.A O no hydrogen 3.104 N/A ARG 383.A NE PRO 434.A O no hydrogen 2.868 N/A ARG 383.A NH2 PRO 434.A O no hydrogen 3.224 N/A ILE 384.A N ILE 380.A O no hydrogen 2.903 N/A GLY 385.A N GLN 381.A O no hydrogen 2.720 N/A GLN 386.A N LYS 382.A O no hydrogen 3.149 N/A GLN 386.A NE2 GLN 427.A O no hydrogen 2.998 N/A SER 387.A N ARG 383.A O no hydrogen 2.937 N/A SER 387.A OG ARG 383.A O no hydrogen 2.681 N/A ALA 388.A N ILE 384.A O no hydrogen 2.727 N/A GLU 389.A N ILE 384.A O no hydrogen 2.964 N/A GLY 390.A N GLY 385.A O no hydrogen 2.718 N/A ALA 393.A N GLY 390.A O no hydrogen 3.185 N/A TRP 394.A N GLN 386.A O no hydrogen 3.203 N/A LEU 395.A N SER 387.A O no hydrogen 3.094 N/A ARG 396.A N ALA 393.A O no hydrogen 2.901 N/A ARG 396.A NE GLU 389.A O no hydrogen 3.549 N/A ARG 396.A NE GLY 390.A O no hydrogen 2.732 N/A ARG 396.A NH2 GLU 389.A O no hydrogen 3.183 N/A TYR 397.A N TRP 394.A O no hydrogen 2.987 N/A ALA 399.A N LYS 403.A O no hydrogen 2.838 N/A GLY 402.A N ALA 399.A O no hydrogen 3.186 N/A LYS 403.A N ASP 401.A OD1 no hydrogen 2.919 N/A LYS 403.A NZ ASP 401.A O no hydrogen 3.253 N/A LYS 403.A NZ HIS 448.A ND1 no hydrogen 3.157 N/A ILE 404.A N PHE 226.A O no hydrogen 3.102 N/A HIS 405.A ND1 GLU 222.A O no hydrogen 2.777 N/A HIS 405.A NE2 ASP 401.A OD1 no hydrogen 3.121 N/A HIS 405.A NE2 ASP 401.A OD2 no hydrogen 2.856 N/A SER 407.A N ALA 421.A O no hydrogen 2.915 N/A VAL 408.A N GLU 222.A OE2 no hydrogen 2.751 N/A ASN 409.A N THR 419.A O no hydrogen 2.943 N/A ASN 411.A N ASN 409.A OD1 no hydrogen 3.171 N/A ASN 411.A ND2 ARG 96.A O no hydrogen 2.908 N/A GLY 412.A N ASN 409.A O no hydrogen 3.184 N/A ALA 413.A N ARG 417.A O no hydrogen 3.077 N/A THR 415.A OG1 GLN 597.A OE1 no hydrogen 2.453 N/A GLY 416.A N ALA 413.A O no hydrogen 2.968 N/A ARG 417.A NH2 GLU 468.A OE2 no hydrogen 3.540 N/A THR 419.A N ASN 409.A O no hydrogen 2.954 N/A HIS 420.A NE2 TRP 633.A O no hydrogen 2.817 N/A ALA 421.A N SER 407.A O no hydrogen 3.219 N/A ALA 426.A N ASN 424.A OD1 no hydrogen 2.668 N/A GLN 427.A N ASN 424.A O no hydrogen 3.306 N/A SER 433.A N GLY 430.A O no hydrogen 3.064 N/A SER 433.A OG GLY 430.A O no hydrogen 2.835 N/A GLY 436.A N SER 433.A O no hydrogen 2.779 N/A GLN 438.A NE2 GLU 239.A OE1 no hydrogen 3.392 N/A CYS 439.A N TYR 435.A O no hydrogen 3.009 N/A CYS 439.A SG TYR 435.A O no hydrogen 3.293 N/A ARG 440.A N GLY 436.A O no hydrogen 2.752 N/A ARG 440.A NH1 PRO 429.A O no hydrogen 3.048 N/A ALA 441.A N GLU 437.A O no hydrogen 2.825 N/A ALA 442.A N GLN 438.A O no hydrogen 3.316 N/A PHE 443.A N ARG 440.A O no hydrogen 3.211 N/A GLY 444.A N PRO 227.A O no hydrogen 3.134 N/A ALA 445.A N GLN 459.A OE1 no hydrogen 2.959 N/A GLU 446.A N PRO 680.A O no hydrogen 2.935 N/A HIS 447.A N GLY 444.A O no hydrogen 2.972 N/A HIS 447.A NE2 ALA 441.A O no hydrogen 2.789 N/A HIS 448.A N ALA 445.A O no hydrogen 2.903 N/A ASP 450.A N LYS 455.A O no hydrogen 2.838 N/A ILE 452.A N ASP 450.A OD2 no hydrogen 2.820 N/A THR 453.A N ASP 450.A OD2 no hydrogen 3.106 N/A GLY 454.A N ASP 450.A O no hydrogen 3.010 N/A LYS 455.A N THR 453.A OG1 no hydrogen 3.249 N/A TRP 457.A N HIS 448.A O no hydrogen 3.013 N/A TRP 457.A NE1 ASP 450.A OD1 no hydrogen 3.162 N/A VAL 458.A N CYS 642.A O no hydrogen 2.747 N/A GLN 459.A N GLY 679.A O no hydrogen 2.695 N/A GLN 459.A NE2 GLN 639.A OE1 no hydrogen 2.699 N/A ALA 460.A N VAL 640.A O no hydrogen 2.857 N/A GLY 461.A N LYS 677.A O no hydrogen 2.802 N/A ILE 462.A N ILE 638.A O no hydrogen 3.021 N/A ASP 463.A N GLU 675.A O no hydrogen 2.965 N/A ALA 464.A N ASP 636.A O no hydrogen 2.846 N/A SER 465.A N ASP 673.A O no hydrogen 3.008 N/A LEU 469.A N GLY 466.A O no hydrogen 3.087 N/A ARG 470.A N GLY 466.A O no hydrogen 3.061 N/A ARG 470.A NH1 LEU 671.A O no hydrogen 2.793 N/A ARG 470.A NH1 ASP 673.A OD2 no hydrogen 2.618 N/A CYS 471.A N LEU 467.A O no hydrogen 3.008 N/A CYS 471.A SG LEU 467.A O no hydrogen 3.504 N/A LEU 472.A N GLU 468.A O no hydrogen 2.971 N/A ALA 473.A N LEU 469.A O no hydrogen 2.888 N/A HIS 474.A N ARG 470.A O no hydrogen 2.973 N/A PHE 475.A N CYS 471.A O no hydrogen 3.056 N/A MET 476.A N LEU 472.A O no hydrogen 2.941 N/A ALA 477.A N HIS 474.A O no hydrogen 3.192 N/A PHE 479.A N MET 476.A O no hydrogen 2.855 N/A ASP 480.A N MET 476.A O no hydrogen 2.997 N/A GLY 482.A N ASP 480.A OD1 no hydrogen 3.151 N/A GLU 483.A N ASP 480.A O no hydrogen 3.002 N/A TYR 484.A N ASP 480.A OD2 no hydrogen 2.687 N/A HIS 486.A N GLY 482.A O no hydrogen 2.904 N/A HIS 486.A N GLU 483.A O no hydrogen 3.053 N/A GLU 487.A N GLU 483.A O no hydrogen 2.950 N/A ILE 488.A N TYR 484.A O no hydrogen 2.741 N/A ASN 490.A N GLU 487.A O no hydrogen 3.092 N/A THR 495.A N ASP 492.A OD2 no hydrogen 2.754 N/A THR 495.A OG1 ASP 492.A OD2 no hydrogen 3.038 N/A LYS 496.A N ASP 492.A O no hydrogen 2.915 N/A LYS 496.A NZ GLU 487.A OE2 no hydrogen 3.469 N/A ASN 497.A N ILE 493.A O no hydrogen 2.938 N/A GLN 498.A N HIS 494.A O no hydrogen 2.968 N/A GLN 498.A NE2 LEU 503.A O no hydrogen 3.324 N/A ILE 499.A N THR 495.A O no hydrogen 3.210 N/A ALA 500.A N LYS 496.A O no hydrogen 3.158 N/A ALA 501.A N ASN 497.A O no hydrogen 2.711 N/A GLU 502.A N ILE 499.A O no hydrogen 2.672 N/A LEU 503.A N GLN 498.A O no hydrogen 2.730 N/A ARG 506.A NE ASP 492.A OD2 no hydrogen 3.032 N/A ARG 506.A NH2 ASP 492.A OD1 no hydrogen 3.122 N/A ARG 506.A NH2 ASP 492.A OD2 no hydrogen 3.297 N/A ASN 508.A N THR 505.A OG1 no hydrogen 3.203 N/A ASN 508.A ND2 ILE 528.A O no hydrogen 2.908 N/A ALA 509.A N THR 505.A O no hydrogen 3.194 N/A LYS 510.A N ARG 506.A O no hydrogen 3.357 N/A LYS 510.A N ASP 507.A O no hydrogen 3.077 N/A THR 511.A N ASP 507.A O no hydrogen 3.089 N/A PHE 512.A N ASN 508.A O no hydrogen 3.027 N/A ILE 513.A N ALA 509.A O no hydrogen 2.816 N/A TYR 514.A N LYS 510.A O no hydrogen 2.969 N/A GLY 515.A N THR 511.A O no hydrogen 3.016 N/A PHE 516.A N PHE 512.A O no hydrogen 2.800 N/A LEU 517.A N ILE 513.A O no hydrogen 2.812 N/A TYR 518.A N TYR 514.A O no hydrogen 3.140 N/A TYR 518.A OH GLU 468.A OE1 no hydrogen 2.678 N/A GLY 519.A N PHE 516.A O no hydrogen 3.253 N/A ALA 520.A N GLY 515.A O no hydrogen 2.959 N/A ILE 525.A N GLY 521.A O no hydrogen 2.957 N/A GLY 526.A N ASP 522.A O no hydrogen 3.159 N/A GLN 527.A N GLU 523.A O no hydrogen 2.947 N/A ILE 528.A N LYS 524.A O no hydrogen 3.074 N/A VAL 529.A N ILE 525.A O no hydrogen 3.150 N/A GLY 530.A N GLN 527.A O no hydrogen 3.077 N/A ALA 531.A N GLY 526.A O no hydrogen 2.772 N/A ARG 535.A NH1 GLU 538.A OE1 no hydrogen 3.431 N/A ARG 535.A NH2 ALA 501.A O no hydrogen 3.285 N/A ARG 535.A NH2 GLU 502.A OE2 no hydrogen 3.558 N/A GLY 536.A N GLY 532.A O no hydrogen 3.141 N/A LYS 537.A N LYS 533.A O no hydrogen 2.935 N/A GLU 538.A N GLU 534.A O no hydrogen 3.140 N/A LEU 539.A N ARG 535.A O no hydrogen 3.275 N/A LYS 540.A N GLY 536.A O no hydrogen 3.064 N/A LYS 540.A NZ ASP 522.A OD1 no hydrogen 3.244 N/A LYS 541.A N LYS 537.A O no hydrogen 3.143 N/A LYS 541.A NZ GLU 545.A OE2 no hydrogen 3.267 N/A LYS 542.A N GLU 538.A O no hydrogen 2.893 N/A PHE 543.A N LEU 539.A O no hydrogen 2.995 N/A LEU 544.A N LYS 540.A O no hydrogen 3.023 N/A GLU 545.A N LYS 541.A O no hydrogen 2.994 N/A THR 547.A N PHE 543.A O no hydrogen 3.419 N/A THR 547.A OG1 THR 547.A O no hydrogen 2.606 N/A ILE 550.A N THR 547.A O no hydrogen 3.197 N/A ALA 551.A N PRO 548.A O no hydrogen 3.235 N/A LEU 553.A N ALA 549.A O no hydrogen 2.818 N/A ARG 554.A N ILE 550.A O no hydrogen 2.849 N/A ARG 554.A NH2 LEU 517.A O no hydrogen 3.130 N/A GLU 555.A N ALA 551.A O no hydrogen 2.866 N/A SER 556.A N ALA 552.A O no hydrogen 3.041 N/A SER 556.A OG ALA 552.A O no hydrogen 3.262 N/A SER 556.A OG LEU 553.A O no hydrogen 2.748 N/A ILE 557.A N LEU 553.A O no hydrogen 3.100 N/A GLN 558.A N ARG 554.A O no hydrogen 3.202 N/A GLN 558.A NE2 PRO 588.A O no hydrogen 3.667 N/A GLN 559.A N GLU 555.A O no hydrogen 2.863 N/A THR 560.A N SER 556.A O no hydrogen 2.990 N/A THR 560.A N ILE 557.A O no hydrogen 2.983 N/A THR 560.A OG1 SER 556.A O no hydrogen 2.801 N/A LEU 561.A N ILE 557.A O no hydrogen 3.049 N/A LEU 561.A N GLN 558.A O no hydrogen 3.259 N/A VAL 562.A N GLN 558.A O no hydrogen 2.848 N/A GLU 563.A N LYS 569.A O no hydrogen 3.183 N/A LYS 569.A N SER 564.A O no hydrogen 2.691 N/A LYS 571.A N LEU 561.A O no hydrogen 2.619 N/A LYS 571.A NZ GLN 559.A O no hydrogen 2.912 N/A LYS 571.A NZ VAL 562.A O no hydrogen 3.361 N/A ARG 572.A N LEU 561.A O no hydrogen 3.363 N/A ARG 572.A NH1 TRP 574.A O no hydrogen 2.885 N/A ARG 573.A NE VAL 585.A O no hydrogen 3.114 N/A ARG 573.A NH2 ARG 586.A O no hydrogen 3.094 N/A ILE 575.A N VAL 583.A O no hydrogen 2.738 N/A GLY 577.A N ARG 581.A O no hydrogen 2.684 N/A GLY 580.A N GLY 577.A O no hydrogen 2.943 N/A ARG 581.A N ASP 579.A OD1 no hydrogen 3.365 N/A ARG 581.A NH1 GLU 211.A OE2 no hydrogen 2.970 N/A ARG 581.A NH1 ASP 579.A OD2 no hydrogen 2.952 N/A ARG 581.A NH2 GLU 211.A OE2 no hydrogen 2.850 N/A LYS 582.A N TYR 185.A OH no hydrogen 3.146 N/A VAL 583.A N ILE 575.A O no hydrogen 2.674 N/A VAL 585.A N ARG 573.A O no hydrogen 3.026 N/A SER 587.A OG HIS 589.A ND1 no hydrogen 2.708 N/A HIS 589.A ND1 SER 587.A OG no hydrogen 2.708 N/A ALA 590.A N SER 587.A O no hydrogen 2.939 N/A ALA 591.A N PRO 588.A O no hydrogen 3.411 N/A THR 594.A N ALA 590.A O no hydrogen 2.827 N/A THR 594.A OG1 ALA 590.A O no hydrogen 3.207 N/A LEU 595.A N ALA 591.A O no hydrogen 2.864 N/A LEU 596.A N LEU 592.A O no hydrogen 2.917 N/A GLN 597.A N ASN 593.A O no hydrogen 2.698 N/A SER 598.A N THR 594.A O no hydrogen 3.040 N/A SER 598.A OG THR 415.A O no hydrogen 2.898 N/A ALA 599.A N LEU 595.A O no hydrogen 3.174 N/A GLY 600.A N LEU 596.A O no hydrogen 3.012 N/A ALA 601.A N GLN 597.A O no hydrogen 2.934 N/A LEU 602.A N SER 598.A O no hydrogen 2.806 N/A ILE 603.A N ALA 599.A O no hydrogen 2.934 N/A CYS 604.A N GLY 600.A O no hydrogen 3.072 N/A CYS 604.A SG GLY 600.A O no hydrogen 3.246 N/A LYS 605.A N ALA 601.A O no hydrogen 2.976 N/A LYS 605.A NZ GLU 211.A OE2 no hydrogen 3.078 N/A LYS 605.A NZ PRO 410.A O no hydrogen 2.815 N/A LYS 605.A NZ GLY 416.A O no hydrogen 2.661 N/A LEU 606.A N LEU 602.A O no hydrogen 3.032 N/A TRP 607.A N ILE 603.A O no hydrogen 2.828 N/A TRP 607.A NE1 ALA 655.A O no hydrogen 2.889 N/A ILE 608.A N CYS 604.A O no hydrogen 3.017 N/A ILE 609.A N LYS 605.A O no hydrogen 3.340 N/A LYS 610.A N LEU 606.A O no hydrogen 2.868 N/A THR 611.A N TRP 607.A O no hydrogen 2.833 N/A THR 611.A OG1 TRP 607.A O no hydrogen 2.846 N/A GLU 612.A N ILE 608.A O no hydrogen 3.149 N/A GLU 613.A N ILE 609.A O no hydrogen 3.103 N/A MET 614.A N LYS 610.A O no hydrogen 2.898 N/A LEU 615.A N THR 611.A O no hydrogen 3.038 N/A VAL 616.A N GLU 612.A O no hydrogen 2.941 N/A GLU 617.A N GLU 613.A O no hydrogen 2.915 N/A LYS 618.A N LEU 615.A O no hydrogen 3.065 N/A LYS 618.A NZ THR 654.A OG1 no hydrogen 3.030 N/A LYS 618.A NZ GLU 657.A OE2 no hydrogen 3.448 N/A GLY 619.A N VAL 616.A O no hydrogen 2.820 N/A LEU 620.A N LEU 615.A O no hydrogen 3.128 N/A LYS 621.A N ASP 627.A OD2 no hydrogen 2.753 N/A HIS 622.A ND1 GLU 612.A OE2 no hydrogen 2.687 N/A GLY 623.A N PHE 628.A O no hydrogen 2.710 N/A TRP 624.A NE1 ASN 224.A O no hydrogen 2.934 N/A GLY 626.A N GLY 623.A O no hydrogen 2.904 N/A ASP 627.A N LYS 621.A O no hydrogen 2.884 N/A PHE 628.A N LYS 621.A O no hydrogen 3.223 N/A ALA 629.A N GLY 641.A O no hydrogen 2.914 N/A TYR 630.A N HIS 622.A NE2 no hydrogen 3.124 N/A TYR 630.A OH ILE 608.A O no hydrogen 2.766 N/A MET 631.A N GLN 639.A O no hydrogen 3.047 N/A ALA 632.A N GLN 639.A O no hydrogen 3.405 N/A TRP 633.A NE1 HIS 635.A O no hydrogen 2.971 N/A VAL 634.A N GLU 637.A O no hydrogen 2.826 N/A ILE 638.A N ILE 462.A O no hydrogen 2.960 N/A GLN 639.A N ALA 632.A O no hydrogen 2.986 N/A GLN 639.A NE2 GLU 637.A OE1 no hydrogen 2.863 N/A GLN 639.A NE2 CYS 685.A O no hydrogen 3.028 N/A VAL 640.A N ALA 460.A O no hydrogen 2.883 N/A GLY 641.A N ALA 629.A O no hydrogen 2.914 N/A CYS 642.A N VAL 458.A O no hydrogen 2.566 N/A CYS 642.A SG VAL 640.A O no hydrogen 3.519 N/A ARG 643.A N ASP 627.A O no hydrogen 2.977 N/A ARG 643.A NE GLY 626.A O no hydrogen 3.080 N/A ARG 643.A NH2 ASP 627.A OD1 no hydrogen 2.743 N/A ILE 647.A N THR 644.A OG1 no hydrogen 3.144 N/A ALA 648.A N THR 644.A O no hydrogen 3.062 N/A GLN 649.A N GLU 645.A O no hydrogen 2.863 N/A GLN 649.A NE2 GLU 653.A OE2 no hydrogen 3.314 N/A VAL 650.A N GLU 646.A O no hydrogen 3.047 N/A VAL 651.A N ILE 647.A O no hydrogen 2.816 N/A ILE 652.A N ALA 648.A O no hydrogen 2.961 N/A GLU 653.A N GLN 649.A O no hydrogen 3.049 N/A THR 654.A N VAL 650.A O no hydrogen 2.849 N/A THR 654.A OG1 VAL 650.A O no hydrogen 2.423 N/A ALA 655.A N VAL 651.A O no hydrogen 2.784 N/A GLN 656.A N ILE 652.A O no hydrogen 3.322 N/A GLN 656.A NE2 ASP 673.A OD1 no hydrogen 3.021 N/A GLU 657.A N GLU 653.A O no hydrogen 3.071 N/A ALA 658.A N THR 654.A O no hydrogen 2.899 N/A MET 659.A N ALA 655.A O no hydrogen 3.021 N/A ARG 660.A N GLN 656.A O no hydrogen 3.086 N/A ARG 660.A NH1 LEU 672.A O no hydrogen 2.739 N/A ARG 660.A NH1 ASP 673.A OD1 no hydrogen 2.229 N/A TRP 661.A N GLU 657.A O no hydrogen 2.958 N/A VAL 662.A N ALA 658.A O no hydrogen 2.923 N/A GLY 663.A N MET 659.A O no hydrogen 3.007 N/A ASP 664.A N ARG 660.A O no hydrogen 3.003 N/A HIS 665.A N TRP 661.A O no hydrogen 2.722 N/A HIS 665.A NE2 GLU 206.A OE2 no hydrogen 2.744 N/A TRP 666.A N VAL 662.A O no hydrogen 3.156 N/A TRP 666.A NE1 GLU 206.A OE1 no hydrogen 3.149 N/A ASN 667.A N ASP 664.A O no hydrogen 3.079 N/A PHE 668.A N GLY 663.A O no hydrogen 2.988 N/A ARG 669.A N HIS 474.A ND1 no hydrogen 2.835 N/A CYS 670.A SG ALA 485.A O no hydrogen 4.033 N/A CYS 670.A SG LEU 671.A O no hydrogen 3.724 N/A THR 674.A N GLN 656.A OE1 no hydrogen 2.821 N/A THR 674.A OG1 GLN 656.A OE1 no hydrogen 2.567 N/A GLU 675.A N ASP 463.A O no hydrogen 2.881 N/A LYS 677.A N GLY 461.A O no hydrogen 2.734 N/A LYS 677.A NZ HIS 686.A O no hydrogen 2.918 N/A GLY 679.A N GLN 459.A O no hydrogen 2.957 N/A ASN 681.A ND2 GLU 446.A OE2 no hydrogen 2.771 N/A TRP 682.A N PHE 443.A O no hydrogen 2.791 N/A TRP 682.A NE1 GLU 637.A OE1 no hydrogen 3.111 N/A ALA 683.A N ASN 681.A OD1 no hydrogen 2.836 N/A ILE 684.A N ASN 681.A O no hydrogen 3.264 N/A ILE 684.A N ASN 681.A OD1 no hydrogen 3.299 N/A CYS 685.A N ASN 681.A O no hydrogen 2.979 N/A CYS 685.A SG GLN 459.A O no hydrogen 3.443 N/A CYS 685.A SG LYS 677.A O no hydrogen 3.478 N/A CYS 685.A SG ASN 681.A O no hydrogen 3.452 N/A