Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1tk8_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): MET 1.A N GLU 49.A OE2 no hydrogen 3.104 N/A ILE 2.A N LEU 55.A O no hydrogen 2.868 N/A VAL 3.A N TYR 24.A O no hydrogen 2.813 N/A SER 4.A N VAL 57.A O no hydrogen 2.846 N/A SER 4.A OG VAL 22.A O no hydrogen 2.700 N/A SER 4.A OG TYR 42.A OH no hydrogen 2.743 N/A ILE 6.A N ASP 65.A OD2 no hydrogen 3.275 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 2.950 N/A ASN 9.A ND2 THR 16.A OG1 no hydrogen 2.885 N/A SER 14.A N LEU 11.A O no hydrogen 3.042 N/A THR 16.A N ASN 9.A OD1 no hydrogen 2.879 N/A LYS 17.A N ASN 9.A OD1 no hydrogen 2.944 N/A PHE 18.A N GLN 76.A OE1 no hydrogen 2.821 N/A HIS 19.A N GLU 7.A O no hydrogen 2.758 N/A HIS 19.A NE2 TRP 154.A O no hydrogen 2.823 N/A CYS 20.A N GLU 7.A O no hydrogen 3.154 N/A CYS 20.A SG ASN 165.A OD1 no hydrogen 3.258 N/A GLY 21.A N TYR 34.A O no hydrogen 3.020 N/A VAL 22.A N ASP 5.A O no hydrogen 3.174 N/A ILE 23.A N VAL 32.A O no hydrogen 2.861 N/A TYR 24.A N VAL 3.A O no hydrogen 2.827 N/A ASP 25.A N GLU 30.A O no hydrogen 3.226 N/A TYR 26.A N MET 1.A O no hydrogen 3.094 N/A TYR 26.A OH GLU 177.A OE2 no hydrogen 2.720 N/A SER 27.A N ASP 25.A OD1 no hydrogen 2.838 N/A SER 27.A OG ASP 25.A OD1 no hydrogen 2.786 N/A THR 28.A N ASP 25.A O no hydrogen 3.124 N/A THR 28.A OG1 ASP 25.A O no hydrogen 3.260 N/A ALA 29.A N ASP 25.A O no hydrogen 2.648 N/A GLU 30.A N THR 28.A OG1 no hydrogen 3.261 N/A VAL 32.A N ILE 23.A O no hydrogen 2.795 N/A TYR 34.A N GLY 21.A O no hydrogen 2.772 N/A ARG 35.A N ASP 38.A OD2 no hydrogen 2.853 N/A ARG 35.A NE GLU 159.A OE2 no hydrogen 2.895 N/A ARG 35.A NH2 GLU 159.A OE1 no hydrogen 3.322 N/A ARG 35.A NH2 GLU 159.A OE2 no hydrogen 3.272 N/A ASP 38.A N ARG 35.A O no hydrogen 2.627 N/A TYR 42.A N ASP 38.A O no hydrogen 2.738 N/A TYR 42.A OH SER 4.A OG no hydrogen 2.743 N/A LEU 43.A N PHE 39.A O no hydrogen 2.977 N/A ASP 44.A N GLY 40.A O no hydrogen 2.949 N/A ALA 45.A N ALA 41.A O no hydrogen 2.984 N/A LEU 46.A N TYR 42.A O no hydrogen 3.196 N/A GLU 47.A N LEU 43.A O no hydrogen 3.004 N/A ALA 48.A N ASP 44.A O no hydrogen 2.938 N/A GLU 49.A N ALA 45.A O no hydrogen 3.222 N/A VAL 50.A N LEU 46.A O no hydrogen 3.148 N/A ALA 51.A N GLU 47.A O no hydrogen 2.843 N/A ARG 52.A N ALA 48.A O no hydrogen 3.151 N/A ARG 52.A NH1 GLU 49.A OE1 no hydrogen 2.481 N/A GLY 53.A N VAL 50.A O no hydrogen 3.001 N/A GLY 54.A N GLU 49.A O no hydrogen 2.862 N/A LEU 55.A N GLU 49.A OE2 no hydrogen 2.967 N/A ILE 56.A N ASN 87.A O no hydrogen 2.834 N/A VAL 57.A N ILE 2.A O no hydrogen 2.807 N/A PHE 58.A N ILE 89.A O no hydrogen 2.989 N/A HIS 59.A ND1 THR 91.A OG1 no hydrogen 2.692 N/A ASN 60.A N ASP 90.A OD1 no hydrogen 2.795 N/A HIS 62.A N ASP 90.A OD2 no hydrogen 3.047 N/A LYS 63.A NZ GLU 222.A OE1 no hydrogen 3.460 N/A LYS 63.A NZ GLU 222.A OE2 no hydrogen 2.667 N/A LYS 63.A NZ SER 413.A OG no hydrogen 3.229 N/A LYS 63.A NZ VAL 414.A O no hydrogen 3.544 N/A TYR 64.A N ASN 60.A O no hydrogen 2.996 N/A TYR 64.A OH ALA 10.A O no hydrogen 2.854 N/A VAL 66.A N GLY 61.A O no hydrogen 2.958 N/A ALA 68.A N TYR 64.A O no hydrogen 2.792 N/A LEU 69.A N ASP 65.A O no hydrogen 2.798 N/A THR 70.A N VAL 66.A O no hydrogen 3.083 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 2.966 N/A LYS 71.A NZ LEU 12.A O no hydrogen 2.915 N/A LEU 72.A N ALA 68.A O no hydrogen 2.777 N/A ALA 73.A N LEU 69.A O no hydrogen 2.891 N/A LYS 74.A N THR 70.A O no hydrogen 3.386 N/A LYS 74.A N LYS 71.A O no hydrogen 3.167 N/A LYS 74.A NZ ASN 78.A OD1 no hydrogen 3.025 N/A LEU 75.A N LYS 71.A O no hydrogen 3.047 N/A GLN 76.A N LEU 72.A O no hydrogen 2.754 N/A LEU 77.A N ALA 73.A O no hydrogen 3.171 N/A ARG 79.A N ALA 73.A O no hydrogen 2.839 N/A ARG 79.A NH1 ASP 44.A OD1 no hydrogen 3.143 N/A ARG 79.A NH2 ASP 44.A OD1 no hydrogen 2.737 N/A HIS 82.A NE2 GLU 80.A OE1 no hydrogen 3.022 N/A GLU 86.A N GLU 86.A OE1 no hydrogen 2.805 N/A ASN 87.A N PRO 84.A O no hydrogen 3.198 N/A ASN 87.A ND2 GLY 54.A O no hydrogen 2.993 N/A CYS 88.A N ARG 85.A O no hydrogen 3.058 N/A CYS 88.A SG PRO 84.A O no hydrogen 3.483 N/A ILE 89.A N ILE 56.A O no hydrogen 2.859 N/A ASP 90.A N HIS 212.A NE2 no hydrogen 3.027 N/A THR 91.A N PHE 58.A O no hydrogen 2.966 N/A THR 91.A OG1 PHE 58.A O no hydrogen 3.229 N/A THR 91.A OG1 HIS 59.A ND1 no hydrogen 2.692 N/A LEU 92.A N ASP 90.A OD1 no hydrogen 2.780 N/A VAL 93.A N ASP 90.A OD1 no hydrogen 3.328 N/A LEU 94.A N ASP 90.A O no hydrogen 2.994 N/A SER 95.A N THR 91.A O no hydrogen 2.809 N/A ARG 96.A N LEU 92.A O no hydrogen 2.905 N/A ARG 96.A NE ASP 104.A OD2 no hydrogen 2.849 N/A ARG 96.A NH2 ASP 104.A OD1 no hydrogen 3.139 N/A ARG 96.A NH2 ASP 104.A OD2 no hydrogen 3.536 N/A ARG 96.A NH2 ASP 106.A OD1 no hydrogen 3.129 N/A LEU 97.A N VAL 93.A O no hydrogen 3.133 N/A LEU 97.A N LEU 94.A O no hydrogen 3.018 N/A ILE 98.A N LEU 94.A O no hydrogen 2.904 N/A HIS 99.A N SER 95.A O no hydrogen 2.955 N/A LEU 102.A N HIS 99.A O no hydrogen 2.999 N/A ASP 106.A N ASP 104.A OD1 no hydrogen 2.618 N/A GLY 108.A N THR 105.A OG1 no hydrogen 3.152 N/A LEU 110.A N THR 105.A O no hydrogen 2.896 N/A LYS 114.A N ARG 111.A O no hydrogen 3.175 N/A LEU 115.A N SER 112.A O no hydrogen 3.067 N/A TRP 122.A N GLU 120.A OE2 no hydrogen 3.040 N/A GLY 123.A N GLU 120.A OE1 no hydrogen 2.752 N/A TYR 124.A N GLU 120.A O no hydrogen 2.945 N/A ARG 125.A N ALA 121.A O no hydrogen 2.903 N/A LEU 126.A N TRP 122.A O no hydrogen 3.015 N/A GLY 127.A N GLY 123.A O no hydrogen 2.965 N/A GLU 128.A N ARG 125.A O no hydrogen 2.915 N/A GLU 132.A N GLU 128.A O no hydrogen 2.819 N/A TYR 133.A N MET 129.A O no hydrogen 2.786 N/A TYR 133.A OH GLU 153.A O no hydrogen 2.693 N/A LYS 134.A N LYS 130.A O no hydrogen 3.077 N/A ASP 135.A N GLY 131.A O no hydrogen 3.137 N/A ASP 136.A N GLU 132.A O no hydrogen 3.243 N/A PHE 137.A N TYR 133.A O no hydrogen 2.936 N/A LYS 138.A N LYS 134.A O no hydrogen 2.927 N/A ARG 139.A N ASP 135.A O no hydrogen 2.892 N/A MET 140.A N ASP 136.A O no hydrogen 3.030 N/A LEU 141.A N PHE 137.A O no hydrogen 3.108 N/A GLU 142.A N LYS 138.A O no hydrogen 3.091 N/A GLU 143.A N MET 140.A O no hydrogen 3.079 N/A GLN 144.A N MET 140.A O no hydrogen 3.182 N/A GLN 144.A N LEU 141.A O no hydrogen 2.988 N/A GLN 144.A NE2 MET 140.A O no hydrogen 3.698 N/A TYR 148.A OH ASP 150.A O no hydrogen 2.810 N/A TYR 148.A OH GLU 153.A OE1 no hydrogen 2.442 N/A MET 152.A N VAL 149.A O no hydrogen 2.913 N/A GLU 153.A N GLU 153.A OE1 no hydrogen 2.854 N/A TRP 154.A N GLY 151.A O no hydrogen 3.107 N/A TRP 155.A N MET 152.A O no hydrogen 3.058 N/A ASN 158.A ND2 TYR 133.A OH no hydrogen 2.976 N/A MET 161.A N ASN 158.A OD1 no hydrogen 2.754 N/A MET 162.A N ASN 158.A O no hydrogen 3.155 N/A ASP 163.A N GLU 159.A O no hydrogen 2.862 N/A TYR 164.A N GLU 160.A O no hydrogen 3.162 N/A TYR 164.A OH ASP 136.A OD1 no hydrogen 3.226 N/A ASN 165.A N MET 161.A O no hydrogen 2.940 N/A ASN 165.A ND2 ASP 5.A O no hydrogen 3.176 N/A VAL 166.A N MET 162.A O no hydrogen 2.966 N/A GLN 167.A N ASP 163.A O no hydrogen 2.932 N/A ASP 168.A N TYR 164.A O no hydrogen 2.817 N/A VAL 169.A N ASN 165.A O no hydrogen 3.382 N/A VAL 170.A N VAL 166.A O no hydrogen 3.076 N/A VAL 171.A N GLN 167.A O no hydrogen 2.829 N/A THR 172.A N ASP 168.A O no hydrogen 2.608 N/A THR 172.A OG1 ASP 168.A O no hydrogen 2.829 N/A LYS 173.A N VAL 169.A O no hydrogen 2.820 N/A LYS 173.A NZ GLU 177.A OE1 no hydrogen 3.396 N/A LYS 173.A NZ GLU 177.A OE2 no hydrogen 2.770 N/A ALA 174.A N VAL 170.A O no hydrogen 3.023 N/A LEU 175.A N VAL 171.A O no hydrogen 2.924 N/A LEU 176.A N THR 172.A O no hydrogen 2.852 N/A GLU 177.A N LYS 173.A O no hydrogen 3.065 N/A LYS 178.A N ALA 174.A O no hydrogen 3.016 N/A LYS 178.A NZ GLU 120.A OE2 no hydrogen 2.581 N/A LEU 179.A N LEU 175.A O no hydrogen 2.990 N/A LEU 180.A N LEU 176.A O no hydrogen 2.912 N/A SER 181.A N GLU 177.A O no hydrogen 3.230 N/A SER 181.A N LYS 178.A O no hydrogen 3.341 N/A SER 181.A OG LYS 178.A O no hydrogen 2.611 N/A ASP 182.A N LEU 179.A O no hydrogen 3.136 N/A HIS 184.A N ASP 182.A OD1 no hydrogen 2.962 N/A HIS 184.A NE2 GLY 586.A O no hydrogen 2.741 N/A TYR 185.A N ASP 182.A O no hydrogen 3.153 N/A PHE 186.A N ASP 182.A O no hydrogen 3.040 N/A ILE 190.A N PRO 187.A O no hydrogen 3.344 N/A THR 193.A N ASP 191.A OD1 no hydrogen 3.065 N/A THR 193.A OG1 ASP 191.A OD1 no hydrogen 2.598 N/A ASP 194.A N ASP 191.A O no hydrogen 2.913 N/A TYR 197.A N GLY 53.A O no hydrogen 3.136 N/A PHE 200.A N GLY 196.A O no hydrogen 3.125 N/A TRP 201.A N TYR 197.A O no hydrogen 3.118 N/A TRP 201.A NE1 GLU 86.A O no hydrogen 2.737 N/A SER 202.A N THR 198.A O no hydrogen 3.009 N/A SER 202.A OG THR 198.A O no hydrogen 2.927 N/A SER 202.A OG THR 199.A O no hydrogen 3.363 N/A GLU 203.A N THR 199.A O no hydrogen 2.800 N/A SER 204.A OG PHE 200.A O no hydrogen 2.649 N/A SER 204.A OG TRP 201.A O no hydrogen 3.330 N/A LEU 205.A N TYR 185.A O no hydrogen 3.068 N/A ALA 207.A N ASP 585.A O no hydrogen 3.269 N/A VAL 208.A N LEU 205.A O no hydrogen 2.888 N/A ASP 209.A N GLU 206.A O no hydrogen 3.026 N/A ILE 210.A N GLU 206.A O no hydrogen 3.173 N/A GLU 211.A N ALA 207.A O no hydrogen 3.028 N/A HIS 212.A N VAL 208.A O no hydrogen 3.354 N/A HIS 212.A ND1 VAL 208.A O no hydrogen 2.894 N/A ARG 213.A N ASP 209.A O no hydrogen 3.013 N/A ARG 213.A NE ASP 209.A OD1 no hydrogen 3.288 N/A ARG 213.A NE ASP 209.A OD2 no hydrogen 3.147 N/A ALA 214.A N ILE 210.A O no hydrogen 2.846 N/A ALA 215.A N GLU 211.A O no hydrogen 3.005 N/A TRP 216.A N HIS 212.A O no hydrogen 3.040 N/A LEU 217.A N ARG 213.A O no hydrogen 2.967 N/A LEU 218.A N ALA 214.A O no hydrogen 2.741 N/A ALA 219.A N ALA 215.A O no hydrogen 2.829 N/A LYS 220.A N TRP 216.A O no hydrogen 3.271 N/A LYS 220.A NZ HIS 628.A O no hydrogen 2.982 N/A GLN 221.A N LEU 217.A O no hydrogen 3.082 N/A GLU 222.A N LEU 218.A O no hydrogen 2.985 N/A ARG 223.A N ALA 219.A O no hydrogen 3.172 N/A ASN 224.A N LYS 220.A O no hydrogen 2.899 N/A ASN 224.A ND2 HIS 628.A NE2 no hydrogen 3.195 N/A ASN 224.A ND2 TYR 636.A O no hydrogen 2.917 N/A GLY 225.A N GLN 221.A O no hydrogen 2.995 N/A PHE 226.A N ILE 410.A O no hydrogen 2.834 N/A PHE 228.A N GLY 408.A O no hydrogen 3.020 N/A ASP 229.A N ALA 448.A O no hydrogen 2.722 N/A THR 230.A N PHE 228.A O no hydrogen 3.204 N/A ALA 232.A N ASP 229.A OD1 no hydrogen 3.138 N/A ILE 233.A N ASP 229.A O no hydrogen 3.203 N/A GLU 234.A N THR 230.A O no hydrogen 2.907 N/A GLU 235.A N LYS 231.A O no hydrogen 3.048 N/A LEU 236.A N ALA 232.A O no hydrogen 3.036 N/A TYR 237.A N ILE 233.A O no hydrogen 2.806 N/A TYR 237.A OH GLU 395.A OE2 no hydrogen 2.483 N/A VAL 238.A N GLU 234.A O no hydrogen 3.124 N/A GLU 239.A N GLU 235.A O no hydrogen 3.174 N/A LEU 240.A N LEU 236.A O no hydrogen 2.874 N/A ALA 241.A N TYR 237.A O no hydrogen 2.796 N/A ALA 242.A N VAL 238.A O no hydrogen 2.985 N/A ARG 243.A N GLU 239.A O no hydrogen 3.127 N/A ARG 243.A NE GLU 382.A OE2 no hydrogen 2.437 N/A ARG 243.A NH2 GLU 382.A OE1 no hydrogen 2.980 N/A ARG 243.A NH2 GLU 382.A OE2 no hydrogen 3.182 N/A ARG 244.A N LEU 240.A O no hydrogen 2.880 N/A ARG 244.A NH1 GLN 387.A OE1 no hydrogen 2.748 N/A ARG 244.A NH1 GLU 395.A OE1 no hydrogen 3.006 N/A ARG 244.A NH2 GLU 395.A OE2 no hydrogen 2.965 N/A SER 245.A N ALA 241.A O no hydrogen 2.863 N/A SER 245.A OG ALA 241.A O no hydrogen 3.142 N/A GLU 246.A N ALA 242.A O no hydrogen 2.950 N/A LEU 247.A N ARG 243.A O no hydrogen 2.966 N/A LEU 248.A N ARG 244.A O no hydrogen 2.855 N/A ARG 249.A N SER 245.A O no hydrogen 2.976 N/A ARG 249.A NE GLU 246.A OE1 no hydrogen 3.426 N/A ARG 249.A NE GLU 246.A OE2 no hydrogen 3.374 N/A ARG 249.A NH2 GLU 246.A OE2 no hydrogen 2.883 N/A LYS 250.A N GLU 246.A O no hydrogen 3.079 N/A LEU 251.A N LEU 247.A O no hydrogen 2.830 N/A THR 252.A N LEU 248.A O no hydrogen 2.833 N/A THR 252.A OG1 LEU 248.A O no hydrogen 2.771 N/A THR 252.A OG1 ARG 249.A O no hydrogen 2.808 N/A GLU 253.A N ARG 249.A O no hydrogen 3.105 N/A THR 254.A N LYS 250.A O no hydrogen 3.057 N/A THR 254.A OG1 LYS 250.A O no hydrogen 3.302 N/A THR 254.A OG1 GLU 372.A OE2 no hydrogen 2.719 N/A PHE 255.A N LEU 251.A O no hydrogen 2.752 N/A SER 257.A OG HIS 325.A NE2 no hydrogen 2.561 N/A TRP 258.A N VAL 326.A O no hydrogen 2.948 N/A TRP 258.A NE1 GLN 260.A OE1 no hydrogen 3.180 N/A GLN 260.A N GLU 324.A O no hydrogen 3.090 N/A LYS 262.A N PRO 322.A O no hydrogen 2.845 N/A LYS 262.A NZ GLU 324.A OE1 no hydrogen 3.083 N/A THR 265.A N ILE 283.A O no hydrogen 3.233 N/A GLU 266.A N ILE 283.A O no hydrogen 3.114 N/A CYS 269.A SG MET 267.A O no hydrogen 3.847 N/A HIS 270.A N LYS 275.A O no hydrogen 3.130 N/A LEU 277.A N PHE 268.A O no hydrogen 2.829 N/A TYR 280.A N LEU 277.A O no hydrogen 2.775 N/A ILE 283.A N GLU 266.A O no hydrogen 3.018 N/A LYS 284.A N TYR 320.A O no hydrogen 2.986 N/A THR 285.A N GLU 266.A OE1 no hydrogen 2.698 N/A THR 285.A OG1 GLU 266.A OE2 no hydrogen 3.030 N/A GLY 290.A N ASP 310.A OD1 no hydrogen 3.174 N/A LYS 293.A N GLU 308.A O no hydrogen 2.584 N/A LYS 296.A N GLN 300.A OE1 no hydrogen 2.494 N/A LYS 296.A NZ GLU 308.A OE1 no hydrogen 3.282 N/A LYS 296.A NZ GLU 308.A OE2 no hydrogen 2.739 N/A ASN 297.A N GLN 300.A OE1 no hydrogen 3.442 N/A LYS 298.A NZ GLU 302.A OE1 no hydrogen 2.538 N/A LYS 298.A NZ GLU 302.A OE2 no hydrogen 3.304 N/A ARG 301.A N LYS 298.A O no hydrogen 2.922 N/A GLU 302.A N ALA 299.A O no hydrogen 2.666 N/A ARG 304.A N ALA 299.A O no hydrogen 2.909 N/A CYS 307.A SG GLN 300.A O no hydrogen 3.942 N/A ASP 310.A N ILE 291.A O no hydrogen 2.910 N/A ARG 312.A N ASP 310.A OD2 no hydrogen 3.043 N/A ALA 316.A N GLY 289.A O no hydrogen 2.596 N/A GLY 317.A N PRO 286.A O no hydrogen 3.131 N/A ALA 318.A N VAL 315.A O no hydrogen 2.916 N/A TYR 320.A N LYS 284.A O no hydrogen 3.270 N/A GLU 324.A N GLN 260.A O no hydrogen 2.852 N/A HIS 325.A NE2 SER 257.A OG no hydrogen 2.561 N/A VAL 326.A N TRP 258.A O no hydrogen 2.762 N/A ASN 329.A N HIS 335.A ND1 no hydrogen 2.843 N/A SER 331.A N ASN 329.A OD1 no hydrogen 2.874 N/A SER 332.A N ASN 329.A O no hydrogen 2.730 N/A ARG 333.A NH1 VAL 358.A O no hydrogen 3.068 N/A HIS 335.A N SER 332.A OG no hydrogen 3.079 N/A ILE 336.A N SER 332.A O no hydrogen 2.850 N/A GLN 337.A N ARG 333.A O no hydrogen 2.950 N/A LYS 338.A N ASP 334.A O no hydrogen 2.943 N/A LYS 339.A N HIS 335.A O no hydrogen 3.014 N/A LYS 339.A NZ GLY 256.A O no hydrogen 2.912 N/A LEU 340.A N ILE 336.A O no hydrogen 2.987 N/A GLN 341.A N GLN 337.A O no hydrogen 3.090 N/A GLU 342.A N LYS 338.A O no hydrogen 3.128 N/A ALA 343.A N LEU 340.A O no hydrogen 2.997 N/A GLY 344.A N GLN 341.A O no hydrogen 3.043 N/A TRP 345.A N LEU 340.A O no hydrogen 3.044 N/A TYR 350.A OH PRO 347.A O no hydrogen 3.310 N/A THR 351.A N ALA 355.A O no hydrogen 2.607 N/A THR 351.A OG1 ALA 355.A O no hydrogen 3.104 N/A LYS 353.A N THR 351.A OG1 no hydrogen 3.203 N/A GLY 354.A N THR 351.A O no hydrogen 2.966 N/A ALA 355.A N THR 351.A OG1 no hydrogen 3.003 N/A VAL 357.A N LYS 349.A O no hydrogen 3.048 N/A VAL 362.A N ASP 359.A OD1 no hydrogen 3.048 N/A LEU 363.A N ASP 359.A O no hydrogen 3.087 N/A GLU 364.A N ASP 360.A O no hydrogen 3.085 N/A GLY 365.A N GLU 361.A O no hydrogen 3.246 N/A VAL 366.A N LEU 363.A O no hydrogen 3.181 N/A ARG 367.A NH1 GLU 364.A O no hydrogen 3.166 N/A ARG 367.A NH1 VAL 366.A O no hydrogen 2.889 N/A VAL 368.A N GLN 374.A OE1 no hydrogen 2.787 N/A LYS 373.A N ASP 370.A OD2 no hydrogen 2.787 N/A GLN 374.A N ASP 370.A O no hydrogen 3.012 N/A GLN 374.A NE2 VAL 366.A O no hydrogen 3.212 N/A ALA 375.A N PRO 371.A O no hydrogen 3.160 N/A ALA 376.A N GLU 372.A O no hydrogen 3.033 N/A ILE 377.A N LYS 373.A O no hydrogen 3.272 N/A ILE 377.A N GLN 374.A O no hydrogen 3.383 N/A ASP 378.A N ALA 375.A O no hydrogen 3.056 N/A ILE 380.A N ALA 376.A O no hydrogen 2.982 N/A LYS 381.A N ILE 377.A O no hydrogen 3.157 N/A LYS 381.A NZ GLU 364.A OE2 no hydrogen 3.336 N/A LYS 381.A NZ ASP 378.A OD1 no hydrogen 3.073 N/A GLU 382.A N ASP 378.A O no hydrogen 2.911 N/A TYR 383.A N LEU 379.A O no hydrogen 2.871 N/A LEU 384.A N ILE 380.A O no hydrogen 2.903 N/A MET 385.A N LYS 381.A O no hydrogen 3.120 N/A ILE 386.A N GLU 382.A O no hydrogen 2.743 N/A GLN 387.A N TYR 383.A O no hydrogen 2.926 N/A LYS 388.A N LEU 384.A O no hydrogen 3.135 N/A ARG 389.A N MET 385.A O no hydrogen 3.079 N/A ARG 389.A NE PRO 440.A O no hydrogen 2.918 N/A ARG 389.A NH2 PRO 440.A O no hydrogen 3.247 N/A ILE 390.A N ILE 386.A O no hydrogen 2.886 N/A GLY 391.A N GLN 387.A O no hydrogen 2.693 N/A GLN 392.A N LYS 388.A O no hydrogen 3.222 N/A GLN 392.A NE2 GLN 433.A O no hydrogen 2.948 N/A SER 393.A N ARG 389.A O no hydrogen 2.961 N/A SER 393.A OG ARG 389.A O no hydrogen 2.774 N/A ALA 394.A N ILE 390.A O no hydrogen 2.705 N/A GLU 395.A N ILE 390.A O no hydrogen 2.894 N/A GLY 396.A N GLY 391.A O no hydrogen 2.678 N/A ALA 399.A N GLY 396.A O no hydrogen 3.173 N/A TRP 400.A N GLN 392.A O no hydrogen 3.157 N/A LEU 401.A N SER 393.A O no hydrogen 3.203 N/A ARG 402.A N ALA 399.A O no hydrogen 2.891 N/A ARG 402.A NE GLY 396.A O no hydrogen 2.906 N/A ARG 402.A NH2 GLU 395.A O no hydrogen 3.525 N/A TYR 403.A N TRP 400.A O no hydrogen 2.880 N/A VAL 404.A N TRP 400.A O no hydrogen 3.141 N/A ALA 405.A N LYS 409.A O no hydrogen 2.901 N/A GLY 408.A N ALA 405.A O no hydrogen 2.971 N/A LYS 409.A N ASP 407.A OD1 no hydrogen 2.882 N/A LYS 409.A NZ ASP 407.A O no hydrogen 3.029 N/A LYS 409.A NZ HIS 454.A ND1 no hydrogen 2.749 N/A ILE 410.A N PHE 226.A O no hydrogen 3.028 N/A HIS 411.A ND1 GLU 222.A O no hydrogen 2.666 N/A HIS 411.A NE2 ASP 407.A OD1 no hydrogen 3.158 N/A HIS 411.A NE2 ASP 407.A OD2 no hydrogen 2.853 N/A SER 413.A N ALA 427.A O no hydrogen 2.822 N/A VAL 414.A N GLU 222.A OE2 no hydrogen 3.048 N/A ASN 415.A N THR 425.A O no hydrogen 2.995 N/A ASN 417.A N ASN 415.A OD1 no hydrogen 3.217 N/A ASN 417.A ND2 ARG 96.A O no hydrogen 2.679 N/A GLY 418.A N ASN 415.A O no hydrogen 3.072 N/A ALA 419.A N ARG 423.A O no hydrogen 3.098 N/A THR 421.A OG1 GLN 603.A OE1 no hydrogen 2.440 N/A GLY 422.A N ALA 419.A O no hydrogen 2.853 N/A ARG 423.A NH2 GLU 474.A OE2 no hydrogen 3.033 N/A THR 425.A N ASN 415.A O no hydrogen 3.035 N/A HIS 426.A NE2 TRP 639.A O no hydrogen 2.869 N/A ALA 427.A N SER 413.A O no hydrogen 3.068 N/A ALA 432.A N ASN 430.A OD1 no hydrogen 2.673 N/A GLN 433.A N ASN 430.A O no hydrogen 3.355 N/A SER 439.A N GLY 436.A O no hydrogen 3.053 N/A SER 439.A OG GLY 436.A O no hydrogen 2.738 N/A GLY 442.A N SER 439.A O no hydrogen 2.933 N/A GLN 444.A NE2 GLU 239.A OE1 no hydrogen 3.464 N/A CYS 445.A N TYR 441.A O no hydrogen 3.007 N/A CYS 445.A SG TYR 441.A O no hydrogen 3.282 N/A ARG 446.A N GLY 442.A O no hydrogen 2.772 N/A ARG 446.A NH1 PRO 435.A O no hydrogen 3.133 N/A ALA 447.A N GLU 443.A O no hydrogen 2.868 N/A ALA 448.A N CYS 445.A O no hydrogen 3.096 N/A PHE 449.A N ARG 446.A O no hydrogen 3.449 N/A GLY 450.A N PRO 227.A O no hydrogen 2.964 N/A ALA 451.A N GLN 465.A OE1 no hydrogen 3.123 N/A GLU 452.A N PRO 686.A O no hydrogen 3.037 N/A HIS 453.A N GLY 450.A O no hydrogen 3.014 N/A HIS 453.A NE2 ALA 447.A O no hydrogen 2.780 N/A HIS 454.A N ALA 451.A O no hydrogen 2.759 N/A ASP 456.A N LYS 461.A O no hydrogen 2.876 N/A ILE 458.A N ASP 456.A OD2 no hydrogen 2.960 N/A THR 459.A N ASP 456.A OD2 no hydrogen 3.016 N/A THR 459.A OG1 ASP 456.A OD2 no hydrogen 3.404 N/A GLY 460.A N ASP 456.A O no hydrogen 2.944 N/A LYS 461.A N THR 459.A OG1 no hydrogen 3.238 N/A TRP 463.A N HIS 454.A O no hydrogen 2.839 N/A TRP 463.A NE1 ASP 456.A OD1 no hydrogen 3.106 N/A VAL 464.A N CYS 648.A O no hydrogen 2.721 N/A GLN 465.A N GLY 685.A O no hydrogen 2.811 N/A GLN 465.A NE2 GLN 645.A OE1 no hydrogen 2.584 N/A ALA 466.A N VAL 646.A O no hydrogen 2.786 N/A GLY 467.A N LYS 683.A O no hydrogen 2.861 N/A ILE 468.A N ILE 644.A O no hydrogen 2.944 N/A ASP 469.A N GLU 681.A O no hydrogen 2.986 N/A ALA 470.A N ASP 642.A O no hydrogen 2.730 N/A SER 471.A N ASP 679.A O no hydrogen 2.919 N/A ARG 476.A N GLY 472.A O no hydrogen 2.946 N/A ARG 476.A NH1 LEU 677.A O no hydrogen 2.725 N/A ARG 476.A NH1 ASP 679.A OD2 no hydrogen 2.740 N/A ARG 476.A NH2 ASP 679.A OD2 no hydrogen 3.491 N/A CYS 477.A N LEU 473.A O no hydrogen 2.968 N/A CYS 477.A SG LEU 473.A O no hydrogen 3.428 N/A LEU 478.A N GLU 474.A O no hydrogen 3.035 N/A ALA 479.A N LEU 475.A O no hydrogen 2.946 N/A HIS 480.A N ARG 476.A O no hydrogen 2.863 N/A PHE 481.A N CYS 477.A O no hydrogen 3.019 N/A MET 482.A N LEU 478.A O no hydrogen 2.990 N/A ALA 483.A N HIS 480.A O no hydrogen 3.271 N/A PHE 485.A N MET 482.A O no hydrogen 2.770 N/A ASP 486.A N MET 482.A O no hydrogen 2.856 N/A GLY 488.A N ASP 486.A OD1 no hydrogen 3.204 N/A GLU 489.A N ASP 486.A O no hydrogen 3.201 N/A TYR 490.A N ASP 486.A OD2 no hydrogen 2.670 N/A HIS 492.A N GLY 488.A O no hydrogen 2.986 N/A HIS 492.A N GLU 489.A O no hydrogen 3.202 N/A GLU 493.A N GLU 489.A O no hydrogen 3.013 N/A ILE 494.A N TYR 490.A O no hydrogen 2.852 N/A LEU 495.A N HIS 492.A O no hydrogen 3.395 N/A ASN 496.A N GLU 493.A O no hydrogen 3.041 N/A THR 501.A N ASP 498.A OD2 no hydrogen 2.843 N/A THR 501.A OG1 ASP 498.A OD2 no hydrogen 3.337 N/A LYS 502.A N ASP 498.A O no hydrogen 2.943 N/A ASN 503.A N ILE 499.A O no hydrogen 2.943 N/A GLN 504.A N HIS 500.A O no hydrogen 2.702 N/A GLN 504.A NE2 LEU 509.A O no hydrogen 3.551 N/A ILE 505.A N THR 501.A O no hydrogen 3.132 N/A ALA 506.A N LYS 502.A O no hydrogen 3.266 N/A ALA 507.A N ASN 503.A O no hydrogen 2.724 N/A GLU 508.A N ILE 505.A O no hydrogen 2.778 N/A LEU 509.A N GLN 504.A O no hydrogen 2.900 N/A ARG 512.A NE ASP 498.A OD2 no hydrogen 2.742 N/A ARG 512.A NH2 ASP 498.A OD1 no hydrogen 3.027 N/A ARG 512.A NH2 ASP 498.A OD2 no hydrogen 3.173 N/A ASN 514.A N THR 511.A OG1 no hydrogen 3.191 N/A ASN 514.A ND2 ILE 534.A O no hydrogen 2.861 N/A ALA 515.A N THR 511.A O no hydrogen 3.301 N/A LYS 516.A N ARG 512.A O no hydrogen 3.076 N/A THR 517.A N ASP 513.A O no hydrogen 3.070 N/A PHE 518.A N ASN 514.A O no hydrogen 3.015 N/A ILE 519.A N ALA 515.A O no hydrogen 2.939 N/A TYR 520.A N LYS 516.A O no hydrogen 3.151 N/A GLY 521.A N THR 517.A O no hydrogen 3.099 N/A PHE 522.A N PHE 518.A O no hydrogen 2.775 N/A LEU 523.A N ILE 519.A O no hydrogen 2.671 N/A TYR 524.A N TYR 520.A O no hydrogen 2.956 N/A TYR 524.A OH GLU 474.A OE1 no hydrogen 2.520 N/A GLY 525.A N PHE 522.A O no hydrogen 3.144 N/A ALA 526.A N GLY 521.A O no hydrogen 2.837 N/A ILE 531.A N GLY 527.A O no hydrogen 2.946 N/A GLY 532.A N ASP 528.A O no hydrogen 3.064 N/A GLN 533.A N GLU 529.A O no hydrogen 2.830 N/A ILE 534.A N LYS 530.A O no hydrogen 3.024 N/A VAL 535.A N ILE 531.A O no hydrogen 3.192 N/A GLY 536.A N GLN 533.A O no hydrogen 2.938 N/A ALA 537.A N GLY 532.A O no hydrogen 2.687 N/A LYS 539.A NZ GLU 540.A OE2 no hydrogen 2.833 N/A ARG 541.A NH2 ALA 507.A O no hydrogen 3.011 N/A GLY 542.A N GLY 538.A O no hydrogen 3.076 N/A LYS 543.A N LYS 539.A O no hydrogen 3.023 N/A GLU 544.A N GLU 540.A O no hydrogen 3.373 N/A LEU 545.A N ARG 541.A O no hydrogen 3.247 N/A LYS 546.A N GLY 542.A O no hydrogen 2.947 N/A LYS 546.A NZ ALA 526.A O no hydrogen 3.477 N/A LYS 546.A NZ ASP 528.A OD1 no hydrogen 3.198 N/A LYS 547.A N LYS 543.A O no hydrogen 2.890 N/A LYS 547.A NZ GLU 551.A OE2 no hydrogen 3.011 N/A LYS 548.A N GLU 544.A O no hydrogen 2.814 N/A LYS 548.A NZ ALA 506.A O no hydrogen 3.032 N/A PHE 549.A N LEU 545.A O no hydrogen 3.064 N/A LEU 550.A N LYS 546.A O no hydrogen 2.967 N/A GLU 551.A N LYS 547.A O no hydrogen 2.979 N/A ASN 552.A N LYS 548.A O no hydrogen 3.032 N/A THR 553.A N PHE 549.A O no hydrogen 3.243 N/A THR 553.A OG1 PHE 549.A O no hydrogen 3.451 N/A THR 553.A OG1 THR 553.A O no hydrogen 2.644 N/A ILE 556.A N THR 553.A O no hydrogen 3.062 N/A ALA 558.A N PRO 554.A O no hydrogen 3.325 N/A LEU 559.A N ALA 555.A O no hydrogen 2.848 N/A ARG 560.A N ILE 556.A O no hydrogen 2.984 N/A ARG 560.A NH2 LEU 523.A O no hydrogen 3.064 N/A GLU 561.A N ALA 557.A O no hydrogen 2.916 N/A SER 562.A N ALA 558.A O no hydrogen 3.007 N/A SER 562.A OG ALA 558.A O no hydrogen 3.361 N/A SER 562.A OG LEU 559.A O no hydrogen 2.748 N/A ILE 563.A N LEU 559.A O no hydrogen 3.096 N/A GLN 564.A N ARG 560.A O no hydrogen 3.182 N/A GLN 565.A N GLU 561.A O no hydrogen 2.870 N/A THR 566.A N SER 562.A O no hydrogen 3.031 N/A THR 566.A N ILE 563.A O no hydrogen 3.070 N/A THR 566.A OG1 SER 562.A O no hydrogen 3.025 N/A LEU 567.A N ILE 563.A O no hydrogen 2.937 N/A VAL 568.A N GLN 564.A O no hydrogen 2.703 N/A GLU 569.A N LYS 575.A O no hydrogen 3.199 N/A SER 570.A N LYS 575.A O no hydrogen 3.297 N/A LYS 575.A N SER 570.A O no hydrogen 2.649 N/A LYS 577.A N LEU 567.A O no hydrogen 2.762 N/A LYS 577.A NZ GLN 565.A O no hydrogen 2.735 N/A ARG 578.A N LEU 567.A O no hydrogen 3.389 N/A ARG 578.A NH1 TRP 580.A O no hydrogen 2.865 N/A ARG 579.A NE VAL 591.A O no hydrogen 3.011 N/A ARG 579.A NH2 ARG 592.A O no hydrogen 3.028 N/A ILE 581.A N VAL 589.A O no hydrogen 2.833 N/A GLY 583.A N ARG 587.A O no hydrogen 2.817 N/A GLY 586.A N GLY 583.A O no hydrogen 2.862 N/A ARG 587.A N ASP 585.A OD1 no hydrogen 3.214 N/A ARG 587.A NH1 GLU 211.A OE2 no hydrogen 2.941 N/A ARG 587.A NH1 ASP 585.A OD2 no hydrogen 2.719 N/A ARG 587.A NH2 GLU 211.A OE2 no hydrogen 2.839 N/A LYS 588.A N TYR 185.A OH no hydrogen 3.066 N/A VAL 589.A N ILE 581.A O no hydrogen 2.752 N/A VAL 591.A N ARG 579.A O no hydrogen 3.067 N/A ALA 596.A N SER 593.A O no hydrogen 2.997 N/A ALA 597.A N PRO 594.A O no hydrogen 3.212 N/A THR 600.A N ALA 596.A O no hydrogen 2.970 N/A THR 600.A OG1 ALA 596.A O no hydrogen 3.296 N/A LEU 601.A N ALA 597.A O no hydrogen 2.844 N/A LEU 602.A N LEU 598.A O no hydrogen 2.967 N/A GLN 603.A N ASN 599.A O no hydrogen 2.880 N/A SER 604.A N THR 600.A O no hydrogen 3.060 N/A SER 604.A OG THR 421.A O no hydrogen 2.763 N/A ALA 605.A N LEU 601.A O no hydrogen 3.198 N/A GLY 606.A N LEU 602.A O no hydrogen 2.924 N/A ALA 607.A N GLN 603.A O no hydrogen 2.834 N/A LEU 608.A N SER 604.A O no hydrogen 2.881 N/A ILE 609.A N ALA 605.A O no hydrogen 2.967 N/A CYS 610.A N GLY 606.A O no hydrogen 2.965 N/A CYS 610.A SG GLY 606.A O no hydrogen 3.233 N/A LYS 611.A N ALA 607.A O no hydrogen 2.837 N/A LYS 611.A NZ GLU 211.A OE2 no hydrogen 3.060 N/A LYS 611.A NZ PRO 416.A O no hydrogen 2.899 N/A LYS 611.A NZ GLY 422.A O no hydrogen 2.809 N/A LEU 612.A N LEU 608.A O no hydrogen 2.935 N/A TRP 613.A N ILE 609.A O no hydrogen 2.826 N/A TRP 613.A NE1 ALA 661.A O no hydrogen 2.926 N/A ILE 614.A N CYS 610.A O no hydrogen 2.957 N/A ILE 615.A N LYS 611.A O no hydrogen 3.284 N/A LYS 616.A N LEU 612.A O no hydrogen 2.851 N/A THR 617.A N TRP 613.A O no hydrogen 2.763 N/A THR 617.A OG1 TRP 613.A O no hydrogen 2.882 N/A GLU 618.A N ILE 614.A O no hydrogen 3.131 N/A GLU 619.A N ILE 615.A O no hydrogen 3.100 N/A MET 620.A N LYS 616.A O no hydrogen 2.928 N/A LEU 621.A N THR 617.A O no hydrogen 2.991 N/A VAL 622.A N GLU 618.A O no hydrogen 2.952 N/A GLU 623.A N GLU 619.A O no hydrogen 2.922 N/A LYS 624.A N LEU 621.A O no hydrogen 2.963 N/A LYS 624.A NZ THR 660.A OG1 no hydrogen 2.833 N/A GLY 625.A N VAL 622.A O no hydrogen 2.955 N/A LEU 626.A N LEU 621.A O no hydrogen 3.186 N/A LYS 627.A N ASP 633.A OD2 no hydrogen 2.781 N/A HIS 628.A ND1 GLU 618.A OE2 no hydrogen 2.766 N/A GLY 629.A N PHE 634.A O no hydrogen 2.667 N/A TRP 630.A NE1 ASN 224.A O no hydrogen 2.670 N/A GLY 632.A N GLY 629.A O no hydrogen 2.804 N/A ASP 633.A N LYS 627.A O no hydrogen 2.881 N/A PHE 634.A N LYS 627.A O no hydrogen 3.215 N/A ALA 635.A N GLY 647.A O no hydrogen 2.839 N/A TYR 636.A N HIS 628.A NE2 no hydrogen 3.037 N/A TYR 636.A OH ILE 614.A O no hydrogen 2.736 N/A MET 637.A N GLN 645.A O no hydrogen 2.996 N/A ALA 638.A N GLN 645.A O no hydrogen 3.308 N/A VAL 640.A N GLU 643.A O no hydrogen 2.765 N/A ILE 644.A N ILE 468.A O no hydrogen 2.867 N/A GLN 645.A N ALA 638.A O no hydrogen 3.003 N/A GLN 645.A NE2 GLU 643.A OE1 no hydrogen 2.719 N/A GLN 645.A NE2 CYS 691.A O no hydrogen 3.250 N/A VAL 646.A N ALA 466.A O no hydrogen 2.849 N/A GLY 647.A N ALA 635.A O no hydrogen 2.850 N/A CYS 648.A N VAL 464.A O no hydrogen 2.537 N/A CYS 648.A SG VAL 646.A O no hydrogen 3.680 N/A ARG 649.A N ASP 633.A O no hydrogen 2.913 N/A ARG 649.A NE GLY 632.A O no hydrogen 3.168 N/A ARG 649.A NH2 ASP 633.A OD1 no hydrogen 2.746 N/A ILE 653.A N THR 650.A OG1 no hydrogen 3.091 N/A ALA 654.A N THR 650.A O no hydrogen 2.996 N/A GLN 655.A N GLU 651.A O no hydrogen 2.792 N/A VAL 656.A N GLU 652.A O no hydrogen 3.032 N/A VAL 657.A N ILE 653.A O no hydrogen 2.774 N/A ILE 658.A N ALA 654.A O no hydrogen 3.051 N/A GLU 659.A N GLN 655.A O no hydrogen 3.170 N/A THR 660.A N VAL 656.A O no hydrogen 2.858 N/A THR 660.A OG1 VAL 656.A O no hydrogen 2.563 N/A ALA 661.A N VAL 657.A O no hydrogen 2.967 N/A GLN 662.A N ILE 658.A O no hydrogen 3.381 N/A GLN 662.A NE2 ASP 679.A OD1 no hydrogen 3.091 N/A GLU 663.A N GLU 659.A O no hydrogen 3.112 N/A ALA 664.A N THR 660.A O no hydrogen 2.918 N/A MET 665.A N ALA 661.A O no hydrogen 3.025 N/A ARG 666.A N GLN 662.A O no hydrogen 3.183 N/A TRP 667.A N GLU 663.A O no hydrogen 2.959 N/A VAL 668.A N ALA 664.A O no hydrogen 2.886 N/A GLY 669.A N MET 665.A O no hydrogen 2.943 N/A ASP 670.A N ARG 666.A O no hydrogen 2.996 N/A HIS 671.A N TRP 667.A O no hydrogen 2.727 N/A HIS 671.A NE2 GLU 206.A OE2 no hydrogen 2.785 N/A TRP 672.A N VAL 668.A O no hydrogen 3.200 N/A TRP 672.A NE1 GLU 206.A OE1 no hydrogen 3.184 N/A ASN 673.A N ASP 670.A O no hydrogen 3.163 N/A PHE 674.A N GLY 669.A O no hydrogen 2.926 N/A ARG 675.A N HIS 480.A ND1 no hydrogen 2.831 N/A CYS 676.A SG ALA 491.A O no hydrogen 3.960 N/A CYS 676.A SG LEU 677.A O no hydrogen 3.622 N/A THR 680.A N GLN 662.A OE1 no hydrogen 2.914 N/A THR 680.A OG1 GLN 662.A OE1 no hydrogen 2.547 N/A GLU 681.A N ASP 469.A O no hydrogen 2.894 N/A LYS 683.A N GLY 467.A O no hydrogen 2.795 N/A LYS 683.A NZ HIS 692.A O no hydrogen 3.275 N/A GLY 685.A N GLN 465.A O no hydrogen 2.955 N/A ASN 687.A ND2 GLU 452.A OE2 no hydrogen 2.838 N/A TRP 688.A N PHE 449.A O no hydrogen 2.880 N/A TRP 688.A NE1 GLU 643.A OE1 no hydrogen 2.789 N/A ALA 689.A N ASN 687.A OD1 no hydrogen 2.856 N/A ILE 690.A N ASN 687.A OD1 no hydrogen 3.227 N/A CYS 691.A N ASN 687.A O no hydrogen 3.008 N/A CYS 691.A SG GLN 465.A O no hydrogen 3.472 N/A CYS 691.A SG LYS 683.A O no hydrogen 3.662 N/A CYS 691.A SG ASN 687.A O no hydrogen 3.379 N/A