Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 7l7j_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLN 7.A NE2 ALA 5.A O no hydrogen 3.032 N/A GLN 12.A N GLU 9.A O no hydrogen 3.010 N/A LEU 13.A N GLU 9.A O no hydrogen 2.867 N/A MET 14.A N ILE 10.A O no hydrogen 2.975 N/A SER 15.A OG ALA 11.A O no hydrogen 2.782 N/A LEU 16.A N GLN 12.A O no hydrogen 2.911 N/A ILE 17.A N LEU 13.A O no hydrogen 3.296 N/A ILE 18.A N MET 14.A O no hydrogen 3.205 N/A ASN 19.A N SER 15.A O no hydrogen 2.887 N/A ASN 19.A ND2 SER 15.A O no hydrogen 2.856 N/A THR 20.A N LEU 16.A O no hydrogen 2.808 N/A THR 20.A OG1 LEU 16.A O no hydrogen 3.082 N/A PHE 21.A N LEU 16.A O no hydrogen 3.140 N/A SER 23.A OG GLU 331.A OE1 no hydrogen 3.341 N/A GLU 26.A N ASN 24.A OD1 no hydrogen 2.954 N/A PHE 28.A N LYS 25.A O no hydrogen 3.270 N/A ARG 30.A NE GLU 31.A OE2 no hydrogen 3.015 N/A ARG 30.A NH1 ARG 330.A O no hydrogen 3.470 N/A ARG 30.A NH2 GLU 31.A OE2 no hydrogen 2.665 N/A ARG 30.A NH2 SER 329.A O no hydrogen 3.084 N/A GLU 31.A N ILE 27.A O no hydrogen 2.959 N/A LEU 32.A N PHE 28.A O no hydrogen 3.125 N/A ILE 33.A N LEU 29.A O no hydrogen 2.952 N/A SER 34.A N ARG 30.A O no hydrogen 2.792 N/A SER 34.A OG ARG 30.A O no hydrogen 2.828 N/A ASN 35.A N GLU 31.A O no hydrogen 2.876 N/A SER 36.A N LEU 32.A O no hydrogen 3.125 N/A SER 36.A OG LEU 32.A O no hydrogen 2.761 N/A SER 37.A N ILE 33.A O no hydrogen 2.858 N/A ASP 38.A N SER 34.A O no hydrogen 2.946 N/A ALA 39.A N ASN 35.A O no hydrogen 3.036 N/A LEU 40.A N SER 36.A O no hydrogen 2.857 N/A ASP 41.A N SER 37.A O no hydrogen 2.988 N/A LYS 42.A N ASP 38.A O no hydrogen 2.919 N/A LYS 42.A NZ THR 99.A OG1 no hydrogen 2.947 N/A ILE 43.A N ALA 39.A O no hydrogen 3.344 N/A ARG 44.A N LEU 40.A O no hydrogen 2.868 N/A ARG 44.A NE TYR 200.A OH no hydrogen 2.848 N/A ARG 44.A NH2 ASP 41.A OD1 no hydrogen 2.829 N/A TYR 45.A N ASP 41.A O no hydrogen 2.973 N/A TYR 45.A OH GLN 107.A OE1 no hydrogen 2.835 N/A GLU 46.A N LYS 42.A O no hydrogen 2.986 N/A SER 47.A N ILE 43.A O no hydrogen 2.937 N/A SER 47.A OG ARG 44.A O no hydrogen 2.653 N/A LEU 48.A N TYR 45.A O no hydrogen 3.043 N/A THR 49.A OG1 GLU 46.A O no hydrogen 3.536 N/A ASP 50.A N GLU 46.A O no hydrogen 3.326 N/A SER 52.A N ASP 50.A OD1 no hydrogen 3.200 N/A SER 52.A OG ASP 50.A OD1 no hydrogen 2.618 N/A SER 52.A OG ASP 50.A OD2 no hydrogen 3.366 N/A LYS 53.A N ASP 50.A O no hydrogen 3.157 N/A LYS 53.A NZ GLU 46.A OE1 no hydrogen 2.774 N/A LEU 54.A N PRO 51.A O no hydrogen 3.120 N/A ASP 55.A N SER 52.A O no hydrogen 3.039 N/A SER 56.A OG LYS 53.A O no hydrogen 3.368 N/A SER 56.A OG ASN 139.A OD1 no hydrogen 2.671 N/A GLY 57.A N LEU 54.A O no hydrogen 2.870 N/A LYS 58.A NZ ASP 55.A OD1 no hydrogen 3.507 N/A HIS 61.A N THR 78.A OG1 no hydrogen 3.083 N/A ILE 62.A N PRO 201.A O no hydrogen 2.971 N/A ASN 63.A N VAL 76.A O no hydrogen 2.843 N/A ASN 63.A ND2 HIS 61.A NE2 no hydrogen 3.243 N/A LEU 64.A N THR 203.A O no hydrogen 2.803 N/A ILE 65.A N THR 74.A O no hydrogen 2.848 N/A ASN 67.A N THR 72.A O no hydrogen 2.914 N/A ASN 67.A ND2 ASP 70.A OD2 no hydrogen 2.874 N/A LYS 68.A NZ GLU 207.A OE2 no hydrogen 2.780 N/A ASP 70.A N ASN 67.A O no hydrogen 2.963 N/A LEU 73.A N LEU 172.A O no hydrogen 2.972 N/A THR 74.A N ILE 65.A O no hydrogen 2.919 N/A ILE 75.A N VAL 170.A O no hydrogen 2.815 N/A VAL 76.A N ASN 63.A O no hydrogen 2.813 N/A ASP 77.A N THR 168.A O no hydrogen 2.843 N/A THR 78.A N HIS 61.A O no hydrogen 3.248 N/A THR 78.A OG1 GLU 59.A O no hydrogen 2.743 N/A THR 78.A OG1 HIS 61.A O no hydrogen 3.563 N/A ILE 80.A N ALA 39.A O no hydrogen 2.862 N/A MET 82.A N THR 136.A OG1 no hydrogen 3.016 N/A THR 83.A N ASP 86.A OD2 no hydrogen 3.000 N/A THR 83.A OG1 ASP 86.A OD2 no hydrogen 2.615 N/A LYS 84.A N ASP 141.A OD2 no hydrogen 2.944 N/A ASP 86.A N THR 83.A OG1 no hydrogen 3.334 N/A LEU 87.A N THR 83.A O no hydrogen 2.989 N/A ILE 88.A N LYS 84.A O no hydrogen 3.091 N/A ASN 89.A N ALA 85.A O no hydrogen 2.931 N/A ASN 90.A N ASP 86.A O no hydrogen 2.829 N/A LEU 91.A N LEU 87.A O no hydrogen 3.202 N/A GLY 92.A N LEU 87.A O no hydrogen 3.183 N/A THR 93.A N ASN 89.A O no hydrogen 2.901 N/A THR 93.A OG1 ASN 89.A O no hydrogen 2.818 N/A ALA 95.A N GLY 119.A O no hydrogen 2.961 N/A LYS 96.A N THR 93.A O no hydrogen 3.304 N/A LYS 100.A N SER 97.A OG no hydrogen 3.242 N/A LYS 100.A NZ GLU 104.A OE1 no hydrogen 3.528 N/A LYS 100.A NZ GLU 104.A OE2 no hydrogen 2.796 N/A ALA 101.A N SER 97.A O no hydrogen 3.083 N/A PHE 102.A N GLY 98.A O no hydrogen 2.911 N/A MET 103.A N THR 99.A O no hydrogen 2.852 N/A GLU 104.A N LYS 100.A O no hydrogen 2.950 N/A ALA 105.A N PHE 102.A O no hydrogen 3.028 N/A LEU 106.A N MET 103.A O no hydrogen 3.332 N/A GLN 107.A N GLN 107.A OE1 no hydrogen 2.853 N/A ALA 110.A N GLN 107.A O no hydrogen 2.978 N/A ILE 112.A N ALA 110.A O no hydrogen 3.012 N/A SER 113.A OG GLU 322.A OE1 no hydrogen 2.568 N/A ILE 115.A N ASP 38.A OD1 no hydrogen 2.779 N/A GLY 116.A N ASP 38.A OD2 no hydrogen 2.783 N/A TYR 123.A N VAL 120.A O no hydrogen 3.081 N/A TYR 123.A OH LEU 91.A O no hydrogen 2.687 N/A TYR 123.A OH THR 93.A O no hydrogen 3.396 N/A SER 124.A N GLY 121.A O no hydrogen 3.250 N/A SER 124.A OG GLY 121.A O no hydrogen 2.645 N/A ALA 125.A N PHE 122.A O no hydrogen 2.958 N/A TYR 126.A N TYR 123.A O no hydrogen 3.038 N/A TYR 126.A OH SER 148.A O no hydrogen 2.689 N/A LEU 127.A N SER 124.A O no hydrogen 2.979 N/A VAL 128.A N ALA 125.A O no hydrogen 3.274 N/A ALA 129.A N ALA 125.A O no hydrogen 2.864 N/A GLU 130.A N HIS 173.A O no hydrogen 2.755 N/A LYS 131.A NZ GLU 147.A OE2 no hydrogen 2.748 N/A VAL 132.A N SER 148.A O no hydrogen 2.981 N/A THR 133.A N ILE 171.A O no hydrogen 3.003 N/A THR 133.A OG1 HIS 173.A NE2 no hydrogen 3.022 N/A VAL 134.A N TRP 146.A O no hydrogen 2.762 N/A ILE 135.A N LYS 169.A O no hydrogen 2.888 N/A THR 136.A N TYR 144.A O no hydrogen 2.889 N/A THR 136.A OG1 GLY 167.A O no hydrogen 3.133 N/A THR 136.A OG1 THR 168.A OG1 no hydrogen 2.878 N/A LYS 137.A N GLY 167.A O no hydrogen 2.866 N/A LYS 137.A NZ ASP 141.A O no hydrogen 2.818 N/A ASN 139.A ND2 LYS 53.A O no hydrogen 3.013 N/A ASP 140.A N HIS 138.A ND1 no hydrogen 3.036 N/A ASP 141.A N HIS 138.A O no hydrogen 3.431 N/A GLU 142.A N ASP 141.A OD1 no hydrogen 2.816 N/A GLN 143.A N GLU 142.A OE2 no hydrogen 2.832 N/A GLN 143.A NE2 ASP 159.A OD2 no hydrogen 2.785 N/A GLN 143.A NE2 GLU 162.A O no hydrogen 2.902 N/A TYR 144.A N THR 136.A O no hydrogen 2.918 N/A TYR 144.A OH ASP 141.A OD1 no hydrogen 2.729 N/A ALA 145.A N ARG 157.A O no hydrogen 2.974 N/A TRP 146.A N VAL 134.A O no hydrogen 2.838 N/A GLU 147.A N THR 155.A O no hydrogen 2.847 N/A SER 148.A N VAL 132.A O no hydrogen 3.036 N/A SER 148.A OG SER 153.A O no hydrogen 2.708 N/A ALA 150.A N SER 148.A OG no hydrogen 2.907 N/A THR 155.A N GLU 147.A O no hydrogen 2.852 N/A ARG 157.A N ALA 145.A O no hydrogen 3.057 N/A ASP 159.A N GLN 143.A O no hydrogen 2.822 N/A THR 160.A OG1 ASP 159.A O no hydrogen 3.039 N/A GLY 161.A N ASP 159.A OD2 no hydrogen 3.010 N/A MET 164.A N GLN 143.A OE1 no hydrogen 2.901 N/A ARG 166.A N MET 164.A O no hydrogen 2.885 N/A ARG 166.A NH2 GLY 57.A O no hydrogen 2.651 N/A GLY 167.A N LYS 137.A O no hydrogen 2.902 N/A THR 168.A N ASP 77.A O no hydrogen 2.828 N/A THR 168.A OG1 THR 136.A OG1 no hydrogen 2.878 N/A LYS 169.A N ILE 135.A O no hydrogen 2.737 N/A VAL 170.A N ILE 75.A O no hydrogen 3.085 N/A ILE 171.A N THR 133.A O no hydrogen 2.783 N/A LEU 172.A N LEU 73.A O no hydrogen 2.861 N/A HIS 173.A N LYS 131.A O no hydrogen 2.916 N/A HIS 173.A NE2 THR 133.A OG1 no hydrogen 3.022 N/A LEU 174.A N ARG 71.A O no hydrogen 3.158 N/A LYS 175.A N VAL 128.A O no hydrogen 2.950 N/A LYS 175.A NZ TYR 126.A O no hydrogen 2.890 N/A LYS 175.A NZ LEU 127.A O no hydrogen 2.941 N/A GLU 176.A N GLU 176.A OE1 no hydrogen 2.787 N/A GLN 178.A N LYS 175.A O no hydrogen 2.886 N/A GLN 178.A NE2 ASP 177.A OD1 no hydrogen 2.826 N/A TYR 181.A N GLN 178.A O no hydrogen 3.182 N/A LEU 182.A N THR 179.A O no hydrogen 3.081 N/A GLU 183.A N GLU 180.A O no hydrogen 3.036 N/A GLU 184.A N GLU 184.A OE1 no hydrogen 2.505 N/A ARG 185.A NE GLU 183.A OE2 no hydrogen 3.426 N/A ARG 185.A NH2 GLU 183.A OE1 no hydrogen 3.311 N/A ARG 186.A NH1 GLU 189.A OE1 no hydrogen 2.630 N/A ARG 186.A NH2 GLU 26.A OE1 no hydrogen 3.195 N/A ILE 187.A N GLU 183.A O no hydrogen 3.045 N/A LYS 188.A N GLU 184.A O no hydrogen 2.865 N/A GLU 189.A N ARG 185.A O no hydrogen 2.754 N/A ILE 190.A N ARG 186.A O no hydrogen 3.056 N/A VAL 191.A N ILE 187.A O no hydrogen 2.927 N/A LYS 192.A N LYS 188.A O no hydrogen 3.010 N/A LYS 192.A NZ LEU 220.A O no hydrogen 3.035 N/A LYS 193.A N GLU 189.A O no hydrogen 2.900 N/A LYS 193.A NZ GLU 26.A OE2 no hydrogen 2.929 N/A HIS 194.A N ILE 190.A O no hydrogen 2.947 N/A HIS 194.A NE2 GLU 26.A OE2 no hydrogen 2.832 N/A SER 195.A N VAL 191.A O no hydrogen 2.849 N/A ILE 198.A N SER 195.A O no hydrogen 3.227 N/A TYR 200.A OH ASP 41.A OD1 no hydrogen 2.570 N/A ILE 202.A N ASN 221.A OD1 no hydrogen 2.895 N/A THR 203.A N ILE 62.A O no hydrogen 2.797 N/A THR 203.A OG1 GLU 218.A O no hydrogen 2.671 N/A LEU 204.A N GLN 217.A O no hydrogen 3.093 N/A PHE 205.A N LEU 64.A O no hydrogen 2.881 N/A VAL 206.A N ILE 215.A O no hydrogen 3.172 N/A GLU 209.A N GLU 212.A O no hydrogen 2.963 N/A ARG 210.A NH1 GLU 207.A OE1 no hydrogen 3.106 N/A LYS 211.A NZ ARG 210.A O no hydrogen 2.900 N/A GLU 212.A N GLU 209.A OE1 no hydrogen 2.813 N/A LYS 213.A N GLU 212.A OE2 no hydrogen 2.859 N/A TYR 214.A OH ASP 216.A OD2 no hydrogen 2.636 N/A ILE 215.A N VAL 206.A O no hydrogen 2.832 N/A GLN 217.A N LEU 204.A O no hydrogen 2.966 N/A GLN 217.A NE2 GLU 219.A O no hydrogen 3.124 N/A LEU 220.A N ILE 202.A O no hydrogen 2.757 N/A ASN 221.A ND2 TYR 200.A O no hydrogen 2.796 N/A TRP 227.A NE1 ASP 320.A OD2 no hydrogen 2.766 N/A THR 228.A N PRO 225.A O no hydrogen 3.270 N/A THR 228.A OG1 PRO 225.A O no hydrogen 3.084 N/A ARG 229.A N ILE 226.A O no hydrogen 3.178 N/A ARG 229.A NH1 GLU 238.A OE2 no hydrogen 3.031 N/A ASP 232.A N ASN 230.A OD1 no hydrogen 3.075 N/A ASP 233.A N ASN 230.A O no hydrogen 2.980 N/A THR 235.A N GLU 238.A OE1 no hydrogen 2.984 N/A THR 235.A OG1 GLU 237.A OE1 no hydrogen 2.571 N/A THR 235.A OG1 GLU 238.A OE1 no hydrogen 3.550 N/A TYR 239.A N THR 235.A O no hydrogen 3.075 N/A TYR 239.A OH PRO 231.A O no hydrogen 3.175 N/A GLY 240.A N ASN 236.A O no hydrogen 2.988 N/A GLU 241.A N GLU 237.A O no hydrogen 2.844 N/A PHE 242.A N GLU 238.A O no hydrogen 3.189 N/A TYR 243.A N TYR 239.A O no hydrogen 2.887 N/A TYR 243.A OH ASP 249.A OD2 no hydrogen 2.694 N/A LYS 244.A N GLY 240.A O no hydrogen 3.018 N/A LYS 244.A NZ ASP 252.A OD1 no hydrogen 2.775 N/A SER 245.A N GLU 241.A O no hydrogen 3.160 N/A SER 245.A OG GLU 241.A O no hydrogen 2.731 N/A LEU 246.A N PHE 242.A O no hydrogen 2.818 N/A THR 247.A N TYR 243.A O no hydrogen 3.045 N/A THR 247.A OG1 TYR 243.A O no hydrogen 2.683 N/A ASN 248.A N LYS 244.A O no hydrogen 2.904 N/A ASP 249.A N THR 247.A OG1 no hydrogen 3.165 N/A GLU 251.A N ASP 249.A OD1 no hydrogen 3.075 N/A ASP 252.A N GLU 251.A OE2 no hydrogen 2.797 N/A HIS 253.A NE2 ASN 236.A OD1 no hydrogen 2.884 N/A LEU 254.A N VAL 273.A O no hydrogen 2.811 N/A LYS 257.A N LEU 271.A O no hydrogen 2.963 N/A LYS 257.A NZ GLU 352.A OE1 no hydrogen 2.812 N/A HIS 258.A NE2 TRP 227.A O no hydrogen 2.764 N/A PHE 259.A N ALA 269.A O no hydrogen 2.980 N/A VAL 261.A N PHE 267.A O no hydrogen 2.840 N/A GLY 263.A N GLU 266.A OE2 no hydrogen 2.991 N/A GLN 264.A N GLN 264.A OE1 no hydrogen 2.775 N/A PHE 267.A N VAL 261.A O no hydrogen 3.063 N/A ARG 268.A N ASP 320.A O no hydrogen 2.828 N/A ARG 268.A NE TRP 227.A O no hydrogen 2.818 N/A ARG 268.A NH2 ARG 229.A O no hydrogen 2.869 N/A ALA 269.A N PHE 259.A O no hydrogen 3.120 N/A LEU 270.A N VAL 318.A O no hydrogen 2.975 N/A LEU 271.A N LYS 257.A O no hydrogen 3.043 N/A PHE 272.A N ARG 316.A O no hydrogen 2.814 N/A VAL 273.A N ALA 255.A O no hydrogen 2.996 N/A ARG 275.A NE ASP 252.A O no hydrogen 3.366 N/A ARG 275.A NH2 HIS 253.A O no hydrogen 2.817 N/A ARG 276.A NH1 ASP 249.A OD1 no hydrogen 3.057 N/A ALA 277.A N GLN 370.A OE1 no hydrogen 3.423 N/A LEU 281.A N PRO 278.A O no hydrogen 3.132 N/A PHE 282.A N GLU 283.A OE1 no hydrogen 3.169 N/A GLU 283.A N GLU 283.A OE1 no hydrogen 2.756 N/A ASN 284.A N ASP 280.A O no hydrogen 2.878 N/A ASN 284.A ND2 ASP 280.A OD2 no hydrogen 2.954 N/A ARG 285.A N GLU 283.A O no hydrogen 3.028 N/A LYS 286.A N ASN 284.A OD1 no hydrogen 3.291 N/A LYS 287.A N ASN 284.A OD1 no hydrogen 2.966 N/A LYS 288.A N LYS 286.A O no hydrogen 3.166 N/A LYS 288.A N ASN 303.A OD1 no hydrogen 2.676 N/A LYS 288.A NZ ARG 285.A O no hydrogen 2.835 N/A ASN 289.A ND2 CYS 304.A O no hydrogen 2.783 N/A ASN 289.A ND2 ILE 308.A O no hydrogen 3.626 N/A ASN 290.A ND2 ASN 313.A O no hydrogen 2.837 N/A LYS 292.A N GLY 317.A O no hydrogen 2.956 N/A LEU 293.A N MET 301.A O no hydrogen 2.800 N/A TYR 294.A N VAL 319.A O no hydrogen 2.767 N/A VAL 295.A N VAL 298.A O no hydrogen 2.936 N/A ARG 296.A N SER 321.A O no hydrogen 2.898 N/A ARG 296.A NE GLU 322.A O no hydrogen 2.713 N/A ARG 296.A NH1 MET 114.A O no hydrogen 2.568 N/A ARG 296.A NH2 GLU 322.A O no hydrogen 3.044 N/A ARG 297.A N ASP 320.A OD1 no hydrogen 3.166 N/A ARG 297.A NH1 ASP 320.A OD2 no hydrogen 2.774 N/A ARG 297.A NH1 GLU 322.A OE2 no hydrogen 2.781 N/A ARG 297.A NH2 GLU 322.A OE2 no hydrogen 3.237 N/A VAL 298.A N VAL 295.A O no hydrogen 3.037 N/A PHE 299.A N HIS 194.A O no hydrogen 3.244 N/A ILE 300.A N LEU 293.A O no hydrogen 2.839 N/A MET 301.A N LEU 293.A O no hydrogen 3.287 N/A ASN 303.A ND2 LYS 286.A O no hydrogen 2.888 N/A GLU 305.A N GLU 305.A OE1 no hydrogen 2.781 N/A LEU 307.A N CYS 304.A O no hydrogen 2.990 N/A GLU 310.A N GLU 310.A OE1 no hydrogen 2.787 N/A TYR 311.A OH ASP 382.A OD2 no hydrogen 2.643 N/A LEU 312.A N PRO 309.A O no hydrogen 2.857 N/A ASN 313.A N GLU 310.A O no hydrogen 3.288 N/A ASN 313.A ND2 LEU 281.A O no hydrogen 2.895 N/A ILE 315.A N LEU 312.A O no hydrogen 3.012 N/A ARG 316.A N PHE 272.A O no hydrogen 3.077 N/A GLY 317.A N ASN 290.A O no hydrogen 3.131 N/A VAL 318.A N LEU 270.A O no hydrogen 2.942 N/A VAL 319.A N LYS 292.A O no hydrogen 2.859 N/A ASP 320.A N ARG 268.A O no hydrogen 2.850 N/A SER 321.A N TYR 294.A O no hydrogen 3.220 N/A SER 321.A OG GLU 266.A O no hydrogen 2.658 N/A ASP 323.A N SER 321.A OG no hydrogen 3.111 N/A ASN 327.A N MET 332.A O no hydrogen 2.923 N/A ASN 327.A ND2 GLN 334.A OE1 no hydrogen 2.824 N/A SER 329.A N ASN 327.A OD1 no hydrogen 3.184 N/A SER 329.A OG ASN 327.A OD1 no hydrogen 2.981 N/A ARG 330.A N ASN 327.A O no hydrogen 2.809 N/A ARG 330.A NH2 ILE 115.A O no hydrogen 2.569 N/A GLU 331.A N SER 329.A OG no hydrogen 3.174 N/A GLN 334.A N PRO 325.A O no hydrogen 2.923 N/A ILE 338.A N GLN 335.A O no hydrogen 3.336 N/A LYS 340.A N SER 336.A O no hydrogen 3.078 N/A VAL 341.A N LYS 337.A O no hydrogen 3.126 N/A ILE 342.A N ILE 338.A O no hydrogen 2.996 N/A ARG 343.A N LEU 339.A O no hydrogen 2.816 N/A LYS 344.A N LYS 340.A O no hydrogen 2.939 N/A ASN 345.A ND2 VAL 341.A O no hydrogen 2.824 N/A LEU 346.A N ILE 342.A O no hydrogen 2.816 N/A VAL 347.A N ARG 343.A O no hydrogen 2.890 N/A LYS 348.A N LYS 344.A O no hydrogen 2.912 N/A LYS 349.A N ASN 345.A O no hydrogen 3.076 N/A LYS 349.A NZ GLU 352.A OE2 no hydrogen 2.778 N/A CYS 350.A N LEU 346.A O no hydrogen 2.852 N/A CYS 350.A SG LEU 346.A O no hydrogen 3.107 N/A LEU 351.A N VAL 347.A O no hydrogen 2.967 N/A GLU 352.A N LYS 348.A O no hydrogen 3.333 N/A LEU 353.A N LYS 349.A O no hydrogen 2.981 N/A PHE 354.A N CYS 350.A O no hydrogen 2.981 N/A THR 355.A N LEU 351.A O no hydrogen 3.035 N/A THR 355.A OG1 LEU 351.A O no hydrogen 2.670 N/A GLU 356.A N GLU 352.A O no hydrogen 2.821 N/A LEU 357.A N LEU 353.A O no hydrogen 2.822 N/A ALA 358.A N PHE 354.A O no hydrogen 2.871 N/A GLU 359.A N GLU 356.A O no hydrogen 3.413 N/A ASP 360.A N LEU 357.A O no hydrogen 2.992 N/A ASN 363.A ND2 ASP 360.A OD2 no hydrogen 2.771 N/A TYR 364.A N ASP 360.A O no hydrogen 2.838 N/A TYR 364.A OH LEU 392.A O no hydrogen 2.640 N/A LYS 365.A N LYS 361.A O no hydrogen 2.911 N/A LYS 365.A NZ GLU 362.A OE1 no hydrogen 3.201 N/A LYS 365.A NZ GLU 362.A OE2 no hydrogen 2.840 N/A LYS 366.A N GLU 362.A O no hydrogen 3.289 N/A PHE 367.A N ASN 363.A O no hydrogen 3.008 N/A TYR 368.A N TYR 364.A O no hydrogen 2.799 N/A TYR 368.A OH ARG 394.A O no hydrogen 2.706 N/A GLU 369.A N LYS 365.A O no hydrogen 3.007 N/A GLN 370.A N PHE 367.A O no hydrogen 3.163 N/A GLN 370.A NE2 ARG 275.A O no hydrogen 2.926 N/A GLN 370.A NE2 LYS 366.A O no hydrogen 2.884 N/A PHE 371.A N PHE 367.A O no hydrogen 2.887 N/A SER 372.A N TYR 368.A O no hydrogen 3.048 N/A SER 372.A OG TYR 368.A O no hydrogen 2.900 N/A LYS 373.A NZ GLU 453.A OE1 no hydrogen 2.799 N/A ASN 374.A N PHE 371.A O no hydrogen 2.954 N/A ASN 374.A ND2 TYR 311.A O no hydrogen 2.840 N/A ILE 375.A N PHE 371.A O no hydrogen 3.183 N/A LYS 376.A N SER 372.A O no hydrogen 3.040 N/A LYS 376.A NZ ASP 456.A OD1 no hydrogen 2.704 N/A LEU 377.A N LYS 373.A O no hydrogen 2.874 N/A GLY 378.A N ASN 374.A O no hydrogen 2.817 N/A ILE 379.A N ILE 375.A O no hydrogen 2.888 N/A HIS 380.A N LYS 376.A O no hydrogen 2.975 N/A HIS 380.A ND1 GLN 462.A OE1 no hydrogen 2.802 N/A GLU 381.A N LEU 377.A O no hydrogen 2.936 N/A ASP 382.A N GLY 378.A O no hydrogen 2.770 N/A ASN 385.A N ASP 382.A O no hydrogen 3.260 N/A ASN 385.A ND2 ASP 382.A OD1 no hydrogen 3.118 N/A ASN 385.A ND2 ASP 382.A OD2 no hydrogen 2.835 N/A ARG 386.A NE ILE 379.A O no hydrogen 2.753 N/A ARG 386.A NH2 HIS 380.A O no hydrogen 2.937 N/A LYS 388.A N ASN 385.A O no hydrogen 2.832 N/A LEU 389.A N ASN 385.A O no hydrogen 2.822 N/A SER 390.A N ARG 386.A O no hydrogen 2.882 N/A SER 390.A OG ARG 386.A O no hydrogen 2.757 N/A GLU 391.A N LYS 388.A O no hydrogen 3.041 N/A LEU 392.A N LEU 389.A O no hydrogen 2.926 N/A ARG 394.A N TYR 368.A OH no hydrogen 2.937 N/A ARG 394.A NH1 GLU 391.A O no hydrogen 3.230 N/A ARG 394.A NH1 LEU 393.A O no hydrogen 3.034 N/A TYR 395.A N VAL 405.A O no hydrogen 2.865 N/A THR 397.A N SER 400.A OG no hydrogen 2.953 N/A THR 397.A OG1 SER 400.A OG no hydrogen 2.800 N/A THR 397.A OG1 GLU 447.A OE2 no hydrogen 2.571 N/A SER 398.A N VAL 448.A O no hydrogen 2.914 N/A SER 400.A N THR 397.A O no hydrogen 3.387 N/A SER 400.A OG THR 397.A O no hydrogen 3.179 N/A SER 400.A OG THR 397.A OG1 no hydrogen 2.800 N/A SER 400.A OG GLU 403.A O no hydrogen 3.333 N/A GLU 403.A N SER 400.A O no hydrogen 3.289 N/A VAL 405.A N TYR 395.A O no hydrogen 2.845 N/A SER 406.A N ASP 409.A OD2 no hydrogen 2.900 N/A SER 406.A OG ASP 409.A OD2 no hydrogen 2.574 N/A LYS 408.A NZ GLU 391.A OE1 no hydrogen 2.785 N/A ASP 409.A N SER 406.A O no hydrogen 3.009 N/A ASP 409.A N SER 406.A OG no hydrogen 3.293 N/A TYR 410.A N SER 406.A O no hydrogen 3.121 N/A TYR 410.A OH GLU 447.A O no hydrogen 2.637 N/A CYS 411.A N LEU 407.A O no hydrogen 2.879 N/A CYS 411.A SG LEU 407.A O no hydrogen 3.132 N/A CYS 411.A SG GLU 467.A OE1 no hydrogen 3.499 N/A THR 412.A N LYS 408.A O no hydrogen 2.981 N/A THR 412.A N ASP 409.A O no hydrogen 3.118 N/A THR 412.A OG1 LYS 408.A O no hydrogen 2.728 N/A ARG 413.A N ASP 409.A O no hydrogen 3.054 N/A ARG 413.A NE GLU 447.A OE1 no hydrogen 2.799 N/A ARG 413.A NH2 GLU 447.A OE1 no hydrogen 3.435 N/A ARG 413.A NH2 GLU 447.A OE2 no hydrogen 2.724 N/A MET 414.A N TYR 410.A O no hydrogen 2.910 N/A LYS 415.A N GLN 418.A OE1 no hydrogen 3.172 N/A LYS 415.A NZ GLY 445.A O no hydrogen 3.054 N/A GLN 418.A N LYS 415.A O no hydrogen 2.876 N/A GLN 418.A NE2 TYR 410.A OH no hydrogen 3.015 N/A GLN 418.A NE2 HIS 420.A O no hydrogen 2.966 N/A ILE 421.A N THR 470.A O no hydrogen 2.877 N/A TYR 422.A N TYR 410.A OH no hydrogen 3.091 N/A TYR 423.A N VAL 472.A O no hydrogen 2.941 N/A ILE 424.A N ILE 449.A O no hydrogen 2.858 N/A THR 425.A OG1 GLU 457.A OE1 no hydrogen 2.585 N/A GLY 426.A N MET 451.A O no hydrogen 3.095 N/A GLU 427.A N GLN 431.A OE1 no hydrogen 3.325 N/A LYS 429.A NZ GLY 401.A O no hydrogen 2.861 N/A GLN 431.A N THR 428.A OG1 no hydrogen 3.091 N/A GLN 431.A NE2 GLU 427.A OE1 no hydrogen 2.897 N/A VAL 432.A N THR 428.A O no hydrogen 3.084 N/A ALA 433.A N LYS 429.A O no hydrogen 2.873 N/A ASN 434.A N ASP 430.A O no hydrogen 3.401 N/A ASN 434.A ND2 ASP 430.A O no hydrogen 2.878 N/A SER 435.A N VAL 432.A O no hydrogen 3.124 N/A GLU 439.A N ALA 436.A O no hydrogen 3.352 N/A ARG 440.A N ARG 521.A O no hydrogen 3.067 N/A ARG 440.A NE ASN 520.A O no hydrogen 2.743 N/A ARG 440.A NH2 LEU 522.A O no hydrogen 2.834 N/A ARG 442.A N VAL 438.A O no hydrogen 2.920 N/A ARG 442.A NH1 ALA 433.A O no hydrogen 2.752 N/A ARG 442.A NH2 ALA 433.A O no hydrogen 2.868 N/A LYS 443.A N GLU 439.A O no hydrogen 3.085 N/A HIS 444.A N ARG 440.A O no hydrogen 2.942 N/A LEU 446.A N LEU 441.A O no hydrogen 2.938 N/A VAL 448.A N SER 398.A OG no hydrogen 2.932 N/A ILE 449.A N TYR 422.A O no hydrogen 2.945 N/A TYR 450.A N TYR 396.A O no hydrogen 2.874 N/A MET 451.A N ILE 424.A O no hydrogen 2.919 N/A ILE 452.A N ASP 456.A OD2 no hydrogen 2.790 N/A GLU 453.A N ASP 456.A OD2 no hydrogen 2.909 N/A ASP 456.A N GLU 453.A O no hydrogen 2.970 N/A GLU 457.A N PRO 454.A O no hydrogen 3.093 N/A CYS 459.A N ILE 455.A O no hydrogen 3.084 N/A CYS 459.A SG TYR 395.A OH no hydrogen 3.729 N/A VAL 460.A N ASP 456.A O no hydrogen 3.316 N/A GLN 461.A N TYR 458.A O no hydrogen 3.055 N/A GLN 462.A N CYS 459.A O no hydrogen 3.252 N/A LEU 463.A N CYS 459.A O no hydrogen 2.895 N/A LYS 464.A N GLN 462.A O no hydrogen 2.889 N/A LYS 464.A NZ GLN 461.A O no hydrogen 2.801 N/A PHE 466.A N LYS 469.A O no hydrogen 2.978 N/A LYS 469.A N PHE 466.A O no hydrogen 2.862 N/A LYS 469.A NZ GLU 467.A O no hydrogen 3.060 N/A LEU 471.A N LYS 464.A O no hydrogen 3.003 N/A VAL 472.A N ILE 421.A O no hydrogen 2.908 N/A SER 473.A OG THR 475.A OG1 no hydrogen 3.387 N/A VAL 474.A N TYR 423.A O no hydrogen 2.870 N/A THR 475.A N SER 473.A OG no hydrogen 3.153 N/A THR 475.A OG1 SER 473.A OG no hydrogen 3.387 N/A LYS 476.A NZ THR 533.A O no hydrogen 2.844 N/A GLU 477.A N THR 531.A O no hydrogen 2.873 N/A GLU 480.A N GLY 478.A O no hydrogen 2.938 N/A ASP 484.A N GLU 483.A OE2 no hydrogen 2.899 N/A GLU 486.A N ASP 484.A OD2 no hydrogen 3.069 N/A LYS 488.A N ASP 484.A O no hydrogen 2.893 N/A LYS 488.A NZ GLU 485.A OE2 no hydrogen 2.802 N/A LYS 489.A N GLU 485.A O no hydrogen 2.905 N/A LYS 489.A NZ GLU 493.A OE2 no hydrogen 2.777 N/A LYS 490.A N GLU 486.A O no hydrogen 2.970 N/A LYS 490.A NZ GLU 487.A OE1 no hydrogen 3.202 N/A LYS 490.A NZ GLU 487.A OE2 no hydrogen 2.849 N/A GLN 491.A N GLU 487.A O no hydrogen 2.815 N/A GLU 492.A N LYS 488.A O no hydrogen 2.984 N/A GLU 493.A N LYS 489.A O no hydrogen 3.088 N/A LYS 494.A N LYS 490.A O no hydrogen 2.843 N/A LYS 494.A NZ ASP 569.A OD1 no hydrogen 3.053 N/A LYS 494.A NZ ASP 569.A OD2 no hydrogen 2.797 N/A LYS 495.A N GLN 491.A O no hydrogen 2.946 N/A LYS 495.A NZ GLU 492.A OE2 no hydrogen 2.810 N/A THR 496.A N GLU 492.A O no hydrogen 2.943 N/A THR 496.A OG1 GLU 492.A O no hydrogen 2.733 N/A LYS 497.A N GLU 493.A O no hydrogen 2.885 N/A PHE 498.A N LYS 495.A O no hydrogen 3.142 N/A ASN 500.A ND2 GLU 581.A OE2 no hydrogen 2.819 N/A CYS 502.A N PHE 498.A O no hydrogen 2.983 N/A CYS 502.A SG PHE 498.A O no hydrogen 3.238 N/A LYS 503.A N GLU 499.A O no hydrogen 3.103 N/A LYS 503.A NZ ASP 507.A OD1 no hydrogen 2.754 N/A LYS 503.A NZ ASP 507.A OD2 no hydrogen 3.132 N/A ILE 504.A N ASN 500.A O no hydrogen 2.947 N/A MET 505.A N LEU 501.A O no hydrogen 2.840 N/A LYS 506.A N CYS 502.A O no hydrogen 2.864 N/A LYS 506.A NZ GLU 510.A OE1 no hydrogen 3.035 N/A LYS 506.A NZ GLU 510.A OE2 no hydrogen 2.784 N/A ASP 507.A N LYS 503.A O no hydrogen 2.936 N/A ILE 508.A N ILE 504.A O no hydrogen 3.093 N/A LEU 509.A N MET 505.A O no hydrogen 2.868 N/A LYS 511.A N GLU 510.A OE2 no hydrogen 2.865 N/A LYS 512.A N LEU 509.A O no hydrogen 2.939 N/A LYS 512.A NZ GLU 609.A OE2 no hydrogen 2.815 N/A GLU 514.A N LYS 562.A O no hydrogen 2.746 N/A VAL 517.A N LEU 564.A O no hydrogen 2.977 N/A SER 519.A N ILE 566.A O no hydrogen 3.001 N/A SER 519.A OG GLU 565.A OE1 no hydrogen 2.598 N/A ARG 521.A NH1 VAL 474.A O no hydrogen 2.568 N/A ARG 521.A NH1 LYS 476.A O no hydrogen 3.194 N/A ARG 521.A NH2 LYS 476.A O no hydrogen 3.214 N/A VAL 523.A N GLU 439.A OE1 no hydrogen 2.791 N/A THR 524.A N GLU 439.A OE1 no hydrogen 2.768 N/A SER 525.A N GLU 439.A OE1 no hydrogen 2.977 N/A SER 525.A OG GLU 439.A OE2 no hydrogen 2.647 N/A CYS 527.A SG LEU 596.A O no hydrogen 3.768 N/A CYS 528.A N GLU 565.A O no hydrogen 2.985 N/A ILE 529.A N SER 604.A OG no hydrogen 2.865 N/A VAL 530.A N HIS 563.A O no hydrogen 2.889 N/A THR 531.A N THR 475.A O no hydrogen 3.168 N/A THR 531.A OG1 SER 532.A O no hydrogen 3.081 N/A THR 531.A OG1 TRP 536.A O no hydrogen 3.434 N/A SER 532.A N LYS 561.A O no hydrogen 3.002 N/A THR 533.A N GLU 477.A OE2 no hydrogen 2.993 N/A TRP 536.A N MET 558.A O no hydrogen 3.244 N/A THR 537.A OG1 GLU 457.A OE2 no hydrogen 2.678 N/A ASN 539.A ND2 GLU 457.A OE1 no hydrogen 2.796 N/A MET 540.A N THR 537.A OG1 no hydrogen 2.905 N/A GLU 541.A N THR 537.A O no hydrogen 3.030 N/A ARG 542.A N ALA 538.A O no hydrogen 3.481 N/A ARG 542.A NE ASN 539.A OD1 no hydrogen 3.172 N/A ARG 542.A NH2 ASN 539.A OD1 no hydrogen 2.783 N/A ILE 543.A N ASN 539.A O no hydrogen 2.952 N/A MET 544.A N MET 540.A O no hydrogen 2.887 N/A LYS 545.A N GLU 541.A O no hydrogen 2.878 N/A ALA 546.A N ILE 543.A O no hydrogen 3.040 N/A GLN 547.A N MET 544.A O no hydrogen 3.208 N/A GLN 547.A NE2 ILE 543.A O no hydrogen 2.851 N/A ARG 550.A NH1 LEU 549.A O no hydrogen 2.828 N/A SER 553.A OG ASP 551.A OD2 no hydrogen 2.597 N/A THR 554.A N ASP 551.A O no hydrogen 3.034 N/A THR 554.A N ASP 551.A OD2 no hydrogen 2.915 N/A THR 554.A OG1 ASP 551.A OD2 no hydrogen 2.666 N/A MET 555.A N ASP 551.A O no hydrogen 3.025 N/A GLY 556.A N ASN 552.A O no hydrogen 2.905 N/A MET 558.A N MET 555.A O no hydrogen 3.293 N/A ALA 559.A N GLY 556.A O no hydrogen 3.310 N/A ALA 560.A N GLU 541.A OE1 no hydrogen 2.937 N/A LYS 562.A NZ ALA 560.A O no hydrogen 2.870 N/A HIS 563.A N VAL 530.A O no hydrogen 2.737 N/A LEU 564.A N LYS 515.A O no hydrogen 2.980 N/A GLU 565.A N CYS 528.A O no hydrogen 2.841 N/A ILE 566.A N VAL 517.A O no hydrogen 2.842 N/A ASN 567.A N PRO 526.A O no hydrogen 2.884 N/A ASN 567.A ND2 VAL 523.A O no hydrogen 2.968 N/A ASN 567.A ND2 SER 525.A O no hydrogen 2.824 N/A ASP 569.A N ASN 567.A OD1 no hydrogen 3.091 N/A HIS 570.A N ASN 567.A O no hydrogen 3.326 N/A HIS 570.A NE2 THR 524.A O no hydrogen 2.869 N/A ILE 572.A N HIS 570.A ND1 no hydrogen 3.214 N/A GLU 574.A N HIS 570.A O no hydrogen 2.928 N/A THR 575.A N SER 571.A O no hydrogen 3.111 N/A THR 575.A OG1 SER 571.A O no hydrogen 2.737 N/A LEU 576.A N ILE 572.A O no hydrogen 2.856 N/A ARG 577.A N ILE 573.A O no hydrogen 2.814 N/A ARG 577.A NE GLU 574.A OE1 no hydrogen 3.090 N/A ARG 577.A NH2 GLU 574.A OE2 no hydrogen 2.996 N/A GLN 578.A N GLU 574.A O no hydrogen 3.106 N/A GLN 578.A NE2 GLU 574.A OE2 no hydrogen 2.802 N/A LYS 579.A N THR 575.A O no hydrogen 2.959 N/A ALA 580.A N LEU 576.A O no hydrogen 2.842 N/A GLU 581.A N ARG 577.A O no hydrogen 2.799 N/A ALA 582.A N GLN 578.A O no hydrogen 3.144 N/A ASP 583.A N LYS 579.A O no hydrogen 2.993 N/A ASN 585.A N ASP 583.A OD1 no hydrogen 2.906 N/A ASP 586.A N ASP 583.A O no hydrogen 3.232 N/A LYS 587.A NZ ASP 591.A OD1 no hydrogen 2.802 N/A LYS 587.A NZ ASP 591.A OD2 no hydrogen 3.145 N/A SER 588.A N ASP 586.A OD1 no hydrogen 2.959 N/A LYS 590.A N ASP 586.A O no hydrogen 3.019 N/A LYS 590.A NZ ASN 585.A OD1 no hydrogen 2.991 N/A ASP 591.A N LYS 587.A O no hydrogen 3.068 N/A LEU 592.A N SER 588.A O no hydrogen 3.005 N/A VAL 593.A N VAL 589.A O no hydrogen 2.917 N/A ILE 594.A N LYS 590.A O no hydrogen 3.388 N/A LEU 595.A N ASP 591.A O no hydrogen 2.888 N/A LEU 596.A N LEU 592.A O no hydrogen 2.796 N/A TYR 597.A N VAL 593.A O no hydrogen 3.061 N/A TYR 597.A OH LYS 512.A O no hydrogen 2.931 N/A GLU 598.A N ILE 594.A O no hydrogen 2.919 N/A THR 599.A N LEU 595.A O no hydrogen 2.896 N/A THR 599.A OG1 LEU 595.A O no hydrogen 2.676 N/A ALA 600.A N LEU 596.A O no hydrogen 2.840 N/A LEU 601.A N TYR 597.A O no hydrogen 2.872 N/A LEU 602.A N GLU 598.A O no hydrogen 3.328 N/A SER 603.A N THR 599.A O no hydrogen 2.989 N/A SER 603.A OG THR 599.A O no hydrogen 3.337 N/A SER 603.A OG ALA 600.A O no hydrogen 3.515 N/A SER 604.A N ALA 600.A O no hydrogen 3.016 N/A SER 604.A OG ILE 529.A O no hydrogen 3.510 N/A SER 604.A OG ALA 600.A O no hydrogen 2.654 N/A GLY 605.A N LEU 602.A O no hydrogen 3.031 N/A PHE 606.A N LEU 601.A O no hydrogen 2.958 N/A GLU 609.A N GLU 609.A OE1 no hydrogen 2.790 N/A GLN 612.A N ASP 610.A OD1 no hydrogen 2.939 N/A GLN 612.A NE2 ASN 616.A OD1 no hydrogen 3.607 N/A THR 613.A N ASP 610.A OD2 no hydrogen 3.297 N/A THR 613.A OG1 ASP 610.A OD2 no hydrogen 2.647 N/A HIS 614.A ND1 GLU 598.A OE1 no hydrogen 2.823 N/A ALA 615.A N PRO 611.A O no hydrogen 2.907 N/A ASN 616.A N GLN 612.A O no hydrogen 2.990 N/A ARG 617.A N HIS 614.A O no hydrogen 2.856 N/A ARG 617.A NH1 ASP 591.A OD1 no hydrogen 3.527 N/A TYR 619.A N ALA 615.A O no hydrogen 2.912 N/A ARG 620.A N ASN 616.A O no hydrogen 3.028 N/A MET 621.A N ARG 617.A O no hydrogen 2.883 N/A ILE 622.A N ILE 618.A O no hydrogen 2.928 N/A LYS 623.A N TYR 619.A O no hydrogen 2.902 N/A LEU 624.A N ARG 620.A O no hydrogen 2.884 N/A GLY 625.A N MET 621.A O no hydrogen 2.876 N/A LEU 626.A N ILE 622.A O no hydrogen 2.901 N/A GLY 627.A N LEU 624.A O no hydrogen 3.165 N/A ILE 628.A N LYS 623.A O no hydrogen 2.896 N/A