Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 5tf0_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLN 1.A N ASP 3.A OD2 no hydrogen 3.498 N/A ARG 4.A N GLN 1.A O no hydrogen 3.177 N/A PHE 5.A N ASP 2.A O no hydrogen 2.949 N/A ASP 7.A N ASP 3.A O no hydrogen 2.791 N/A ALA 8.A N ARG 4.A O no hydrogen 3.210 N/A LEU 9.A N PHE 5.A O no hydrogen 3.180 N/A LYS 11.A N LEU 9.A O no hydrogen 2.865 N/A THR 12.A OG1 GLU 14.A OE1 no hydrogen 3.334 N/A THR 12.A OG1 GLU 15.A OE1 no hydrogen 3.377 N/A GLU 14.A N GLU 14.A OE1 no hydrogen 2.930 N/A GLU 15.A N THR 12.A OG1 no hydrogen 3.088 N/A LYS 16.A N THR 12.A O no hydrogen 2.994 N/A LYS 16.A NZ ASP 293.A OD1 no hydrogen 3.313 N/A ILE 17.A N VAL 13.A O no hydrogen 2.996 N/A GLY 18.A N GLU 14.A O no hydrogen 2.889 N/A GLN 19.A N GLU 15.A O no hydrogen 3.121 N/A GLN 19.A N LYS 16.A O no hydrogen 3.196 N/A LEU 20.A N ILE 17.A O no hydrogen 2.927 N/A ASN 21.A N GLY 18.A O no hydrogen 3.026 N/A ASN 21.A ND2 LEU 37.A O no hydrogen 3.101 N/A ASN 21.A ND2 GLU 273.A OE2 no hydrogen 3.527 N/A LEU 22.A N ASP 270.A O no hydrogen 2.993 N/A LYS 31.A N ASP 28.A O no hydrogen 3.151 N/A ILE 33.A N VAL 29.A O no hydrogen 3.078 N/A GLU 34.A N ALA 30.A O no hydrogen 2.825 N/A GLN 35.A N LYS 31.A O no hydrogen 3.116 N/A GLY 36.A N ILE 33.A O no hydrogen 2.851 N/A LEU 37.A N LYS 32.A O no hydrogen 2.923 N/A GLY 39.A N ASN 21.A O no hydrogen 2.648 N/A LEU 41.A N ILE 68.A O no hydrogen 2.744 N/A LEU 42.A N PRO 23.A O no hydrogen 3.432 N/A ASN 43.A N GLY 70.A O no hydrogen 3.085 N/A VAL 47.A N ASP 108.A OD2 no hydrogen 2.967 N/A ILE 50.A N GLY 46.A O no hydrogen 3.111 N/A ARG 51.A N VAL 47.A O no hydrogen 3.067 N/A ARG 51.A NH2 ASP 52.A OD1 no hydrogen 3.526 N/A ASP 52.A N GLU 48.A O no hydrogen 3.305 N/A VAL 53.A N LYS 49.A O no hydrogen 2.920 N/A GLN 54.A N ILE 50.A O no hydrogen 2.809 N/A GLN 54.A NE2 LEU 67.A O no hydrogen 3.205 N/A GLN 54.A NE2 PRO 312.A O no hydrogen 3.205 N/A LYS 55.A N ARG 51.A O no hydrogen 2.715 N/A LEU 56.A N ASP 52.A O no hydrogen 3.333 N/A ALA 57.A N VAL 53.A O no hydrogen 3.301 N/A ILE 58.A N GLN 54.A O no hydrogen 2.952 N/A GLU 59.A N LYS 55.A O no hydrogen 2.798 N/A LYS 60.A N LEU 56.A O no hydrogen 2.794 N/A SER 61.A OG ALA 57.A O no hydrogen 2.792 N/A ARG 62.A NE GLU 15.A OE2 no hydrogen 2.889 N/A ARG 62.A NH2 LYS 11.A O no hydrogen 2.612 N/A ARG 62.A NH2 GLU 15.A OE1 no hydrogen 2.945 N/A ARG 62.A NH2 GLU 15.A OE2 no hydrogen 3.400 N/A GLY 64.A N SER 61.A OG no hydrogen 2.975 N/A LEU 67.A N GLN 54.A OE1 no hydrogen 2.760 N/A PHE 69.A N SER 111.A OG no hydrogen 3.401 N/A GLY 70.A N LEU 41.A O no hydrogen 2.661 N/A VAL 72.A N THR 113.A OG1 no hydrogen 3.040 N/A HIS 74.A ND1 PHE 80.A O no hydrogen 2.931 N/A HIS 74.A NE2 THR 379.A O no hydrogen 2.565 N/A TYR 76.A OH ASP 108.A OD1 no hydrogen 2.372 N/A GLU 77.A N GLU 104.A OE1 no hydrogen 3.065 N/A THR 78.A N GLU 104.A OE1 no hydrogen 2.838 N/A THR 78.A OG1 GLU 104.A OE2 no hydrogen 2.550 N/A ILE 79.A N SER 520.A OG no hydrogen 3.077 N/A PHE 80.A N HIS 74.A O no hydrogen 2.682 N/A ILE 82.A N PHE 517.A O no hydrogen 3.250 N/A LEU 84.A N SER 129.A O no hydrogen 2.842 N/A LEU 86.A N ILE 82.A O no hydrogen 3.019 N/A SER 87.A N PRO 83.A O no hydrogen 2.888 N/A SER 87.A OG PRO 83.A O no hydrogen 3.470 N/A SER 87.A OG LEU 84.A O no hydrogen 2.476 N/A SER 87.A OG THR 541.A OG1 no hydrogen 2.894 N/A CYS 88.A N GLY 85.A O no hydrogen 2.946 N/A CYS 88.A SG LEU 84.A O no hydrogen 3.645 N/A SER 89.A N LEU 86.A O no hydrogen 2.998 N/A SER 89.A OG LEU 86.A O no hydrogen 2.615 N/A TRP 90.A N SER 87.A O no hydrogen 3.063 N/A TRP 90.A NE1 LYS 539.A O no hydrogen 2.804 N/A ALA 93.A N ASP 91.A OD1 no hydrogen 2.918 N/A ILE 94.A N ASP 91.A O no hydrogen 2.939 N/A ARG 95.A NE GLU 92.A OE2 no hydrogen 2.730 N/A ARG 95.A NH2 GLU 92.A OE1 no hydrogen 2.896 N/A ARG 95.A NH2 GLU 92.A OE2 no hydrogen 2.741 N/A LYS 96.A N GLU 92.A O no hydrogen 2.938 N/A SER 97.A N ALA 93.A O no hydrogen 2.968 N/A SER 97.A OG ILE 94.A O no hydrogen 2.865 N/A ALA 98.A N ILE 94.A O no hydrogen 3.209 N/A ARG 99.A N.A ARG 95.A O no hydrogen 2.957 N/A ARG 99.A N.B ARG 95.A O no hydrogen 2.925 N/A ARG 99.A NE.B GLY 148.A O no hydrogen 3.200 N/A ARG 99.A NH1.B ASP 162.A OD1 no hydrogen 2.765 N/A ARG 99.A NH2.B ASP 162.A OD1 no hydrogen 3.546 N/A VAL 100.A N LYS 96.A O no hydrogen 3.064 N/A ALA 101.A N SER 97.A O no hydrogen 3.150 N/A ALA 102.A N ALA 98.A O no hydrogen 2.817 N/A ILE 103.A N ARG 99.A O.A no hydrogen 3.052 N/A ILE 103.A N ARG 99.A O.B no hydrogen 3.047 N/A GLU 104.A N VAL 100.A O no hydrogen 2.934 N/A ALA 105.A N ALA 101.A O no hydrogen 2.910 N/A SER 106.A N ALA 102.A O no hydrogen 2.883 N/A SER 106.A OG ALA 102.A O no hydrogen 2.569 N/A SER 106.A OG ILE 103.A O no hydrogen 3.118 N/A SER 106.A OG ASN 161.A O no hydrogen 3.430 N/A ALA 107.A N ILE 103.A O no hydrogen 3.176 N/A ASP 108.A N ALA 105.A O no hydrogen 3.133 N/A GLY 109.A N SER 106.A O no hydrogen 3.038 N/A ILE 110.A N ALA 105.A O no hydrogen 2.950 N/A SER 111.A N PHE 69.A O no hydrogen 3.176 N/A TRP 112.A NE1 SER 207.A OG no hydrogen 2.861 N/A THR 113.A OG1 VAL 72.A O no hydrogen 2.991 N/A SER 115.A OG VAL 72.A O no hydrogen 3.400 N/A SER 115.A OG TYR 149.A OH no hydrogen 2.757 N/A SER 120.A OG.A GLY 174.A O no hydrogen 2.859 N/A ARG 121.A NH1 GLU 193.A OE2 no hydrogen 2.781 N/A ARG 121.A NH2 GLU 193.A OE2 no hydrogen 2.519 N/A ARG 124.A N ASP 122.A OD1 no hydrogen 3.203 N/A ARG 124.A NE ASP 122.A OD1 no hydrogen 2.723 N/A ARG 124.A NH2 ASP 122.A OD1 no hydrogen 3.442 N/A ARG 124.A NH2 ASP 122.A OD2 no hydrogen 2.638 N/A TRP 125.A N ASP 122.A O no hydrogen 3.241 N/A ARG 127.A NE GLU 130.A OE1 no hydrogen 3.038 N/A ARG 127.A NE GLU 130.A OE2 no hydrogen 2.767 N/A ARG 127.A NH1 TYR 173.A OH no hydrogen 3.192 N/A ARG 127.A NH2 GLU 130.A OE1 no hydrogen 2.963 N/A VAL 128.A N TRP 125.A O no hydrogen 3.317 N/A SER 129.A N GLY 126.A O no hydrogen 3.448 N/A SER 129.A OG GLY 126.A O no hydrogen 2.793 N/A GLU 130.A N ARG 127.A O no hydrogen 2.899 N/A GLY 131.A N VAL 128.A O no hydrogen 3.176 N/A GLU 134.A N THR 541.A O no hydrogen 3.094 N/A PHE 137.A N ASP 135.A OD2 no hydrogen 2.730 N/A LEU 138.A N ASP 135.A OD2 no hydrogen 2.874 N/A GLY 139.A N ASP 135.A O no hydrogen 2.904 N/A GLY 140.A N PRO 136.A O no hydrogen 3.041 N/A ALA 141.A N PHE 137.A O no hydrogen 3.068 N/A ILE 142.A N LEU 138.A O no hydrogen 3.034 N/A ALA 143.A N GLY 139.A O no hydrogen 2.930 N/A LYS 144.A N GLY 140.A O no hydrogen 2.990 N/A ALA 145.A N ALA 141.A O no hydrogen 2.868 N/A SER 147.A N LYS 144.A O no hydrogen 3.026 N/A SER 147.A OG LYS 144.A O no hydrogen 2.760 N/A SER 147.A OG ALA 145.A O no hydrogen 3.169 N/A GLY 148.A N ALA 145.A O no hydrogen 2.829 N/A TYR 149.A OH SER 115.A OG no hydrogen 2.757 N/A GLN 150.A N VAL 146.A O no hydrogen 2.874 N/A GLN 150.A NE2 GLN 157.A OE1 no hydrogen 2.927 N/A GLN 150.A NE2 GLY 204.A O no hydrogen 2.763 N/A GLY 151.A N SER 147.A O no hydrogen 2.885 N/A ASN 155.A N ASP 153.A OD1 no hydrogen 2.876 N/A ASN 156.A N ASP 153.A O no hydrogen 2.847 N/A ASN 156.A ND2 ASP 153.A OD2 no hydrogen 3.480 N/A GLN 157.A NE2 GLY 151.A O no hydrogen 2.852 N/A GLN 157.A NE2 ALA 203.A O no hydrogen 3.243 N/A LEU 158.A N GLN 150.A O no hydrogen 2.948 N/A ARG 160.A N GLU 163.A OE2 no hydrogen 3.110 N/A ARG 160.A NE ASP 162.A OD1 no hydrogen 2.921 N/A ARG 160.A NH2 ASP 162.A OD2 no hydrogen 2.804 N/A GLU 163.A N ARG 160.A O no hydrogen 3.284 N/A ILE 164.A N TYR 149.A O no hydrogen 3.038 N/A CYS 166.A N SER 115.A O no hydrogen 2.749 N/A CYS 166.A SG VAL 167.A O no hydrogen 3.972 N/A VAL 167.A N SER 207.A O no hydrogen 3.116 N/A LYS 168.A N PRO 116.A O no hydrogen 3.243 N/A LYS 168.A NZ PHE 114.A O no hydrogen 2.858 N/A HIS 169.A N ASP 118.A OD1 no hydrogen 2.909 N/A HIS 169.A ND1 ASP 118.A OD2 no hydrogen 2.929 N/A LEU 172.A N TYR 197.A OH no hydrogen 3.051 N/A TYR 173.A OH ASP 181.A OD1 no hydrogen 2.473 N/A ALA 175.A N LEU 172.A O no hydrogen 2.978 N/A GLU 177.A N THR 184.A O no hydrogen 2.710 N/A GLY 179.A N GLY 176.A O no hydrogen 3.103 N/A ASP 181.A N SER 466.A OG no hydrogen 3.080 N/A TYR 182.A OH GLU 463.A OE1 no hydrogen 2.700 N/A ASN 183.A N ARG 180.A O no hydrogen 3.049 N/A ASN 183.A ND2 GLU 177.A O no hydrogen 2.592 N/A THR 184.A N ASN 183.A OD1 no hydrogen 2.888 N/A ARG 188.A NE ASP 215.A OD2 no hydrogen 2.907 N/A ARG 188.A NH1 ASP 215.A OD2 no hydrogen 2.730 N/A ASN 189.A ND2 TYR 676.A O no hydrogen 2.786 N/A ASN 189.A ND2 ASP 677.A O no hydrogen 2.828 N/A ARG 190.A N SER 187.A OG no hydrogen 3.103 N/A ASN 192.A N ASN 189.A O no hydrogen 2.827 N/A ASN 192.A ND2 ASN 189.A O no hydrogen 3.599 N/A ASN 192.A ND2 ASN 189.A OD1 no hydrogen 2.761 N/A ASN 192.A ND2 TYR 676.A O no hydrogen 2.562 N/A TYR 197.A OH ASP 118.A OD1 no hydrogen 2.576 N/A ALA 199.A N TYR 195.A O no hydrogen 2.748 N/A ALA 200.A N PRO 196.A O no hydrogen 3.206 N/A VAL 201.A N TYR 197.A O no hydrogen 3.095 N/A ASP 202.A N GLN 198.A O no hydrogen 2.809 N/A ALA 203.A N ALA 199.A O no hydrogen 2.741 N/A GLY 204.A N VAL 201.A O no hydrogen 2.965 N/A VAL 205.A N ALA 200.A O no hydrogen 3.018 N/A GLY 206.A N GLN 150.A OE1 no hydrogen 2.861 N/A SER 207.A OG ALA 165.A O no hydrogen 2.898 N/A VAL 208.A N PHE 238.A O no hydrogen 3.022 N/A SER 210.A N PHE 170.A O no hydrogen 2.876 N/A SER 210.A OG ALA 171.A O no hydrogen 3.387 N/A SER 210.A OG ASN 212.A OD1 no hydrogen 2.728 N/A ASN 212.A ND2 ALA 171.A O no hydrogen 3.055 N/A ASN 212.A ND2 GLU 213.A O no hydrogen 3.155 N/A ILE 214.A N ILE 217.A O no hydrogen 2.791 N/A ILE 217.A N ILE 214.A O no hydrogen 2.922 N/A ALA 219.A N ASN 212.A O no hydrogen 3.066 N/A ALA 221.A N PRO 218.A O no hydrogen 2.715 N/A ASN 222.A N ALA 219.A O no hydrogen 3.284 N/A LEU 225.A N ASN 222.A OD1 no hydrogen 3.069 N/A THR 226.A OG1 ALA 266.A O no hydrogen 2.737 N/A ASP 227.A N LYS 223.A O no hydrogen 3.425 N/A VAL 228.A N TRP 224.A O no hydrogen 2.900 N/A LEU 229.A N LEU 225.A O no hydrogen 3.088 N/A ARG 230.A N THR 226.A O no hydrogen 2.977 N/A ARG 230.A NH1 GLY 267.A O no hydrogen 2.847 N/A ARG 230.A NH2 GLY 237.A O no hydrogen 3.210 N/A ARG 230.A NH2 ASP 269.A OD2 no hydrogen 2.872 N/A LYS 231.A N THR 226.A O no hydrogen 2.749 N/A GLN 232.A N ASP 227.A O no hydrogen 2.791 N/A TRP 233.A N VAL 228.A O no hydrogen 2.887 N/A GLY 234.A N ARG 230.A O no hydrogen 2.923 N/A PHE 235.A N LEU 229.A O no hydrogen 3.001 N/A PHE 238.A N GLY 206.A O no hydrogen 3.449 N/A VAL 239.A N ASP 269.A OD2 no hydrogen 2.473 N/A VAL 240.A N VAL 208.A O no hydrogen 2.746 N/A THR 241.A OG1 ASP 242.A O no hydrogen 2.720 N/A PHE 243.A N ASP 242.A OD1 no hydrogen 2.543 N/A GLY 245.A N ASP 242.A O no hydrogen 2.871 N/A SER 247.A OG THR 244.A O no hydrogen 3.443 N/A GLU 248.A N THR 244.A O no hydrogen 3.246 N/A HIS 251.A N GLU 248.A O no hydrogen 3.052 N/A HIS 251.A NE2 PHE 211.A O no hydrogen 3.017 N/A GLY 252.A N ILE 249.A O no hydrogen 3.010 N/A GLN 257.A NE2 SER 282.A OG no hydrogen 3.291 N/A GLN 257.A NE2 GLU 285.A OE2 no hydrogen 2.621 N/A THR 258.A N ASP 255.A OD1 no hydrogen 2.662 N/A THR 258.A OG1 ASP 255.A OD1 no hydrogen 2.830 N/A VAL 259.A N ASP 255.A O no hydrogen 2.993 N/A SER 260.A N LEU 256.A O no hydrogen 2.943 N/A SER 260.A OG LEU 256.A O no hydrogen 2.871 N/A ALA 261.A N GLN 257.A O no hydrogen 3.119 N/A ARG 262.A N THR 258.A O no hydrogen 3.209 N/A ALA 263.A N VAL 259.A O no hydrogen 3.150 N/A LEU 264.A N SER 260.A O no hydrogen 3.052 N/A ASN 265.A N ALA 261.A O no hydrogen 2.790 N/A ASN 265.A ND2 LYS 287.A O no hydrogen 3.191 N/A ALA 266.A N ARG 262.A O no hydrogen 2.716 N/A GLY 267.A N LEU 264.A O no hydrogen 3.285 N/A VAL 268.A N ALA 263.A O no hydrogen 2.866 N/A ASP 269.A N VAL 239.A O no hydrogen 2.833 N/A SER 272.A OG ASP 270.A OD1 no hydrogen 3.107 N/A PHE 275.A N ASP 270.A OD2 no hydrogen 3.061 N/A GLY 277.A N GLU 273.A O no hydrogen 2.883 N/A THR 278.A N GLY 274.A O no hydrogen 3.043 N/A THR 278.A N PHE 275.A O no hydrogen 3.352 N/A THR 278.A OG1 GLY 274.A O no hydrogen 2.623 N/A ILE 279.A N PHE 275.A O no hydrogen 3.040 N/A LYS 280.A NZ GLU 14.A OE2 no hydrogen 3.276 N/A LYS 281.A NZ GLN 257.A OE1 no hydrogen 3.125 N/A LYS 281.A NZ GLU 285.A OE1 no hydrogen 2.613 N/A SER 282.A N THR 278.A O no hydrogen 3.018 N/A SER 282.A OG THR 278.A O no hydrogen 3.211 N/A ILE 283.A N ILE 279.A O no hydrogen 2.779 N/A ASP 284.A N LYS 280.A O no hydrogen 2.953 N/A GLU 285.A N LYS 281.A O no hydrogen 2.961 N/A GLY 286.A N ILE 283.A O no hydrogen 3.063 N/A LYS 287.A N SER 282.A O no hydrogen 2.731 N/A LYS 287.A NZ GLU 285.A OE2 no hydrogen 3.377 N/A ILE 288.A N SER 282.A O no hydrogen 3.356 N/A SER 289.A OG THR 291.A OG1 no hydrogen 3.065 N/A THR 291.A N SER 289.A OG no hydrogen 2.939 N/A THR 291.A OG1 SER 289.A OG no hydrogen 3.065 N/A LEU 292.A N SER 289.A O no hydrogen 3.223 N/A LYS 294.A N GLU 290.A O no hydrogen 2.981 N/A ALA 295.A N THR 291.A O no hydrogen 3.335 N/A CYS 296.A N LEU 292.A O no hydrogen 2.916 N/A ARG 297.A N ASP 293.A O no hydrogen 2.875 N/A ARG 297.A NH2 ASP 7.A OD1 no hydrogen 2.625 N/A ARG 298.A N LYS 294.A O no hydrogen 3.048 N/A ARG 298.A NH1 ASP 269.A OD1 no hydrogen 2.490 N/A ILE 299.A N ALA 295.A O no hydrogen 3.230 N/A LEU 300.A N CYS 296.A O no hydrogen 2.979 N/A GLU 301.A N ARG 297.A O no hydrogen 2.570 N/A ALA 302.A N ARG 298.A O no hydrogen 3.006 N/A LYS 303.A N ILE 299.A O no hydrogen 3.146 N/A LYS 303.A NZ GLN 19.A OE1 no hydrogen 2.561 N/A LYS 303.A NZ GLY 39.A O no hydrogen 2.777 N/A LYS 303.A NZ PRO 66.A O no hydrogen 3.089 N/A TYR 304.A N LEU 300.A O no hydrogen 2.859 N/A LYS 305.A N GLU 301.A O no hydrogen 2.828 N/A LEU 306.A N ALA 302.A O no hydrogen 2.958 N/A GLY 307.A N TYR 304.A O no hydrogen 2.791 N/A LEU 308.A N LYS 303.A O no hydrogen 2.987 N/A ASN 311.A N GLY 307.A O no hydrogen 3.002 N/A TYR 313.A N ASN 311.A OD1 no hydrogen 3.167 N/A LYS 314.A N ASN 311.A O no hydrogen 3.124 N/A LYS 314.A NZ ARG 160.A O no hydrogen 3.131 N/A LYS 314.A NZ LEU 306.A O no hydrogen 2.728 N/A LYS 314.A NZ TYR 315.A OH no hydrogen 2.845 N/A TYR 315.A OH GLU 163.A O no hydrogen 3.000 N/A CYS 316.A N TYR 313.A O no hydrogen 2.801 N/A LYS 319.A N ASP 317.A OD1 no hydrogen 3.076 N/A ARG 320.A N ASP 317.A O no hydrogen 3.005 N/A ARG 320.A NE ASP 324.A OD1 no hydrogen 2.809 N/A ARG 320.A NH1 ASN 161.A O no hydrogen 2.616 N/A ARG 320.A NH2 SER 106.A OG no hydrogen 2.893 N/A ARG 320.A NH2 ASP 324.A OD1 no hydrogen 3.224 N/A ARG 323.A N ARG 320.A O no hydrogen 2.805 N/A ARG 323.A NE ASP 324.A OD2 no hydrogen 2.936 N/A ARG 323.A NH2 ASP 324.A OD1 no hydrogen 2.873 N/A ARG 323.A NH2 ASP 324.A OD2 no hydrogen 3.218 N/A ASP 324.A N ARG 320.A O no hydrogen 2.808 N/A ILE 325.A N PRO 321.A O no hydrogen 3.199 N/A PHE 326.A N GLU 104.A OE2 no hydrogen 2.888 N/A GLU 329.A N GLU 329.A OE1 no hydrogen 2.677 N/A HIS 330.A N THR 327.A OG1 no hydrogen 3.134 N/A ARG 331.A N THR 327.A O no hydrogen 3.048 N/A ARG 331.A NE GLU 521.A OE1 no hydrogen 3.145 N/A ARG 331.A NE GLU 521.A OE2 no hydrogen 2.804 N/A ARG 331.A NH2 GLU 521.A OE1 no hydrogen 3.145 N/A ASP 332.A N LYS 328.A O no hydrogen 2.664 N/A ALA 333.A N GLU 329.A O no hydrogen 3.261 N/A ALA 334.A N HIS 330.A O no hydrogen 3.063 N/A ARG 335.A N ARG 331.A O no hydrogen 3.006 N/A ARG 335.A NE ASP 528.A OD2 no hydrogen 3.188 N/A ARG 335.A NH2 ASP 528.A OD1 no hydrogen 3.105 N/A LYS 336.A N ASP 332.A O no hydrogen 2.924 N/A LYS 336.A NZ GLU 340.A OE2 no hydrogen 2.886 N/A ILE 337.A N ALA 333.A O no hydrogen 3.008 N/A ALA 338.A N ALA 334.A O no hydrogen 2.878 N/A GLY 339.A N ARG 335.A O no hydrogen 3.251 N/A GLU 340.A N LYS 336.A O no hydrogen 3.223 N/A GLU 340.A N ILE 337.A O no hydrogen 3.119 N/A SER 341.A N ALA 338.A O no hydrogen 3.060 N/A SER 341.A OG ILE 337.A O no hydrogen 2.799 N/A PHE 342.A N ALA 338.A O no hydrogen 3.209 N/A VAL 343.A N ASN 514.A O no hydrogen 3.060 N/A LEU 345.A N ILE 512.A O no hydrogen 2.967 N/A LYS 346.A NZ GLN 506.A O no hydrogen 2.848 N/A LYS 346.A NZ VAL 509.A O no hydrogen 2.875 N/A ASN 347.A ND2 LEU 356.A O no hydrogen 3.172 N/A ASP 348.A N PRO 510.A O no hydrogen 3.077 N/A LYS 349.A NZ ALA 352.A O no hydrogen 2.974 N/A SER 350.A OG THR 355.A OG1 no hydrogen 2.521 N/A ASN 353.A ND2 PRO 354.A O no hydrogen 2.856 N/A THR 355.A N ASP 348.A O no hydrogen 3.070 N/A THR 355.A OG1 ASP 348.A O no hydrogen 2.896 N/A THR 355.A OG1 SER 350.A OG no hydrogen 2.521 N/A LEU 356.A N ASN 347.A OD1 no hydrogen 2.926 N/A LEU 358.A N LEU 530.A O no hydrogen 2.633 N/A LYS 360.A NZ PHE 531.A O no hydrogen 3.554 N/A LYS 360.A NZ ASP 533.A OD1 no hydrogen 3.569 N/A LYS 360.A NZ ASP 533.A OD2 no hydrogen 3.078 N/A THR 363.A N ASP 449.A OD2 no hydrogen 3.096 N/A THR 363.A OG1 ASN 403.A OD1 no hydrogen 3.415 N/A VAL 364.A N ASN 403.A O no hydrogen 2.910 N/A ALA 365.A N VAL 450.A O no hydrogen 3.028 N/A VAL 366.A N THR 405.A O no hydrogen 3.078 N/A ILE 367.A N ILE 452.A O no hydrogen 2.959 N/A GLY 368.A N ALA 407.A O no hydrogen 3.098 N/A LEU 370.A N ALA 454.A O no hydrogen 3.314 N/A ALA 371.A N GLY 368.A O no hydrogen 3.245 N/A THR 373.A OG1 ASN 376.A OD1 no hydrogen 3.004 N/A ARG 374.A NE GLU 394.A OE1 no hydrogen 3.040 N/A ARG 374.A NE GLU 394.A OE2 no hydrogen 3.140 N/A ARG 374.A NH1 ASN 387.A O no hydrogen 2.912 N/A ARG 374.A NH2 GLU 394.A OE2 no hydrogen 2.921 N/A SER 375.A OG GLY 425.A O no hydrogen 3.319 N/A ASN 376.A N THR 373.A OG1 no hydrogen 3.343 N/A THR 379.A OG1 GLU 460.A OE1 no hydrogen 2.343 N/A THR 379.A OG1 GLU 460.A OE2 no hydrogen 3.315 N/A SER 381.A OG GLY 378.A O no hydrogen 2.729 N/A ALA 384.A N SER 381.A O no hydrogen 3.030 N/A ARG 385.A N TYR 389.A OH no hydrogen 3.034 N/A ARG 385.A NE ASP 388.A OD2 no hydrogen 2.501 N/A ARG 385.A NH1 GLU 77.A OE2 no hydrogen 2.715 N/A ARG 385.A NH2 ASP 388.A OD2 no hydrogen 3.344 N/A ASP 388.A N ARG 385.A O no hydrogen 2.896 N/A SER 391.A N GLU 394.A OE1 no hydrogen 2.931 N/A SER 391.A OG ASN 372.A OD1 no hydrogen 2.608 N/A TYR 393.A N ALA 371.A O no hydrogen 2.680 N/A GLY 395.A N SER 391.A O no hydrogen 2.769 N/A LEU 396.A N VAL 392.A O no hydrogen 3.113 N/A LYS 397.A N TYR 393.A O no hydrogen 3.032 N/A LYS 397.A NZ TYR 393.A OH no hydrogen 3.448 N/A GLU 398.A N GLU 394.A O no hydrogen 2.979 N/A ASN 403.A N GLY 362.A O no hydrogen 2.923 N/A THR 405.A N VAL 364.A O no hydrogen 3.284 N/A ALA 407.A N VAL 366.A O no hydrogen 3.356 N/A LYS 408.A NZ LEU 428.A O no hydrogen 3.115 N/A SER 410.A N LYS 408.A O no hydrogen 2.885 N/A SER 410.A OG ASN 411.A O no hydrogen 3.110 N/A LEU 412.A N GLU 419.A OE1 no hydrogen 3.217 N/A SER 414.A N ASP 474.A OD1 no hydrogen 3.217 N/A SER 414.A OG ASP 474.A OD1 no hydrogen 3.553 N/A SER 414.A OG ASP 474.A OD2 no hydrogen 2.880 N/A TYR 418.A N ASP 415.A OD1 no hydrogen 3.038 N/A GLU 419.A N ASP 415.A O no hydrogen 2.961 N/A GLU 420.A N ALA 416.A O no hydrogen 2.948 N/A ARG 421.A N ALA 417.A O no hydrogen 3.324 N/A ALA 422.A N TYR 418.A O no hydrogen 2.866 N/A THR 423.A N GLU 420.A O no hydrogen 3.166 N/A THR 423.A OG1 GLU 419.A O no hydrogen 2.614 N/A THR 423.A OG1 GLU 420.A O no hydrogen 3.253 N/A ARG 426.A N THR 423.A O no hydrogen 3.170 N/A ARG 426.A NE SER 375.A O no hydrogen 3.307 N/A ARG 426.A NH1 PHE 424.A O no hydrogen 2.791 N/A ARG 426.A NH2 GLY 378.A O no hydrogen 2.962 N/A ASN 429.A N SER 427.A OG no hydrogen 2.898 N/A ARG 430.A NH1 ILE 413.A O no hydrogen 2.411 N/A ARG 430.A NH1 GLU 419.A OE1 no hydrogen 2.621 N/A ARG 430.A NH2 SER 414.A O no hydrogen 2.764 N/A ARG 433.A NH1 GLU 440.A OE2 no hydrogen 2.969 N/A THR 434.A N GLU 437.A OE1 no hydrogen 3.156 N/A GLU 437.A N THR 434.A OG1 no hydrogen 2.807 N/A ASP 439.A N LYS 436.A O no hydrogen 2.760 N/A GLU 440.A N GLU 437.A O no hydrogen 3.027 N/A LEU 442.A N LEU 438.A O no hydrogen 3.084 N/A LYS 443.A N ASP 439.A O no hydrogen 2.904 N/A VAL 444.A N GLU 440.A O no hydrogen 3.084 N/A ALA 445.A N ALA 441.A O no hydrogen 2.866 N/A ALA 446.A N LEU 442.A O no hydrogen 3.080 N/A ASN 447.A N VAL 444.A O no hydrogen 3.042 N/A ALA 448.A N ALA 445.A O no hydrogen 3.064 N/A ASP 449.A N THR 363.A O no hydrogen 2.707 N/A ILE 451.A N PRO 489.A O no hydrogen 2.801 N/A ILE 452.A N ALA 365.A O no hydrogen 2.776 N/A ALA 453.A N VAL 491.A O no hydrogen 2.773 N/A ALA 454.A N ILE 367.A O no hydrogen 2.865 N/A LEU 455.A N THR 493.A O no hydrogen 3.312 N/A GLY 456.A N GLN 476.A OE1 no hydrogen 2.701 N/A GLU 457.A N PHE 495.A O no hydrogen 2.823 N/A SER 458.A OG ALA 422.A O no hydrogen 2.667 N/A SER 459.A OG GLU 460.A OE2 no hydrogen 2.406 N/A SER 461.A OG SER 459.A O no hydrogen 3.135 N/A GLY 462.A N GLY 126.A O no hydrogen 2.846 N/A SER 464.A N ASP 181.A OD2 no hydrogen 2.730 N/A SER 465.A OG GLU 460.A O no hydrogen 2.999 N/A SER 465.A OG SER 461.A O no hydrogen 3.185 N/A SER 466.A OG GLY 179.A O no hydrogen 2.688 N/A ARG 467.A N ARG 124.A O no hydrogen 3.051 N/A ARG 467.A NH1 GLU 457.A OE2 no hydrogen 2.856 N/A ARG 467.A NH2 ALA 471.A O no hydrogen 2.781 N/A ALA 471.A N ASN 469.A OD1 no hydrogen 3.002 N/A VAL 475.A N ASP 474.A OD1 no hydrogen 2.622 N/A GLN 476.A NE2 LEU 412.A O no hydrogen 3.000 N/A GLN 476.A NE2 GLY 456.A O no hydrogen 2.748 N/A ARG 477.A N PRO 473.A O no hydrogen 3.043 N/A THR 478.A N ASP 474.A O no hydrogen 3.092 N/A THR 478.A OG1 ASP 474.A O no hydrogen 3.322 N/A LEU 479.A N VAL 475.A O no hydrogen 2.956 N/A LEU 480.A N GLN 476.A O no hydrogen 2.719 N/A GLU 481.A N ARG 477.A O no hydrogen 2.969 N/A ALA 482.A N THR 478.A O no hydrogen 3.240 N/A LEU 483.A N LEU 479.A O no hydrogen 3.040 N/A LEU 484.A N LEU 480.A O no hydrogen 2.874 N/A LYS 485.A N GLU 481.A O no hydrogen 2.776 N/A LYS 485.A N ALA 482.A O no hydrogen 3.179 N/A LYS 485.A NZ GLU 481.A O no hydrogen 3.211 N/A THR 486.A N LEU 483.A O no hydrogen 3.229 N/A THR 486.A OG1 LEU 483.A O no hydrogen 2.799 N/A GLY 487.A N LEU 484.A O no hydrogen 3.420 N/A LYS 488.A N THR 486.A OG1 no hydrogen 3.160 N/A LYS 488.A NZ ALA 445.A O no hydrogen 2.878 N/A LYS 488.A NZ ALA 446.A O no hydrogen 2.905 N/A LYS 488.A NZ ALA 448.A O no hydrogen 2.420 N/A VAL 491.A N ILE 451.A O no hydrogen 2.738 N/A LEU 492.A N ALA 511.A O no hydrogen 2.928 N/A THR 493.A N ALA 453.A O no hydrogen 2.737 N/A LEU 494.A N LEU 513.A O no hydrogen 2.821 N/A PHE 495.A N LEU 455.A O no hydrogen 3.096 N/A THR 496.A N TRP 516.A O no hydrogen 3.003 N/A THR 496.A OG1 ARG 498.A O no hydrogen 2.798 N/A GLY 497.A N GLU 457.A OE1 no hydrogen 2.838 N/A ARG 498.A N THR 496.A OG1 no hydrogen 3.210 N/A ARG 498.A NE PRO 123.A O no hydrogen 2.730 N/A ARG 498.A NH1 GLU 457.A OE2 no hydrogen 2.755 N/A ARG 498.A NH2 ARG 124.A O no hydrogen 3.127 N/A ARG 498.A NH2 SER 465.A O no hydrogen 2.790 N/A THR 501.A N LEU 470.A O no hydrogen 2.912 N/A GLU 505.A N GLU 505.A OE1 no hydrogen 2.513 N/A GLN 506.A N LEU 502.A O no hydrogen 2.814 N/A GLN 506.A NE2 LEU 345.A O no hydrogen 3.553 N/A GLU 507.A N THR 503.A O no hydrogen 3.183 N/A GLU 507.A N TRP 504.A O no hydrogen 3.212 N/A HIS 508.A N TRP 504.A O no hydrogen 3.042 N/A HIS 508.A N GLU 505.A O no hydrogen 3.278 N/A HIS 508.A ND1 TRP 504.A O no hydrogen 3.090 N/A VAL 509.A N GLU 505.A O no hydrogen 2.898 N/A ILE 512.A N LYS 346.A O no hydrogen 3.074 N/A LEU 513.A N LEU 492.A O no hydrogen 2.831 N/A ASN 514.A N VAL 343.A O no hydrogen 2.860 N/A VAL 515.A N LEU 494.A O no hydrogen 2.827 N/A TRP 516.A N ASN 514.A OD1 no hydrogen 2.853 N/A SER 520.A N ILE 79.A O no hydrogen 2.829 N/A SER 520.A OG ILE 79.A O no hydrogen 3.505 N/A SER 520.A OG GLU 521.A OE2 no hydrogen 3.040 N/A ALA 522.A N GLY 519.A O no hydrogen 3.062 N/A TYR 524.A OH GLU 398.A OE1 no hydrogen 3.042 N/A TYR 524.A OH GLU 398.A OE2 no hydrogen 3.301 N/A ALA 525.A N GLU 521.A O no hydrogen 3.331 N/A ILE 526.A N ALA 522.A O no hydrogen 2.892 N/A GLY 527.A N ALA 523.A O no hydrogen 2.932 N/A ASP 528.A N TYR 524.A O no hydrogen 2.659 N/A VAL 529.A N ALA 525.A O no hydrogen 2.988 N/A LEU 530.A N ILE 526.A O no hydrogen 2.893 N/A PHE 531.A N GLY 527.A O no hydrogen 3.195 N/A GLY 532.A N VAL 529.A O no hydrogen 3.083 N/A VAL 534.A N ASP 528.A O no hydrogen 3.054 N/A ASN 535.A ND2 SER 592.A OG no hydrogen 3.198 N/A ASN 535.A ND2 ASP 625.A O no hydrogen 3.046 N/A LYS 539.A N CYS 88.A O no hydrogen 2.887 N/A LYS 539.A NZ GLY 590.A O no hydrogen 3.009 N/A LYS 539.A NZ GLU 628.A OE1 no hydrogen 3.211 N/A LYS 539.A NZ GLU 628.A OE2 no hydrogen 3.508 N/A LYS 539.A NZ GLY 694.A O no hydrogen 2.967 N/A LEU 540.A N TYR 589.A O no hydrogen 2.766 N/A THR 541.A OG1 SER 87.A OG no hydrogen 2.894 N/A THR 541.A OG1 ASN 132.A O no hydrogen 3.268 N/A THR 542.A OG1 GLU 134.A OE1 no hydrogen 3.150 N/A THR 542.A OG1 GLU 134.A OE2 no hydrogen 3.104 N/A PHE 543.A N TYR 585.A O no hydrogen 3.055 N/A LYS 545.A N GLN 549.A OE1 no hydrogen 2.694 N/A LYS 545.A NZ ASP 580.A OD1 no hydrogen 2.667 N/A LYS 545.A NZ ASP 580.A OD2 no hydrogen 2.793 N/A ASN 546.A N GLN 549.A OE1 no hydrogen 3.415 N/A GLN 549.A N ASN 546.A O no hydrogen 3.244 N/A GLN 549.A NE2 ASP 580.A O no hydrogen 3.100 N/A GLN 549.A NE2 ASP 582.A O no hydrogen 3.429 N/A ILE 550.A N VAL 547.A O no hydrogen 3.276 N/A TYR 554.A N GLU 134.A OE2 no hydrogen 2.872 N/A TYR 554.A OH ASP 135.A OD1 no hydrogen 2.223 N/A HIS 556.A ND1 LYS 557.A O no hydrogen 2.815 N/A LYS 557.A NZ THR 642.A O no hydrogen 2.894 N/A LYS 557.A NZ THR 642.A OG1 no hydrogen 2.974 N/A THR 559.A OG1 ASN 558.A O no hydrogen 2.523 N/A ARG 561.A N THR 559.A OG1 no hydrogen 3.313 N/A ARG 561.A NH1 PHE 572.A O no hydrogen 3.375 N/A LYS 567.A N LEU 564.A O no hydrogen 3.054 N/A TRP 568.A NE1 TYR 576.A O no hydrogen 2.901 N/A GLU 570.A N ASN 575.A OD1 no hydrogen 3.088 N/A ARG 573.A N GLU 570.A O no hydrogen 3.328 N/A ARG 573.A NE PHE 572.A O no hydrogen 3.017 N/A ARG 573.A NH2 PHE 572.A O no hydrogen 3.087 N/A SER 574.A N ARG 561.A O no hydrogen 2.892 N/A ASN 575.A N ARG 573.A O no hydrogen 3.152 N/A ASN 575.A ND2 GLU 570.A O no hydrogen 3.179 N/A ASN 575.A ND2 ARG 573.A O no hydrogen 3.123 N/A ASN 581.A ND2 SER 574.A O no hydrogen 2.714 N/A ASP 582.A N ASP 580.A OD1 no hydrogen 2.807 N/A LEU 584.A N PHE 543.A O no hydrogen 2.827 N/A TYR 585.A N PHE 543.A O no hydrogen 3.264 N/A GLY 588.A N LEU 540.A O no hydrogen 2.796 N/A TYR 589.A N PRO 586.A O no hydrogen 3.154 N/A LEU 591.A N LEU 344.A O no hydrogen 2.888 N/A SER 592.A OG ASN 535.A OD1 no hydrogen 3.191 N/A TYR 593.A N ASN 535.A OD1 no hydrogen 2.953 N/A TYR 593.A OH VAL 529.A O no hydrogen 2.598 N/A THR 594.A N SER 592.A OG no hydrogen 3.148 N/A THR 594.A OG1 ASN 620.A OD1 no hydrogen 2.389 N/A THR 594.A OG1 TYR 624.A O no hydrogen 3.166 N/A GLN 597.A N THR 619.A O no hydrogen 2.728 N/A TYR 598.A OH GLU 628.A OE2 no hydrogen 3.239 N/A SER 599.A N THR 617.A O no hydrogen 3.020 N/A SER 599.A OG ASP 600.A O no hydrogen 3.215 N/A SER 599.A OG THR 617.A O no hydrogen 3.361 N/A SER 604.A N THR 614.A O no hydrogen 2.891 N/A VAL 613.A N ILE 668.A O no hydrogen 3.067 N/A THR 614.A N SER 604.A OG no hydrogen 2.969 N/A ALA 615.A N PHE 666.A O no hydrogen 2.885 N/A THR 617.A N SER 599.A OG no hydrogen 2.728 N/A VAL 618.A N LYS 662.A O no hydrogen 2.823 N/A THR 619.A N GLN 597.A O no hydrogen 2.738 N/A ASN 620.A N GLU 660.A O no hydrogen 3.005 N/A ASN 620.A ND2 TYR 624.A O no hydrogen 2.739 N/A ASN 620.A ND2 LEU 656.A O no hydrogen 2.918 N/A THR 621.A N ASN 595.A O no hydrogen 3.151 N/A GLY 622.A N ASN 620.A OD1 no hydrogen 3.397 N/A GLY 626.A N LEU 656.A O no hydrogen 2.806 N/A GLU 628.A N ILE 654.A O no hydrogen 2.859 N/A VAL 630.A N ASP 652.A O no hydrogen 2.826 N/A GLN 631.A N GLY 693.A O no hydrogen 2.759 N/A GLN 631.A NE2 GLY 588.A O no hydrogen 3.098 N/A GLN 631.A NE2 VAL 629.A O no hydrogen 3.484 N/A LEU 632.A N GLY 650.A O no hydrogen 2.768 N/A TYR 633.A OH GLN 631.A OE1 no hydrogen 2.495 N/A ILE 634.A N GLU 647.A O no hydrogen 3.074 N/A ARG 635.A N ASP 690.A O no hydrogen 2.920 N/A LEU 637.A N ASP 688.A O no hydrogen 3.275 N/A SER 640.A N GLU 685.A OE1 no hydrogen 3.034 N/A SER 640.A OG GLU 685.A OE2 no hydrogen 2.765 N/A ARG 643.A NE ASP 636.A OD2 no hydrogen 2.759 N/A VAL 645.A N HIS 556.A O no hydrogen 3.049 N/A LYS 646.A NZ SER 696.A O no hydrogen 3.042 N/A GLU 647.A N ILE 634.A O no hydrogen 2.952 N/A LEU 648.A N TYR 554.A OH no hydrogen 2.709 N/A LYS 649.A N LEU 632.A O no hydrogen 2.885 N/A ASP 652.A N VAL 630.A O no hydrogen 2.927 N/A LYS 653.A NZ SER 89.A O no hydrogen 2.980 N/A LYS 653.A NZ SER 537.A O no hydrogen 3.353 N/A LYS 653.A NZ SER 537.A OG no hydrogen 2.578 N/A ILE 654.A N GLU 628.A O no hydrogen 3.013 N/A LEU 656.A N GLY 626.A O no hydrogen 2.712 N/A LYS 657.A N GLU 660.A OE2 no hydrogen 2.845 N/A ALA 658.A N ASP 625.A OD2 no hydrogen 2.779 N/A GLY 659.A N ASN 620.A O no hydrogen 2.873 N/A GLU 660.A N LYS 657.A O no hydrogen 2.954 N/A SER 661.A OG THR 619.A OG1 no hydrogen 3.218 N/A LYS 662.A N VAL 618.A O no hydrogen 2.995 N/A LYS 662.A NZ PHE 655.A O no hydrogen 2.679 N/A VAL 664.A N VAL 616.A O no hydrogen 2.835 N/A PHE 666.A N ALA 615.A O no hydrogen 2.878 N/A LYS 667.A NZ SER 612.A OG no hydrogen 2.972 N/A ILE 668.A N VAL 613.A O no hydrogen 2.652 N/A GLU 671.A N GLU 671.A OE2 no hydrogen 2.960 N/A LEU 672.A N THR 669.A OG1 no hydrogen 3.295 N/A LEU 673.A N PRO 670.A O no hydrogen 3.140 N/A ARG 674.A N GLU 671.A O no hydrogen 3.113 N/A PHE 675.A N VAL 683.A O no hydrogen 3.121 N/A TYR 676.A N ASN 192.A OD1 no hydrogen 2.797 N/A ASP 677.A N ASN 681.A O no hydrogen 2.938 N/A LEU 680.A N ASP 677.A O no hydrogen 2.942 N/A ASN 681.A N ASP 677.A OD1 no hydrogen 3.013 N/A VAL 683.A N PHE 675.A O no hydrogen 2.995 N/A PHE 689.A N LEU 704.A O no hydrogen 2.676 N/A ASP 690.A N ARG 635.A O no hydrogen 2.927 N/A ILE 691.A N THR 702.A O no hydrogen 2.762 N/A GLY 693.A N GLN 631.A O no hydrogen 3.019 N/A SER 696.A N PHE 587.A O no hydrogen 3.190 N/A SER 696.A OG PHE 587.A O no hydrogen 2.809 N/A GLN 697.A N ASN 695.A OD1 no hydrogen 2.815 N/A SER 698.A N ASN 695.A O no hydrogen 3.125 N/A SER 698.A N ASN 695.A OD1 no hydrogen 2.858 N/A LYS 700.A N ILE 692.A O no hydrogen 2.838 N/A THR 702.A N ILE 691.A O no hydrogen 2.864 N/A HIS 703.A ND1 ASP 690.A OD1 no hydrogen 2.793 N/A LEU 704.A N PHE 689.A O no hydrogen 3.052 N/A SER 705.A N PRO 606.A O no hydrogen 3.151 N/A LEU 706.A N GLY 687.A O no hydrogen 3.095 N/A