Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 6w2k_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): SER 4.A OG THR 190.A O no hydrogen 2.907 N/A VAL 11.A N THR 49.A O no hydrogen 2.804 N/A SER 13.A N ARG 51.A O no hydrogen 3.236 N/A SER 13.A OG ASP 56.A OD2 no hydrogen 2.588 N/A GLN 14.A N LEU 17.A O no hydrogen 2.794 N/A GLN 14.A NE2 ARG 12.A O no hydrogen 2.895 N/A LEU 17.A N GLN 14.A O no hydrogen 3.159 N/A LEU 18.A N.A THR 57.A O no hydrogen 2.852 N/A LEU 18.A N.B THR 57.A O no hydrogen 2.861 N/A LEU 20.A N ARG 59.A O no hydrogen 2.986 N/A LYS 21.A NZ GLU 63.A OE1 no hydrogen 3.424 N/A LEU 22.A N THR 61.A O no hydrogen 2.823 N/A SER 23.A OG GLU 63.A OE1 no hydrogen 2.699 N/A ALA 24.A N GLU 63.A O no hydrogen 2.837 N/A THR 25.A N THR 40.A O no hydrogen 3.023 N/A THR 27.A N LEU 38.A O no hydrogen 2.585 N/A THR 27.A OG1 THR 25.A O no hydrogen 3.036 N/A THR 27.A OG1 THR 40.A OG1 no hydrogen 2.819 N/A LEU 29.A N ALA 36.A O no hydrogen 2.712 N/A ILE 31.A N GLN 34.A O no hydrogen 2.724 N/A GLN 34.A N ILE 31.A O no hydrogen 3.045 N/A ALA 36.A N LEU 29.A O no hydrogen 2.848 N/A THR 37.A N GLY 162.A O no hydrogen 2.950 N/A LEU 38.A N THR 27.A O no hydrogen 2.962 N/A LEU 39.A N ALA 126.A O no hydrogen 3.080 N/A THR 40.A N THR 25.A O no hydrogen 3.027 N/A THR 40.A OG1 THR 27.A OG1 no hydrogen 2.819 N/A GLY 42.A N SER 23.A O no hydrogen 3.198 N/A SER 44.A N TYR 41.A O no hydrogen 3.301 N/A SER 44.A OG PRO 46.A O no hydrogen 2.747 N/A GLY 47.A N LEU 129.A O no hydrogen 2.603 N/A THR 49.A N LYS 9.A O no hydrogen 2.903 N/A LEU 50.A N ALA 131.A O no hydrogen 2.896 N/A ARG 51.A N VAL 11.A O no hydrogen 2.854 N/A ARG 51.A NE GLU 135.A OE2 no hydrogen 3.171 N/A ARG 51.A NH1 GLU 135.A OE2 no hydrogen 3.531 N/A ARG 51.A NH2 GLU 149.A OE1 no hydrogen 2.926 N/A VAL 52.A N VAL 133.A O no hydrogen 2.864 N/A ARG 53.A N ASP 56.A OD2 no hydrogen 2.904 N/A ARG 53.A NH1 GLU 135.A OE1 no hydrogen 2.520 N/A ARG 55.A N VAL 102.A O no hydrogen 2.796 N/A ASP 56.A N ARG 53.A O no hydrogen 3.081 N/A THR 57.A N GLY 16.A O no hydrogen 2.899 N/A VAL 58.A N PHE 100.A O no hydrogen 2.788 N/A ARG 59.A N LEU 18.A O.A no hydrogen 2.805 N/A ARG 59.A N LEU 18.A O.B no hydrogen 2.894 N/A ARG 59.A NE GLU 99.A OE1 no hydrogen 3.281 N/A ARG 59.A NH2 GLU 99.A OE1 no hydrogen 2.710 N/A LEU 60.A N TYR 98.A O no hydrogen 2.793 N/A THR 61.A N LEU 20.A O no hydrogen 2.918 N/A THR 61.A OG1 THR 97.A OG1 no hydrogen 2.734 N/A LEU 62.A N TRP 96.A O no hydrogen 2.898 N/A GLU 63.A N LEU 22.A O no hydrogen 2.758 N/A ASN 64.A N GLU 94.A O no hydrogen 2.886 N/A ASN 64.A ND2 GLU 68.A O no hydrogen 2.899 N/A ASN 64.A ND2 ILE 90.A O no hydrogen 2.793 N/A ARG 65.A N ALA 24.A O no hydrogen 2.804 N/A ARG 65.A NE GLU 63.A OE1 no hydrogen 2.908 N/A ARG 65.A NH2 GLU 63.A OE1 no hydrogen 2.934 N/A LEU 66.A N ASN 64.A OD1 no hydrogen 2.819 N/A THR 70.A N ILE 90.A O no hydrogen 3.101 N/A THR 70.A OG1 ASN 71.A O no hydrogen 3.547 N/A THR 70.A OG1 GLN 123.A OE1 no hydrogen 2.667 N/A ASN 71.A ND2 PRO 86.A O no hydrogen 3.649 N/A ASN 71.A ND2 LEU 88.A O no hydrogen 2.665 N/A ASN 71.A ND2 HIS 115.A O no hydrogen 3.022 N/A LEU 72.A N TYR 98.A OH no hydrogen 3.017 N/A HIS 73.A N HIS 113.A O no hydrogen 2.761 N/A HIS 73.A ND1 ASP 84.A OD1 no hydrogen 2.661 N/A HIS 73.A NE2 HIS 374.A NE2 no hydrogen 3.235 N/A TRP 74.A N ASP 84.A OD1 no hydrogen 2.932 N/A HIS 75.A N TRP 111.A O no hydrogen 2.726 N/A HIS 75.A NE2 ASP 397.A OD1 no hydrogen 2.823 N/A LEU 77.A N TRP 74.A O no hydrogen 3.107 N/A ILE 79.A N LEU 77.A O no hydrogen 2.829 N/A LYS 82.A N SER 80.A OG no hydrogen 2.989 N/A VAL 83.A N SER 80.A O no hydrogen 2.874 N/A ASP 84.A N SER 80.A O no hydrogen 2.981 N/A ASP 85.A N VAL 83.A O no hydrogen 2.769 N/A PHE 87.A N ASP 85.A OD1 no hydrogen 2.817 N/A LEU 88.A N ASP 85.A O no hydrogen 3.361 N/A ILE 90.A N THR 70.A O no hydrogen 2.850 N/A GLY 93.A N ASN 64.A O no hydrogen 2.684 N/A GLU 94.A N PRO 91.A O no hydrogen 2.953 N/A TRP 96.A N LEU 62.A O no hydrogen 3.091 N/A THR 97.A OG1 THR 61.A OG1 no hydrogen 2.734 N/A TYR 98.A N LEU 60.A O no hydrogen 2.797 N/A PHE 100.A N VAL 58.A O no hydrogen 2.954 N/A VAL 102.A N ASP 56.A O no hydrogen 2.838 N/A GLY 108.A N VAL 134.A O no hydrogen 3.158 N/A THR 109.A OG1 GLU 248.A OE1 no hydrogen 2.848 N/A PHE 110.A N LEU 132.A O no hydrogen 2.696 N/A TRP 111.A N HIS 75.A O no hydrogen 3.444 N/A TYR 112.A N GLY 130.A O no hydrogen 2.916 N/A TYR 112.A OH PRO 48.A O no hydrogen 2.651 N/A HIS 113.A N HIS 73.A O no hydrogen 3.361 N/A HIS 113.A ND1 PRO 114.A O no hydrogen 2.705 N/A HIS 115.A N ASN 71.A OD1 no hydrogen 2.769 N/A HIS 115.A ND1 HIS 115.A O no hydrogen 2.711 N/A HIS 115.A NE2 HIS 422.A NE2 no hydrogen 3.148 N/A HIS 117.A ND1 GLU 429.A OE2.B no hydrogen 2.853 N/A GLY 118.A N ASP 430.A OD1 no hydrogen 2.840 N/A ARG 119.A N LEU 116.A O no hydrogen 2.891 N/A ARG 119.A NE.B GLU 68.A OE1 no hydrogen 2.758 N/A ARG 119.A NH1.B GLU 68.A OE2 no hydrogen 3.556 N/A VAL 120.A N ASP 430.A OD1 no hydrogen 3.107 N/A ALA 121.A N ASP 430.A OD2 no hydrogen 2.708 N/A GLN 123.A N ARG 119.A O no hydrogen 3.402 N/A GLN 123.A NE2 GLU 68.A OE1 no hydrogen 2.927 N/A GLN 123.A NE2 PRO 69.A O no hydrogen 2.959 N/A LEU 124.A N VAL 120.A O no hydrogen 2.861 N/A PHE 125.A N ALA 121.A O no hydrogen 2.932 N/A ALA 126.A N PRO 122.A O no hydrogen 3.132 N/A ALA 126.A N GLN 123.A O no hydrogen 3.257 N/A GLY 127.A N LEU 124.A O no hydrogen 3.095 N/A LEU 128.A N GLN 123.A O no hydrogen 3.432 N/A LEU 129.A N GLY 127.A O no hydrogen 3.042 N/A GLY 130.A N TYR 112.A O no hydrogen 3.157 N/A LEU 132.A N PHE 110.A O no hydrogen 2.927 N/A VAL 133.A N LEU 50.A O no hydrogen 2.706 N/A VAL 134.A N GLY 108.A O no hydrogen 2.904 N/A GLU 135.A N VAL 52.A O no hydrogen 2.792 N/A SER 136.A N ASP 139.A OD2 no hydrogen 3.093 N/A LEU 138.A N SER 136.A OG no hydrogen 2.864 N/A ASP 139.A N SER 136.A O no hydrogen 2.845 N/A ALA 140.A N SER 137.A O no hydrogen 3.088 N/A ILE 141.A N LEU 138.A O no hydrogen 3.185 N/A GLU 143.A N GLU 143.A OE1 no hydrogen 2.593 N/A LEU 144.A N ILE 141.A O no hydrogen 2.985 N/A ARG 145.A N ILE 141.A O no hydrogen 2.883 N/A GLU 146.A N PRO 142.A O no hydrogen 3.001 N/A ALA 147.A N LEU 144.A O no hydrogen 2.981 N/A GLU 148.A N THR 197.A O no hydrogen 2.941 N/A HIS 150.A N ARG 199.A O no hydrogen 3.013 N/A HIS 150.A ND1 GLU 7.A OE2 no hydrogen 2.530 N/A HIS 150.A NE2 GLU 148.A OE2 no hydrogen 2.599 N/A LEU 151.A N GLU 7.A OE1 no hydrogen 2.825 N/A LEU 152.A N ARG 201.A O no hydrogen 2.705 N/A VAL 153.A N ASN 184.A OD1 no hydrogen 2.718 N/A LEU 154.A N LEU 203.A O no hydrogen 2.646 N/A LYS 155.A N.A LEU 182.A O no hydrogen 3.379 N/A LYS 155.A N.B LEU 182.A O no hydrogen 3.366 N/A LYS 155.A NZ.A PHE 125.A O no hydrogen 2.817 N/A LYS 155.A NZ.A ASP 156.A O no hydrogen 2.610 N/A LYS 155.A NZ.B ALA 205.A O no hydrogen 2.831 N/A LYS 155.A NZ.B ASN 207.A OD1 no hydrogen 3.043 N/A LEU 157.A N LEU 180.A O no hydrogen 2.885 N/A GLN 160.A N ARG 163.A O no hydrogen 2.729 N/A ARG 163.A N GLN 160.A O no hydrogen 3.049 N/A ALA 165.A N ALA 158.A O no hydrogen 2.809 N/A HIS 167.A NE2 GLU 427.A OE1 no hydrogen 2.609 N/A THR 168.A N ASP 171.A OD2 no hydrogen 2.970 N/A ASP 171.A N THR 168.A OG1 no hydrogen 3.040 N/A TRP 172.A N THR 168.A O no hydrogen 3.176 N/A MET 173.A N PRO 169.A O no hydrogen 3.288 N/A ASN 174.A N MET 170.A O no hydrogen 2.897 N/A ASN 174.A ND2 MET 271.A O no hydrogen 2.824 N/A GLY 175.A N ASP 171.A O no hydrogen 2.658 N/A LYS 176.A N GLU 427.A OE1 no hydrogen 3.049 N/A LYS 176.A NZ PRO 166.A O no hydrogen 3.089 N/A LYS 176.A NZ ASP 171.A OD2 no hydrogen 2.617 N/A GLY 178.A N ASP 156.A OD2 no hydrogen 2.703 N/A LEU 180.A N LEU 157.A O no hydrogen 2.919 N/A LEU 182.A N LYS 155.A O.A no hydrogen 3.285 N/A LEU 182.A N LYS 155.A O.B no hydrogen 3.283 N/A VAL 183.A N ALA 186.A O no hydrogen 2.893 N/A ASN 184.A N VAL 153.A O no hydrogen 2.899 N/A ASN 184.A ND2 PRO 6.A O no hydrogen 2.887 N/A ASN 184.A ND2 LEU 151.A O no hydrogen 2.846 N/A ALA 186.A N VAL 183.A O no hydrogen 2.835 N/A LEU 191.A N TYR 295.A O no hydrogen 2.700 N/A ALA 193.A N ILE 297.A O no hydrogen 2.917 N/A GLN 194.A N GLU 148.A OE1 no hydrogen 2.780 N/A LYS 195.A N GLU 148.A OE1 no hydrogen 3.149 N/A LYS 195.A NZ GLU 146.A O no hydrogen 3.030 N/A LEU 198.A N VAL 251.A O no hydrogen 2.816 N/A ARG 199.A N GLU 148.A O no hydrogen 2.739 N/A ARG 199.A NE GLU 248.A OE2 no hydrogen 3.087 N/A ARG 199.A NH1 ASP 139.A OD1 no hydrogen 3.028 N/A ARG 199.A NH2 ASP 139.A OD1 no hydrogen 2.899 N/A ARG 199.A NH2 GLU 248.A OE2 no hydrogen 2.999 N/A LEU 200.A N VAL 249.A O no hydrogen 2.822 N/A ARG 201.A N HIS 150.A O no hydrogen 2.864 N/A ARG 201.A NE GLU 149.A OE1 no hydrogen 2.782 N/A ARG 201.A NH1 GLU 149.A OE1 no hydrogen 3.351 N/A LEU 202.A N ALA 247.A O no hydrogen 2.686 N/A LEU 203.A N LEU 152.A O no hydrogen 2.964 N/A ASN 204.A N GLU 245.A O no hydrogen 3.121 N/A ASN 204.A ND2 ARG 209.A O no hydrogen 3.006 N/A ASN 204.A ND2 LEU 241.A O.A no hydrogen 2.839 N/A ASN 204.A ND2 LEU 241.A O.B no hydrogen 2.804 N/A ALA 205.A N LEU 154.A O no hydrogen 2.936 N/A SER 206.A N ASN 204.A OD1 no hydrogen 2.996 N/A SER 206.A OG LEU 154.A O no hydrogen 3.350 N/A SER 206.A OG ASP 156.A OD1 no hydrogen 3.186 N/A SER 206.A OG ASN 204.A OD1 no hydrogen 3.338 N/A SER 206.A OG TYR 211.A OH no hydrogen 2.678 N/A ASN 207.A ND2 ALA 121.A O no hydrogen 2.916 N/A ASN 207.A ND2 GLU 427.A OE1 no hydrogen 2.857 N/A ARG 209.A NE ASP 156.A OD2 no hydrogen 2.848 N/A ARG 209.A NH2 GLY 178.A O no hydrogen 2.851 N/A TYR 210.A OH ASN 400.A OD1 no hydrogen 2.650 N/A TYR 211.A N LEU 241.A O.A no hydrogen 3.126 N/A TYR 211.A N LEU 241.A O.B no hydrogen 3.148 N/A TYR 211.A OH SER 206.A OG no hydrogen 2.678 N/A ARG 212.A NE GLU 238.A OE1 no hydrogen 2.985 N/A ARG 212.A NE GLU 238.A OE2 no hydrogen 3.312 N/A ARG 212.A NH1 PRO 265.A O no hydrogen 2.952 N/A ARG 212.A NH2 GLU 238.A OE2 no hydrogen 3.037 N/A LEU 213.A N LEU 239.A O no hydrogen 2.804 N/A ALA 214.A N GLN 262.A O no hydrogen 3.085 N/A GLN 216.A N LEU 260.A O no hydrogen 2.935 N/A HIS 218.A N LEU 215.A O no hydrogen 2.920 N/A HIS 218.A ND1 GLN 216.A O no hydrogen 2.856 N/A LEU 220.A N VAL 236.A O no hydrogen 2.765 N/A TYR 221.A N LEU 250.A O no hydrogen 3.054 N/A TYR 221.A OH GLU 235.A OE1.A no hydrogen 2.466 N/A LEU 222.A N LEU 234.A O no hydrogen 2.824 N/A ILE 223.A N GLU 248.A O no hydrogen 2.851 N/A ALA 224.A N GLU 248.A O no hydrogen 3.276 N/A ALA 225.A N GLY 228.A O no hydrogen 2.853 N/A GLY 227.A N TRP 395.A O no hydrogen 2.879 N/A LEU 230.A N ILE 223.A O no hydrogen 2.820 N/A LEU 234.A N LEU 222.A O no hydrogen 2.927 N/A VAL 236.A N LEU 220.A O no hydrogen 2.767 N/A LEU 239.A N LEU 213.A O no hydrogen 2.896 N/A LEU 241.A N.A TYR 211.A O no hydrogen 2.916 N/A LEU 241.A N.B TYR 211.A O no hydrogen 2.919 N/A ALA 242.A N GLU 245.A OE2 no hydrogen 2.764 N/A GLY 244.A N ASN 204.A O no hydrogen 2.839 N/A GLU 245.A N ALA 242.A O no hydrogen 3.001 N/A ARG 246.A N ASP 226.A OD1 no hydrogen 2.870 N/A ARG 246.A NE THR 109.A O no hydrogen 2.737 N/A ARG 246.A NH1 THR 109.A O no hydrogen 3.569 N/A ARG 246.A NH1 ASP 397.A OD2 no hydrogen 2.839 N/A ARG 246.A NH2 GLY 244.A O no hydrogen 2.846 N/A ARG 246.A NH2 ASP 397.A OD1 no hydrogen 2.907 N/A ARG 246.A NH2 ASP 397.A OD2 no hydrogen 3.519 N/A ALA 247.A N LEU 202.A O no hydrogen 3.062 N/A GLU 248.A N ALA 224.A O no hydrogen 3.040 N/A VAL 249.A N LEU 200.A O no hydrogen 2.934 N/A LEU 250.A N TYR 221.A O no hydrogen 2.793 N/A VAL 251.A N LEU 198.A O no hydrogen 2.832 N/A ARG 252.A NE LEU 305.A O no hydrogen 3.190 N/A ARG 252.A NH1 LEU 305.A O no hydrogen 2.870 N/A LEU 253.A N ALA 196.A O no hydrogen 2.852 N/A ARG 254.A N HIS 218.A NE2 no hydrogen 3.167 N/A ARG 254.A NH1 ASP 217.A OD2 no hydrogen 2.915 N/A LYS 255.A NZ ASP 217.A OD2 no hydrogen 3.025 N/A PHE 259.A N LEU 296.A O no hydrogen 2.801 N/A LEU 260.A N GLN 216.A OE1 no hydrogen 2.933 N/A LEU 261.A N LEU 294.A O no hydrogen 2.996 N/A GLN 262.A N ALA 214.A O no hydrogen 2.972 N/A ALA 263.A N GLU 291.A O no hydrogen 2.774 N/A LEU 264.A N ARG 212.A O no hydrogen 2.752 N/A TYR 266.A N SER 288.A OG no hydrogen 3.105 N/A TYR 266.A OH ASP 370.A OD2 no hydrogen 2.485 N/A ARG 268.A NE GLU 177.A OE2 no hydrogen 2.814 N/A ARG 268.A NH1 ASN 174.A O no hydrogen 2.899 N/A ARG 268.A NH2 ASN 174.A O no hydrogen 3.150 N/A ARG 268.A NH2 GLY 175.A O no hydrogen 3.169 N/A ARG 268.A NH2 GLU 177.A OE2 no hydrogen 2.945 N/A GLY 269.A N ASP 267.A OD1 no hydrogen 2.897 N/A MET 271.A N ASN 174.A OD1 no hydrogen 2.915 N/A GLY 272.A N MET 283.A O no hydrogen 2.689 N/A MET 274.A N HIS 281.A O no hydrogen 3.004 N/A GLY 277.A N ASP 275.A OD1 no hydrogen 3.374 N/A HIS 281.A N MET 274.A O no hydrogen 2.997 N/A MET 283.A N GLY 272.A O no hydrogen 2.758 N/A GLN 285.A N ALA 270.A O no hydrogen 2.834 N/A GLN 285.A NE2 MET 271.A O no hydrogen 3.074 N/A SER 288.A N TYR 266.A O no hydrogen 2.824 N/A SER 288.A OG TYR 266.A O no hydrogen 3.389 N/A GLU 291.A N ALA 263.A O no hydrogen 2.997 N/A LEU 293.A N LEU 261.A O no hydrogen 2.605 N/A LEU 294.A N LEU 261.A O no hydrogen 3.397 N/A TYR 295.A N PRO 189.A O no hydrogen 3.014 N/A LEU 296.A N PHE 259.A O no hydrogen 2.840 N/A ILE 297.A N LEU 191.A O no hydrogen 2.784 N/A ALA 298.A N GLY 257.A O no hydrogen 2.803 N/A LYS 300.A NZ GLU 256.A OE1 no hydrogen 2.655 N/A LYS 300.A NZ GLU 256.A OE2 no hydrogen 3.023 N/A ASN 301.A N GLU 256.A OE1 no hydrogen 2.917 N/A LYS 303.A NZ ASN 301.A O no hydrogen 2.997 N/A LEU 305.A N THR 197.A OG1 no hydrogen 3.034 N/A LYS 309.A NZ GLU 143.A OE2 no hydrogen 3.044 N/A LYS 309.A NZ LEU 307.A O no hydrogen 2.773 N/A LEU 311.A N GLU 231.A O no hydrogen 2.884 N/A SER 312.A N.A LEU 230.A O no hydrogen 3.276 N/A SER 312.A N.B LEU 230.A O no hydrogen 3.278 N/A PHE 314.A N GLU 231.A OE2 no hydrogen 2.861 N/A VAL 321.A N VAL 358.A O no hydrogen 2.799 N/A ARG 324.A N VAL 360.A O no hydrogen 2.665 N/A ARG 324.A NE GLU 359.A OE1 no hydrogen 2.910 N/A ARG 324.A NH2 LYS 352.A O.A no hydrogen 2.635 N/A ARG 324.A NH2 LYS 352.A O.B no hydrogen 2.727 N/A ARG 324.A NH2 GLU 359.A OE2 no hydrogen 2.803 N/A ARG 325.A NE GLU 364.A OE1 no hydrogen 3.363 N/A ARG 325.A NH1 GLU 362.A OE2 no hydrogen 2.988 N/A ARG 325.A NH2 GLU 364.A OE1 no hydrogen 2.560 N/A LEU 326.A N GLU 362.A O no hydrogen 2.904 N/A VAL 327.A N.A ASN 340.A OD1 no hydrogen 2.783 N/A VAL 327.A N.B ASN 340.A OD1 no hydrogen 2.784 N/A LEU 328.A N GLU 364.A O no hydrogen 2.783 N/A THR 329.A N PHE 338.A O no hydrogen 3.163 N/A ASP 331.A N ARG 336.A O no hydrogen 2.749 N/A ALA 334.A N ASP 331.A O no hydrogen 3.138 N/A ALA 334.A N ASP 331.A OD1 no hydrogen 3.241 N/A ALA 335.A N MET 332.A O no hydrogen 2.950 N/A ARG 336.A N ASP 331.A O no hydrogen 3.089 N/A ARG 336.A NH2 ARG 431.A O no hydrogen 3.239 N/A PHE 338.A N THR 329.A O no hydrogen 3.057 N/A ILE 339.A N GLN 342.A O no hydrogen 2.946 N/A ASN 340.A N VAL 327.A O.A no hydrogen 2.745 N/A ASN 340.A N VAL 327.A O.B no hydrogen 2.744 N/A ASN 340.A ND2 ARG 325.A O no hydrogen 3.070 N/A GLN 342.A N ILE 339.A O no hydrogen 3.014 N/A PHE 344.A N GLY 432.A O no hydrogen 2.778 N/A ARG 347.A N ASP 345.A OD1 no hydrogen 2.823 N/A ARG 347.A NE ASP 345.A OD1 no hydrogen 3.168 N/A ARG 347.A NH2 ASP 345.A OD2 no hydrogen 3.026 N/A ARG 348.A N ASP 345.A O no hydrogen 2.902 N/A ARG 348.A NE ASP 350.A OD1 no hydrogen 2.632 N/A ARG 348.A NH1 VAL 343.A O no hydrogen 3.051 N/A ARG 348.A NH2 VAL 343.A O no hydrogen 2.942 N/A ARG 348.A NH2 ASP 350.A OD1 no hydrogen 3.278 N/A ASP 350.A N VAL 436.A O no hydrogen 2.892 N/A LEU 351.A N VAL 436.A O no hydrogen 3.056 N/A LYS 352.A NZ.A GLU 438.A OE2 no hydrogen 3.044 N/A LYS 352.A NZ.B GLY 353.A O no hydrogen 2.935 N/A GLY 353.A N GLU 438.A O no hydrogen 2.892 N/A ALA 355.A N GLY 440.A OXT no hydrogen 2.946 N/A GLN 356.A N LEU 413.A O no hydrogen 2.733 N/A GLN 356.A NE2 ARG 414.A O no hydrogen 3.381 N/A THR 357.A N GLN 354.A O no hydrogen 3.127 N/A THR 357.A OG1 GLN 354.A O no hydrogen 2.591 N/A GLU 359.A N VAL 411.A O no hydrogen 2.850 N/A VAL 360.A N VAL 322.A O no hydrogen 2.865 N/A TRP 361.A N LEU 409.A O no hydrogen 2.883 N/A TRP 361.A NE1 GLU 359.A OE1 no hydrogen 2.786 N/A GLU 362.A N ARG 324.A O no hydrogen 2.800 N/A VAL 363.A N ALA 407.A O no hydrogen 2.865 N/A GLU 364.A N LEU 326.A O no hydrogen 2.907 N/A ASN 365.A N GLU 405.A O no hydrogen 2.849 N/A ASN 365.A ND2 MET 369.A O no hydrogen 2.789 N/A ASN 365.A ND2 LEU 401.A O no hydrogen 2.798 N/A GLN 366.A N LEU 328.A O no hydrogen 2.843 N/A GLN 366.A NE2 GLU 364.A OE1 no hydrogen 3.478 N/A GLN 366.A NE2 GLU 364.A OE2 no hydrogen 3.104 N/A GLY 367.A N ASN 365.A OD1 no hydrogen 2.823 N/A ASP 368.A N GLU 330.A OE2 no hydrogen 2.909 N/A MET 369.A N GLU 330.A OE1 no hydrogen 2.851 N/A ASP 370.A N ARG 268.A O no hydrogen 2.832 N/A HIS 371.A N LEU 401.A O no hydrogen 2.945 N/A HIS 371.A NE2 GLU 330.A OE1 no hydrogen 2.791 N/A PHE 373.A N VAL 399.A O no hydrogen 2.868 N/A HIS 374.A N HIS 422.A O no hydrogen 2.761 N/A HIS 374.A ND1 ASP 397.A O no hydrogen 2.550 N/A HIS 374.A NE2 HIS 73.A NE2 no hydrogen 3.235 N/A LEU 375.A N ASP 397.A O no hydrogen 3.245 N/A HIS 376.A N VAL 420.A O no hydrogen 3.134 N/A HIS 376.A NE2 HIS 422.A NE2 no hydrogen 3.176 N/A HIS 378.A N HIS 376.A O no hydrogen 2.737 N/A PHE 380.A N LYS 396.A O no hydrogen 2.722 N/A GLN 381.A N LEU 410.A O no hydrogen 2.918 N/A LEU 383.A N ARG 408.A O no hydrogen 2.839 N/A SER 384.A N ARG 408.A O no hydrogen 3.454 N/A VAL 385.A N ARG 388.A O no hydrogen 3.044 N/A GLY 386.A N VAL 406.A O no hydrogen 2.791 N/A ARG 388.A N VAL 385.A O no hydrogen 2.980 N/A ARG 388.A NH1 GLU 405.A OE2 no hydrogen 3.198 N/A ARG 388.A NH2 GLU 405.A OE2 no hydrogen 2.635 N/A PHE 390.A N LEU 383.A O no hydrogen 2.884 N/A ARG 393.A NE GLU 231.A OE1 no hydrogen 2.851 N/A ARG 393.A NH1 GLU 231.A OE1 no hydrogen 3.415 N/A ARG 393.A NH1 GLU 231.A OE2 no hydrogen 2.716 N/A LYS 396.A N PHE 380.A O no hydrogen 2.824 N/A LYS 396.A NZ ASP 226.A OD1 no hydrogen 3.331 N/A LYS 396.A NZ ASP 226.A OD2 no hydrogen 2.784 N/A LYS 396.A NZ GLU 245.A OE1 no hydrogen 2.784 N/A LYS 396.A NZ VAL 398.A O no hydrogen 2.713 N/A ASP 397.A N ASP 226.A OD2 no hydrogen 2.973 N/A VAL 398.A N ASP 226.A OD2 no hydrogen 3.025 N/A VAL 399.A N PHE 373.A O no hydrogen 2.933 N/A ASN 400.A ND2 ASP 370.A OD2 no hydrogen 2.926 N/A LEU 401.A N HIS 371.A O no hydrogen 3.004 N/A LYS 402.A N GLU 405.A OE1 no hydrogen 2.974 N/A LYS 402.A NZ TYR 266.A OH no hydrogen 3.161 N/A LYS 402.A NZ ASP 267.A O no hydrogen 3.067 N/A LYS 402.A NZ ASP 370.A OD1 no hydrogen 2.686 N/A LYS 402.A NZ ASP 370.A OD2 no hydrogen 3.551 N/A GLU 405.A N LYS 402.A O no hydrogen 3.007 N/A ALA 407.A N VAL 363.A O no hydrogen 2.712 N/A ARG 408.A N SER 384.A O no hydrogen 2.911 N/A LEU 409.A N TRP 361.A O no hydrogen 2.813 N/A LEU 410.A N GLN 381.A O no hydrogen 2.886 N/A VAL 411.A N GLU 359.A O no hydrogen 2.662 N/A LEU 413.A N THR 357.A O no hydrogen 2.850 N/A ARG 414.A N HIS 378.A ND1 no hydrogen 2.858 N/A GLY 417.A N VAL 439.A O no hydrogen 2.779 N/A ARG 418.A NE.B GLU 438.A OE1 no hydrogen 2.593 N/A ARG 418.A NE.C GLU 438.A OE1 no hydrogen 2.561 N/A THR 419.A N LEU 437.A O no hydrogen 2.819 N/A VAL 420.A N THR 419.A OG1 no hydrogen 2.868 N/A PHE 421.A N GLY 435.A O no hydrogen 2.986 N/A HIS 422.A N HIS 374.A O no hydrogen 2.798 N/A HIS 422.A ND1 CYS 423.A O no hydrogen 2.805 N/A HIS 422.A NE2 HIS 376.A NE2 no hydrogen 3.176 N/A CYS 423.A N MET 433.A O no hydrogen 3.173 N/A CYS 423.A SG HIS 371.A ND1 no hydrogen 3.705 N/A CYS 423.A SG PRO 372.A O no hydrogen 3.948 N/A CYS 423.A SG HIS 428.A ND1 no hydrogen 3.897 N/A HIS 424.A N PRO 372.A O no hydrogen 2.690 N/A HIS 424.A ND1 HIS 424.A O no hydrogen 2.764 N/A GLU 427.A N GLU 427.A OE2 no hydrogen 2.611 N/A HIS 428.A N ILE 425.A O no hydrogen 2.733 N/A HIS 428.A NE2 MET 173.A O no hydrogen 2.794 N/A GLU 429.A N.A ILE 425.A O no hydrogen 3.321 N/A GLU 429.A N.B ILE 425.A O no hydrogen 3.331 N/A ASP 430.A N VAL 426.A O no hydrogen 2.883 N/A ARG 431.A N GLU 427.A O no hydrogen 3.008 N/A ARG 431.A N HIS 428.A O no hydrogen 3.138 N/A ARG 431.A NE ALA 335.A O no hydrogen 2.703 N/A ARG 431.A NH2 ALA 334.A O no hydrogen 2.978 N/A ARG 431.A NH2 ALA 335.A O no hydrogen 3.353 N/A GLY 432.A N GLU 429.A O.A no hydrogen 3.128 N/A GLY 432.A N GLU 429.A O.B no hydrogen 2.990 N/A MET 433.A N HIS 428.A O no hydrogen 2.913 N/A MET 434.A N GLY 432.A O no hydrogen 2.781 N/A GLY 435.A N PHE 421.A O no hydrogen 2.853 N/A VAL 436.A N ASP 350.A OD2 no hydrogen 2.851 N/A LEU 437.A N THR 419.A O no hydrogen 2.883 N/A GLU 438.A N LEU 351.A O no hydrogen 2.808 N/A VAL 439.A N GLY 417.A O no hydrogen 2.939 N/A GLY 440.A N GLY 353.A O no hydrogen 2.967 N/A