Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3bit_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LEU 3.A N GLU 2.A OE2 no hydrogen 3.064 N/A VAL 9.A N ASP 6.A OD1 no hydrogen 2.993 N/A PHE 10.A N ASP 6.A O no hydrogen 3.039 N/A LYS 11.A N PHE 7.A O no hydrogen 2.854 N/A LYS 11.A NZ GLU 15.A OE1 no hydrogen 3.303 N/A LYS 11.A NZ GLU 15.A OE2 no hydrogen 3.496 N/A LYS 12.A N ASP 8.A O no hydrogen 2.850 N/A LYS 12.A NZ ASP 175.A OD2 no hydrogen 3.308 N/A ARG 13.A N VAL 9.A O no hydrogen 2.858 N/A ARG 13.A NH1 ASP 175.A OD2 no hydrogen 3.037 N/A ARG 13.A NH2 TRP 53.A O no hydrogen 2.728 N/A ILE 14.A N PHE 10.A O no hydrogen 2.935 N/A GLU 15.A N LYS 11.A O no hydrogen 3.068 N/A LEU 16.A N LYS 12.A O no hydrogen 2.937 N/A LEU 17.A N ARG 13.A O no hydrogen 2.980 N/A TYR 18.A N ILE 14.A O no hydrogen 3.079 N/A SER 19.A N GLU 15.A O no hydrogen 3.031 N/A SER 19.A OG LEU 16.A O no hydrogen 2.785 N/A LYS 20.A N LEU 17.A O no hydrogen 3.059 N/A TYR 21.A N LEU 17.A O no hydrogen 2.855 N/A TYR 21.A OH ASN 29.A O no hydrogen 2.960 N/A GLU 23.A N LYS 20.A O no hydrogen 2.973 N/A PHE 24.A N TYR 21.A O no hydrogen 3.084 N/A SER 27.A N PHE 24.A O no hydrogen 2.880 N/A SER 27.A OG ASN 22.A O no hydrogen 3.462 N/A ASN 29.A N THR 129.A O no hydrogen 2.857 N/A SER 30.A N.A THR 129.A O no hydrogen 3.365 N/A SER 30.A N.B THR 129.A O no hydrogen 3.360 N/A LEU 31.A N LEU 66.A O no hydrogen 2.818 N/A LEU 32.A N GLY 131.A O no hydrogen 2.982 N/A PHE 33.A N ILE 64.A O no hydrogen 2.764 N/A LEU 35.A N THR 62.A O no hydrogen 3.042 N/A SER 37.A N.A GLN 139.A O no hydrogen 2.927 N/A SER 37.A N.B GLN 139.A O no hydrogen 2.928 N/A SER 37.A OG.A GLN 139.A O no hydrogen 3.142 N/A SER 37.A OG.B GLN 139.A O no hydrogen 3.440 N/A GLU 41.A N ASN 39.A OD1 no hydrogen 2.887 N/A ASN 42.A N ASN 39.A O no hydrogen 3.137 N/A TYR 44.A OH THR 252.A O no hydrogen 2.545 N/A GLN 45.A NE2 SER 137.A O no hydrogen 2.706 N/A LYS 46.A N.A ASP 136.A OD2 no hydrogen 3.321 N/A LYS 46.A N.B ASP 136.A OD2 no hydrogen 3.319 N/A LYS 46.A NZ.A SER 164.A O no hydrogen 2.766 N/A LYS 46.A NZ.B GLU 366.A OE1 no hydrogen 2.986 N/A THR 47.A N ASP 136.A OD1 no hydrogen 2.764 N/A THR 47.A OG1 ASP 136.A OD1 no hydrogen 2.924 N/A THR 48.A OG1 GLU 58.A OE1 no hydrogen 2.542 N/A THR 48.A OG1 TYR 138.A OH no hydrogen 2.675 N/A ILE 49.A N GLN 45.A O no hydrogen 2.897 N/A LEU 50.A N LYS 46.A O.A no hydrogen 2.792 N/A LEU 50.A N LYS 46.A O.B no hydrogen 2.823 N/A HIS 51.A N THR 47.A O no hydrogen 3.035 N/A ASN 52.A N THR 48.A O no hydrogen 2.922 N/A TRP 53.A N ILE 49.A O no hydrogen 2.785 N/A LEU 54.A N LEU 50.A O no hydrogen 2.872 N/A LEU 55.A N HIS 51.A O no hydrogen 2.875 N/A SER 56.A N ASN 52.A O no hydrogen 2.944 N/A SER 56.A OG LEU 55.A O no hydrogen 2.780 N/A ALA 61.A N GLY 36.A O no hydrogen 3.032 N/A THR 62.A N LEU 35.A O no hydrogen 3.121 N/A THR 62.A OG1 PHE 59.A O no hydrogen 3.051 N/A THR 62.A OG1 PRO 60.A O no hydrogen 2.787 N/A THR 62.A OG1 THR 75.A OG1 no hydrogen 2.842 N/A LEU 63.A N ILE 74.A O no hydrogen 2.938 N/A ILE 64.A N PHE 33.A O no hydrogen 2.764 N/A ALA 65.A N ILE 72.A O.A no hydrogen 2.863 N/A ALA 65.A N ILE 72.A O.B no hydrogen 2.869 N/A LEU 66.A N LEU 31.A O no hydrogen 2.825 N/A VAL 67.A N LYS 70.A O no hydrogen 2.923 N/A GLY 69.A N TYR 18.A OH no hydrogen 2.656 N/A LYS 70.A N VAL 67.A O no hydrogen 3.095 N/A LYS 70.A NZ GLU 100.A OE2 no hydrogen 2.772 N/A VAL 71.A N THR 98.A O no hydrogen 2.918 N/A ILE 72.A N.A ALA 65.A O no hydrogen 2.940 N/A ILE 72.A N.B ALA 65.A O no hydrogen 2.932 N/A ILE 73.A N GLU 100.A O no hydrogen 2.861 N/A ILE 74.A N LEU 63.A O no hydrogen 2.921 N/A THR 75.A N TRP 102.A O no hydrogen 3.095 N/A THR 75.A OG1 THR 62.A OG1 no hydrogen 2.842 N/A SER 77.A OG.A GLN 103.A OE1 no hydrogen 2.873 N/A SER 77.A OG.B GLN 103.A OE1 no hydrogen 3.340 N/A LYS 79.A N SER 76.A OG no hydrogen 3.079 N/A ALA 80.A N SER 76.A O no hydrogen 2.797 N/A LYS 81.A N SER 77.A O.A no hydrogen 3.124 N/A LYS 81.A N SER 77.A O.B no hydrogen 3.018 N/A LYS 81.A NZ SER 77.A OG.B no hydrogen 3.375 N/A HIS 82.A N LYS 79.A O no hydrogen 3.076 N/A HIS 82.A ND1 GLU 2.A OE2 no hydrogen 2.390 N/A LEU 83.A N ALA 80.A O no hydrogen 2.950 N/A ALA 86.A N LEU 83.A O no hydrogen 2.982 N/A ILE 87.A N GLN 84.A O no hydrogen 3.000 N/A PHE 90.A N ILE 87.A O no hydrogen 3.193 N/A LYS 91.A N ASP 88.A O no hydrogen 3.177 N/A SER 95.A N ASP 92.A O no hydrogen 3.183 N/A SER 95.A OG PHE 90.A O no hydrogen 2.681 N/A SER 95.A OG ASP 92.A O no hydrogen 3.408 N/A THR 98.A N GLY 69.A O no hydrogen 2.972 N/A GLU 100.A N VAL 71.A O no hydrogen 2.859 N/A TRP 102.A N ILE 73.A O no hydrogen 2.702 N/A TRP 102.A NE1 GLU 100.A OE1 no hydrogen 2.942 N/A ARG 104.A N THR 75.A O no hydrogen 2.837 N/A ARG 104.A NH1 GLU 144.A OE2 no hydrogen 3.117 N/A ARG 104.A NH2 GLU 144.A OE2 no hydrogen 3.334 N/A LYS 107.A N ASN 105.A OD1 no hydrogen 2.747 N/A GLU 108.A N ASN 105.A O no hydrogen 3.066 N/A ASN 112.A N GLU 108.A O no hydrogen 3.297 N/A LYS 113.A N PRO 109.A O no hydrogen 2.953 N/A LYS 113.A NZ ASP 117.A OD1 no hydrogen 3.124 N/A LYS 113.A NZ ASP 117.A OD2 no hydrogen 3.338 N/A LYS 114.A N GLU 110.A O no hydrogen 3.288 N/A LYS 114.A NZ ASP 118.A OD1 no hydrogen 2.792 N/A LEU 115.A N LEU 111.A O no hydrogen 3.001 N/A PHE 116.A N ASN 112.A O no hydrogen 2.954 N/A ASP 117.A N LYS 113.A O no hydrogen 2.819 N/A ASP 118.A N LYS 114.A O no hydrogen 2.881 N/A VAL 119.A N LEU 115.A O no hydrogen 3.015 N/A ILE 120.A N PHE 116.A O no hydrogen 3.062 N/A ALA 121.A N ASP 117.A O no hydrogen 3.081 N/A LEU 122.A N ASP 118.A O no hydrogen 3.314 N/A ILE 123.A N VAL 119.A O no hydrogen 3.107 N/A ASN 124.A N ILE 120.A O no hydrogen 2.955 N/A SER 125.A N ALA 121.A O no hydrogen 2.926 N/A SER 125.A OG ALA 121.A O no hydrogen 3.160 N/A ALA 126.A N LEU 122.A O no hydrogen 3.131 N/A GLY 127.A N ILE 123.A O no hydrogen 3.247 N/A LYS 128.A NZ ASN 124.A OD1 no hydrogen 2.732 N/A LYS 128.A NZ ASN 156.A O no hydrogen 2.795 N/A THR 129.A N ASN 29.A OD1 no hydrogen 3.073 N/A THR 129.A OG1 ASN 159.A OD1 no hydrogen 3.341 N/A VAL 130.A N ASN 159.A O no hydrogen 3.044 N/A GLY 131.A N SER 30.A O.A no hydrogen 2.876 N/A GLY 131.A N SER 30.A O.B no hydrogen 2.863 N/A ILE 132.A N ILE 161.A O no hydrogen 2.847 N/A GLU 134.A N ASP 162.A OD1 no hydrogen 3.066 N/A LYS 135.A NZ ASP 162.A OD2 no hydrogen 2.778 N/A ASP 136.A N PRO 133.A O no hydrogen 3.277 N/A SER 137.A N GLN 45.A OE1 no hydrogen 2.733 N/A TYR 138.A OH THR 48.A OG1 no hydrogen 2.675 N/A LYS 141.A NZ GLU 144.A OE1 no hydrogen 2.780 N/A THR 143.A OG1 LYS 141.A O no hydrogen 2.841 N/A GLU 144.A N LYS 141.A O no hydrogen 3.072 N/A GLU 144.A N PHE 142.A O no hydrogen 3.161 N/A TRP 145.A N PHE 142.A O no hydrogen 2.943 N/A TRP 149.A N TRP 145.A O no hydrogen 2.893 N/A GLU 150.A N ASN 146.A O no hydrogen 2.936 N/A ALA 151.A N PRO 147.A O no hydrogen 2.994 N/A ALA 152.A N VAL 148.A O no hydrogen 3.119 N/A VAL 153.A N TRP 149.A O no hydrogen 2.970 N/A LYS 154.A N GLU 150.A O no hydrogen 3.410 N/A GLU 155.A N ALA 151.A O no hydrogen 2.852 N/A ASN 156.A N ALA 152.A O no hydrogen 2.767 N/A ASN 156.A ND2 ALA 152.A O no hydrogen 3.369 N/A GLU 157.A N LYS 154.A O no hydrogen 3.262 N/A PHE 158.A N VAL 153.A O no hydrogen 3.100 N/A ASN 159.A N LYS 128.A O no hydrogen 2.642 N/A ILE 161.A N VAL 130.A O no hydrogen 2.919 N/A ILE 163.A N ILE 132.A O no hydrogen 3.021 N/A SER 164.A N ASP 162.A OD1 no hydrogen 3.286 N/A SER 164.A OG ASP 162.A OD1 no hydrogen 2.736 N/A LEU 167.A N ILE 163.A O no hydrogen 2.938 N/A SER 168.A N SER 164.A O no hydrogen 3.160 N/A SER 168.A OG ASP 369.A OD1 no hydrogen 2.521 N/A SER 168.A OG ASP 369.A OD2 no hydrogen 3.309 N/A LYS 169.A N LEU 165.A O no hydrogen 3.070 N/A VAL 170.A N GLY 166.A O no hydrogen 2.948 N/A TRP 171.A N LEU 167.A O no hydrogen 3.320 N/A GLU 172.A N LYS 169.A O no hydrogen 3.487 N/A LYS 174.A N GLY 386.A O no hydrogen 3.029 N/A LYS 174.A NZ TRP 171.A O no hydrogen 3.163 N/A LYS 174.A NZ GLU 172.A O no hydrogen 2.895 N/A ASP 175.A N GLU 178.A OE1 no hydrogen 3.038 N/A ASN 177.A N ASP 175.A OD1 no hydrogen 2.896 N/A GLU 178.A N ASP 175.A OD1 no hydrogen 2.974 N/A GLN 179.A N ASP 175.A O no hydrogen 2.946 N/A GLN 179.A NE2 LYS 174.A O no hydrogen 2.867 N/A ALA 180.A N VAL 176.A O no hydrogen 3.137 N/A PHE 181.A N ASN 177.A O no hydrogen 2.859 N/A LEU 182.A N GLU 178.A O no hydrogen 2.842 N/A SER 183.A N.A GLN 179.A O no hydrogen 3.047 N/A SER 183.A N.A ALA 180.A O no hydrogen 3.134 N/A SER 183.A N.B GLN 179.A O no hydrogen 3.032 N/A SER 183.A OG.A GLN 179.A O no hydrogen 2.964 N/A SER 183.A OG.B ALA 180.A O no hydrogen 2.512 N/A VAL 184.A N ALA 180.A O no hydrogen 3.034 N/A SER 185.A N.A PHE 181.A O no hydrogen 2.981 N/A SER 185.A N.B PHE 181.A O no hydrogen 2.995 N/A SER 185.A OG.A PHE 181.A O no hydrogen 2.989 N/A SER 185.A OG.A TYR 293.A O no hydrogen 2.431 N/A SER 185.A OG.B TYR 293.A O no hydrogen 2.703 N/A SER 185.A OG.B SER 295.A OG.A no hydrogen 3.158 N/A SER 185.A OG.B SER 295.A OG.B no hydrogen 2.919 N/A SER 186.A N LEU 182.A O no hydrogen 2.947 N/A SER 186.A OG LEU 182.A O no hydrogen 2.835 N/A SER 186.A OG SER 295.A OG.B no hydrogen 2.913 N/A LYS 187.A N SER 183.A O.A no hydrogen 2.883 N/A LYS 187.A N SER 183.A O.B no hydrogen 2.924 N/A GLY 188.A N VAL 184.A O no hydrogen 2.980 N/A SER 189.A N SER 185.A O.A no hydrogen 3.021 N/A SER 189.A N SER 185.A O.B no hydrogen 2.965 N/A SER 189.A OG SER 185.A O.A no hydrogen 3.415 N/A SER 189.A OG SER 185.A O.B no hydrogen 3.450 N/A SER 189.A OG SER 295.A OG.A no hydrogen 2.715 N/A ASP 190.A N SER 186.A O no hydrogen 2.988 N/A LYS 191.A N LYS 187.A O no hydrogen 3.124 N/A PHE 192.A N GLY 188.A O no hydrogen 2.952 N/A LEU 194.A N LYS 191.A O no hydrogen 3.178 N/A LEU 195.A N PHE 192.A O no hydrogen 2.799 N/A ASN 197.A N ASP 193.A O no hydrogen 3.021 N/A GLU 198.A N LEU 194.A O no hydrogen 2.827 N/A ARG 200.A N ASN 197.A O no hydrogen 3.236 N/A ALA 201.A N GLU 198.A O no hydrogen 2.955 N/A ASP 203.A N VAL 199.A O no hydrogen 2.726 N/A GLU 204.A N ARG 200.A O no hydrogen 2.945 N/A GLU 205.A N VAL 202.A O no hydrogen 3.141 N/A LEU 206.A N ALA 201.A O no hydrogen 2.968 N/A ILE 208.A N GLN 275.A OE1 no hydrogen 3.335 N/A ASN 210.A N ASP 274.A O no hydrogen 2.966 N/A ASN 210.A ND2 SER 259.A OG no hydrogen 2.534 N/A ALA 211.A N THR 272.A O no hydrogen 3.083 N/A LYS 212.A N THR 209.A OG1 no hydrogen 2.967 N/A LEU 213.A N THR 209.A O no hydrogen 3.070 N/A SER 214.A N ASN 210.A O no hydrogen 2.926 N/A SER 214.A OG ASN 210.A O no hydrogen 3.325 N/A SER 214.A OG ALA 211.A O no hydrogen 3.179 N/A SER 214.A OG PRO 255.A O no hydrogen 3.428 N/A SER 214.A OG SER 271.A OG no hydrogen 2.805 N/A ASP 215.A N ALA 211.A O no hydrogen 2.866 N/A LYS 216.A N LYS 212.A O no hydrogen 2.926 N/A LYS 216.A NZ GLU 198.A OE2 no hydrogen 3.332 N/A ILE 217.A N LEU 213.A O no hydrogen 3.280 N/A GLU 218.A N SER 214.A O no hydrogen 2.902 N/A ASN 219.A N ASP 215.A O no hydrogen 2.942 N/A LYS 220.A N ILE 217.A O no hydrogen 3.140 N/A LYS 220.A NZ ASP 223.A OD2 no hydrogen 3.117 N/A ILE 221.A N GLU 218.A O no hydrogen 3.327 N/A ASP 222.A N ASN 219.A O no hydrogen 3.046 N/A ASP 223.A N LYS 220.A O no hydrogen 2.998 N/A LEU 227.A N ASP 223.A O no hydrogen 2.844 N/A LYS 228.A N VAL 224.A O no hydrogen 2.758 N/A GLN 229.A N LYS 225.A O no hydrogen 3.288 N/A LEU 230.A N PHE 226.A O no hydrogen 3.309 N/A LEU 230.A N LEU 227.A O no hydrogen 3.176 N/A SER 231.A N LYS 228.A O no hydrogen 3.339 N/A SER 231.A OG LEU 227.A O no hydrogen 3.324 N/A LEU 234.A N LEU 230.A O no hydrogen 3.259 N/A SER 235.A N SER 231.A O no hydrogen 2.776 N/A SER 235.A OG SER 231.A O no hydrogen 2.889 N/A SER 235.A OG PRO 232.A O no hydrogen 3.011 N/A ALA 236.A N PRO 232.A O no hydrogen 2.957 N/A LEU 237.A N LEU 234.A O no hydrogen 3.051 N/A CYS 238.A N SER 235.A O no hydrogen 3.201 N/A CYS 238.A SG LEU 234.A O no hydrogen 3.685 N/A TYR 242.A N PRO 239.A O no hydrogen 3.143 N/A TYR 242.A OH ASP 6.A OD2 no hydrogen 2.733 N/A ASN 245.A N TYR 290.A OH no hydrogen 2.986 N/A ASP 247.A N ASN 245.A OD1 no hydrogen 3.007 N/A LEU 248.A N ASN 245.A O no hydrogen 3.040 N/A LEU 249.A N PHE 246.A O no hydrogen 3.122 N/A ASP 250.A N.A ARG 289.A O no hydrogen 2.936 N/A ASP 250.A N.B ARG 289.A O no hydrogen 2.974 N/A TRP 251.A NE1 GLU 218.A O no hydrogen 2.934 N/A THR 252.A N GLY 287.A O no hydrogen 2.764 N/A THR 252.A OG1 GLY 287.A O no hydrogen 3.245 N/A THR 252.A OG1 ILE 288.A O no hydrogen 3.201 N/A TYR 253.A OH ASN 296.A OD1 no hydrogen 2.571 N/A SER 254.A OG GLU 218.A OE1 no hydrogen 2.869 N/A ILE 256.A N SER 285.A O no hydrogen 2.798 N/A ILE 257.A N SER 271.A OG no hydrogen 3.000 N/A GLN 258.A N LEU 283.A O no hydrogen 2.842 N/A GLN 258.A NE2 ASP 264.A O no hydrogen 2.841 N/A LYS 261.A NZ ASN 405.A OD1 no hydrogen 3.199 N/A ASP 264.A N GLN 258.A OE1 no hydrogen 2.839 N/A ARG 266.A N.A ASP 264.A OD2 no hydrogen 3.076 N/A ARG 266.A N.B ASP 264.A OD2 no hydrogen 3.062 N/A ARG 266.A NH2.B ASP 264.A OD2 no hydrogen 2.572 N/A SER 268.A OG ASP 264.A OD1 no hydrogen 3.097 N/A ALA 269.A N ARG 266.A O.A no hydrogen 2.918 N/A ALA 269.A N ARG 266.A O.B no hydrogen 3.307 N/A SER 271.A OG SER 214.A OG no hydrogen 2.805 N/A SER 271.A OG PRO 255.A O no hydrogen 3.465 N/A THR 272.A OG1 ASN 210.A OD1 no hydrogen 3.041 N/A THR 272.A OG1 ASP 274.A OD2 no hydrogen 2.971 N/A GLN 275.A NE2 LEU 206.A O no hydrogen 2.980 N/A GLN 275.A NE2 LEU 276.A O no hydrogen 3.027 N/A LEU 276.A N ILE 208.A O no hydrogen 2.805 N/A TYR 277.A N SER 259.A OG no hydrogen 2.998 N/A GLY 280.A N ILE 303.A O no hydrogen 2.798 N/A CYS 281.A SG ALA 408.A O no hydrogen 3.358 N/A ILE 282.A N.A PHE 301.A O no hydrogen 2.795 N/A ILE 282.A N.B PHE 301.A O no hydrogen 2.814 N/A LEU 283.A N GLN 258.A O no hydrogen 2.945 N/A ALA 284.A N ARG 299.A O no hydrogen 2.916 N/A SER 285.A N ILE 256.A O no hydrogen 2.755 N/A SER 285.A OG THR 298.A OG1 no hydrogen 2.526 N/A CYS 286.A N.A ILE 297.A O no hydrogen 2.957 N/A CYS 286.A N.B ILE 297.A O no hydrogen 3.024 N/A CYS 286.A SG.B SER 189.A O no hydrogen 3.626 N/A ILE 288.A N SER 189.A OG no hydrogen 2.942 N/A ARG 289.A N ASP 250.A O.A no hydrogen 2.787 N/A ARG 289.A N ASP 250.A O.B no hydrogen 2.736 N/A ARG 289.A NE ASN 292.A O no hydrogen 2.807 N/A ARG 289.A NH2 LEU 365.A O no hydrogen 2.676 N/A TYR 290.A N SER 185.A OG.A no hydrogen 2.944 N/A TYR 290.A N TYR 293.A O no hydrogen 3.067 N/A ASN 291.A N LEU 248.A O no hydrogen 2.856 N/A ASN 292.A ND2 SER 56.A O no hydrogen 3.074 N/A TYR 293.A N TYR 290.A O no hydrogen 2.880 N/A TYR 293.A OH GLU 178.A OE2 no hydrogen 2.474 N/A CYS 294.A N GLY 364.A O no hydrogen 2.868 N/A CYS 294.A SG LEU 365.A O no hydrogen 3.644 N/A SER 295.A N.A ILE 288.A O no hydrogen 3.147 N/A SER 295.A N.B ILE 288.A O no hydrogen 3.143 N/A SER 295.A OG.A SER 185.A OG.B no hydrogen 3.158 N/A SER 295.A OG.A SER 189.A OG no hydrogen 2.715 N/A SER 295.A OG.A ILE 288.A O no hydrogen 2.975 N/A SER 295.A OG.B SER 186.A OG no hydrogen 2.913 N/A ASN 296.A N THR 414.A OG1 no hydrogen 2.941 N/A ASN 296.A ND2 ASN 390.A OD1 no hydrogen 2.816 N/A ILE 297.A N CYS 286.A O.A no hydrogen 2.860 N/A ILE 297.A N CYS 286.A O.B no hydrogen 3.038 N/A THR 298.A N ALA 412.A O no hydrogen 2.966 N/A THR 298.A OG1 SER 285.A OG no hydrogen 2.526 N/A ARG 299.A N ALA 284.A O no hydrogen 2.924 N/A ARG 299.A NE TYR 431.A O no hydrogen 3.241 N/A ARG 299.A NE THR 432.A O no hydrogen 2.961 N/A ARG 299.A NH1 THR 298.A O no hydrogen 2.938 N/A ARG 299.A NH1 ALA 412.A O no hydrogen 3.077 N/A ARG 299.A NH1 ASP 413.A OD1 no hydrogen 3.467 N/A ARG 299.A NH1 ASP 413.A OD2 no hydrogen 3.433 N/A ARG 299.A NH2 ASP 413.A OD1 no hydrogen 3.466 N/A ARG 299.A NH2 ASP 413.A OD2 no hydrogen 2.747 N/A ARG 299.A NH2 TYR 431.A O no hydrogen 2.841 N/A THR 300.A OG1 GLN 410.A O no hydrogen 2.795 N/A PHE 301.A N ILE 282.A O.A no hydrogen 2.787 N/A PHE 301.A N ILE 282.A O.B no hydrogen 2.816 N/A LEU 302.A N ILE 438.A O no hydrogen 2.951 N/A ILE 303.A N GLY 280.A O no hydrogen 2.681 N/A ASP 304.A N PHE 440.A O no hydrogen 2.957 N/A SER 306.A OG ASP 400.A OD1 no hydrogen 2.673 N/A ASN 310.A N GLU 307.A O no hydrogen 2.702 N/A ASN 311.A N GLU 308.A O no hydrogen 2.882 N/A TYR 312.A OH LYS 433.A O no hydrogen 2.524 N/A ASP 313.A N ALA 309.A O no hydrogen 2.973 N/A PHE 314.A N ASN 310.A O no hydrogen 3.169 N/A LEU 315.A N ASN 311.A O no hydrogen 2.933 N/A LEU 316.A N TYR 312.A O no hydrogen 3.059 N/A THR 317.A N ASP 313.A O no hydrogen 3.060 N/A THR 317.A OG1 ASP 313.A O no hydrogen 3.209 N/A LEU 318.A N PHE 314.A O no hydrogen 2.800 N/A GLN 319.A N LEU 315.A O no hydrogen 2.947 N/A GLN 319.A NE2 ASP 413.A OD1 no hydrogen 2.777 N/A LYS 320.A N LEU 316.A O no hydrogen 3.049 N/A GLU 321.A N THR 317.A O no hydrogen 3.000 N/A ILE 322.A N LEU 318.A O no hydrogen 2.862 N/A VAL 323.A N GLN 319.A O no hydrogen 3.007 N/A THR 324.A N LYS 320.A O no hydrogen 2.921 N/A THR 324.A OG1 LYS 320.A O no hydrogen 2.856 N/A ASN 325.A N GLU 321.A O no hydrogen 2.979 N/A ILE 326.A N ILE 322.A O no hydrogen 3.073 N/A LEU 327.A N ILE 322.A O no hydrogen 2.926 N/A LYS 328.A NZ THR 324.A O no hydrogen 2.815 N/A GLY 330.A N ILE 383.A O no hydrogen 2.724 N/A ARG 331.A N LYS 328.A O no hydrogen 3.349 N/A ARG 331.A NH1 SER 339.A OG no hydrogen 2.639 N/A ARG 331.A NH2 ILE 326.A O no hydrogen 3.012 N/A ARG 331.A NH2 SER 339.A OG no hydrogen 3.336 N/A THR 332.A N GLU 335.A OE2 no hydrogen 2.917 N/A LYS 334.A N ASN 378.A O no hydrogen 2.885 N/A GLU 335.A N THR 332.A OG1 no hydrogen 3.013 N/A VAL 336.A N THR 332.A O no hydrogen 3.007 N/A TYR 337.A N PRO 333.A O no hydrogen 2.841 N/A TYR 337.A OH THR 356.A O no hydrogen 2.682 N/A GLU 338.A N LYS 334.A O no hydrogen 2.902 N/A SER 339.A N GLU 335.A O no hydrogen 3.012 N/A SER 339.A OG GLU 335.A O no hydrogen 3.112 N/A VAL 340.A N VAL 336.A O no hydrogen 3.029 N/A ILE 341.A N TYR 337.A O no hydrogen 3.006 N/A GLU 342.A N GLU 338.A O no hydrogen 2.892 N/A TYR 343.A N SER 339.A O no hydrogen 3.050 N/A ILE 344.A N VAL 340.A O no hydrogen 3.028 N/A GLU 345.A N.A ILE 341.A O no hydrogen 2.818 N/A GLU 345.A N.B ILE 341.A O no hydrogen 2.828 N/A LYS 346.A N GLU 342.A O no hydrogen 3.150 N/A LYS 346.A N TYR 343.A O no hydrogen 3.224 N/A THR 347.A N TYR 343.A O no hydrogen 3.103 N/A THR 347.A N ILE 344.A O no hydrogen 3.153 N/A THR 347.A OG1 TYR 343.A O no hydrogen 2.874 N/A THR 347.A OG1 ILE 344.A O no hydrogen 3.380 N/A LYS 348.A N ILE 344.A O no hydrogen 2.696 N/A GLU 350.A N GLU 350.A OE2 no hydrogen 2.594 N/A LEU 351.A N LYS 348.A O no hydrogen 2.887 N/A VAL 352.A N PRO 349.A O no hydrogen 3.083 N/A ASN 354.A N LEU 351.A O no hydrogen 2.916 N/A ASN 354.A ND2 ASN 396.A O no hydrogen 2.832 N/A PHE 355.A N VAL 352.A O no hydrogen 3.108 N/A THR 356.A N GLY 394.A O no hydrogen 3.100 N/A THR 356.A OG1 ASN 358.A O no hydrogen 2.921 N/A ILE 359.A N LEU 374.A O no hydrogen 3.026 N/A GLY 360.A N ASN 358.A OD1 no hydrogen 2.794 N/A SER 361.A N ASN 390.A O no hydrogen 3.009 N/A SER 361.A OG LEU 362.A O no hydrogen 2.922 N/A LEU 362.A N PHE 372.A O no hydrogen 3.021 N/A ILE 363.A N CYS 388.A O no hydrogen 2.991 N/A GLY 364.A N GLU 366.A O no hydrogen 3.036 N/A ASP 369.A N LEU 362.A O no hydrogen 3.497 N/A ASN 371.A N ASP 369.A OD2 no hydrogen 2.877 N/A ASN 371.A ND2 TYR 380.A OH no hydrogen 3.180 N/A PHE 372.A N ASP 369.A O no hydrogen 2.834 N/A LEU 374.A N GLY 360.A O no hydrogen 2.782 N/A ASN 375.A N ILE 373.A O no hydrogen 2.981 N/A LYS 377.A N ASN 375.A OD1 no hydrogen 3.232 N/A ASN 378.A N ASN 375.A O no hydrogen 3.383 N/A ASN 378.A ND2 ASN 371.A O no hydrogen 2.919 N/A TYR 380.A N ASN 378.A OD1 no hydrogen 3.039 N/A ARG 381.A N ASN 378.A OD1 no hydrogen 3.195 N/A ARG 381.A NH1 SER 168.A OG no hydrogen 2.964 N/A ARG 381.A NH1 GLU 172.A OE2 no hydrogen 2.848 N/A ARG 381.A NH2 SER 168.A OG no hydrogen 2.872 N/A ARG 381.A NH2 ASN 371.A O no hydrogen 2.854 N/A ILE 383.A N ARG 331.A O no hydrogen 2.840 N/A GLN 384.A N ASP 387.A OD2 no hydrogen 2.915 N/A GLN 384.A NE2 GLU 172.A OE1 no hydrogen 3.191 N/A GLN 384.A NE2 GLU 172.A OE2 no hydrogen 3.432 N/A GLY 386.A N ILE 417.A O no hydrogen 2.823 N/A ASP 387.A N GLN 384.A O no hydrogen 2.988 N/A CYS 388.A SG VAL 415.A O no hydrogen 3.572 N/A PHE 389.A N VAL 415.A O no hydrogen 2.772 N/A ASN 390.A N SER 361.A O no hydrogen 2.812 N/A ILE 391.A N ASP 413.A O no hydrogen 2.901 N/A SER 392.A N ILE 359.A O no hydrogen 2.834 N/A PHE 393.A N LEU 411.A O no hydrogen 3.184 N/A GLY 394.A N THR 356.A OG1 no hydrogen 3.321 N/A PHE 395.A N LEU 409.A O no hydrogen 2.973 N/A ASN 396.A N ASN 354.A O no hydrogen 2.972 N/A ASN 396.A ND2 PHE 263.A O no hydrogen 2.962 N/A ASN 397.A N ASN 396.A OD1 no hydrogen 2.836 N/A LEU 398.A N TYR 407.A O no hydrogen 2.975 N/A ASP 400.A N ASN 405.A O no hydrogen 2.847 N/A SER 401.A N GLU 308.A OE1 no hydrogen 3.009 N/A SER 401.A OG GLU 308.A OE2 no hydrogen 2.597 N/A SER 403.A N ASP 400.A OD2 no hydrogen 3.151 N/A SER 403.A OG ASP 400.A OD2 no hydrogen 2.733 N/A ALA 404.A N ASP 400.A O no hydrogen 2.687 N/A ASN 405.A N SER 403.A OG no hydrogen 3.017 N/A TYR 407.A N LEU 398.A O no hydrogen 2.768 N/A TYR 407.A OH ASN 311.A OD1 no hydrogen 3.039 N/A LEU 409.A N PHE 395.A O no hydrogen 2.919 N/A GLN 410.A N THR 300.A OG1 no hydrogen 2.920 N/A LEU 411.A N PHE 393.A O no hydrogen 3.047 N/A ALA 412.A N THR 298.A O no hydrogen 3.082 N/A ASP 413.A N ILE 391.A O no hydrogen 3.067 N/A THR 414.A N THR 429.A OG1 no hydrogen 2.926 N/A THR 414.A OG1 ASN 296.A O no hydrogen 2.816 N/A VAL 415.A N PHE 389.A O no hydrogen 2.794 N/A GLN 416.A N ARG 426.A O no hydrogen 2.876 N/A GLN 416.A NE2 GLY 386.A O no hydrogen 2.944 N/A GLN 416.A NE2 ILE 417.A O no hydrogen 3.030 N/A ILE 417.A N ASP 387.A O no hydrogen 2.817 N/A THR 422.A N ASP 420.A OD2 no hydrogen 2.656 N/A THR 422.A OG1 ASP 420.A OD2 no hydrogen 2.470 N/A GLU 423.A N ASP 420.A O no hydrogen 3.296 N/A ARG 426.A N GLN 416.A O no hydrogen 2.880 N/A ARG 426.A NH1 GLN 179.A OE1 no hydrogen 3.020 N/A LEU 428.A N THR 414.A O no hydrogen 2.813 N/A THR 429.A OG1 ASP 413.A OD2 no hydrogen 2.569 N/A ASN 430.A N ASP 190.A OD1 no hydrogen 3.064 N/A ASN 430.A N ASP 190.A OD2 no hydrogen 2.793 N/A ASN 430.A ND2 PHE 427.A O no hydrogen 3.078 N/A TYR 431.A N ASP 190.A OD1 no hydrogen 3.111 N/A THR 432.A OG1 GLN 437.A OE1.A no hydrogen 2.927 N/A LYS 433.A NZ GLN 319.A OE1 no hydrogen 2.751 N/A LYS 433.A NZ ASP 413.A OD1 no hydrogen 3.323 N/A ALA 434.A N THR 432.A OG1 no hydrogen 3.152 N/A LYS 435.A NZ ASP 313.A OD1 no hydrogen 3.177 N/A LYS 435.A NZ ASP 313.A OD2 no hydrogen 2.887 N/A GLN 437.A N.A ALA 434.A O no hydrogen 2.853 N/A GLN 437.A N.B ALA 434.A O no hydrogen 2.829 N/A GLN 437.A NE2.B SER 436.A OG no hydrogen 2.849 N/A ILE 438.A N ALA 434.A O no hydrogen 3.132 N/A ILE 438.A N LYS 435.A O no hydrogen 3.283 N/A SER 439.A OG LYS 435.A O no hydrogen 2.747 N/A PHE 440.A N LEU 302.A O no hydrogen 2.863 N/A PHE 442.A N ASP 304.A OD1 no hydrogen 3.180 N/A