Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3iii_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LEU 3.A N GLN 1.A OE1 no hydrogen 3.020 N/A LEU 4.A N GLN 1.A O no hydrogen 3.017 N/A GLY 5.A N HIS 2.A O no hydrogen 2.948 N/A ASN 6.A N ASN 33.A O no hydrogen 2.936 N/A LYS 8.A N ASN 6.A OD1 no hydrogen 2.968 N/A LEU 9.A N ASN 6.A O no hydrogen 3.151 N/A THR 12.A N VAL 25.A O no hydrogen 2.833 N/A THR 12.A OG1 VAL 25.A O no hydrogen 3.531 N/A GLU 16.A N HIS 13.A O no hydrogen 2.988 N/A VAL 17.A N VAL 14.A O no hydrogen 3.414 N/A GLY 20.A N LYS 38.A O no hydrogen 2.829 N/A ASN 22.A ND2 LYS 18.A O no hydrogen 2.844 N/A VAL 25.A N THR 12.A OG1 no hydrogen 2.788 N/A SER 28.A N GLY 32.A O no hydrogen 3.035 N/A SER 28.A OG GLN 30.A OE1 no hydrogen 3.372 N/A SER 28.A OG GLY 102.A O no hydrogen 2.603 N/A GLN 30.A N SER 28.A OG no hydrogen 3.262 N/A TYR 31.A N SER 28.A OG no hydrogen 2.989 N/A TYR 31.A OH ASN 107.A OD1 no hydrogen 2.923 N/A ASN 33.A ND2 ASN 6.A O no hydrogen 3.527 N/A GLN 34.A N VAL 26.A O no hydrogen 2.985 N/A GLN 34.A NE2 HIS 2.A O no hydrogen 2.937 N/A GLN 34.A NE2 TYR 31.A O no hydrogen 2.789 N/A LYS 38.A N GLY 20.A O no hydrogen 2.776 N/A LYS 38.A NZ VAL 17.A O no hydrogen 3.076 N/A ASP 39.A N ASN 52.A OD1 no hydrogen 3.325 N/A VAL 42.A N LEU 49.A O no hydrogen 2.823 N/A ARG 44.A NE GLU 139.A OE2 no hydrogen 3.124 N/A ARG 44.A NH2 GLU 135.A OE1 no hydrogen 3.141 N/A GLU 47.A N ASP 45.A OD1 no hydrogen 2.898 N/A LEU 49.A N VAL 42.A O no hydrogen 2.898 N/A ILE 51.A N GLY 40.A O no hydrogen 2.845 N/A ASN 52.A N LYS 113.A O no hydrogen 2.937 N/A ASN 52.A ND2 ASP 73.A OD1 no hydrogen 2.835 N/A ILE 53.A N GLU 37.A O no hydrogen 2.912 N/A PHE 54.A N VAL 111.A O no hydrogen 2.760 N/A ARG 55.A N ILE 36.A O no hydrogen 2.913 N/A ARG 55.A NE GLU 37.A OE2 no hydrogen 2.827 N/A ARG 55.A NH2 GLU 37.A OE2 no hydrogen 3.060 N/A ASN 57.A ND2 GLU 35.A OE2.B no hydrogen 2.983 N/A LYS 58.A NZ ASP 108.A OD1 no hydrogen 2.850 N/A LYS 61.A NZ SER 148.A O no hydrogen 3.554 N/A LYS 61.A NZ SER 150.A O no hydrogen 3.115 N/A PHE 62.A N TRP 149.A O no hydrogen 2.820 N/A VAL 64.A N ASN 153.A O no hydrogen 3.045 N/A VAL 65.A N VAL 110.A O no hydrogen 2.811 N/A ASP 68.A N VAL 114.A O no hydrogen 3.370 N/A THR 69.A OG1 TYR 161.A OH no hydrogen 2.944 N/A TYR 70.A N ASP 68.A OD1 no hydrogen 2.863 N/A LYS 72.A NZ ASP 39.A OD1 no hydrogen 2.726 N/A LYS 72.A NZ ASN 52.A OD1 no hydrogen 2.764 N/A LYS 72.A NZ ASP 73.A OD1 no hydrogen 3.423 N/A LYS 72.A NZ ASP 73.A OD2 no hydrogen 2.648 N/A ASN 74.A ND2 TYR 70.A O no hydrogen 2.795 N/A LYS 77.A N GLU 96.A OE2 no hydrogen 2.865 N/A ALA 80.A N ASN 78.A O no hydrogen 3.125 N/A LEU 81.A N ASN 78.A O no hydrogen 3.037 N/A TRP 82.A NE1 SER 510.A OG no hydrogen 2.973 N/A THR 84.A OG1 HIS 433.A O no hydrogen 2.599 N/A LEU 85.A N TRP 82.A O no hydrogen 3.420 N/A THR 87.A N GLU 290.A OE1 no hydrogen 2.771 N/A THR 90.A OG1 SER 91.A O no hydrogen 3.030 N/A SER 91.A N ASP 100.A OD2 no hydrogen 2.884 N/A SER 91.A OG THR 94.A OG1 no hydrogen 3.069 N/A SER 91.A OG ASP 100.A OD1 no hydrogen 2.496 N/A SER 92.A N ASP 27.A OD1 no hydrogen 3.014 N/A SER 92.A N ASP 27.A OD2 no hydrogen 3.193 N/A SER 92.A OG ASP 27.A OD1 no hydrogen 2.732 N/A SER 92.A OG ASP 27.A OD2 no hydrogen 3.440 N/A PHE 93.A N SER 91.A OG no hydrogen 3.265 N/A THR 94.A OG1 SER 91.A O no hydrogen 3.390 N/A THR 94.A OG1 SER 91.A OG no hydrogen 3.069 N/A GLU 96.A N GLU 96.A OE1 no hydrogen 2.882 N/A SER 98.A N PRO 95.A O no hydrogen 2.995 N/A SER 98.A OG PRO 95.A O no hydrogen 2.765 N/A GLY 102.A N ASP 100.A OD1 no hydrogen 2.797 N/A PHE 103.A N ASP 100.A O no hydrogen 2.953 N/A TRP 104.A N ASP 100.A O no hydrogen 3.112 N/A VAL 105.A N PRO 101.A O no hydrogen 2.966 N/A ASN 107.A N TRP 104.A O no hydrogen 2.994 N/A ASP 108.A N VAL 105.A O no hydrogen 2.926 N/A TYR 109.A N TRP 104.A O no hydrogen 3.344 N/A TYR 109.A OH ASP 306.A OD1 no hydrogen 2.530 N/A VAL 110.A N PRO 63.A O no hydrogen 2.810 N/A VAL 111.A N PHE 54.A O no hydrogen 2.831 N/A VAL 112.A N VAL 65.A O no hydrogen 2.844 N/A LYS 113.A N ASN 52.A O no hydrogen 2.819 N/A LYS 113.A NZ SER 66.A OG no hydrogen 2.825 N/A LYS 113.A NZ ASP 68.A OD2 no hydrogen 2.629 N/A LYS 113.A NZ SER 98.A OG no hydrogen 2.806 N/A VAL 114.A N SER 66.A O no hydrogen 2.894 N/A ALA 115.A N TYR 50.A O no hydrogen 2.912 N/A LEU 116.A N ASP 68.A O no hydrogen 2.960 N/A ARG 117.A NE ASP 136.A OD2 no hydrogen 2.812 N/A ARG 117.A NH1 ASP 45.A OD2 no hydrogen 2.862 N/A ARG 117.A NH2 ASP 45.A OD1 no hydrogen 3.368 N/A ARG 117.A NH2 ASP 45.A OD2 no hydrogen 3.417 N/A ARG 117.A NH2 ASP 136.A OD1 no hydrogen 2.984 N/A GLY 118.A N SER 122.A OG no hydrogen 2.975 N/A SER 119.A N LEU 116.A O no hydrogen 3.053 N/A SER 119.A OG LEU 116.A O no hydrogen 2.581 N/A LYS 121.A NZ ASP 39.A OD1 no hydrogen 2.881 N/A LYS 121.A NZ ASP 120.A OD1 no hydrogen 3.568 N/A LYS 121.A NZ ASP 120.A OD2 no hydrogen 2.556 N/A SER 122.A N SER 119.A O no hydrogen 3.196 N/A SER 122.A OG GLU 47.A OE2 no hydrogen 2.538 N/A LYS 123.A NZ ASP 120.A O no hydrogen 3.005 N/A LYS 123.A NZ ASP 216.A OD1 no hydrogen 2.800 N/A LYS 123.A NZ ASP 216.A OD2 no hydrogen 3.549 N/A GLY 124.A N SER 122.A OG no hydrogen 3.285 N/A LEU 126.A N ASN 219.A O no hydrogen 3.087 N/A SER 127.A OG GLU 221.A OE1 no hydrogen 2.651 N/A TRP 129.A N GLU 133.A OE2 no hydrogen 2.811 N/A SER 130.A OG SER 127.A O no hydrogen 2.658 N/A GLU 133.A N SER 130.A OG no hydrogen 3.176 N/A ALA 134.A N SER 130.A O no hydrogen 3.028 N/A GLU 135.A N LYS 131.A O no hydrogen 2.804 N/A ASP 136.A N ARG 132.A O no hydrogen 3.344 N/A TYR 137.A N GLU 133.A O no hydrogen 3.122 N/A TYR 138.A N ALA 134.A O no hydrogen 2.880 N/A GLU 139.A N GLU 135.A O no hydrogen 3.151 N/A VAL 140.A N ASP 136.A O no hydrogen 3.219 N/A ILE 141.A N TYR 137.A O no hydrogen 2.968 N/A GLU 142.A N TYR 138.A O no hydrogen 3.062 N/A TRP 143.A N GLU 139.A O no hydrogen 2.895 N/A ALA 144.A N VAL 140.A O no hydrogen 2.950 N/A ALA 145.A N ILE 141.A O no hydrogen 3.152 N/A ASN 146.A N TRP 143.A O no hydrogen 3.035 N/A GLN 147.A N ALA 144.A O no hydrogen 3.277 N/A GLN 147.A NE2 TRP 143.A O no hydrogen 2.834 N/A SER 150.A N GLN 147.A O no hydrogen 2.947 N/A SER 150.A OG ALA 144.A O no hydrogen 3.150 N/A ASN 151.A N PHE 62.A O no hydrogen 2.862 N/A ASN 151.A ND2 LEU 309.A O no hydrogen 3.081 N/A GLY 152.A N SER 150.A OG no hydrogen 2.988 N/A ASN 153.A N ASN 151.A OD1 no hydrogen 2.911 N/A ASN 153.A ND2 LEU 309.A O no hydrogen 2.910 N/A ASN 153.A ND2 GLU 311.A OE2 no hydrogen 2.912 N/A ILE 154.A N HIS 176.A O no hydrogen 2.968 N/A GLY 155.A N VAL 64.A O no hydrogen 2.876 N/A THR 156.A N ALA 179.A O no hydrogen 3.149 N/A THR 156.A OG1 GLN 166.A OE1 no hydrogen 2.751 N/A ASN 157.A ND2 GLN 301.A OE1 no hydrogen 2.967 N/A GLY 158.A N ILE 180.A O no hydrogen 3.375 N/A VAL 159.A N GLU 97.A O no hydrogen 3.095 N/A SER 160.A N GLU 183.A O no hydrogen 2.907 N/A SER 160.A OG HIS 263.A NE2 no hydrogen 2.848 N/A TYR 161.A OH GLU 133.A OE1 no hydrogen 2.607 N/A LEU 162.A N VAL 159.A O no hydrogen 3.070 N/A ALA 163.A N SER 160.A O no hydrogen 2.798 N/A VAL 164.A N SER 160.A O no hydrogen 2.896 N/A THR 165.A N TYR 161.A O no hydrogen 3.045 N/A THR 165.A OG1 ALA 67.A O no hydrogen 3.041 N/A THR 165.A OG1 TYR 161.A O no hydrogen 3.122 N/A GLN 166.A N ALA 163.A O no hydrogen 2.953 N/A GLN 166.A NE2 LEU 162.A O no hydrogen 2.911 N/A GLN 166.A NE2 ILE 180.A O no hydrogen 2.861 N/A TRP 167.A N ALA 163.A O no hydrogen 3.175 N/A TRP 167.A NE1 GLY 184.A O no hydrogen 2.799 N/A TRP 168.A N VAL 164.A O no hydrogen 3.069 N/A VAL 169.A N THR 165.A O no hydrogen 2.947 N/A ALA 170.A N GLN 166.A O no hydrogen 2.970 N/A SER 171.A N TRP 167.A O no hydrogen 3.235 N/A SER 171.A N TRP 168.A O no hydrogen 3.079 N/A SER 171.A OG TRP 168.A O no hydrogen 2.664 N/A LEU 172.A N VAL 169.A O no hydrogen 2.965 N/A ASN 173.A N.A ALA 170.A O no hydrogen 3.019 N/A ASN 173.A N.B ALA 170.A O no hydrogen 3.000 N/A ASN 173.A ND2.A GLN 246.A O no hydrogen 2.849 N/A HIS 176.A N GLU 142.A OE2 no hydrogen 2.935 N/A HIS 176.A ND1 GLU 142.A OE1 no hydrogen 2.569 N/A LEU 177.A N PRO 174.A O no hydrogen 3.113 N/A LYS 178.A N ILE 154.A O no hydrogen 2.772 N/A LYS 178.A NZ ASN 153.A OD1 no hydrogen 3.100 N/A ILE 180.A N GLN 166.A OE1 no hydrogen 3.103 N/A TRP 182.A N GLY 158.A O no hydrogen 3.063 N/A GLU 183.A N CYS 254.A O no hydrogen 2.951 N/A GLY 184.A N SER 267.A OG no hydrogen 3.238 N/A LEU 185.A N HIS 263.A ND1 no hydrogen 3.076 N/A ASN 186.A N GLU 190.A OE1 no hydrogen 3.009 N/A ASN 186.A ND2 GLY 266.A O no hydrogen 2.753 N/A ASP 187.A N GLU 190.A OE1 no hydrogen 3.073 N/A TYR 188.A OH PRO 231.A O no hydrogen 2.678 N/A ARG 189.A N ASP 187.A O no hydrogen 3.212 N/A ARG 189.A NH1 ASP 187.A OD2 no hydrogen 2.828 N/A ARG 189.A NH2 HIS 463.A O no hydrogen 2.925 N/A HIS 194.A N ILE 197.A O no hydrogen 2.790 N/A HIS 194.A ND1 HIS 519.A NE2 no hydrogen 2.719 N/A HIS 194.A NE2 GLY 261.A O no hydrogen 2.921 N/A ILE 197.A N HIS 194.A O no hydrogen 2.861 N/A ASP 199.A N ALA 192.A O no hydrogen 3.032 N/A THR 200.A N GLU 518.A O no hydrogen 2.792 N/A GLY 201.A N ASP 199.A OD1 no hydrogen 2.696 N/A PHE 202.A N ARG 516.A O no hydrogen 2.911 N/A TYR 203.A N ASP 199.A OD2 no hydrogen 2.846 N/A TYR 203.A OH LEU 223.A O no hydrogen 2.725 N/A ARG 204.A NE GLN 227.A OE1 no hydrogen 2.909 N/A ARG 204.A NH1 GLU 521.A OE2 no hydrogen 2.913 N/A ARG 204.A NH2 GLN 227.A OE1 no hydrogen 3.017 N/A ARG 204.A NH2 GLU 521.A OE1 no hydrogen 2.946 N/A ARG 204.A NH2 GLU 521.A OE2 no hydrogen 3.472 N/A PHE 205.A N GLY 201.A O no hydrogen 2.964 N/A TRP 206.A N PHE 202.A O no hydrogen 2.711 N/A TRP 206.A NE1 TYR 70.A OH no hydrogen 3.020 N/A THR 207.A N TYR 203.A O no hydrogen 2.958 N/A THR 207.A OG1 TYR 203.A O no hydrogen 2.828 N/A GLN 208.A N ARG 204.A O no hydrogen 2.900 N/A GLY 209.A N PHE 205.A O no hydrogen 2.864 N/A ILE 210.A N TRP 206.A O no hydrogen 3.176 N/A PHE 211.A N THR 207.A O no hydrogen 3.226 N/A ALA 212.A N GLN 208.A O no hydrogen 2.807 N/A ARG 213.A N GLY 209.A O no hydrogen 2.995 N/A ARG 213.A N ILE 210.A O no hydrogen 3.049 N/A ARG 213.A NE TYR 70.A O no hydrogen 3.057 N/A ARG 213.A NH1 ARG 213.A O no hydrogen 3.023 N/A ARG 213.A NH2 ASN 74.A OD1 no hydrogen 3.058 N/A TRP 214.A NE1 THR 69.A O no hydrogen 2.789 N/A ASN 217.A N TRP 214.A O no hydrogen 3.010 N/A ASN 217.A ND2 GLY 118.A O no hydrogen 2.965 N/A ASN 217.A ND2 GLY 124.A O no hydrogen 2.881 N/A ASN 219.A N ASN 217.A OD1 no hydrogen 2.677 N/A GLU 221.A N LEU 126.A O no hydrogen 2.947 N/A GLN 225.A N ASP 222.A OD1 no hydrogen 2.936 N/A GLN 225.A NE2 GLU 229.A OE2 no hydrogen 2.727 N/A ALA 226.A N ASP 222.A O no hydrogen 3.079 N/A GLN 227.A N LEU 223.A O no hydrogen 3.199 N/A GLN 227.A NE2 ALA 192.A O no hydrogen 2.835 N/A GLN 227.A NE2 ASP 199.A O no hydrogen 2.836 N/A GLN 228.A N ILE 224.A O no hydrogen 3.156 N/A GLU 229.A N GLN 225.A O no hydrogen 2.929 N/A HIS 230.A N ALA 226.A O no hydrogen 2.906 N/A HIS 230.A ND1 ASP 234.A OD2 no hydrogen 2.547 N/A PHE 233.A N HIS 465.A O no hydrogen 2.816 N/A TRP 237.A N ASP 234.A OD1 no hydrogen 3.262 N/A TRP 237.A NE1 HIS 230.A O no hydrogen 2.794 N/A LYS 238.A N ASP 234.A O no hydrogen 2.909 N/A GLN 239.A N ASP 235.A O no hydrogen 3.358 N/A GLN 239.A NE2 ASP 235.A O no hydrogen 3.282 N/A ARG 240.A N TRP 237.A O no hydrogen 2.855 N/A ARG 240.A NE PRO 128.A O no hydrogen 3.289 N/A ARG 240.A NE TRP 129.A O no hydrogen 3.061 N/A ARG 240.A NH1 GLU 221.A OE1 no hydrogen 3.348 N/A ARG 240.A NH1 GLU 221.A OE2 no hydrogen 2.919 N/A ARG 240.A NH2 PRO 128.A O no hydrogen 2.703 N/A ARG 240.A NH2 GLU 221.A OE1 no hydrogen 2.699 N/A GLN 241.A N LYS 238.A O no hydrogen 3.371 N/A GLN 241.A NE2 ASP 187.A OD2 no hydrogen 2.923 N/A VAL 242.A N ASN 186.A O no hydrogen 2.836 N/A GLN 246.A N PRO 243.A O no hydrogen 3.109 N/A ILE 247.A N LEU 244.A O no hydrogen 2.951 N/A LEU 251.A N GLU 278.A O no hydrogen 2.981 N/A THR 253.A N TRP 280.A O no hydrogen 2.871 N/A CYS 254.A N PRO 181.A O no hydrogen 3.271 N/A CYS 254.A SG ALA 255.A O no hydrogen 3.570 N/A CYS 254.A SG TYR 282.A O no hydrogen 3.631 N/A ALA 255.A N TYR 282.A O no hydrogen 3.061 N/A SER 256.A OG SER 258.A OG no hydrogen 3.204 N/A SER 256.A OG HIS 284.A O no hydrogen 2.856 N/A TRP 257.A N HIS 284.A O no hydrogen 2.967 N/A TRP 257.A NE1 GLU 325.A O no hydrogen 2.794 N/A SER 258.A N SER 256.A OG no hydrogen 3.123 N/A SER 258.A OG SER 256.A OG no hydrogen 3.204 N/A SER 258.A OG ARG 286.A O no hydrogen 2.714 N/A THR 259.A OG1.A GLU 183.A OE2 no hydrogen 2.809 N/A THR 259.A OG1.A SER 256.A O no hydrogen 3.316 N/A THR 259.A OG1.B GLU 183.A OE2 no hydrogen 2.685 N/A GLN 260.A NE2 TRP 257.A O no hydrogen 3.041 N/A GLN 260.A NE2 VAL 439.A O no hydrogen 3.061 N/A LEU 262.A N THR 259.A O.A no hydrogen 3.018 N/A LEU 262.A N THR 259.A O.B no hydrogen 3.111 N/A LEU 262.A N THR 259.A O.C no hydrogen 3.074 N/A HIS 263.A NE2 SER 160.A OG no hydrogen 2.848 N/A ASN 264.A N THR 259.A O.A no hydrogen 3.268 N/A ASN 264.A N THR 259.A O.B no hydrogen 3.208 N/A ASN 264.A N THR 259.A O.C no hydrogen 3.220 N/A ASN 264.A ND2 SER 256.A O no hydrogen 3.025 N/A ASN 264.A ND2 PRO 485.A O no hydrogen 2.960 N/A ARG 265.A NE GLU 482.A OE1 no hydrogen 3.289 N/A ARG 265.A NE GLU 482.A OE2 no hydrogen 2.748 N/A ARG 265.A NH1 GLU 190.A OE2 no hydrogen 2.725 N/A SER 267.A N HIS 263.A O no hydrogen 2.922 N/A SER 267.A OG HIS 263.A O no hydrogen 2.674 N/A PHE 268.A N ASN 264.A O no hydrogen 3.269 N/A GLU 269.A N ARG 265.A O no hydrogen 2.967 N/A GLY 270.A N GLY 266.A O no hydrogen 2.839 N/A PHE 271.A N SER 267.A O no hydrogen 3.199 N/A LYS 272.A N PHE 268.A O no hydrogen 2.870 N/A LYS 272.A NZ GLU 269.A OE2 no hydrogen 2.709 N/A GLN 273.A N GLU 269.A O no hydrogen 2.840 N/A GLN 273.A NE2 GLU 269.A OE1 no hydrogen 2.843 N/A ALA 274.A N GLY 270.A O no hydrogen 3.044 N/A SER 276.A OG ILE 247.A O no hydrogen 3.464 N/A SER 276.A OG THR 249.A O no hydrogen 2.708 N/A LYS 279.A NZ PHE 271.A O no hydrogen 2.669 N/A LYS 279.A NZ ALA 274.A O no hydrogen 2.913 N/A TRP 280.A N LEU 251.A O no hydrogen 2.787 N/A TRP 280.A NE1 THR 319.A O no hydrogen 2.927 N/A LEU 281.A N HIS 321.A O no hydrogen 2.796 N/A TYR 282.A N THR 253.A O no hydrogen 2.841 N/A VAL 283.A N ILE 323.A O no hydrogen 2.726 N/A HIS 284.A N ALA 255.A O no hydrogen 3.336 N/A GLY 285.A N GLU 325.A OE1 no hydrogen 2.794 N/A ARG 286.A N HIS 284.A ND1 no hydrogen 2.955 N/A ARG 286.A NE GLU 325.A OE1 no hydrogen 3.062 N/A ARG 286.A NE GLU 325.A OE2 no hydrogen 3.213 N/A ARG 286.A NH2 GLU 325.A OE2 no hydrogen 2.803 N/A LYS 287.A N TYR 331.A OH no hydrogen 3.062 N/A LYS 287.A NZ THR 84.A O no hydrogen 2.553 N/A LYS 287.A NZ GLU 435.A OE2 no hydrogen 2.737 N/A SER 291.A N LYS 287.A O no hydrogen 3.063 N/A SER 291.A OG LYS 287.A O no hydrogen 2.719 N/A TYR 292.A N GLU 288.A O no hydrogen 3.240 N/A TYR 292.A OH ASN 157.A OD1 no hydrogen 2.745 N/A TYR 293.A N TRP 289.A O no hydrogen 3.169 N/A TYR 293.A OH SER 98.A O no hydrogen 2.660 N/A ALA 294.A N SER 291.A O no hydrogen 3.367 N/A ARG 295.A NE GLU 299.A OE2 no hydrogen 2.898 N/A ASN 297.A N ALA 294.A O no hydrogen 2.903 N/A ASN 297.A ND2 SER 291.A O no hydrogen 2.858 N/A LEU 298.A N ALA 294.A O no hydrogen 2.959 N/A GLU 299.A N ARG 295.A O no hydrogen 2.931 N/A ARG 300.A N GLU 296.A O no hydrogen 3.101 N/A ARG 300.A NE ASN 297.A OD1 no hydrogen 3.018 N/A ARG 300.A NH2 ASN 297.A OD1 no hydrogen 2.783 N/A GLN 301.A N ASN 297.A O no hydrogen 2.911 N/A GLN 301.A NE2 TYR 292.A O no hydrogen 3.088 N/A GLN 301.A NE2 ASN 297.A O no hydrogen 3.364 N/A LYS 302.A N LEU 298.A O no hydrogen 2.945 N/A LYS 302.A NZ ASP 306.A OD2 no hydrogen 2.972 N/A SER 303.A N GLU 299.A O no hydrogen 2.895 N/A PHE 304.A N ARG 300.A O no hydrogen 3.091 N/A PHE 305.A N GLN 301.A O no hydrogen 2.958 N/A ASP 306.A N LYS 302.A O no hydrogen 2.737 N/A PHE 307.A N SER 303.A O no hydrogen 3.096 N/A TYR 308.A N PHE 304.A O no hydrogen 2.985 N/A TYR 308.A OH GLU 278.A OE2 no hydrogen 2.810 N/A LEU 309.A N PHE 305.A O no hydrogen 2.676 N/A LYS 310.A N PHE 305.A O no hydrogen 3.260 N/A LYS 310.A NZ ASN 107.A O no hydrogen 2.634 N/A GLU 312.A N ASP 306.A O no hydrogen 3.022 N/A ASN 314.A ND2 SER 303.A O no hydrogen 2.983 N/A TRP 316.A N ASN 314.A OD1 no hydrogen 2.983 N/A LYS 317.A NZ GLU 278.A OE2 no hydrogen 2.876 N/A ASP 318.A N ASP 315.A O no hydrogen 2.946 N/A THR 319.A N TRP 316.A O no hydrogen 2.916 N/A THR 319.A OG1 TRP 316.A O no hydrogen 2.613 N/A HIS 321.A ND1 LYS 279.A O no hydrogen 2.784 N/A VAL 322.A N ALA 338.A O no hydrogen 2.950 N/A ILE 323.A N LEU 281.A O no hydrogen 2.922 N/A TYR 324.A N LYS 336.A O no hydrogen 2.920 N/A GLU 325.A N VAL 283.A O no hydrogen 2.898 N/A VAL 326.A N GLU 334.A O no hydrogen 2.763 N/A ARG 327.A N GLY 487.A O no hydrogen 2.967 N/A ARG 327.A NE GLY 487.A O no hydrogen 2.951 N/A ARG 327.A NH2 VAL 439.A O no hydrogen 2.946 N/A ARG 327.A NH2 THR 488.A OG1 no hydrogen 2.891 N/A ASP 328.A N LYS 332.A O no hydrogen 2.860 N/A GLN 329.A N LYS 332.A O no hydrogen 3.104 N/A TYR 331.A OH GLU 290.A OE2 no hydrogen 2.502 N/A LYS 332.A N GLN 329.A O no hydrogen 2.990 N/A LYS 332.A NZ ASP 328.A OD2 no hydrogen 2.831 N/A GLU 334.A N VAL 326.A O no hydrogen 3.144 N/A LYS 336.A N TYR 324.A O no hydrogen 2.852 N/A LYS 336.A NZ GLU 393.A OE1 no hydrogen 2.640 N/A LYS 336.A NZ GLU 393.A OE2 no hydrogen 2.792 N/A ALA 338.A N VAL 322.A O no hydrogen 2.863 N/A ASN 345.A ND2 ASN 544.A OD1 no hydrogen 3.609 N/A ALA 346.A N LEU 343.A O no hydrogen 3.059 N/A GLU 347.A N ILE 542.A O no hydrogen 2.735 N/A THR 349.A N ILE 540.A O no hydrogen 2.940 N/A THR 349.A OG1 GLU 347.A O no hydrogen 2.895 N/A LEU 351.A N LEU 538.A O no hydrogen 2.847 N/A TYR 352.A N ASN 361.A O no hydrogen 2.795 N/A LEU 353.A N SER 536.A O no hydrogen 3.070 N/A ASN 354.A N THR 359.A O no hydrogen 2.915 N/A ALA 355.A N THR 530.A OG1 no hydrogen 2.850 N/A GLU 356.A N ASN 354.A OD1 no hydrogen 3.092 N/A HIS 358.A N.B ASN 354.A O no hydrogen 3.166 N/A THR 359.A OG1 ASN 357.A OD1 no hydrogen 2.499 N/A LEU 360.A N LYS 385.A O no hydrogen 2.937 N/A ASN 361.A ND2 TYR 352.A O no hydrogen 2.967 N/A ASN 361.A ND2 THR 359.A OG1 no hydrogen 2.980 N/A HIS 369.A N THR 530.A O no hydrogen 2.783 N/A HIS 369.A ND1 SER 367.A O no hydrogen 2.917 N/A ALA 371.A N ILE 528.A O no hydrogen 2.831 N/A TYR 373.A N HIS 527.A O no hydrogen 3.056 N/A TYR 373.A OH HIS 527.A ND1 no hydrogen 2.856 N/A ASP 374.A N GLN 380.A OE1 no hydrogen 2.847 N/A SER 375.A N GLY 526.A O no hydrogen 2.974 N/A SER 375.A OG GLY 526.A O no hydrogen 2.646 N/A GLU 376.A N ASP 374.A OD1 no hydrogen 2.828 N/A ASP 377.A N ASP 374.A O no hydrogen 3.197 N/A GLN 379.A N ASP 377.A OD1 no hydrogen 2.830 N/A GLN 380.A N ASP 377.A O no hydrogen 2.981 N/A GLN 380.A NE2 ASP 377.A OD2 no hydrogen 3.385 N/A VAL 382.A N VAL 500.A O no hydrogen 2.902 N/A SER 383.A OG GLU 497.A OE2 no hydrogen 3.040 N/A PHE 384.A N VAL 498.A O no hydrogen 2.917 N/A LYS 385.A N HIS 358.A O.A no hydrogen 3.040 N/A LYS 385.A N HIS 358.A O.B no hydrogen 3.102 N/A TYR 386.A N LEU 496.A O no hydrogen 2.935 N/A TYR 386.A OH HIS 362.A NE2.B no hydrogen 2.758 N/A THR 387.A OG1 THR 495.A OG1 no hydrogen 2.859 N/A PHE 388.A N GLU 494.A O no hydrogen 2.899 N/A THR 392.A N PHE 490.A O no hydrogen 2.787 N/A THR 392.A OG1 LYS 390.A O no hydrogen 2.967 N/A LEU 394.A N THR 488.A O no hydrogen 2.953 N/A VAL 395.A N PRO 541.A O no hydrogen 3.078 N/A GLY 396.A N SER 486.A O no hydrogen 2.955 N/A ASN 398.A ND2 ILE 458.A O no hydrogen 3.098 N/A ASN 398.A ND2 GLU 480.A OE1 no hydrogen 2.908 N/A LEU 399.A N ILE 481.A O no hydrogen 2.998 N/A LYS 400.A N GLN 537.A O no hydrogen 2.784 N/A LYS 400.A NZ ASP 535.A OD1 no hydrogen 2.851 N/A LYS 400.A NZ ASP 535.A OD2 no hydrogen 3.444 N/A LEU 401.A N VAL 479.A O no hydrogen 2.837 N/A TRP 402.A N SER 536.A OG no hydrogen 3.177 N/A TRP 402.A NE1 ASP 535.A OD1 no hydrogen 2.926 N/A VAL 403.A N VAL 477.A O no hydrogen 2.873 N/A SER 404.A OG TYR 529.A OH no hydrogen 2.698 N/A SER 408.A OG ASP 410.A O no hydrogen 3.328 N/A SER 408.A OG VAL 523.A O no hydrogen 2.713 N/A ASP 411.A N ASN 524.A OD1 no hydrogen 2.796 N/A LEU 412.A N LEU 444.A O no hydrogen 2.856 N/A PHE 413.A N LYS 501.A O no hydrogen 3.040 N/A ALA 414.A N GLY 442.A O no hydrogen 2.828 N/A GLY 415.A N VAL 499.A O no hydrogen 2.979 N/A ILE 416.A N ALA 440.A O no hydrogen 2.779 N/A LYS 417.A N GLU 497.A O no hydrogen 2.834 N/A LYS 417.A NZ GLU 425.A OE1 no hydrogen 3.165 N/A LYS 417.A NZ GLU 425.A OE2 no hydrogen 2.938 N/A LYS 417.A NZ GLN 438.A OE1 no hydrogen 2.998 N/A LYS 418.A NZ ASP 328.A O no hydrogen 2.879 N/A LYS 418.A NZ ASP 328.A OD1 no hydrogen 2.953 N/A LYS 418.A NZ LEU 489.A O no hydrogen 2.833 N/A LYS 418.A NZ GLU 494.A OE1 no hydrogen 2.769 N/A LEU 419.A N THR 495.A O no hydrogen 2.891 N/A ASP 420.A N ASN 424.A O no hydrogen 2.768 N/A ARG 421.A NE GLN 492.A O no hydrogen 2.934 N/A ARG 421.A NH2 GLN 492.A O no hydrogen 2.971 N/A ARG 422.A N.A ASP 420.A OD1 no hydrogen 2.886 N/A ARG 422.A N.B ASP 420.A OD1 no hydrogen 2.880 N/A GLY 423.A N ASP 420.A O no hydrogen 2.886 N/A ASN 424.A N ASP 420.A OD1 no hydrogen 3.009 N/A VAL 426.A N LYS 418.A O no hydrogen 2.723 N/A ASN 427.A ND2 GLY 437.A O no hydrogen 3.007 N/A PHE 428.A N GLY 437.A O no hydrogen 3.148 N/A ASP 430.A N ILE 434.A O no hydrogen 3.096 N/A PHE 431.A N ASP 430.A OD1 no hydrogen 2.803 N/A ASN 432.A ND2 THR 515.A O no hydrogen 2.882 N/A HIS 433.A ND1 ASN 432.A OD1 no hydrogen 2.951 N/A ILE 434.A N ASP 430.A O no hydrogen 3.070 N/A GLY 437.A N PHE 428.A O no hydrogen 3.076 N/A GLN 438.A N ASP 430.A OD2 no hydrogen 3.011 N/A GLN 438.A NE2 THR 441.A OG1 no hydrogen 2.949 N/A VAL 439.A N ILE 416.A O no hydrogen 2.914 N/A ALA 440.A N ILE 416.A O no hydrogen 3.253 N/A THR 441.A N GLN 260.A OE1 no hydrogen 2.883 N/A GLY 442.A N ALA 414.A O no hydrogen 3.020 N/A TRP 443.A NE1 GLU 504.A OE1 no hydrogen 2.898 N/A LEU 444.A N LEU 412.A O no hydrogen 2.895 N/A ARG 445.A N GLY 195.A O no hydrogen 2.886 N/A ARG 445.A NE ASP 411.A OD1 no hydrogen 2.694 N/A ARG 445.A NH2 ASP 411.A OD1 no hydrogen 3.471 N/A ARG 445.A NH2 ASP 411.A OD2 no hydrogen 2.862 N/A ARG 445.A NH2 GLU 521.A O no hydrogen 3.211 N/A SER 447.A N ASP 410.A OD1 no hydrogen 2.884 N/A SER 447.A OG ASP 410.A OD1 no hydrogen 3.463 N/A SER 447.A OG ASP 410.A OD2 no hydrogen 2.621 N/A HIS 448.A N ARG 445.A O no hydrogen 2.786 N/A HIS 448.A ND1 HIS 465.A ND1 no hydrogen 2.965 N/A HIS 448.A NE2 GLU 468.A OE2 no hydrogen 2.633 N/A ARG 449.A N VAL 446.A O no hydrogen 3.027 N/A ARG 449.A NH1 VAL 446.A O no hydrogen 2.975 N/A ARG 449.A NH1 LEU 469.A O no hydrogen 2.872 N/A ASP 452.A N TRP 462.A O no hydrogen 2.685 N/A GLU 454.A N.A GLU 454.A OE1.A no hydrogen 2.914 N/A LYS 455.A N ASP 452.A OD1 no hydrogen 3.026 N/A SER 456.A N ASP 452.A O no hydrogen 2.902 N/A SER 456.A OG ASP 452.A O no hydrogen 2.710 N/A SER 457.A N GLN 460.A O no hydrogen 2.957 N/A SER 457.A OG GLN 460.A O no hydrogen 3.435 N/A GLN 460.A N SER 457.A OG no hydrogen 2.965 N/A GLN 460.A NE2 GLU 269.A OE2 no hydrogen 3.041 N/A GLN 460.A NE2 GLU 482.A OE2 no hydrogen 3.103 N/A TRP 462.A N SER 456.A OG no hydrogen 2.967 N/A LYS 464.A N GLU 450.A O no hydrogen 3.068 N/A LYS 464.A NZ GLU 450.A OE2 no hydrogen 3.542 N/A HIS 465.A ND1 HIS 448.A ND1 no hydrogen 2.965 N/A LEU 469.A N SER 447.A O no hydrogen 2.760 N/A LYS 470.A NZ ASP 410.A OD2 no hydrogen 2.734 N/A LEU 471.A N ASP 409.A O no hydrogen 2.753 N/A SER 472.A N GLU 475.A OE1 no hydrogen 2.739 N/A ASP 474.A N THR 405.A O no hydrogen 3.099 N/A GLU 475.A N SER 472.A O no hydrogen 2.930 N/A VAL 477.A N VAL 403.A O no hydrogen 2.744 N/A VAL 479.A N LEU 401.A O no hydrogen 2.772 N/A ILE 481.A N LEU 399.A O no hydrogen 2.781 N/A LEU 484.A N THR 441.A O no hydrogen 3.084 N/A SER 486.A N GLY 396.A O no hydrogen 3.108 N/A THR 488.A N LEU 394.A O no hydrogen 2.970 N/A LEU 489.A N ARG 327.A O no hydrogen 2.850 N/A PHE 490.A N THR 392.A O no hydrogen 2.819 N/A LYS 491.A N GLU 494.A OE1 no hydrogen 2.868 N/A GLN 492.A N ASP 391.A OD1 no hydrogen 2.825 N/A GLY 493.A N PHE 388.A O no hydrogen 2.813 N/A GLU 494.A N LYS 491.A O no hydrogen 2.821 N/A THR 495.A N LEU 419.A O no hydrogen 2.937 N/A THR 495.A OG1 THR 387.A OG1 no hydrogen 2.859 N/A LEU 496.A N TYR 386.A O no hydrogen 2.896 N/A GLU 497.A N LYS 417.A O no hydrogen 2.904 N/A VAL 498.A N PHE 384.A O no hydrogen 2.838 N/A VAL 499.A N GLY 415.A O no hydrogen 2.900 N/A VAL 500.A N VAL 382.A O no hydrogen 2.913 N/A LYS 501.A N PHE 413.A O no hydrogen 3.016 N/A LYS 501.A NZ LYS 378.A O no hydrogen 2.751 N/A LYS 501.A NZ GLU 504.A O no hydrogen 3.217 N/A SER 510.A OG THR 84.A OG1 no hydrogen 3.261 N/A SER 510.A OG ASN 432.A O no hydrogen 2.908 N/A SER 510.A OG HIS 433.A O no hydrogen 3.099 N/A THR 511.A N ASN 509.A OD1 no hydrogen 2.926 N/A THR 511.A OG1 THR 511.A O no hydrogen 2.617 N/A THR 511.A OG1 THR 515.A OG1 no hydrogen 2.840 N/A THR 515.A OG1 THR 511.A OG1 no hydrogen 2.840 N/A ARG 516.A NE PHE 431.A O no hydrogen 2.906 N/A ARG 516.A NH1 VAL 506.A O no hydrogen 2.769 N/A ARG 516.A NH1 GLY 508.A O no hydrogen 2.833 N/A ARG 516.A NH2 VAL 506.A O no hydrogen 3.253 N/A ARG 516.A NH2 TYR 517.A OH no hydrogen 2.936 N/A GLU 518.A N ASP 199.A OD1 no hydrogen 3.009 N/A HIS 519.A ND1 GLU 504.A OE2 no hydrogen 2.698 N/A HIS 519.A NE2 HIS 194.A ND1 no hydrogen 2.719 N/A GLU 520.A N THR 200.A OG1 no hydrogen 3.009 N/A THR 522.A OG1 ASP 411.A OD2 no hydrogen 3.134 N/A VAL 523.A N ASP 411.A OD2 no hydrogen 3.028 N/A ASN 524.A N THR 522.A OG1 no hydrogen 3.142 N/A ASN 524.A ND2 ASP 411.A O no hydrogen 2.972 N/A ASN 524.A ND2 GLY 502.A O no hydrogen 2.958 N/A GLY 526.A N GLU 376.A OE1 no hydrogen 2.889 N/A HIS 527.A ND1 TYR 373.A OH no hydrogen 2.856 N/A TYR 529.A N TRP 402.A O no hydrogen 2.739 N/A TYR 529.A OH SER 404.A OG no hydrogen 2.698 N/A THR 530.A N HIS 369.A O no hydrogen 2.949 N/A GLY 532.A N ILE 365.A O no hydrogen 2.810 N/A TYR 534.A N GLY 531.A O no hydrogen 2.905 N/A ASP 535.A N LYS 533.A O no hydrogen 3.064 N/A SER 536.A N TYR 534.A O no hydrogen 2.769 N/A SER 536.A OG TYR 529.A O no hydrogen 2.638 N/A GLN 537.A N LYS 400.A O no hydrogen 2.978 N/A GLN 537.A NE2 ASP 535.A O no hydrogen 2.979 N/A LEU 538.A N LEU 351.A O no hydrogen 2.829 N/A ILE 539.A N ASN 398.A O no hydrogen 2.810 N/A ILE 540.A N THR 349.A O no hydrogen 2.951 N/A ILE 542.A N GLU 347.A O no hydrogen 3.157 N/A VAL 543.A N GLU 393.A O no hydrogen 2.843 N/A ASN 544.A ND2 TYR 324.A OH no hydrogen 3.008 N/A ASN 544.A ND2 GLU 393.A OE1 no hydrogen 2.647 N/A