Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 6h9r_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): VAL 4.A N ASN 1.A O no hydrogen 3.349 N/A GLY 6.A N MET 2.A O no hydrogen 2.683 N/A ARG 8.A NH1 CYS 146.A O no hydrogen 3.144 N/A ARG 8.A NH1 LEU 251.A O no hydrogen 2.912 N/A ARG 8.A NH2 VAL 4.A O no hydrogen 2.875 N/A ARG 8.A NH2 LEU 251.A O no hydrogen 3.079 N/A ILE 9.A N ILE 5.A O no hydrogen 3.049 N/A LYS 10.A N GLY 6.A O no hydrogen 2.643 N/A ARG 11.A N GLU 7.A O no hydrogen 3.039 N/A ILE 12.A N ARG 8.A O no hydrogen 3.470 N/A LYS 13.A N ILE 9.A O no hydrogen 3.385 N/A GLU 14.A N.A LYS 10.A O no hydrogen 3.302 N/A GLU 14.A N.B LYS 10.A O no hydrogen 3.292 N/A GLU 15.A N ARG 11.A O no hydrogen 3.023 N/A HIS 16.A N ILE 12.A O no hydrogen 3.095 N/A HIS 16.A N LYS 13.A O no hydrogen 2.400 N/A HIS 16.A ND1 ILE 12.A O no hydrogen 3.197 N/A THR 19.A N HIS 16.A O no hydrogen 3.221 N/A THR 19.A OG1 GLU 38.A O no hydrogen 3.425 N/A HIS 21.A N SER 36.A O no hydrogen 3.289 N/A GLU 25.A N ASP 23.A OD1 no hydrogen 2.562 N/A ASN 26.A ND2 ASP 23.A O no hydrogen 2.857 N/A TYR 28.A N ASN 26.A OD1 no hydrogen 3.295 N/A TYR 28.A OH ASP 265.A OD2 no hydrogen 3.237 N/A LYS 29.A N ASP 69.A OD2 no hydrogen 2.975 N/A THR 30.A N ASP 69.A OD1 no hydrogen 2.924 N/A THR 30.A OG1 ASP 69.A OD1 no hydrogen 2.675 N/A THR 30.A OG1 THR 70.A O no hydrogen 3.178 N/A ALA 32.A N SER 268.A O no hydrogen 2.932 N/A HIS 34.A N ILE 266.A O no hydrogen 3.428 N/A SER 36.A N HIS 21.A O no hydrogen 3.192 N/A SER 36.A OG TYR 33.A OH no hydrogen 3.187 N/A SER 36.A OG GLY 35.A O no hydrogen 3.014 N/A SER 36.A OG MET 264.A O no hydrogen 3.095 N/A SER 36.A OG ASP 265.A OD1 no hydrogen 2.354 N/A TYR 37.A N MET 264.A O no hydrogen 3.173 N/A GLU 38.A N THR 19.A OG1 no hydrogen 3.013 N/A ASN 43.A N ARG 414.A O no hydrogen 2.795 N/A ASN 43.A ND2 THR 426.A O no hydrogen 3.043 N/A VAL 46.A N ASN 43.A OD1 no hydrogen 2.941 N/A LYS 47.A N ASN 43.A O no hydrogen 3.032 N/A LYS 47.A NZ ASP 54.A OD1 no hydrogen 2.790 N/A LEU 48.A N GLY 44.A O no hydrogen 3.157 N/A LEU 49.A N VAL 45.A O no hydrogen 3.362 N/A THR 50.A N LYS 47.A O no hydrogen 2.804 N/A THR 50.A OG1 VAL 46.A O no hydrogen 2.654 N/A THR 50.A OG1 LYS 47.A O no hydrogen 3.263 N/A TRP 53.A N THR 50.A O no hydrogen 3.009 N/A ASP 54.A N LYS 51.A O no hydrogen 2.741 N/A VAL 59.A N VAL 56.A O no hydrogen 2.988 N/A THR 60.A N VAL 56.A O no hydrogen 3.056 N/A THR 60.A OG1 VAL 55.A O no hydrogen 3.118 N/A THR 60.A OG1 VAL 56.A O no hydrogen 3.283 N/A GLN 61.A N PRO 57.A O no hydrogen 2.952 N/A MET 62.A N MET 58.A O no hydrogen 3.120 N/A ALA 63.A N VAL 59.A O no hydrogen 3.378 N/A MET 64.A N GLN 61.A O no hydrogen 3.054 N/A THR 72.A OG1 THR 220.A O no hydrogen 3.486 N/A ARG 74.A NE ASP 225.A OD2 no hydrogen 2.931 N/A ARG 74.A NH2 ASP 225.A OD1 no hydrogen 2.883 N/A ARG 74.A NH2 ASP 225.A OD2 no hydrogen 3.350 N/A LEU 76.A N ASP 358.A OD2 no hydrogen 2.763 N/A THR 79.A N LEU 308.A O no hydrogen 3.261 N/A THR 79.A OG1 ASP 358.A OD2 no hydrogen 2.696 N/A ARG 80.A N LEU 76.A O no hydrogen 2.969 N/A ARG 80.A NH1 PRO 75.A O no hydrogen 3.263 N/A LYS 81.A N PRO 77.A O no hydrogen 3.024 N/A LYS 81.A NZ LEU 313.A O no hydrogen 2.758 N/A VAL 82.A N GLY 78.A O no hydrogen 2.916 N/A MET 83.A N THR 79.A O no hydrogen 2.754 N/A GLU 84.A N ARG 80.A O no hydrogen 3.012 N/A ILE 85.A N LYS 81.A O no hydrogen 2.915 N/A THR 86.A N VAL 82.A O no hydrogen 2.957 N/A THR 86.A OG1 VAL 82.A O no hydrogen 2.906 N/A ALA 87.A N MET 83.A O no hydrogen 2.815 N/A GLU 88.A N GLU 84.A O no hydrogen 3.147 N/A TRP 89.A N ILE 85.A O no hydrogen 3.165 N/A LEU 90.A N THR 86.A O no hydrogen 2.829 N/A TRP 91.A N ALA 87.A O no hydrogen 2.889 N/A TRP 91.A NE1 ASN 229.A O no hydrogen 3.071 N/A ARG 92.A N GLU 88.A O no hydrogen 3.102 N/A THR 93.A N TRP 89.A O no hydrogen 3.008 N/A THR 93.A OG1 TRP 89.A O no hydrogen 2.959 N/A LEU 94.A N LEU 90.A O no hydrogen 2.783 N/A GLY 95.A N TRP 91.A O no hydrogen 2.949 N/A ARG 96.A N THR 93.A O no hydrogen 3.228 N/A ARG 96.A NH1 THR 93.A O no hydrogen 2.871 N/A ARG 96.A NH1 ASN 182.A O no hydrogen 3.005 N/A ARG 96.A NH2 GLU 181.A O no hydrogen 3.317 N/A ARG 96.A NH2 ASN 182.A O no hydrogen 3.542 N/A LYS 98.A NZ ASP 175.A O no hydrogen 2.660 N/A ARG 99.A NH1 ASP 238.A OD1 no hydrogen 2.713 N/A ARG 99.A NH2 ASP 238.A OD1 no hydrogen 3.420 N/A ARG 99.A NH2 ASP 238.A OD2 no hydrogen 3.560 N/A ARG 101.A NE ASP 175.A OD2 no hydrogen 2.782 N/A ARG 101.A NH1 LEU 102.A O no hydrogen 3.375 N/A ARG 101.A NH1 GLU 107.A OE1 no hydrogen 2.699 N/A ARG 101.A NH1 GLU 107.A OE2 no hydrogen 2.953 N/A ARG 101.A NH2 GLU 107.A OE1 no hydrogen 2.976 N/A ARG 101.A NH2 ASP 175.A OD1 no hydrogen 2.712 N/A ARG 101.A NH2 ASP 175.A OD2 no hydrogen 3.278 N/A CYS 103.A N GLU 167.A O no hydrogen 2.998 N/A THR 104.A N GLU 107.A OE2 no hydrogen 2.948 N/A THR 104.A OG1 GLU 106.A OE1 no hydrogen 3.458 N/A THR 104.A OG1 GLU 107.A OE2 no hydrogen 3.389 N/A ARG 105.A NH1 GLU 125.A OE1 no hydrogen 3.288 N/A ARG 105.A NH2 GLU 125.A OE1 no hydrogen 2.542 N/A GLU 106.A N GLU 106.A OE1 no hydrogen 2.754 N/A GLU 107.A N THR 104.A OG1 no hydrogen 2.840 N/A PHE 108.A N THR 104.A O no hydrogen 3.008 N/A THR 109.A N ARG 105.A O no hydrogen 2.849 N/A THR 109.A OG1 ARG 105.A O no hydrogen 2.669 N/A LYS 110.A N GLU 106.A O no hydrogen 2.850 N/A LYS 111.A N GLU 107.A O no hydrogen 3.048 N/A LYS 111.A NZ GLU 174.A OE1 no hydrogen 2.889 N/A LYS 111.A NZ GLU 174.A OE2 no hydrogen 2.370 N/A VAL 112.A N PHE 108.A O no hydrogen 3.037 N/A ARG 113.A N THR 109.A O no hydrogen 3.045 N/A ARG 113.A NE GLU 123.A OE1 no hydrogen 2.874 N/A ARG 113.A NH2 GLU 123.A OE1 no hydrogen 2.472 N/A THR 114.A N LYS 111.A O no hydrogen 3.104 N/A THR 114.A OG1 LYS 110.A O no hydrogen 2.770 N/A THR 114.A OG1 LYS 111.A O no hydrogen 3.475 N/A ASN 115.A N VAL 112.A O no hydrogen 3.247 N/A ALA 121.A N ALA 118.A O no hydrogen 2.683 N/A VAL 122.A N ALA 118.A O no hydrogen 2.975 N/A VAL 122.A N LYS 119.A O no hydrogen 3.305 N/A ASP 124.A N ALA 121.A O no hydrogen 3.303 N/A GLU 126.A N ASP 124.A OD1 no hydrogen 2.415 N/A PHE 127.A N ASP 124.A O no hydrogen 3.176 N/A TRP 128.A NE1 VAL 122.A O no hydrogen 3.257 N/A LYS 129.A N GLU 125.A O no hydrogen 2.849 N/A LEU 130.A N GLU 126.A O no hydrogen 3.059 N/A VAL 131.A N PHE 127.A O no hydrogen 3.078 N/A ASP 132.A N TRP 128.A O no hydrogen 2.965 N/A ARG 133.A N LYS 129.A O no hydrogen 2.987 N/A ARG 133.A NH2 GLU 126.A OE2 no hydrogen 3.383 N/A GLU 134.A N LEU 130.A O no hydrogen 2.835 N/A ARG 135.A N VAL 131.A O no hydrogen 2.704 N/A ARG 135.A NE GLU 167.A OE2 no hydrogen 2.849 N/A ARG 135.A NH1 ASP 132.A OD1 no hydrogen 3.415 N/A ARG 135.A NH2 GLU 167.A OE1 no hydrogen 2.899 N/A ARG 135.A NH2 GLU 167.A OE2 no hydrogen 3.377 N/A GLU 136.A N ASP 132.A O no hydrogen 3.033 N/A LEU 137.A N ARG 133.A O no hydrogen 3.232 N/A HIS 138.A N GLU 134.A O no hydrogen 2.874 N/A LYS 139.A N ARG 135.A O no hydrogen 2.886 N/A LEU 140.A N GLU 136.A O no hydrogen 3.245 N/A GLY 141.A N HIS 138.A O no hydrogen 2.892 N/A LYS 142.A N LEU 137.A O no hydrogen 3.046 N/A CYS 143.A SG GLU 134.A OE1 no hydrogen 3.552 N/A CYS 143.A SG HIS 138.A NE2 no hydrogen 3.759 N/A GLY 144.A N GLU 134.A OE1 no hydrogen 2.460 N/A SER 145.A N GLU 134.A OE1 no hydrogen 3.430 N/A SER 145.A OG GLU 134.A OE2 no hydrogen 3.479 N/A CYS 146.A SG HIS 138.A NE2 no hydrogen 3.467 N/A TYR 148.A N VAL 257.A O no hydrogen 3.027 N/A MET 150.A N LYS 259.A O no hydrogen 2.924 N/A TYR 156.A N ALA 153.A O no hydrogen 3.381 N/A TYR 156.A OH ASP 124.A OD2 no hydrogen 3.057 N/A LEU 159.A N TRP 155.A O no hydrogen 3.084 N/A GLY 160.A N TYR 156.A O no hydrogen 2.865 N/A VAL 161.A N MET 157.A O no hydrogen 3.051 N/A ARG 162.A N TRP 158.A O no hydrogen 3.179 N/A ARG 162.A NH1 GLU 165.A OE2 no hydrogen 3.223 N/A ARG 162.A NH2 VAL 147.A O no hydrogen 3.189 N/A TYR 163.A N LEU 159.A O no hydrogen 3.012 N/A TYR 163.A OH GLU 167.A OE1 no hydrogen 2.739 N/A LEU 164.A N GLY 160.A O no hydrogen 3.018 N/A GLU 165.A N VAL 161.A O no hydrogen 2.943 N/A PHE 166.A N ARG 162.A O no hydrogen 2.774 N/A GLU 167.A N TYR 163.A O no hydrogen 2.556 N/A ALA 168.A N LEU 164.A O no hydrogen 3.037 N/A LEU 169.A N GLU 165.A O no hydrogen 2.752 N/A GLY 170.A N PHE 166.A O no hydrogen 2.722 N/A LEU 172.A N LEU 169.A O no hydrogen 3.154 N/A ASN 173.A N GLY 170.A O no hydrogen 2.858 N/A GLU 174.A N GLY 170.A O no hydrogen 2.833 N/A ASP 175.A N PHE 171.A O no hydrogen 3.046 N/A HIS 176.A N ASN 173.A O no hydrogen 2.737 N/A TRP 177.A N LEU 172.A O no hydrogen 2.935 N/A SER 179.A N HIS 176.A O no hydrogen 3.111 N/A SER 179.A OG HIS 176.A O no hydrogen 3.400 N/A ARG 180.A NH1 SER 185.A O no hydrogen 2.978 N/A ARG 180.A NH1 GLY 186.A O no hydrogen 3.031 N/A ARG 180.A NH1 MET 333.A O no hydrogen 3.164 N/A ARG 180.A NH2 MET 333.A O no hydrogen 2.939 N/A ASN 182.A N SER 179.A OG no hydrogen 3.119 N/A ASN 182.A ND2 LEU 94.A O no hydrogen 2.883 N/A ASN 182.A ND2 TRP 177.A O no hydrogen 2.917 N/A SER 183.A N SER 179.A O no hydrogen 2.731 N/A SER 183.A OG PHE 178.A O no hydrogen 3.079 N/A SER 183.A OG SER 179.A O no hydrogen 2.590 N/A TYR 184.A N ARG 180.A O no hydrogen 2.905 N/A SER 185.A OG LEU 330.A O no hydrogen 2.834 N/A GLY 186.A N SER 183.A OG no hydrogen 2.782 N/A GLU 188.A N PHE 178.A O no hydrogen 3.246 N/A GLU 190.A N VAL 187.A O no hydrogen 3.191 N/A LEU 192.A N HIS 473.A O no hydrogen 2.858 N/A LYS 194.A N GLY 191.A O no hydrogen 3.032 N/A LEU 195.A N LEU 192.A O no hydrogen 3.158 N/A ILE 198.A N LYS 194.A O no hydrogen 3.006 N/A LEU 199.A N LEU 195.A O no hydrogen 2.941 N/A ARG 200.A N GLY 196.A O no hydrogen 2.967 N/A ARG 200.A NH1 GLU 390.A OE1 no hydrogen 2.982 N/A ASP 201.A N TYR 197.A O no hydrogen 3.085 N/A ILE 202.A N ILE 198.A O no hydrogen 2.880 N/A SER 203.A N LEU 199.A O no hydrogen 2.874 N/A SER 203.A OG ARG 200.A O no hydrogen 2.598 N/A LYS 204.A N ASP 201.A O no hydrogen 3.159 N/A LYS 204.A NZ ASP 201.A OD1 no hydrogen 3.542 N/A ILE 205.A N ILE 202.A O no hydrogen 3.039 N/A GLY 208.A N PRO 344.A O no hydrogen 2.888 N/A ALA 209.A N ASP 347.A OD1 no hydrogen 2.935 N/A MET 210.A N TRP 375.A O no hydrogen 2.895 N/A TYR 211.A N VAL 342.A O no hydrogen 2.789 N/A TYR 211.A OH ASP 347.A OD1 no hydrogen 2.605 N/A ALA 216.A N VAL 362.A O no hydrogen 3.089 N/A TRP 218.A NE1 ASN 284.A OD1 no hydrogen 2.972 N/A THR 220.A N GLY 217.A O no hydrogen 3.077 N/A THR 220.A OG1 GLY 217.A O no hydrogen 2.892 N/A ARG 221.A N TRP 218.A O no hydrogen 2.849 N/A ARG 221.A NE GLY 360.A O no hydrogen 2.816 N/A ARG 221.A NH2 GLY 360.A O no hydrogen 3.453 N/A THR 223.A N ASP 226.A OD2 no hydrogen 2.970 N/A ASP 226.A N THR 223.A OG1 no hydrogen 2.999 N/A LEU 227.A N THR 223.A O no hydrogen 2.919 N/A HIS 228.A N.A GLU 224.A O no hydrogen 3.065 N/A HIS 228.A N.B GLU 224.A O no hydrogen 3.022 N/A HIS 228.A ND1.A GLU 224.A O no hydrogen 3.015 N/A ASN 229.A N ASP 225.A O no hydrogen 3.005 N/A GLU 230.A N ASP 226.A O no hydrogen 2.826 N/A GLU 231.A N LEU 227.A O no hydrogen 3.217 N/A GLU 231.A N HIS 228.A O.B no hydrogen 3.329 N/A LYS 232.A N ASN 229.A O no hydrogen 3.231 N/A LYS 232.A NZ GLU 84.A OE2 no hydrogen 3.034 N/A LYS 232.A NZ HIS 228.A O.A no hydrogen 3.489 N/A ILE 233.A N GLU 230.A O no hydrogen 3.477 N/A ILE 234.A N GLU 231.A O no hydrogen 2.924 N/A GLN 235.A N LYS 232.A O no hydrogen 3.180 N/A GLN 236.A N ILE 233.A O no hydrogen 3.058 N/A GLN 236.A NE2 TRP 91.A O no hydrogen 3.218 N/A MET 237.A N ILE 234.A O no hydrogen 3.037 N/A GLU 240.A N GLU 240.A OE2 no hydrogen 2.283 N/A HIS 241.A NE2 ALA 168.A O no hydrogen 2.857 N/A ARG 242.A N ASP 238.A O no hydrogen 2.728 N/A GLN 243.A N PRO 239.A O no hydrogen 3.120 N/A LEU 244.A N GLU 240.A O no hydrogen 3.498 N/A ALA 245.A N HIS 241.A O no hydrogen 3.022 N/A ASN 246.A N ARG 242.A O no hydrogen 2.889 N/A ALA 247.A N GLN 243.A O no hydrogen 3.084 N/A ILE 248.A N LEU 244.A O no hydrogen 3.107 N/A PHE 249.A N ALA 245.A O no hydrogen 2.827 N/A LYS 250.A N ASN 246.A O no hydrogen 2.939 N/A LYS 250.A NZ ASN 246.A OD1 no hydrogen 2.939 N/A LEU 251.A N ALA 247.A O no hydrogen 3.121 N/A THR 252.A N ILE 248.A O no hydrogen 3.006 N/A TYR 253.A N PHE 249.A O no hydrogen 3.298 N/A TYR 253.A OH GLU 165.A OE1 no hydrogen 2.389 N/A GLN 254.A N PHE 249.A O no hydrogen 2.846 N/A GLN 254.A NE2 LEU 227.A O no hydrogen 3.516 N/A GLN 254.A NE2 GLU 231.A OE2 no hydrogen 3.119 N/A ASN 255.A ND2 LYS 250.A O no hydrogen 2.809 N/A LYS 256.A N ARG 269.A O no hydrogen 2.991 N/A LYS 256.A NZ TYR 253.A O no hydrogen 3.116 N/A LYS 256.A NZ ARG 269.A O no hydrogen 3.471 N/A LYS 256.A NZ ASP 271.A O no hydrogen 2.495 N/A LYS 256.A NZ GLN 272.A O no hydrogen 3.494 N/A VAL 258.A N ILE 267.A O no hydrogen 2.583 N/A LYS 259.A N TYR 148.A O no hydrogen 3.052 N/A VAL 260.A N ASP 265.A O no hydrogen 2.954 N/A MET 264.A N TYR 37.A O no hydrogen 2.953 N/A ASP 265.A N VAL 260.A O no hydrogen 3.046 N/A ILE 266.A N GLY 35.A O no hydrogen 3.198 N/A ILE 267.A N VAL 258.A O no hydrogen 2.841 N/A SER 268.A N ALA 32.A O no hydrogen 2.941 N/A ARG 269.A N LYS 256.A O no hydrogen 3.397 N/A ARG 269.A NE ASP 271.A OD1 no hydrogen 3.011 N/A ARG 269.A NH1 THR 30.A OG1 no hydrogen 2.916 N/A ARG 269.A NH1 THR 70.A O no hydrogen 3.476 N/A ARG 269.A NH2 THR 70.A O no hydrogen 2.839 N/A ARG 269.A NH2 ASP 271.A OD1 no hydrogen 3.156 N/A LYS 270.A NZ ASN 255.A OD1 no hydrogen 2.854 N/A GLN 272.A N ILE 222.A O no hydrogen 2.829 N/A GLN 272.A NE2 VAL 68.A O no hydrogen 3.302 N/A ARG 273.A N ASP 219.A O no hydrogen 2.924 N/A ARG 273.A NE ASN 284.A OD1 no hydrogen 2.723 N/A ARG 273.A NH1 GLU 230.A OE1 no hydrogen 3.260 N/A ARG 273.A NH1 GLU 230.A OE2 no hydrogen 2.553 N/A ARG 273.A NH2 GLU 230.A OE1 no hydrogen 2.518 N/A ARG 273.A NH2 ASN 284.A OD1 no hydrogen 2.836 N/A SER 275.A OG ASN 149.A O no hydrogen 3.092 N/A VAL 278.A N GLU 165.A OE2 no hydrogen 3.014 N/A GLY 279.A N GLU 165.A OE1 no hydrogen 2.525 N/A THR 280.A N GLN 277.A O no hydrogen 3.169 N/A THR 280.A OG1 GLY 274.A O no hydrogen 3.465 N/A THR 280.A OG1 GLN 277.A O no hydrogen 3.206 N/A TYR 281.A OH SER 336.A OG no hydrogen 2.816 N/A LEU 283.A N GLY 279.A O no hydrogen 2.926 N/A ASN 284.A N THR 280.A O no hydrogen 2.981 N/A ASN 284.A ND2 ASP 219.A OD1 no hydrogen 2.949 N/A THR 285.A N TYR 281.A O no hydrogen 2.958 N/A THR 285.A OG1 TYR 281.A O no hydrogen 2.601 N/A PHE 286.A N GLY 282.A O no hydrogen 2.797 N/A THR 287.A N LEU 283.A O no hydrogen 2.889 N/A THR 287.A OG1 GLU 230.A OE1 no hydrogen 2.550 N/A THR 287.A OG1 LEU 283.A O no hydrogen 3.166 N/A ASN 288.A N ASN 284.A O no hydrogen 2.685 N/A ASN 288.A ND2 GLY 337.A O no hydrogen 2.961 N/A MET 289.A N THR 285.A O no hydrogen 2.854 N/A GLU 290.A N PHE 286.A O no hydrogen 3.081 N/A ALA 291.A N THR 287.A O no hydrogen 2.961 N/A GLN 292.A N ASN 288.A O no hydrogen 3.011 N/A GLN 292.A NE2 ASN 288.A OD1 no hydrogen 2.925 N/A LEU 293.A N MET 289.A O no hydrogen 3.042 N/A VAL 294.A N GLU 290.A O no hydrogen 2.889 N/A ARG 295.A N ALA 291.A O no hydrogen 2.817 N/A ARG 295.A NE PHE 349.A O no hydrogen 3.210 N/A ARG 295.A NE ALA 352.A O no hydrogen 3.128 N/A ARG 295.A NH1 ASP 213.A OD2 no hydrogen 2.738 N/A ARG 295.A NH2 PHE 349.A O no hydrogen 2.837 N/A ARG 295.A NH2 SER 372.A OG no hydrogen 2.962 N/A GLN 296.A N GLN 292.A O no hydrogen 2.872 N/A GLN 296.A NE2 ARG 329.A O no hydrogen 3.246 N/A MET 297.A N LEU 293.A O no hydrogen 2.889 N/A GLU 298.A N VAL 294.A O no hydrogen 2.960 N/A GLY 299.A N ARG 295.A O no hydrogen 2.872 N/A GLU 300.A N GLN 296.A O no hydrogen 2.907 N/A GLY 301.A N GLU 298.A O no hydrogen 2.887 N/A VAL 302.A N MET 297.A O no hydrogen 2.829 N/A THR 304.A N ASP 307.A OD2 no hydrogen 3.178 N/A ASP 307.A N THR 304.A OG1 no hydrogen 3.305 N/A LEU 308.A N THR 304.A O no hydrogen 3.124 N/A GLU 309.A N LYS 305.A O no hydrogen 3.288 N/A GLU 309.A N ALA 306.A O no hydrogen 3.186 N/A ASN 310.A N ASP 307.A O no hydrogen 3.176 N/A HIS 312.A N ASN 310.A OD1 no hydrogen 2.899 N/A LYS 317.A NZ VAL 302.A O no hydrogen 2.834 N/A LYS 317.A NZ ASP 307.A OD2 no hydrogen 2.719 N/A THR 319.A N GLU 315.A O no hydrogen 3.017 N/A GLN 320.A N LYS 316.A O no hydrogen 2.880 N/A TRP 321.A N LYS 317.A O no hydrogen 3.161 N/A TRP 321.A NE1 GLU 300.A OE1 no hydrogen 2.937 N/A LEU 322.A N ILE 318.A O no hydrogen 2.800 N/A GLU 323.A N THR 319.A O no hydrogen 2.708 N/A THR 324.A N GLN 320.A O no hydrogen 2.854 N/A THR 324.A OG1 GLN 320.A O no hydrogen 3.079 N/A LYS 325.A N TRP 321.A O no hydrogen 2.848 N/A LYS 325.A NZ THR 324.A OG1 no hydrogen 2.356 N/A GLY 326.A N LEU 322.A O no hydrogen 2.876 N/A ARG 329.A N LYS 325.A O no hydrogen 2.881 N/A ARG 329.A NE GLU 300.A OE2 no hydrogen 2.605 N/A ARG 329.A NH1 GLU 328.A OE1 no hydrogen 2.822 N/A ARG 329.A NH2 GLU 300.A OE1 no hydrogen 2.749 N/A ARG 329.A NH2 GLU 300.A OE2 no hydrogen 3.319 N/A LEU 330.A N GLY 326.A O no hydrogen 2.865 N/A LYS 331.A N VAL 327.A O no hydrogen 2.975 N/A ARG 332.A N ARG 329.A O no hydrogen 3.140 N/A ARG 332.A NE GLU 328.A OE1 no hydrogen 2.995 N/A ARG 332.A NE GLU 328.A OE2 no hydrogen 3.249 N/A ARG 332.A NH1 PRO 206.A O no hydrogen 2.902 N/A ARG 332.A NH1 LYS 343.A O no hydrogen 2.938 N/A ARG 332.A NH2 PRO 206.A O no hydrogen 2.974 N/A ARG 332.A NH2 GLU 328.A OE2 no hydrogen 3.030 N/A MET 333.A N LEU 330.A O no hydrogen 3.090 N/A ALA 334.A N VAL 341.A O no hydrogen 2.989 N/A ILE 335.A N SER 185.A O no hydrogen 2.896 N/A SER 336.A N ASP 339.A O no hydrogen 2.819 N/A SER 336.A OG TYR 281.A OH no hydrogen 2.816 N/A SER 336.A OG HIS 473.A NE2 no hydrogen 3.071 N/A GLY 337.A N THR 285.A OG1 no hydrogen 2.946 N/A ASP 339.A N SER 336.A O no hydrogen 2.911 N/A CYS 340.A SG ASP 213.A O no hydrogen 3.735 N/A VAL 341.A N ALA 334.A O no hydrogen 2.793 N/A VAL 342.A N TYR 211.A O no hydrogen 2.840 N/A LYS 343.A N ARG 332.A O no hydrogen 2.914 N/A LYS 343.A NZ ILE 205.A O no hydrogen 2.729 N/A LYS 343.A NZ GLY 208.A O no hydrogen 3.110 N/A ARG 348.A N ASP 346.A OD1 no hydrogen 2.704 N/A ARG 348.A NE ASP 346.A OD1 no hydrogen 3.201 N/A ARG 348.A NE ASP 346.A OD2 no hydrogen 3.247 N/A ARG 348.A NH2 ASP 346.A OD2 no hydrogen 2.941 N/A ALA 350.A N ASP 347.A O no hydrogen 2.923 N/A ASN 351.A N ARG 348.A O no hydrogen 2.965 N/A ALA 352.A N PHE 349.A O no hydrogen 3.187 N/A LEU 354.A N GLU 298.A OE1 no hydrogen 3.014 N/A ALA 355.A N GLU 298.A OE2 no hydrogen 2.819 N/A ASN 357.A N LEU 353.A O no hydrogen 3.095 N/A ASN 357.A ND2 GLN 368.A O no hydrogen 2.879 N/A ASP 358.A N LEU 354.A O no hydrogen 2.916 N/A MET 359.A N ALA 355.A O no hydrogen 2.799 N/A GLY 360.A N ASN 357.A O no hydrogen 2.932 N/A LYS 361.A N LEU 356.A O no hydrogen 3.061 N/A LYS 361.A NZ ARG 221.A O no hydrogen 2.974 N/A LYS 361.A NZ ASP 226.A OD2 no hydrogen 2.952 N/A LYS 361.A NZ MET 359.A O no hydrogen 3.390 N/A VAL 362.A N GLY 360.A O no hydrogen 2.878 N/A ARG 363.A NH1 GLN 370.A O no hydrogen 2.912 N/A ARG 363.A NH1 SER 372.A OG no hydrogen 2.992 N/A ARG 363.A NH2 GLN 368.A O no hydrogen 3.044 N/A ARG 363.A NH2 GLN 370.A O no hydrogen 2.750 N/A LYS 364.A N ASP 214.A O no hydrogen 3.079 N/A GLN 370.A N PRO 367.A O no hydrogen 3.064 N/A SER 372.A N ALA 350.A O no hydrogen 2.980 N/A SER 372.A OG ASP 213.A OD2 no hydrogen 2.385 N/A TRP 375.A N MET 210.A O no hydrogen 2.760 N/A GLN 379.A N ASP 377.A OD1 no hydrogen 3.106 N/A GLN 379.A NE2 ASP 377.A OD1 no hydrogen 3.015 N/A GLN 380.A N ASP 377.A O no hydrogen 2.772 N/A VAL 381.A N TRP 378.A O no hydrogen 3.298 N/A PHE 383.A N HIS 386.A O no hydrogen 2.952 N/A CYS 384.A SG HIS 473.A NE2 no hydrogen 3.735 N/A HIS 386.A N PHE 383.A O no hydrogen 2.840 N/A HIS 386.A ND1 CYS 384.A O no hydrogen 2.850 N/A HIS 386.A NE2 TYR 441.A OH no hydrogen 2.710 N/A HIS 387.A N CYS 403.A O no hydrogen 2.780 N/A HIS 387.A NE2 HIS 389.A NE2 no hydrogen 3.036 N/A HIS 389.A N VAL 401.A O no hydrogen 2.950 N/A HIS 389.A NE2 HIS 387.A NE2 no hydrogen 3.036 N/A GLU 390.A N GLN 379.A OE1 no hydrogen 3.067 N/A LEU 391.A N LEU 399.A O no hydrogen 2.710 N/A MET 393.A N ARG 397.A O no hydrogen 2.617 N/A LYS 394.A NZ ASN 510.A OD1 no hydrogen 3.397 N/A GLY 396.A N MET 393.A O no hydrogen 2.667 N/A ARG 397.A N ASP 395.A OD1 no hydrogen 3.021 N/A ARG 397.A NE ASP 395.A OD1 no hydrogen 3.053 N/A ARG 397.A NE ASP 395.A OD2 no hydrogen 3.349 N/A ARG 397.A NH1 ASP 501.A O no hydrogen 2.812 N/A ARG 397.A NH1 THR 503.A O no hydrogen 2.759 N/A ARG 397.A NH2 ASP 395.A OD2 no hydrogen 3.249 N/A ARG 397.A NH2 THR 503.A O no hydrogen 2.767 N/A LEU 399.A N LEU 391.A O no hydrogen 2.731 N/A VAL 400.A N TYR 197.A OH no hydrogen 3.305 N/A VAL 401.A N HIS 389.A O no hydrogen 2.768 N/A CYS 403.A N HIS 387.A O no hydrogen 2.747 N/A CYS 403.A SG HIS 387.A NE2 no hydrogen 3.553 N/A CYS 403.A SG HIS 389.A NE2 no hydrogen 3.716 N/A CYS 403.A SG ARG 404.A O no hydrogen 3.919 N/A ARG 404.A NE GLU 408.A OE1 no hydrogen 2.915 N/A ARG 404.A NH2 GLU 408.A OE1 no hydrogen 3.082 N/A GLN 406.A N CYS 522.A O no hydrogen 3.079 N/A GLN 406.A NE2 ASP 446.A OD2 no hydrogen 2.772 N/A GLU 408.A N PRO 405.A O no hydrogen 3.029 N/A ILE 410.A N GLN 406.A O no hydrogen 2.915 N/A GLY 411.A N ASP 407.A O no hydrogen 2.875 N/A ARG 412.A N GLU 408.A O no hydrogen 2.975 N/A ALA 413.A N LEU 409.A O no hydrogen 3.041 N/A ARG 414.A N ILE 410.A O no hydrogen 3.070 N/A ARG 414.A NH1 THR 50.A OG1 no hydrogen 2.688 N/A ARG 414.A NH1 ASP 54.A OD1 no hydrogen 3.311 N/A ARG 414.A NH2 ASP 54.A OD1 no hydrogen 2.820 N/A ILE 415.A N ARG 412.A O no hydrogen 3.059 N/A SER 416.A N MET 41.A O no hydrogen 2.762 N/A SER 422.A N GLU 425.A OE1 no hydrogen 2.650 N/A THR 426.A N SER 422.A O no hydrogen 2.877 N/A THR 426.A OG1 SER 422.A O no hydrogen 3.463 N/A ALA 427.A N LEU 423.A O no hydrogen 2.637 N/A CYS 428.A N ARG 424.A O no hydrogen 2.976 N/A CYS 428.A SG ARG 424.A O no hydrogen 3.124 N/A CYS 428.A SG VAL 463.A O no hydrogen 3.401 N/A LEU 429.A N GLU 425.A O no hydrogen 3.031 N/A GLY 430.A N THR 426.A O no hydrogen 3.126 N/A LYS 431.A N ALA 427.A O no hydrogen 2.992 N/A LYS 431.A NZ PRO 459.A O no hydrogen 3.262 N/A LYS 431.A NZ VAL 460.A O no hydrogen 3.227 N/A LYS 431.A NZ TRP 462.A O no hydrogen 2.443 N/A ALA 432.A N CYS 428.A O no hydrogen 3.022 N/A TYR 433.A N LEU 429.A O no hydrogen 3.055 N/A TYR 433.A OH THR 468.A O no hydrogen 2.908 N/A ALA 434.A N GLY 430.A O no hydrogen 2.700 N/A GLN 435.A N LYS 431.A O no hydrogen 2.750 N/A GLN 435.A NE2 TRP 478.A O no hydrogen 2.765 N/A GLN 435.A NE2 THR 480.A O no hydrogen 2.945 N/A MET 436.A N ALA 432.A O no hydrogen 2.797 N/A TRP 437.A N TYR 433.A O no hydrogen 2.859 N/A SER 438.A N ALA 434.A O no hydrogen 3.031 N/A SER 438.A OG ALA 434.A O no hydrogen 3.474 N/A SER 438.A OG SER 451.A OG no hydrogen 2.982 N/A LEU 439.A N GLN 435.A O no hydrogen 2.973 N/A MET 440.A N MET 436.A O no hydrogen 2.906 N/A TYR 441.A N TRP 437.A O no hydrogen 2.808 N/A TYR 441.A OH HIS 386.A NE2 no hydrogen 2.710 N/A HIS 443.A NE2 PRO 402.A O no hydrogen 2.882 N/A ARG 444.A N TYR 441.A O no hydrogen 2.947 N/A ARG 444.A NE ASP 519.A OD1 no hydrogen 2.850 N/A ARG 444.A NH1 ASP 519.A O no hydrogen 3.015 N/A ARG 444.A NH1 ASP 519.A OD1 no hydrogen 2.997 N/A ARG 444.A NH2 ARG 404.A O no hydrogen 3.295 N/A ARG 444.A NH2 CYS 522.A O no hydrogen 3.441 N/A ARG 445.A N ASP 519.A OD2 no hydrogen 3.059 N/A ARG 445.A NH1 LEU 514.A O no hydrogen 2.953 N/A ARG 445.A NH1 ASP 519.A OD2 no hydrogen 2.957 N/A ARG 445.A NH2 LEU 514.A O no hydrogen 3.255 N/A ARG 448.A N ARG 444.A O no hydrogen 2.937 N/A ARG 448.A NE PHE 442.A O no hydrogen 2.841 N/A ARG 448.A NH1 TRP 508.A O no hydrogen 3.121 N/A ARG 448.A NH1 VAL 511.A O no hydrogen 3.116 N/A ARG 448.A NH2 PHE 442.A O no hydrogen 2.844 N/A ARG 448.A NH2 VAL 511.A O no hydrogen 2.833 N/A LEU 449.A N ARG 445.A O no hydrogen 3.067 N/A ALA 450.A N ASP 446.A O no hydrogen 2.819 N/A SER 451.A N LEU 447.A O no hydrogen 2.761 N/A SER 451.A OG ALA 434.A O no hydrogen 2.525 N/A SER 451.A OG SER 438.A OG no hydrogen 2.982 N/A ASN 452.A N ARG 448.A O no hydrogen 2.958 N/A ALA 453.A N LEU 449.A O no hydrogen 2.957 N/A ILE 454.A N ALA 450.A O no hydrogen 2.903 N/A CYS 455.A N SER 451.A O no hydrogen 3.045 N/A CYS 455.A SG SER 451.A O no hydrogen 3.475 N/A SER 456.A N ASN 452.A O no hydrogen 2.873 N/A SER 456.A OG ASN 452.A O no hydrogen 2.823 N/A ALA 457.A N ILE 454.A O no hydrogen 2.956 N/A VAL 458.A N ILE 454.A O no hydrogen 3.115 N/A VAL 460.A N GLU 553.A O no hydrogen 3.411 N/A TRP 462.A N PRO 459.A O no hydrogen 2.948 N/A SER 466.A OG THR 465.A O no hydrogen 2.282 N/A SER 471.A N THR 469.A OG1 no hydrogen 2.892 N/A HIS 473.A N SER 471.A OG no hydrogen 2.962 N/A ALA 474.A N SER 471.A O no hydrogen 3.158 N/A HIS 475.A NE2 GLY 189.A O no hydrogen 3.176 N/A GLN 477.A N GLN 477.A OE1 no hydrogen 2.793 N/A TRP 478.A NE1 THR 468.A OG1 no hydrogen 3.070 N/A MET 479.A N HIS 476.A O no hydrogen 3.231 N/A GLU 482.A N THR 480.A OG1 no hydrogen 2.805 N/A THR 486.A N ASP 483.A O no hydrogen 3.068 N/A THR 486.A OG1 ASP 483.A OD2 no hydrogen 3.568 N/A VAL 487.A N ASP 483.A O no hydrogen 3.137 N/A TRP 488.A N MET 484.A O no hydrogen 2.705 N/A ASN 489.A N LEU 485.A O no hydrogen 2.972 N/A ASN 489.A ND2 LEU 485.A O no hydrogen 2.988 N/A ASN 489.A ND2 VAL 505.A O no hydrogen 2.694 N/A ARG 490.A N THR 486.A O no hydrogen 2.908 N/A ARG 490.A NH1 GLU 482.A OE1 no hydrogen 3.272 N/A ARG 490.A NH1 GLU 482.A OE2 no hydrogen 2.495 N/A ARG 490.A NH2 GLU 482.A OE1 no hydrogen 3.170 N/A VAL 491.A N VAL 487.A O no hydrogen 2.797 N/A TRP 492.A N TRP 488.A O no hydrogen 2.808 N/A TRP 492.A NE1 LEU 439.A O no hydrogen 2.809 N/A ILE 493.A N ASN 489.A O no hydrogen 3.014 N/A GLU 494.A N ASN 489.A O no hydrogen 2.871 N/A GLU 495.A N ARG 490.A O no hydrogen 2.781 N/A ASN 496.A N ILE 493.A O no hydrogen 3.225 N/A ASN 496.A ND2 TYR 197.A OH no hydrogen 3.024 N/A ASN 496.A ND2 TRP 492.A O no hydrogen 2.935 N/A TRP 498.A N ASN 496.A OD1 no hydrogen 2.740 N/A TRP 498.A NE1 ASP 201.A OD2 no hydrogen 2.944 N/A MET 499.A N ASN 496.A O no hydrogen 2.802 N/A LYS 502.A NZ ILE 493.A O no hydrogen 2.901 N/A LYS 502.A NZ GLU 494.A O no hydrogen 3.174 N/A LYS 502.A NZ MET 499.A O no hydrogen 2.645 N/A THR 503.A N ASP 501.A OD1 no hydrogen 3.122 N/A THR 503.A OG1 ASP 501.A OD1 no hydrogen 2.760 N/A VAL 505.A N ASN 489.A OD1 no hydrogen 2.735 N/A GLU 509.A N THR 507.A OG1 no hydrogen 3.074 N/A ASN 510.A N THR 507.A O no hydrogen 2.884 N/A VAL 511.A N TRP 508.A O no hydrogen 3.073 N/A LEU 514.A N HIS 443.A O no hydrogen 2.935 N/A GLU 518.A N GLU 518.A OE1 no hydrogen 2.268 N/A ASP 519.A N GLY 515.A O no hydrogen 2.805 N/A GLN 520.A N LYS 516.A O no hydrogen 2.917 N/A GLN 520.A NE2 ILE 526.A O no hydrogen 3.204 N/A TRP 521.A N ARG 517.A O no hydrogen 2.767 N/A CYS 522.A N GLU 518.A O no hydrogen 2.939 N/A CYS 522.A N ASP 519.A O no hydrogen 3.303 N/A CYS 522.A SG HIS 387.A NE2 no hydrogen 3.648 N/A CYS 522.A SG HIS 389.A NE2 no hydrogen 4.022 N/A CYS 522.A SG GLU 518.A O no hydrogen 3.449 N/A GLY 523.A N GLN 520.A O no hydrogen 3.237 N/A SER 524.A N ASP 519.A O no hydrogen 2.969 N/A SER 524.A OG ASP 446.A OD2 no hydrogen 3.173 N/A LEU 525.A N ASP 446.A OD2 no hydrogen 2.878 N/A ILE 526.A N SER 524.A OG no hydrogen 2.994 N/A LEU 528.A N LEU 525.A O no hydrogen 3.004 N/A ARG 531.A NE ASP 446.A OD1 no hydrogen 2.695 N/A ARG 531.A NH2 ASP 446.A OD1 no hydrogen 2.887 N/A ALA 532.A N LEU 528.A O no hydrogen 3.149 N/A THR 533.A N THR 529.A O no hydrogen 2.699 N/A THR 533.A OG1 THR 529.A O no hydrogen 3.541 N/A TRP 534.A N SER 530.A O no hydrogen 3.075 N/A TRP 534.A NE1 LEU 49.A O no hydrogen 2.895 N/A ALA 535.A N ARG 531.A O no hydrogen 2.932 N/A GLN 536.A N ALA 532.A O no hydrogen 3.009 N/A ASN 537.A N THR 533.A O no hydrogen 2.936 N/A ASN 537.A N TRP 534.A O no hydrogen 3.247 N/A ALA 541.A N ASN 537.A O no hydrogen 3.455 N/A ILE 542.A N ILE 538.A O no hydrogen 2.940 N/A GLN 543.A N PRO 539.A O no hydrogen 2.913 N/A GLN 544.A N THR 540.A O no hydrogen 2.945 N/A VAL 545.A N ALA 541.A O no hydrogen 2.957 N/A ARG 546.A N ILE 542.A O no hydrogen 2.876 N/A SER 547.A N GLN 543.A O no hydrogen 2.921 N/A SER 547.A OG GLN 544.A O no hydrogen 3.232 N/A LEU 548.A N VAL 545.A O no hydrogen 3.145 N/A ILE 549.A N VAL 545.A O no hydrogen 2.982 N/A GLY 550.A N ARG 546.A O no hydrogen 2.887 N/A TYR 557.A N SER 456.A OG no hydrogen 2.971 N/A MET 558.A N ASP 556.A OD1 no hydrogen 3.451 N/A