Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1xje_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): MET 1.A N ASP 344.A OD1 no hydrogen 3.185 N/A MET 1.A N ASP 344.A OD2 no hydrogen 2.907 N/A MET 1.A N GLU 346.A OE2 no hydrogen 3.026 N/A LEU 3.A N GLU 350.A OE2 no hydrogen 2.855 N/A LEU 6.A N LYS 2.A O no hydrogen 3.248 N/A ILE 7.A N LEU 3.A O no hydrogen 2.828 N/A SER 8.A N SER 4.A O no hydrogen 3.102 N/A SER 8.A OG SER 4.A O no hydrogen 2.901 N/A ARG 9.A N ASP 5.A O no hydrogen 3.276 N/A TRP 10.A N ILE 7.A O no hydrogen 3.116 N/A ILE 11.A N ILE 7.A O no hydrogen 2.887 N/A VAL 13.A N TRP 10.A O no hydrogen 2.970 N/A SER 16.A N ASP 493.A OD2 no hydrogen 2.776 N/A SER 16.A OG ASP 493.A OD1 no hydrogen 2.645 N/A SER 16.A OG ASP 493.A OD2 no hydrogen 3.452 N/A ALA 19.A N SER 16.A OG no hydrogen 3.001 N/A GLN 20.A N SER 16.A O no hydrogen 2.936 N/A ILE 21.A N LYS 17.A O no hydrogen 3.120 N/A ILE 21.A N ASN 18.A O no hydrogen 3.131 N/A ILE 22.A N ASN 18.A O no hydrogen 3.483 N/A LEU 23.A N ALA 19.A O no hydrogen 3.002 N/A ARG 24.A N GLN 20.A O no hydrogen 3.086 N/A ASP 25.A N ILE 21.A O no hydrogen 2.962 N/A ARG 26.A N ILE 22.A O no hydrogen 3.077 N/A ARG 26.A NH1 ASP 25.A OD1 no hydrogen 3.304 N/A TYR 27.A N LEU 23.A O no hydrogen 2.759 N/A TYR 27.A OH SER 91.A OG no hydrogen 2.568 N/A PHE 28.A N LEU 23.A O no hydrogen 3.037 N/A MET 29.A N GLU 38.A OE1 no hydrogen 2.801 N/A ASP 31.A N ASN 35.A O no hydrogen 2.911 N/A GLY 34.A N ASP 31.A O no hydrogen 2.623 N/A ASN 35.A ND2 ASP 31.A OD2 no hydrogen 2.654 N/A TYR 36.A OH ARG 24.A O no hydrogen 2.832 N/A LEU 37.A N MET 29.A O no hydrogen 2.803 N/A THR 39.A N ASP 43.A OD2 no hydrogen 2.865 N/A LYS 40.A N ASP 43.A OD2 no hydrogen 3.089 N/A LYS 40.A NZ GLU 14.A OE2 no hydrogen 3.058 N/A TRP 41.A NE1 LEU 82.A O no hydrogen 2.986 N/A ASP 43.A N LYS 40.A O no hydrogen 2.760 N/A ALA 45.A N TRP 41.A O no hydrogen 2.926 N/A ARG 46.A N GLU 42.A O no hydrogen 3.077 N/A ARG 46.A NH2 GLU 75.A OE2 no hydrogen 3.408 N/A ARG 47.A N ASP 43.A O no hydrogen 3.201 N/A ARG 47.A NE GLU 38.A OE2 no hydrogen 2.745 N/A ARG 47.A NH1 LEU 94.A O no hydrogen 2.871 N/A ARG 47.A NH1 ALA 97.A O no hydrogen 3.035 N/A ARG 47.A NH2 GLU 38.A OE1 no hydrogen 2.992 N/A ARG 47.A NH2 GLU 38.A OE2 no hydrogen 3.437 N/A ARG 47.A NH2 LEU 94.A O no hydrogen 3.030 N/A VAL 48.A N VAL 44.A O no hydrogen 3.066 N/A ALA 49.A N ALA 45.A O no hydrogen 2.885 N/A ARG 50.A N ARG 46.A O no hydrogen 2.990 N/A ARG 50.A NE GLU 75.A OE1 no hydrogen 3.326 N/A ARG 50.A NE GLU 75.A OE2 no hydrogen 2.992 N/A ARG 50.A NH1 LEU 105.A O no hydrogen 2.759 N/A ARG 50.A NH1 LYS 108.A O no hydrogen 2.854 N/A ARG 50.A NH2 GLU 75.A OE2 no hydrogen 2.989 N/A ARG 50.A NH2 LYS 108.A O no hydrogen 2.740 N/A VAL 51.A N ARG 47.A O no hydrogen 3.076 N/A VAL 52.A N VAL 48.A O no hydrogen 3.036 N/A ALA 53.A N ALA 49.A O no hydrogen 2.868 N/A THR 54.A N ARG 50.A O no hydrogen 3.175 N/A THR 54.A OG1 ARG 50.A O no hydrogen 2.857 N/A ALA 55.A N VAL 52.A O no hydrogen 3.329 N/A GLU 56.A N ALA 53.A O no hydrogen 2.974 N/A LEU 57.A N THR 54.A O no hydrogen 3.122 N/A LEU 58.A N ALA 55.A O no hydrogen 3.123 N/A ASN 59.A N GLU 56.A O no hydrogen 3.078 N/A ASN 59.A ND2 GLU 56.A OE1 no hydrogen 3.277 N/A ASN 59.A ND2 GLU 431.A OE2 no hydrogen 2.745 N/A SER 61.A N ASN 59.A OD1 no hydrogen 2.947 N/A SER 61.A OG GLU 431.A O no hydrogen 2.688 N/A TYR 62.A N ASN 59.A O no hydrogen 3.454 N/A LYS 63.A N GLU 66.A OE1 no hydrogen 2.939 N/A LYS 64.A NZ GLU 119.A OE2 no hydrogen 3.145 N/A GLU 66.A N LYS 63.A O no hydrogen 2.912 N/A LYS 67.A N LYS 63.A O no hydrogen 3.223 N/A LYS 67.A N LYS 64.A O no hydrogen 3.230 N/A LYS 67.A NZ LEU 57.A O no hydrogen 2.659 N/A ARG 70.A N GLU 66.A O no hydrogen 2.846 N/A ARG 70.A NE GLU 73.A OE1 no hydrogen 2.934 N/A ARG 70.A NH1 GLU 66.A OE2 no hydrogen 2.867 N/A ARG 70.A NH2 GLU 73.A OE1 no hydrogen 3.367 N/A ARG 70.A NH2 GLU 73.A OE2 no hydrogen 3.007 N/A ILE 71.A N LYS 67.A O no hydrogen 2.951 N/A LYS 72.A N LEU 68.A O no hydrogen 2.962 N/A LYS 72.A NZ ILE 110.A O no hydrogen 3.341 N/A LYS 72.A NZ MET 113.A O no hydrogen 3.366 N/A GLU 73.A N ASP 69.A O no hydrogen 3.109 N/A TRP 74.A N ARG 70.A O no hydrogen 3.192 N/A TRP 74.A NE1 TYR 62.A OH no hydrogen 3.135 N/A GLU 75.A N ILE 71.A O no hydrogen 2.930 N/A ASP 76.A N LYS 72.A O no hydrogen 2.966 N/A ILE 77.A N GLU 73.A O no hydrogen 3.057 N/A PHE 78.A N TRP 74.A O no hydrogen 2.851 N/A PHE 79.A N GLU 75.A O no hydrogen 2.906 N/A ARG 80.A N ASP 76.A O no hydrogen 3.021 N/A VAL 81.A N ILE 77.A O no hydrogen 3.049 N/A LEU 82.A N PHE 78.A O no hydrogen 3.076 N/A LYS 83.A N PHE 79.A O no hydrogen 2.811 N/A LYS 83.A NZ GLU 42.A OE2 no hydrogen 2.948 N/A ALA 84.A N ARG 80.A O no hydrogen 2.977 N/A ARG 85.A N LEU 82.A O no hydrogen 2.912 N/A ARG 85.A NH1 ILE 491.A O no hydrogen 2.831 N/A ARG 85.A NH1 ASP 493.A OD2 no hydrogen 2.910 N/A LEU 86.A N VAL 81.A O no hydrogen 3.008 N/A ILE 88.A N SER 331.A O no hydrogen 3.020 N/A ASN 90.A N LEU 329.A O no hydrogen 2.848 N/A ASN 90.A ND2 LEU 131.A O no hydrogen 3.080 N/A SER 91.A OG TYR 27.A OH no hydrogen 2.568 N/A THR 93.A N ASN 90.A O no hydrogen 3.048 N/A THR 93.A OG1 LEU 131.A O no hydrogen 2.759 N/A PHE 95.A N SER 91.A O no hydrogen 2.854 N/A ASN 96.A N PRO 92.A O no hydrogen 2.977 N/A ASN 96.A ND2 MET 130.A O no hydrogen 2.786 N/A ASN 96.A ND2 VAL 159.A O no hydrogen 3.109 N/A ALA 97.A N THR 93.A O no hydrogen 3.197 N/A GLY 98.A N HIS 129.A NE2 no hydrogen 2.948 N/A LEU 99.A N ASN 96.A O no hydrogen 3.167 N/A VAL 101.A N GLY 98.A O no hydrogen 3.066 N/A LEU 105.A N LYS 102.A O no hydrogen 3.144 N/A TRP 107.A NE1 GLU 38.A OE2 no hydrogen 2.909 N/A LYS 108.A NZ GLN 112.A O no hydrogen 2.995 N/A LYS 108.A NZ ASP 117.A OD2 no hydrogen 2.432 N/A GLN 112.A N PRO 109.A O no hydrogen 3.009 N/A MET 113.A N ILE 110.A O no hydrogen 3.157 N/A THR 114.A N ASP 117.A OD2 no hydrogen 3.171 N/A ASP 117.A N THR 114.A OG1 no hydrogen 2.970 N/A TYR 118.A N THR 114.A O no hydrogen 3.253 N/A TYR 118.A OH GLU 75.A OE1 no hydrogen 2.598 N/A GLU 119.A N LEU 115.A O no hydrogen 3.027 N/A GLU 120.A N GLU 116.A O no hydrogen 3.003 N/A ILE 121.A N ASP 117.A O no hydrogen 2.976 N/A TYR 122.A N TYR 118.A O no hydrogen 2.927 N/A ARG 123.A N GLU 119.A O no hydrogen 3.016 N/A SER 124.A N GLU 120.A O no hydrogen 3.038 N/A SER 124.A N ILE 121.A O no hydrogen 3.259 N/A SER 124.A OG GLU 120.A O no hydrogen 2.680 N/A SER 124.A OG ILE 121.A O no hydrogen 3.531 N/A ARG 125.A NE VAL 365.A O no hydrogen 3.337 N/A ARG 125.A NH1 TYR 122.A O no hydrogen 3.000 N/A ASN 126.A N LEU 99.A O no hydrogen 3.098 N/A LEU 128.A N ASN 126.A OD1 no hydrogen 2.934 N/A HIS 129.A N ASN 126.A O no hydrogen 3.100 N/A MET 130.A N LEU 128.A O no hydrogen 2.860 N/A LEU 131.A N ASN 366.A OD1 no hydrogen 2.919 N/A ALA 133.A N ASN 90.A OD1 no hydrogen 3.216 N/A PHE 135.A N GLY 162.A O no hydrogen 2.816 N/A VAL 136.A N GLU 325.A O no hydrogen 3.137 N/A VAL 137.A N GLY 164.A O no hydrogen 3.105 N/A SER 142.A N GLY 140.A O no hydrogen 2.848 N/A SER 142.A OG GLU 145.A OE2 no hydrogen 2.673 N/A GLU 145.A N SER 142.A OG no hydrogen 3.126 N/A ILE 146.A N SER 142.A O no hydrogen 2.974 N/A PHE 147.A N ILE 143.A O no hydrogen 3.068 N/A GLU 148.A N GLU 144.A O no hydrogen 2.986 N/A ALA 149.A N GLU 145.A O no hydrogen 2.972 N/A VAL 150.A N ILE 146.A O no hydrogen 2.899 N/A LYS 151.A N PHE 147.A O no hydrogen 3.117 N/A GLU 152.A N GLU 148.A O no hydrogen 2.936 N/A TYR 153.A N ALA 149.A O no hydrogen 2.892 N/A TYR 153.A OH SER 165.A OG no hydrogen 2.831 N/A ALA 154.A N VAL 150.A O no hydrogen 3.120 N/A LEU 155.A N LYS 151.A O no hydrogen 2.981 N/A ILE 156.A N GLU 152.A O no hydrogen 3.034 N/A THR 157.A N TYR 153.A O no hydrogen 2.963 N/A THR 157.A OG1 TYR 153.A O no hydrogen 2.653 N/A LYS 158.A N ALA 154.A O no hydrogen 2.957 N/A GLY 160.A N THR 157.A O no hydrogen 3.209 N/A GLY 161.A N ILE 156.A O no hydrogen 2.970 N/A GLY 162.A N ALA 133.A O no hydrogen 3.004 N/A VAL 163.A N ALA 210.A O no hydrogen 3.214 N/A GLY 164.A N PHE 135.A O no hydrogen 2.997 N/A SER 165.A N MET 212.A O no hydrogen 3.017 N/A SER 165.A OG VAL 137.A O no hydrogen 2.622 N/A SER 165.A OG TYR 153.A OH no hydrogen 2.831 N/A ASN 166.A ND2 ASN 216.A OD1 no hydrogen 3.011 N/A ASN 166.A ND2 ASN 311.A O no hydrogen 2.896 N/A PHE 167.A N ILE 214.A O no hydrogen 2.827 N/A SER 168.A N ASN 166.A OD1 no hydrogen 3.000 N/A SER 168.A OG ASN 166.A OD1 no hydrogen 2.603 N/A LEU 170.A N PHE 167.A O no hydrogen 3.127 N/A ARG 171.A N ASP 141.A OD1 no hydrogen 2.945 N/A ARG 171.A NE ASP 141.A OD2 no hydrogen 2.965 N/A ARG 171.A NH1 PHE 176.A O no hydrogen 2.905 N/A ARG 171.A NH2 ASP 141.A OD2 no hydrogen 3.130 N/A LYS 173.A N ASP 221.A OD2 no hydrogen 2.875 N/A GLY 174.A N ALA 184.A O no hydrogen 2.860 N/A SER 175.A N PRO 172.A O no hydrogen 3.001 N/A SER 175.A OG PRO 172.A O no hydrogen 2.658 N/A VAL 177.A N GLY 182.A O no hydrogen 2.934 N/A THR 180.A N VAL 177.A O no hydrogen 3.347 N/A HIS 181.A N ALA 178.A O no hydrogen 3.484 N/A GLY 182.A N VAL 177.A O no hydrogen 3.149 N/A ALA 184.A N SER 175.A O no hydrogen 2.766 N/A SER 189.A OG SER 185.A O no hydrogen 3.446 N/A PHE 190.A N GLY 186.A O no hydrogen 3.359 N/A MET 191.A N PRO 187.A O no hydrogen 2.800 N/A HIS 192.A N VAL 188.A O no hydrogen 3.211 N/A VAL 193.A N PHE 190.A O no hydrogen 2.843 N/A PHE 194.A N PHE 190.A O no hydrogen 3.240 N/A ASN 195.A N MET 191.A O no hydrogen 3.001 N/A SER 196.A N HIS 192.A O no hydrogen 3.029 N/A SER 196.A OG HIS 192.A O no hydrogen 3.165 N/A ALA 197.A N VAL 193.A O no hydrogen 3.024 N/A ILE 198.A N PHE 194.A O no hydrogen 3.203 N/A SER 199.A N ASN 195.A O no hydrogen 2.883 N/A SER 199.A OG SER 196.A O no hydrogen 2.699 N/A VAL 200.A N ALA 197.A O no hydrogen 3.260 N/A VAL 201.A N ILE 198.A O no hydrogen 3.341 N/A GLN 203.A N ARG 207.A O no hydrogen 2.948 N/A LEU 211.A N PHE 234.A O no hydrogen 3.001 N/A MET 212.A N VAL 163.A O no hydrogen 2.947 N/A GLY 213.A N ASN 236.A O no hydrogen 2.931 N/A ILE 214.A N SER 165.A O no hydrogen 3.005 N/A LEU 215.A N SER 238.A O no hydrogen 3.355 N/A ASN 216.A N SER 168.A OG no hydrogen 2.872 N/A ILE 217.A N GLY 240.A O no hydrogen 2.925 N/A HIS 219.A N ASN 216.A O no hydrogen 2.949 N/A HIS 219.A NE2 LEU 170.A O no hydrogen 2.935 N/A ASP 221.A N HIS 219.A ND1 no hydrogen 2.972 N/A ILE 222.A N HIS 219.A O no hydrogen 3.058 N/A PHE 225.A N ASP 221.A O no hydrogen 3.029 N/A ILE 226.A N ILE 222.A O no hydrogen 2.803 N/A ASP 227.A N GLU 223.A O no hydrogen 3.169 N/A ALA 228.A N PHE 225.A O no hydrogen 2.936 N/A LYS 229.A NZ PHE 235.A O no hydrogen 2.763 N/A PHE 234.A N ASN 195.A OD1 no hydrogen 2.913 N/A PHE 235.A N LEU 232.A O no hydrogen 3.048 N/A ASN 236.A N LEU 211.A O no hydrogen 2.815 N/A ASN 236.A ND2 PRO 315.A O no hydrogen 3.010 N/A LEU 237.A N ASP 289.A OD2 no hydrogen 3.070 N/A SER 238.A N GLY 213.A O no hydrogen 3.064 N/A VAL 239.A N GLY 291.A O no hydrogen 2.802 N/A GLY 240.A N LEU 215.A O no hydrogen 2.825 N/A PHE 241.A N ALA 293.A O no hydrogen 2.926 N/A LYS 245.A NZ ALA 611.A O no hydrogen 3.195 N/A LYS 245.A NZ THR 614.A O no hydrogen 2.816 N/A LYS 245.A NZ VAL 616.A O no hydrogen 2.757 N/A LYS 246.A N ASP 244.A OD1 no hydrogen 2.825 N/A GLU 247.A N ASP 244.A O no hydrogen 2.971 N/A ILE 248.A N ASP 244.A O no hydrogen 3.244 N/A LEU 249.A N LYS 245.A O no hydrogen 2.929 N/A LYS 250.A N LYS 246.A O no hydrogen 2.957 N/A LYS 250.A NZ GLU 254.A OE2 no hydrogen 2.964 N/A LEU 251.A N GLU 247.A O no hydrogen 3.060 N/A TYR 252.A N ILE 248.A O no hydrogen 2.946 N/A GLU 253.A N LEU 249.A O no hydrogen 2.838 N/A GLU 254.A N LYS 250.A O no hydrogen 3.084 N/A ASP 255.A N TYR 252.A O no hydrogen 2.905 N/A GLY 256.A N LEU 251.A O no hydrogen 2.832 N/A LEU 258.A N VAL 271.A O no hydrogen 2.683 N/A LEU 260.A N LYS 269.A O no hydrogen 2.698 N/A SER 261.A N ASN 218.A O no hydrogen 2.980 N/A HIS 262.A NE2 GLU 169.A O no hydrogen 3.073 N/A ARG 264.A N HIS 262.A ND1 no hydrogen 2.936 N/A ARG 264.A NE ASP 141.A OD2 no hydrogen 2.801 N/A ARG 264.A NH2 GLU 169.A O no hydrogen 3.021 N/A ARG 264.A NH2 GLU 169.A OE2 no hydrogen 2.918 N/A SER 265.A N HIS 262.A O no hydrogen 3.289 N/A LYS 269.A N LEU 260.A O no hydrogen 3.252 N/A LYS 269.A NZ GLU 223.A OE2 no hydrogen 2.813 N/A VAL 271.A N LEU 258.A O no hydrogen 2.983 N/A LYS 272.A NZ ASP 255.A O no hydrogen 3.352 N/A ILE 273.A N GLY 256.A O no hydrogen 3.116 N/A ARG 274.A NE TYR 252.A O no hydrogen 2.908 N/A ARG 274.A NH2 TYR 252.A O no hydrogen 3.119 N/A ARG 274.A NH2 GLU 253.A O no hydrogen 3.134 N/A LEU 276.A N LYS 272.A O no hydrogen 3.176 N/A PHE 277.A N ILE 273.A O no hydrogen 2.934 N/A ARG 278.A N ARG 274.A O no hydrogen 2.937 N/A ARG 278.A NH1 ASP 602.A OD1 no hydrogen 3.042 N/A ARG 278.A NH2 ASP 602.A OD1 no hydrogen 3.333 N/A LYS 279.A N GLU 275.A O no hydrogen 3.130 N/A LYS 279.A NZ ASP 227.A OD2 no hydrogen 2.724 N/A ILE 280.A N LEU 276.A O no hydrogen 3.077 N/A ALA 281.A N PHE 277.A O no hydrogen 2.855 N/A THR 282.A N ARG 278.A O no hydrogen 2.769 N/A THR 282.A OG1 ARG 278.A O no hydrogen 2.673 N/A ASN 283.A N LYS 279.A O no hydrogen 3.010 N/A ASN 283.A ND2 LYS 229.A O no hydrogen 3.452 N/A ASN 283.A ND2 ASP 289.A O no hydrogen 2.801 N/A ALA 284.A N ILE 280.A O no hydrogen 2.894 N/A TRP 285.A N ALA 281.A O no hydrogen 2.829 N/A TRP 285.A NE1 ALA 599.A O no hydrogen 2.850 N/A LYS 286.A N THR 282.A O no hydrogen 3.047 N/A SER 287.A N ASN 283.A O no hydrogen 2.911 N/A SER 287.A OG ASN 283.A O no hydrogen 2.869 N/A GLY 288.A N ALA 284.A O no hydrogen 2.779 N/A ASP 289.A N SER 287.A OG no hydrogen 3.077 N/A GLY 291.A N LEU 237.A O no hydrogen 2.831 N/A LEU 292.A N ILE 619.A O no hydrogen 3.063 N/A ALA 293.A N VAL 239.A O no hydrogen 2.861 N/A PHE 294.A N ARG 617.A O no hydrogen 2.842 N/A LEU 295.A N ALA 293.A O no hydrogen 2.964 N/A GLY 296.A N PHE 241.A O no hydrogen 3.074 N/A MET 298.A N PHE 294.A O no hydrogen 3.163 N/A ASN 299.A N LEU 295.A O no hydrogen 2.957 N/A ASN 299.A ND2 ILE 310.A O no hydrogen 2.938 N/A LYS 300.A N GLY 296.A O no hydrogen 2.885 N/A LYS 300.A NZ TYR 301.A OH no hydrogen 2.704 N/A TYR 301.A N MET 298.A O no hydrogen 3.217 N/A TYR 302.A N ASN 299.A O no hydrogen 3.165 N/A TYR 302.A OH SER 322.A OG no hydrogen 3.341 N/A TYR 305.A N TYR 302.A O no hydrogen 3.194 N/A ARG 308.A N LEU 304.A O no hydrogen 2.873 N/A ARG 308.A NH2 GLU 379.A OE1 no hydrogen 3.193 N/A ILE 310.A N ASN 299.A OD1 no hydrogen 2.925 N/A SER 312.A OG THR 313.A O no hydrogen 2.866 N/A THR 313.A OG1 ASN 314.A O no hydrogen 2.919 N/A ASN 314.A N ILE 319.A O no hydrogen 3.371 N/A ASN 314.A ND2 GLU 318.A OE1 no hydrogen 3.109 N/A GLY 317.A N ASN 314.A O no hydrogen 3.240 N/A GLU 318.A N GLU 318.A OE1 no hydrogen 2.836 N/A ILE 319.A N ASN 314.A OD1 no hydrogen 2.981 N/A LEU 321.A N SER 312.A O no hydrogen 3.028 N/A SER 322.A N GLU 325.A OE1 no hydrogen 3.023 N/A SER 322.A OG TYR 302.A OH no hydrogen 3.341 N/A SER 322.A OG GLU 325.A OE1 no hydrogen 2.747 N/A TYR 324.A N VAL 136.A O no hydrogen 2.967 N/A GLU 325.A N SER 322.A O no hydrogen 2.969 N/A CYS 327.A N CYS 134.A O no hydrogen 2.961 N/A CYS 327.A SG ASN 328.A O no hydrogen 3.838 N/A CYS 327.A SG ARG 382.A O no hydrogen 3.609 N/A ASN 328.A ND2 LEU 359.A O no hydrogen 2.982 N/A LEU 329.A N ASN 90.A OD1 no hydrogen 2.819 N/A GLY 330.A N GLY 384.A O no hydrogen 3.138 N/A SER 331.A N ILE 88.A O no hydrogen 2.996 N/A ILE 332.A N GLY 386.A O no hydrogen 2.860 N/A ASP 333.A N LEU 86.A O no hydrogen 2.996 N/A VAL 334.A N MET 388.A O no hydrogen 3.063 N/A ALA 335.A N ASP 333.A OD1 no hydrogen 3.074 N/A LYS 336.A N ASP 333.A O no hydrogen 3.151 N/A LYS 336.A NZ ARG 85.A O no hydrogen 2.821 N/A LYS 336.A NZ ASP 333.A OD2 no hydrogen 2.943 N/A LYS 336.A NZ ALA 492.A O no hydrogen 3.291 N/A PHE 337.A N VAL 334.A O no hydrogen 2.986 N/A TYR 338.A N ALA 335.A O no hydrogen 3.503 N/A ASN 339.A N PHE 342.A O no hydrogen 2.840 N/A GLY 341.A N TYR 338.A OH no hydrogen 3.125 N/A PHE 342.A N ASN 339.A O no hydrogen 3.219 N/A ASP 344.A N PHE 337.A O no hydrogen 2.844 N/A ALA 347.A N ASP 344.A OD1 no hydrogen 3.057 N/A LEU 348.A N ASP 344.A O no hydrogen 3.013 N/A GLN 349.A N LEU 345.A O no hydrogen 3.056 N/A GLN 349.A NE2 GLN 353.A OE1 no hydrogen 3.254 N/A LEU 351.A N ALA 347.A O no hydrogen 3.181 N/A VAL 352.A N LEU 348.A O no hydrogen 2.956 N/A GLN 353.A N GLN 349.A O no hydrogen 3.164 N/A ILE 354.A N GLU 350.A O no hydrogen 3.120 N/A ALA 355.A N LEU 351.A O no hydrogen 2.802 N/A VAL 356.A N VAL 352.A O no hydrogen 3.020 N/A ARG 357.A N GLN 353.A O no hydrogen 3.381 N/A ARG 357.A NE GLU 56.A OE2 no hydrogen 3.065 N/A ARG 357.A NH1 GLU 431.A OE1 no hydrogen 2.917 N/A ARG 357.A NH2 GLU 56.A OE1 no hydrogen 2.998 N/A ARG 357.A NH2 GLU 56.A OE2 no hydrogen 3.568 N/A ARG 357.A NH2 GLU 431.A OE1 no hydrogen 3.515 N/A ARG 357.A NH2 GLU 431.A OE2 no hydrogen 2.983 N/A PHE 358.A N ILE 354.A O no hydrogen 2.842 N/A LEU 359.A N ALA 355.A O no hydrogen 2.909 N/A ASP 360.A N VAL 356.A O no hydrogen 2.946 N/A ASN 361.A N ARG 357.A O no hydrogen 2.923 N/A ASN 361.A ND2 VAL 52.A O no hydrogen 3.386 N/A ASN 361.A ND2 GLU 56.A OE2 no hydrogen 2.654 N/A VAL 362.A N PHE 358.A O no hydrogen 3.071 N/A ASP 364.A N ASN 361.A O no hydrogen 2.876 N/A VAL 365.A N VAL 362.A O no hydrogen 3.056 N/A ASN 366.A N ILE 363.A O no hydrogen 3.359 N/A ASN 366.A ND2 SER 132.A OG no hydrogen 2.611 N/A VAL 367.A N HIS 129.A O no hydrogen 2.933 N/A ILE 373.A N ILE 370.A O no hydrogen 3.078 N/A THR 374.A N ILE 370.A O no hydrogen 3.399 N/A LYS 375.A N ASP 371.A O no hydrogen 3.042 N/A ALA 376.A N LYS 372.A O no hydrogen 3.145 N/A VAL 377.A N ILE 373.A O no hydrogen 2.967 N/A LYS 378.A N THR 374.A O no hydrogen 3.019 N/A GLU 379.A N LYS 375.A O no hydrogen 2.974 N/A SER 380.A N ALA 376.A O no hydrogen 3.314 N/A SER 380.A N VAL 377.A O no hydrogen 3.254 N/A ARG 381.A N VAL 377.A O no hydrogen 2.780 N/A ARG 381.A NE ASP 360.A OD1 no hydrogen 2.863 N/A ARG 381.A NH1 ASP 364.A OD1 no hydrogen 3.511 N/A ARG 381.A NH2 ASP 360.A O no hydrogen 3.095 N/A ARG 381.A NH2 ASP 360.A OD1 no hydrogen 3.287 N/A ARG 381.A NH2 ASP 364.A OD1 no hydrogen 3.068 N/A ARG 382.A NE GLU 325.A OE2 no hydrogen 3.020 N/A ARG 382.A NH1 ASN 587.A OD1 no hydrogen 2.871 N/A ARG 382.A NH2 GLU 325.A OE1 no hydrogen 3.115 N/A ARG 382.A NH2 GLU 325.A OE2 no hydrogen 3.418 N/A LEU 383.A N ALA 478.A O no hydrogen 2.861 N/A GLY 384.A N ASN 328.A O no hydrogen 3.106 N/A LEU 385.A N LEU 479.A O no hydrogen 2.720 N/A GLY 386.A N GLY 330.A O no hydrogen 2.881 N/A MET 388.A N ILE 332.A O no hydrogen 2.861 N/A GLY 389.A N SER 495.A O no hydrogen 2.890 N/A ASP 392.A N SER 495.A OG no hydrogen 3.227 N/A LEU 393.A N GLY 389.A O no hydrogen 2.926 N/A LEU 394.A N PHE 390.A O no hydrogen 3.035 N/A TYR 395.A N ALA 391.A O no hydrogen 3.130 N/A TYR 395.A OH VAL 564.A O no hydrogen 2.787 N/A LYS 396.A N ASP 392.A O no hydrogen 3.133 N/A LYS 396.A NZ ALA 335.A O no hydrogen 2.807 N/A LEU 397.A N LEU 393.A O no hydrogen 2.970 N/A GLU 398.A N TYR 395.A O no hydrogen 3.021 N/A ILE 399.A N LEU 394.A O no hydrogen 2.924 N/A TYR 401.A OH LEU 498.A O no hydrogen 2.755 N/A SER 403.A OG PRO 400.A O no hydrogen 2.681 N/A GLN 404.A NE2 GLN 404.A O no hydrogen 3.645 N/A GLN 404.A NE2 ASP 408.A OD1 no hydrogen 3.117 N/A ALA 406.A N SER 403.A OG no hydrogen 2.946 N/A ARG 407.A N SER 403.A O no hydrogen 3.410 N/A ARG 407.A NH1 ASP 573.A OD1 no hydrogen 3.395 N/A ARG 407.A NH2 GLN 404.A OE1 no hydrogen 2.887 N/A ASP 408.A N GLN 404.A O no hydrogen 2.930 N/A PHE 409.A N GLU 405.A O no hydrogen 3.043 N/A ALA 410.A N ALA 406.A O no hydrogen 2.849 N/A ALA 411.A N ARG 407.A O no hydrogen 2.933 N/A ASN 412.A N ASP 408.A O no hydrogen 3.155 N/A LEU 413.A N PHE 409.A O no hydrogen 2.793 N/A MET 414.A N ALA 410.A O no hydrogen 2.915 N/A ALA 415.A N ALA 411.A O no hydrogen 2.734 N/A PHE 416.A N ASN 412.A O no hydrogen 3.017 N/A ILE 417.A N LEU 413.A O no hydrogen 3.035 N/A ALA 418.A N MET 414.A O no hydrogen 2.859 N/A LEU 419.A N ALA 415.A O no hydrogen 2.867 N/A HIS 420.A N PHE 416.A O no hydrogen 3.150 N/A ALA 421.A N ILE 417.A O no hydrogen 2.856 N/A HIS 422.A N ALA 418.A O no hydrogen 2.996 N/A HIS 422.A NE2 ASP 586.A OD1 no hydrogen 2.739 N/A ARG 423.A N LEU 419.A O no hydrogen 2.991 N/A THR 424.A N HIS 420.A O no hydrogen 3.091 N/A SER 425.A N ALA 421.A O no hydrogen 3.006 N/A SER 425.A OG ASN 476.A OD1 no hydrogen 2.838 N/A TYR 426.A N HIS 422.A O no hydrogen 2.978 N/A GLU 427.A N ARG 423.A O no hydrogen 3.100 N/A LEU 428.A N THR 424.A O no hydrogen 2.884 N/A GLY 429.A N SER 425.A O no hydrogen 2.928 N/A LYS 430.A N TYR 426.A O no hydrogen 3.096 N/A GLU 431.A N GLU 427.A O no hydrogen 2.881 N/A LYS 432.A N LEU 428.A O no hydrogen 2.763 N/A LYS 432.A NZ GLU 56.A OE1 no hydrogen 3.276 N/A LYS 432.A NZ GLU 56.A OE2 no hydrogen 2.627 N/A LYS 432.A NZ ASN 361.A OD1 no hydrogen 2.711 N/A GLY 433.A N GLY 429.A O no hydrogen 2.896 N/A ASN 434.A ND2 GLU 472.A O no hydrogen 3.132 N/A PHE 435.A N ARG 474.A O no hydrogen 3.089 N/A LEU 437.A N GLU 379.A O no hydrogen 3.272 N/A LEU 438.A N PHE 435.A O no hydrogen 2.868 N/A ILE 440.A N LEU 437.A O no hydrogen 3.139 N/A SER 441.A N LEU 438.A O no hydrogen 2.916 N/A SER 441.A OG LEU 438.A O no hydrogen 2.817 N/A ARG 442.A N PRO 303.A O no hydrogen 2.789 N/A ARG 442.A NE GLU 446.A OE2 no hydrogen 3.089 N/A ARG 442.A NH1 ASN 299.A O no hydrogen 3.202 N/A ARG 442.A NH1 LYS 300.A O no hydrogen 2.986 N/A ARG 442.A NH1 TYR 302.A O no hydrogen 3.022 N/A ARG 442.A NH2 LYS 300.A O no hydrogen 2.821 N/A TYR 443.A N SER 441.A OG no hydrogen 3.267 N/A TYR 443.A OH VAL 477.A O no hydrogen 3.271 N/A ARG 444.A N SER 441.A O no hydrogen 2.990 N/A ARG 444.A NH1 LYS 471.A O no hydrogen 2.565 N/A THR 445.A N SER 441.A O no hydrogen 3.015 N/A THR 445.A OG1 SER 441.A O no hydrogen 3.362 N/A GLU 446.A N ARG 442.A O no hydrogen 3.352 N/A MET 454.A N ARG 583.A O no hydrogen 2.787 N/A GLY 455.A N ASP 460.A OD1 no hydrogen 2.902 N/A MET 456.A N TYR 584.A OH no hydrogen 2.859 N/A SER 457.A OG ASN 412.A OD1 no hydrogen 2.632 N/A TYR 459.A N SER 457.A OG no hydrogen 3.039 N/A ILE 463.A N TYR 459.A O no hydrogen 2.993 N/A ARG 464.A N ASP 460.A O no hydrogen 2.997 N/A ARG 464.A NE ASP 461.A OD1 no hydrogen 3.377 N/A ARG 464.A NH2 ASP 461.A OD1 no hydrogen 3.220 N/A GLU 465.A N ASP 461.A O no hydrogen 3.177 N/A VAL 466.A N GLU 462.A O no hydrogen 3.035 N/A MET 467.A N ILE 463.A O no hydrogen 2.933 N/A LYS 468.A N ARG 464.A O no hydrogen 3.176 N/A MET 469.A N GLU 465.A O no hydrogen 3.000 N/A THR 470.A N VAL 466.A O no hydrogen 3.127 N/A THR 470.A N MET 467.A O no hydrogen 3.222 N/A THR 470.A OG1 PHE 473.A O no hydrogen 2.991 N/A LYS 471.A N LYS 468.A O no hydrogen 3.053 N/A LYS 471.A NZ GLU 446.A O no hydrogen 2.871 N/A LYS 471.A NZ ASP 447.A OD2 no hydrogen 2.886 N/A GLU 472.A N MET 469.A O no hydrogen 3.118 N/A ARG 474.A N ASN 434.A OD1 no hydrogen 3.027 N/A ARG 474.A NH1 HIS 422.A ND1 no hydrogen 3.129 N/A ARG 474.A NH1 ASN 476.A O no hydrogen 3.089 N/A ARG 474.A NH2 HIS 422.A ND1 no hydrogen 2.923 N/A ARG 475.A N SER 425.A O no hydrogen 3.039 N/A ARG 475.A NE ASP 360.A OD2 no hydrogen 2.957 N/A ARG 475.A NH1 GLY 433.A O no hydrogen 2.975 N/A ASN 476.A ND2 ASP 360.A OD1 no hydrogen 3.004 N/A ASN 476.A ND2 ARG 381.A O no hydrogen 2.831 N/A VAL 477.A N SER 380.A O no hydrogen 3.109 N/A LEU 479.A N ASP 586.A OD1 no hydrogen 2.899 N/A LEU 479.A N ASP 586.A OD2 no hydrogen 3.209 N/A LEU 480.A N ASP 586.A OD2 no hydrogen 2.706 N/A THR 481.A N LEU 385.A O no hydrogen 2.842 N/A THR 481.A OG1 GLU 318.A O no hydrogen 3.163 N/A THR 481.A OG1 ASN 588.A O no hydrogen 2.979 N/A THR 485.A OG1 PRO 484.A O no hydrogen 2.612 N/A SER 489.A N THR 485.A O no hydrogen 3.013 N/A SER 489.A OG THR 485.A O no hydrogen 2.638 N/A SER 489.A OG SER 496.A OG no hydrogen 2.739 N/A ILE 491.A N SER 487.A O no hydrogen 3.132 N/A ALA 492.A N ILE 488.A O no hydrogen 2.988 N/A ASP 493.A N ASN 490.A O no hydrogen 3.052 N/A THR 494.A N SER 489.A O no hydrogen 2.965 N/A THR 494.A OG1 ASP 333.A OD1 no hydrogen 2.980 N/A THR 494.A OG1 ASP 333.A OD2 no hydrogen 3.113 N/A SER 495.A N ASP 392.A OD2 no hydrogen 3.137 N/A SER 496.A OG SER 489.A OG no hydrogen 2.739 N/A GLY 497.A N THR 485.A OG1 no hydrogen 2.752 N/A GLU 499.A N SER 496.A O no hydrogen 2.915 N/A ASN 501.A ND2 ASP 392.A OD1 no hydrogen 2.973 N/A ASN 501.A ND2 TYR 395.A OH no hydrogen 3.438 N/A TYR 506.A N TYR 522.A O no hydrogen 2.947 N/A VAL 510.A N GLU 518.A O no hydrogen 3.225 N/A LYS 512.A N THR 516.A O no hydrogen 3.037 N/A THR 516.A OG1 GLY 515.A O no hydrogen 1.939 N/A GLU 518.A N VAL 510.A O no hydrogen 3.127 N/A LEU 520.A N ARG 508.A O no hydrogen 3.070 N/A TYR 522.A N TYR 506.A O no hydrogen 2.650 N/A ASN 524.A N LEU 504.A O no hydrogen 2.713 N/A ASN 524.A ND2 ASP 392.A OD1 no hydrogen 3.193 N/A LEU 527.A N ASN 524.A OD1 no hydrogen 3.258 N/A ARG 528.A N ASN 524.A O no hydrogen 2.993 N/A GLU 529.A N GLN 525.A O no hydrogen 3.055 N/A LYS 530.A N VAL 526.A O no hydrogen 3.027 N/A LYS 530.A N LEU 527.A O no hydrogen 3.131 N/A LYS 530.A NZ TYR 395.A O no hydrogen 2.706 N/A LEU 531.A N LEU 527.A O no hydrogen 2.896 N/A LEU 536.A N ASN 532.A O no hydrogen 3.136 N/A LYS 537.A N PRO 533.A O no hydrogen 3.196 N/A ARG 538.A N GLU 534.A O no hydrogen 3.238 N/A ARG 538.A NH1 ASP 554.A O no hydrogen 3.551 N/A ARG 538.A NH2 PRO 553.A O no hydrogen 2.358 N/A ILE 539.A N ILE 535.A O no hydrogen 2.919 N/A GLU 540.A N LEU 536.A O no hydrogen 2.948 N/A LEU 543.A N ILE 539.A O no hydrogen 2.897 N/A ILE 544.A N GLU 540.A O no hydrogen 2.964 N/A GLU 545.A N LYS 541.A O no hydrogen 3.150 N/A LYS 546.A N GLU 542.A O no hydrogen 2.887 N/A LYS 546.A NZ GLU 542.A OE2 no hydrogen 2.667 N/A GLY 547.A N LEU 543.A O no hydrogen 2.867 N/A SER 548.A OG ASP 568.A OD1 no hydrogen 2.570 N/A SER 548.A OG ASP 568.A OD2 no hydrogen 3.163 N/A LYS 550.A N SER 548.A OG no hydrogen 3.126 N/A ILE 552.A N LEU 549.A O no hydrogen 2.947 N/A LYS 560.A N PRO 556.A O no hydrogen 3.010 N/A LYS 560.A NZ LYS 550.A O no hydrogen 2.682 N/A LYS 560.A NZ ILE 552.A O no hydrogen 2.756 N/A LYS 561.A N GLU 557.A O no hydrogen 2.861 N/A VAL 562.A N LYS 558.A O no hydrogen 3.161 N/A PHE 563.A N ILE 559.A O no hydrogen 2.936 N/A VAL 565.A N ASP 568.A OD2 no hydrogen 3.070 N/A ALA 566.A N ASN 501.A O no hydrogen 2.963 N/A ASP 568.A N VAL 565.A O no hydrogen 2.915 N/A ILE 569.A N ALA 566.A O no hydrogen 3.127 N/A ASP 573.A N ASP 570.A OD1 no hydrogen 2.870 N/A HIS 574.A N ASP 570.A O no hydrogen 3.004 N/A HIS 574.A NE2 ALA 566.A O no hydrogen 2.910 N/A LEU 575.A N PRO 571.A O no hydrogen 2.925 N/A LEU 576.A N MET 572.A O no hydrogen 2.806 N/A MET 577.A N ASP 573.A O no hydrogen 3.242 N/A GLN 578.A N HIS 574.A O no hydrogen 3.184 N/A GLN 578.A NE2 GLY 618.A O no hydrogen 2.955 N/A ASP 579.A N LEU 575.A O no hydrogen 3.082 N/A ALA 580.A N LEU 576.A O no hydrogen 3.146 N/A PHE 581.A N MET 577.A O no hydrogen 3.214 N/A GLN 582.A N GLN 578.A O no hydrogen 2.895 N/A GLN 582.A NE2 GLN 582.A O no hydrogen 3.082 N/A GLN 582.A NE2 ASN 587.A O no hydrogen 2.918 N/A ARG 583.A N ASP 579.A O no hydrogen 3.037 N/A ARG 583.A NE ASP 579.A OD1 no hydrogen 2.854 N/A ARG 583.A NH1 ASP 579.A OD1 no hydrogen 3.542 N/A ARG 583.A NH2 MET 454.A O no hydrogen 2.802 N/A TYR 584.A N PHE 581.A O no hydrogen 2.994 N/A TYR 584.A OH ASP 460.A OD1 no hydrogen 3.227 N/A TYR 584.A OH ASP 460.A OD2 no hydrogen 2.554 N/A VAL 585.A N GLN 582.A O no hydrogen 3.387 N/A ASN 587.A N LEU 480.A O no hydrogen 3.274 N/A ASN 587.A ND2 LEU 383.A O no hydrogen 3.054 N/A ASN 587.A ND2 LEU 480.A O no hydrogen 2.846 N/A ASN 588.A N GLU 318.A O no hydrogen 2.881 N/A ASN 588.A ND2 GLY 317.A O no hydrogen 3.079 N/A SER 590.A N ILE 482.A O no hydrogen 2.890 N/A LYS 591.A NZ GLU 499.A OE1 no hydrogen 2.772 N/A LYS 591.A NZ HIS 574.A ND1 no hydrogen 2.891 N/A LYS 591.A NZ THR 592.A O no hydrogen 2.670 N/A THR 592.A N GLU 499.A OE2 no hydrogen 2.955 N/A ILE 593.A N THR 620.A O no hydrogen 2.838 N/A MET 595.A N TYR 622.A O no hydrogen 2.857 N/A ALA 599.A N PRO 596.A O no hydrogen 2.856 N/A THR 600.A N ASP 603.A OD2 no hydrogen 3.168 N/A ASP 603.A N THR 600.A OG1 no hydrogen 3.015 N/A VAL 604.A N THR 600.A O no hydrogen 3.164 N/A LEU 605.A N VAL 601.A O no hydrogen 2.861 N/A ASN 606.A N ASP 602.A O no hydrogen 2.962 N/A VAL 607.A N ASP 603.A O no hydrogen 3.156 N/A TYR 608.A N VAL 604.A O no hydrogen 3.122 N/A LEU 609.A N LEU 605.A O no hydrogen 2.845 N/A GLU 610.A N ASN 606.A O no hydrogen 2.868 N/A ALA 611.A N VAL 607.A O no hydrogen 2.798 N/A LEU 612.A N TYR 608.A O no hydrogen 3.079 N/A ARG 613.A N GLU 610.A O no hydrogen 3.059 N/A ARG 613.A NE GLU 610.A OE1 no hydrogen 3.197 N/A ARG 613.A NH2 GLU 610.A OE1 no hydrogen 3.204 N/A THR 614.A N GLU 610.A O no hydrogen 3.101 N/A THR 614.A N ALA 611.A O no hydrogen 3.291 N/A THR 614.A OG1 ALA 611.A O no hydrogen 2.894 N/A ASN 615.A N ASP 579.A OD2 no hydrogen 2.834 N/A ASN 615.A ND2 ASP 579.A OD2 no hydrogen 3.072 N/A ARG 617.A NE ASN 588.A OD1 no hydrogen 3.326 N/A ILE 619.A N LEU 292.A O no hydrogen 2.926 N/A TYR 622.A N ILE 593.A O no hydrogen 3.090 N/A ARG 623.A NE TRP 285.A O no hydrogen 2.949 N/A ARG 623.A NH1 GLN 597.A O no hydrogen 3.106 N/A ARG 623.A NH2 TRP 285.A O no hydrogen 3.012 N/A ASP 624.A N MET 595.A O no hydrogen 2.782 N/A SER 626.A N ARG 623.A O no hydrogen 3.070 N/A SER 626.A OG ARG 623.A O no hydrogen 2.760 N/A LEU 627.A N TYR 622.A OH no hydrogen 3.240 N/A