Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1nqe_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): VAL 4.A N GLN 12.A O no hydrogen 2.910 N/A VAL 5.A N GLU 103.A OE1 no hydrogen 2.949 N/A THR 6.A OG1 GLU 103.A OE1 no hydrogen 2.658 N/A ASN 8.A ND2 PHE 10.A O no hydrogen 2.878 N/A ARG 9.A NH2 VAL 112.A O no hydrogen 2.904 N/A ARG 9.A NH2 ASP 271.A OD2 no hydrogen 3.385 N/A GLN 12.A N VAL 4.A O no hydrogen 2.834 N/A ARG 14.A N THR 2.A O no hydrogen 2.870 N/A ARG 14.A NH1 ASP 1.A O no hydrogen 3.401 N/A ARG 14.A NH2 THR 21.A O no hydrogen 2.616 N/A THR 16.A N PRO 13.A O no hydrogen 2.956 N/A VAL 17.A N ARG 14.A O no hydrogen 2.872 N/A LEU 18.A N GLU 309.A OE2 no hydrogen 2.818 N/A THR 22.A N TYR 104.A O no hydrogen 2.809 N/A VAL 24.A N VAL 102.A O no hydrogen 2.886 N/A THR 25.A N ASP 28.A OD2 no hydrogen 2.922 N/A ARG 26.A NE VAL 99.A O no hydrogen 3.135 N/A ARG 26.A NH2 ILE 96.A O no hydrogen 3.135 N/A ARG 26.A NH2 VAL 99.A O no hydrogen 2.631 N/A ASP 28.A N THR 25.A OG1 no hydrogen 3.108 N/A ILE 29.A N THR 25.A O no hydrogen 3.076 N/A ASP 30.A N ARG 26.A O no hydrogen 2.771 N/A ARG 31.A N GLN 27.A O no hydrogen 3.087 N/A ARG 31.A NE ASP 470.A OD1 no hydrogen 2.669 N/A ARG 31.A NE ASP 470.A OD2 no hydrogen 3.215 N/A ARG 31.A NH1 ASP 463.A OD1 no hydrogen 2.921 N/A ARG 31.A NH2 ASP 463.A OD1 no hydrogen 3.105 N/A ARG 31.A NH2 ASP 470.A OD2 no hydrogen 2.845 N/A TRP 32.A N ASP 28.A O no hydrogen 2.934 N/A GLN 33.A N ILE 29.A O no hydrogen 2.977 N/A GLN 33.A NE2 VAL 506.A O no hydrogen 3.351 N/A GLN 33.A NE2 GLY 518.A O no hydrogen 3.019 N/A SER 34.A OG ASP 39.A OD1 no hydrogen 2.725 N/A ASN 38.A ND2 SER 59.A OG no hydrogen 3.093 N/A ASP 39.A N SER 36.A OG no hydrogen 3.191 N/A LEU 41.A N VAL 37.A O no hydrogen 3.021 N/A ARG 42.A N ASN 38.A O no hydrogen 2.965 N/A ARG 42.A NE GLN 476.A OE1 no hydrogen 3.426 N/A ARG 42.A NH1 ASP 39.A OD2 no hydrogen 2.656 N/A ARG 42.A NH2 ASP 503.A OD2 no hydrogen 2.261 N/A ARG 43.A N VAL 40.A O no hydrogen 3.304 N/A ARG 43.A NE ASP 39.A O no hydrogen 3.034 N/A ARG 43.A NH2 ASP 39.A OD1 no hydrogen 2.991 N/A LEU 44.A N LEU 41.A O no hydrogen 3.099 N/A GLY 46.A N ASP 437.A OD2 no hydrogen 2.795 N/A VAL 47.A N LEU 44.A O no hydrogen 3.349 N/A ASP 48.A N PHE 62.A O no hydrogen 3.067 N/A THR 50.A N SER 60.A O no hydrogen 3.167 N/A GLN 51.A N THR 530.A OG1 no hydrogen 2.876 N/A GLN 51.A NE2 GLN 57.A O no hydrogen 2.952 N/A ASN 52.A N LEU 58.A O no hydrogen 2.937 N/A GLN 57.A N GLY 54.A O no hydrogen 3.382 N/A GLN 57.A NE2 SER 55.A O no hydrogen 3.591 N/A GLN 57.A NE2 ASN 205.A O no hydrogen 3.585 N/A SER 59.A N ASP 90.A OD2 no hydrogen 3.010 N/A SER 59.A OG ASP 90.A OD1 no hydrogen 2.634 N/A SER 60.A N THR 50.A O no hydrogen 2.903 N/A PHE 62.A N ASP 48.A O no hydrogen 2.824 N/A ARG 64.A N GLY 46.A O no hydrogen 2.929 N/A ARG 64.A NH1 GLU 374.A OE2 no hydrogen 2.863 N/A ARG 64.A NH2 GLU 374.A OE1 no hydrogen 3.007 N/A ARG 64.A NH2 GLU 420.A OE1 no hydrogen 2.969 N/A THR 66.A N ILE 63.A O no hydrogen 2.927 N/A THR 66.A OG1 ILE 63.A O no hydrogen 2.740 N/A HIS 70.A N ASN 67.A O no hydrogen 2.888 N/A HIS 70.A NE2 GLU 368.A OE1 no hydrogen 2.621 N/A LEU 72.A N GLY 120.A O no hydrogen 3.183 N/A LEU 74.A N VAL 122.A O no hydrogen 2.856 N/A ILE 75.A N VAL 78.A O no hydrogen 2.828 N/A ASP 76.A N ILE 124.A O no hydrogen 2.755 N/A GLY 77.A N ASN 123.A OD1 no hydrogen 3.010 N/A VAL 78.A N ILE 75.A O no hydrogen 3.057 N/A ARG 79.A NE ASP 116.A OD2 no hydrogen 3.165 N/A ARG 79.A NH2 TYR 113.A O no hydrogen 3.197 N/A ARG 79.A NH2 SER 115.A O no hydrogen 2.810 N/A LEU 80.A N VAL 73.A O no hydrogen 2.948 N/A ASN 81.A ND2 SER 212.A OG no hydrogen 2.693 N/A ALA 83.A N LEU 80.A O no hydrogen 3.075 N/A GLY 84.A N ASN 81.A O no hydrogen 2.587 N/A SER 88.A N ALA 83.A O no hydrogen 3.321 N/A SER 92.A N ASP 90.A OD1 no hydrogen 3.134 N/A SER 92.A OG GLY 56.A O no hydrogen 3.550 N/A SER 92.A OG GLN 57.A O no hydrogen 3.149 N/A SER 92.A OG ASP 90.A OD1 no hydrogen 3.282 N/A PHE 94.A N LEU 91.A O no hydrogen 3.009 N/A LEU 98.A N PRO 95.A O no hydrogen 3.102 N/A VAL 99.A N ILE 96.A O no hydrogen 2.905 N/A GLN 100.A N ILE 125.A O no hydrogen 2.864 N/A ARG 101.A N ILE 125.A O no hydrogen 3.188 N/A ARG 101.A NE GLU 103.A OE2 no hydrogen 2.907 N/A ARG 101.A NH1 ASP 1.A OD2 no hydrogen 3.087 N/A ARG 101.A NH2 GLU 103.A OE2 no hydrogen 3.539 N/A VAL 102.A N VAL 24.A O no hydrogen 2.903 N/A GLU 103.A N ASN 123.A O no hydrogen 2.857 N/A TYR 104.A N THR 22.A O no hydrogen 2.925 N/A TYR 104.A OH PRO 45.A O no hydrogen 2.735 N/A ILE 105.A N VAL 121.A O no hydrogen 2.897 N/A ARG 106.A N PRO 20.A O no hydrogen 3.048 N/A ARG 106.A NE GLU 420.A OE1 no hydrogen 2.712 N/A ARG 106.A NE GLU 420.A OE2 no hydrogen 3.295 N/A ARG 106.A NH1 THR 22.A OG1 no hydrogen 2.823 N/A ARG 106.A NH2 GLU 420.A OE2 no hydrogen 2.753 N/A GLY 107.A N GLY 119.A O no hydrogen 2.919 N/A ARG 109.A N ALA 117.A O no hydrogen 2.969 N/A ARG 109.A NH1 ALA 7.A O no hydrogen 2.852 N/A SER 110.A OG GLY 114.A O no hydrogen 2.796 N/A VAL 112.A N ARG 109.A O no hydrogen 3.154 N/A TYR 113.A N ARG 109.A O no hydrogen 2.895 N/A TYR 113.A OH THR 6.A O no hydrogen 2.767 N/A GLY 114.A N SER 110.A O no hydrogen 2.762 N/A SER 115.A OG ASP 116.A OD1 no hydrogen 2.467 N/A ASP 116.A N TYR 348.A O no hydrogen 2.873 N/A ILE 118.A N HIS 70.A O no hydrogen 3.303 N/A ILE 118.A N ASP 116.A O no hydrogen 2.838 N/A GLY 119.A N HIS 70.A O no hydrogen 2.878 N/A VAL 121.A N ILE 105.A O no hydrogen 2.821 N/A VAL 122.A N LEU 72.A O no hydrogen 2.874 N/A ASN 123.A N GLU 103.A O no hydrogen 2.863 N/A ASN 123.A ND2 THR 6.A OG1 no hydrogen 3.032 N/A ILE 124.A N LEU 74.A O no hydrogen 2.892 N/A ILE 125.A N ARG 101.A O no hydrogen 2.816 N/A THR 126.A N ASP 76.A OD1 no hydrogen 2.862 N/A THR 126.A OG1 ASP 76.A OD1 no hydrogen 3.401 N/A THR 126.A OG1 ASP 76.A OD2 no hydrogen 2.398 N/A THR 126.A OG1 TYR 180.A OH no hydrogen 3.344 N/A GLY 132.A N GLN 152.A O no hydrogen 2.964 N/A GLU 134.A N SER 150.A O no hydrogen 2.827 N/A ILE 135.A N TYR 547.A O no hydrogen 2.909 N/A SER 136.A N ASP 148.A O no hydrogen 3.006 N/A ALA 137.A N GLY 545.A O no hydrogen 3.097 N/A GLY 138.A N ASN 146.A O no hydrogen 2.914 N/A TRP 139.A N LEU 543.A O no hydrogen 2.866 N/A GLY 140.A N TYR 144.A O no hydrogen 3.061 N/A SER 141.A N TYR 541.A O no hydrogen 2.893 N/A SER 141.A OG TYR 541.A O no hydrogen 3.411 N/A SER 143.A OG ASN 142.A O no hydrogen 2.603 N/A SER 143.A OG HIS 169.A NE2 no hydrogen 3.179 N/A GLN 145.A N HIS 169.A O no hydrogen 2.867 N/A ASN 146.A N GLY 138.A O no hydrogen 3.033 N/A ASN 146.A ND2 ASP 166.A OD1 no hydrogen 2.887 N/A ASN 146.A ND2 TYR 167.A O no hydrogen 3.002 N/A TYR 147.A N TYR 167.A O no hydrogen 3.179 N/A VAL 149.A N GLY 165.A O no hydrogen 2.976 N/A SER 150.A N GLU 134.A O no hydrogen 3.035 N/A THR 151.A N LEU 163.A O no hydrogen 2.811 N/A THR 151.A OG1 GLY 132.A O no hydrogen 3.357 N/A GLN 152.A N GLY 132.A O no hydrogen 2.844 N/A GLN 153.A N VAL 161.A O no hydrogen 3.008 N/A GLN 154.A NE2 GLY 156.A O no hydrogen 2.662 N/A LEU 155.A N THR 159.A O no hydrogen 2.896 N/A ARG 160.A N GLU 184.A O no hydrogen 2.823 N/A ARG 160.A NE GLN 152.A OE1 no hydrogen 3.489 N/A VAL 161.A N GLN 153.A O no hydrogen 2.910 N/A THR 162.A N ALA 182.A O no hydrogen 2.894 N/A THR 162.A OG1 GLN 152.A OE1 no hydrogen 2.977 N/A LEU 163.A N THR 151.A O no hydrogen 2.737 N/A LEU 164.A N TYR 180.A O no hydrogen 2.854 N/A GLY 165.A N VAL 149.A O no hydrogen 2.900 N/A ASP 166.A N THR 178.A O no hydrogen 3.008 N/A TYR 167.A N TYR 147.A O no hydrogen 2.888 N/A ALA 168.A N SER 176.A O no hydrogen 2.919 N/A HIS 169.A N GLN 145.A O no hydrogen 2.932 N/A HIS 169.A NE2 SER 143.A OG no hydrogen 3.179 N/A THR 170.A N PHE 174.A O no hydrogen 2.919 N/A HIS 171.A N ASN 142.A O no hydrogen 3.088 N/A PHE 174.A N THR 170.A O no hydrogen 2.931 N/A LEU 175.A N ARG 203.A O no hydrogen 2.883 N/A SER 176.A N ALA 168.A O no hydrogen 2.803 N/A LYS 177.A N ASP 201.A O no hydrogen 3.076 N/A THR 178.A N ASP 166.A O no hydrogen 2.934 N/A LEU 179.A N GLY 199.A O no hydrogen 3.044 N/A TYR 180.A N LEU 164.A O no hydrogen 2.922 N/A TYR 180.A OH THR 126.A OG1 no hydrogen 3.344 N/A GLY 181.A N GLY 197.A O no hydrogen 2.929 N/A ALA 182.A N THR 162.A O no hydrogen 3.016 N/A LEU 183.A N VAL 195.A O no hydrogen 2.791 N/A GLU 184.A N ARG 160.A O no hydrogen 2.901 N/A HIS 185.A N GLY 193.A O no hydrogen 2.774 N/A ASN 186.A N LYS 158.A O no hydrogen 2.753 N/A PHE 187.A N TRP 191.A O no hydrogen 2.976 N/A THR 188.A N TRP 191.A O no hydrogen 3.358 N/A TRP 191.A N THR 188.A OG1 no hydrogen 3.179 N/A SER 192.A N ARG 220.A O no hydrogen 2.874 N/A SER 192.A OG ASN 186.A OD1 no hydrogen 3.249 N/A GLY 193.A N HIS 185.A O no hydrogen 2.711 N/A PHE 194.A N GLY 218.A O no hydrogen 3.024 N/A VAL 195.A N LEU 183.A O no hydrogen 2.810 N/A ARG 196.A N ASP 216.A O no hydrogen 2.765 N/A GLY 197.A N GLY 181.A O no hydrogen 2.903 N/A TYR 198.A N SER 214.A O no hydrogen 2.996 N/A GLY 199.A N LEU 179.A O no hydrogen 3.054 N/A TYR 200.A N SER 212.A O no hydrogen 2.917 N/A ASP 201.A N LYS 177.A O no hydrogen 2.885 N/A ASN 202.A N LEU 210.A O no hydrogen 2.931 N/A ARG 203.A N LEU 175.A O no hydrogen 2.825 N/A THR 204.A N ARG 208.A O no hydrogen 3.041 N/A ASN 205.A N GLY 173.A O no hydrogen 2.945 N/A ARG 208.A N THR 204.A O no hydrogen 2.998 N/A ARG 208.A NE ASP 239.A OD1 no hydrogen 2.973 N/A ARG 208.A NE ASP 239.A OD2 no hydrogen 3.420 N/A ARG 208.A NH2 ASP 239.A OD2 no hydrogen 3.213 N/A LYS 209.A N TYR 240.A O no hydrogen 2.899 N/A LYS 209.A NZ ASP 201.A OD1 no hydrogen 2.694 N/A LYS 209.A NZ ASP 201.A OD2 no hydrogen 3.352 N/A LEU 210.A N ASN 202.A O no hydrogen 2.903 N/A TYR 211.A N LYS 238.A O no hydrogen 2.950 N/A SER 212.A N TYR 200.A O no hydrogen 3.221 N/A GLN 213.A N HIS 236.A O no hydrogen 3.019 N/A SER 214.A N TYR 198.A O no hydrogen 2.807 N/A SER 214.A OG SER 235.A OG no hydrogen 2.423 N/A TRP 215.A N TYR 234.A O no hydrogen 2.779 N/A ASP 216.A N ARG 196.A O no hydrogen 2.805 N/A ALA 217.A N THR 232.A O no hydrogen 2.903 N/A GLY 218.A N PHE 194.A O no hydrogen 3.090 N/A LEU 219.A N LEU 230.A O no hydrogen 2.913 N/A ARG 220.A N SER 192.A O no hydrogen 2.965 N/A ARG 220.A NH1 GLN 229.A OE1 no hydrogen 2.603 N/A TYR 221.A N SER 228.A O no hydrogen 2.853 N/A ASN 222.A N ALA 190.A O no hydrogen 2.758 N/A GLY 223.A N ILE 226.A O no hydrogen 2.866 N/A GLU 224.A N GLU 224.A OE1 no hydrogen 2.786 N/A LYS 227.A N ASN 258.A O no hydrogen 2.821 N/A SER 228.A N TYR 221.A O no hydrogen 2.835 N/A SER 228.A OG ALA 256.A O no hydrogen 3.271 N/A GLN 229.A N ALA 256.A O no hydrogen 2.860 N/A LEU 230.A N LEU 219.A O no hydrogen 2.841 N/A ILE 231.A N GLN 254.A O no hydrogen 2.890 N/A THR 232.A N ALA 217.A O no hydrogen 2.724 N/A SER 233.A N THR 252.A O no hydrogen 2.959 N/A SER 233.A OG TRP 215.A O no hydrogen 3.566 N/A SER 233.A OG ASP 216.A OD1 no hydrogen 3.213 N/A SER 233.A OG ASP 216.A OD2 no hydrogen 2.847 N/A TYR 234.A N TRP 215.A O no hydrogen 2.892 N/A SER 235.A N GLN 250.A O no hydrogen 3.043 N/A SER 235.A OG SER 214.A OG no hydrogen 2.423 N/A HIS 236.A N GLN 213.A O no hydrogen 2.996 N/A HIS 236.A NE2 GLU 247.A OE2 no hydrogen 2.682 N/A SER 237.A N MET 248.A O no hydrogen 3.114 N/A LYS 238.A N TYR 211.A O no hydrogen 2.884 N/A ASP 239.A N ASP 246.A O no hydrogen 2.709 N/A TYR 240.A N LYS 209.A O no hydrogen 2.687 N/A ASN 241.A N THR 244.A O no hydrogen 3.022 N/A TYR 242.A N THR 207.A O no hydrogen 2.895 N/A THR 244.A N ASN 241.A O no hydrogen 3.118 N/A ASP 246.A N ASP 239.A O no hydrogen 2.995 N/A GLU 247.A N THR 281.A OG1 no hydrogen 3.003 N/A MET 248.A N SER 237.A O no hydrogen 3.157 N/A LYS 249.A N THR 276.A O no hydrogen 2.907 N/A GLN 250.A N SER 235.A O no hydrogen 2.823 N/A GLN 250.A NE2 GLN 275.A OE1 no hydrogen 3.109 N/A TYR 251.A N LYS 274.A O no hydrogen 2.730 N/A THR 252.A N SER 233.A O no hydrogen 2.762 N/A VAL 253.A N TRP 272.A O no hydrogen 2.913 N/A GLN 254.A N ILE 231.A O no hydrogen 2.928 N/A GLN 254.A NE2 ASP 271.A OD1 no hydrogen 2.902 N/A TRP 255.A N VAL 270.A O no hydrogen 2.988 N/A ALA 256.A N GLN 229.A O no hydrogen 2.967 N/A ASN 257.A N ALA 268.A O no hydrogen 2.982 N/A ASN 258.A N LYS 227.A O no hydrogen 2.831 N/A VAL 259.A N ILE 266.A O no hydrogen 2.805 N/A ILE 260.A N LEU 225.A O no hydrogen 2.995 N/A VAL 261.A N GLY 264.A O no hydrogen 2.954 N/A SER 265.A N LEU 300.A O no hydrogen 2.901 N/A ILE 266.A N VAL 259.A O no hydrogen 2.971 N/A GLY 267.A N THR 298.A O no hydrogen 2.985 N/A ALA 268.A N ASN 257.A O no hydrogen 3.050 N/A GLY 269.A N TYR 296.A O no hydrogen 2.967 N/A VAL 270.A N TRP 255.A O no hydrogen 2.867 N/A ASP 271.A N GLY 294.A O no hydrogen 2.938 N/A TRP 272.A N VAL 253.A O no hydrogen 2.790 N/A GLN 273.A N ASN 292.A O no hydrogen 2.871 N/A LYS 274.A N TYR 251.A O no hydrogen 2.836 N/A GLN 275.A N GLN 290.A O no hydrogen 2.858 N/A GLN 275.A NE2 GLN 290.A OE1 no hydrogen 3.456 N/A THR 276.A N LYS 249.A O no hydrogen 2.937 N/A THR 277.A N TYR 288.A O no hydrogen 2.945 N/A THR 278.A N GLU 247.A O no hydrogen 3.224 N/A THR 278.A OG1 GLU 247.A OE1 no hydrogen 3.376 N/A GLY 280.A N GLU 285.A O no hydrogen 3.037 N/A THR 281.A N THR 278.A O no hydrogen 2.883 N/A THR 281.A OG1 GLU 247.A O no hydrogen 3.510 N/A THR 281.A OG1 THR 278.A O no hydrogen 2.946 N/A GLY 282.A N ASP 246.A OD1 no hydrogen 2.704 N/A VAL 284.A N THR 281.A O no hydrogen 3.167 N/A TYR 288.A N THR 277.A OG1 no hydrogen 3.008 N/A TYR 288.A OH GLU 285.A OE2 no hydrogen 2.811 N/A GLN 290.A N GLN 275.A O no hydrogen 2.872 N/A ARG 291.A N SER 318.A OG no hydrogen 2.955 N/A ARG 291.A NE ASP 289.A OD1 no hydrogen 2.956 N/A ARG 291.A NH2 ASP 289.A OD1 no hydrogen 3.539 N/A ARG 291.A NH2 ASP 289.A OD2 no hydrogen 2.684 N/A ASN 292.A N GLN 273.A O no hydrogen 2.863 N/A ASN 292.A ND2 ASN 317.A OD1 no hydrogen 3.209 N/A THR 293.A N ASP 316.A O no hydrogen 3.025 N/A GLY 294.A N ASP 271.A O no hydrogen 2.821 N/A ILE 295.A N SER 314.A O no hydrogen 2.812 N/A TYR 296.A N GLY 269.A O no hydrogen 3.056 N/A LEU 297.A N ALA 312.A O no hydrogen 2.994 N/A THR 298.A N GLY 267.A O no hydrogen 2.831 N/A GLY 299.A N GLY 310.A O no hydrogen 3.014 N/A LEU 300.A N SER 265.A O no hydrogen 3.070 N/A GLN 301.A N PHE 308.A O no hydrogen 2.901 N/A GLN 301.A NE2 VAL 261.A O no hydrogen 3.133 N/A GLN 302.A N HIS 263.A O no hydrogen 2.745 N/A VAL 303.A N PHE 306.A O no hydrogen 2.986 N/A PHE 306.A N VAL 303.A O no hydrogen 2.856 N/A THR 307.A N GLY 331.A O no hydrogen 2.884 N/A PHE 308.A N GLN 301.A O no hydrogen 2.955 N/A GLU 309.A N SER 329.A O no hydrogen 2.990 N/A GLY 310.A N GLY 299.A O no hydrogen 2.991 N/A ALA 311.A N GLN 327.A O no hydrogen 3.021 N/A ALA 312.A N LEU 297.A O no hydrogen 3.027 N/A ARG 313.A N THR 325.A O no hydrogen 2.879 N/A ARG 313.A NE ASP 315.A OD1 no hydrogen 2.949 N/A ARG 313.A NE ASP 315.A OD2 no hydrogen 3.146 N/A ARG 313.A NH1 VAL 112.A O no hydrogen 2.951 N/A ARG 313.A NH1 ASP 271.A OD2 no hydrogen 3.025 N/A ARG 313.A NH2 ASP 271.A OD2 no hydrogen 3.450 N/A ARG 313.A NH2 ASP 315.A OD2 no hydrogen 2.781 N/A SER 314.A N ILE 295.A O no hydrogen 2.795 N/A ASP 315.A N HIS 323.A O no hydrogen 3.058 N/A ASP 316.A N THR 293.A O no hydrogen 2.896 N/A ASN 317.A N GLY 321.A O no hydrogen 2.656 N/A SER 318.A N ARG 291.A O no hydrogen 2.850 N/A SER 318.A OG ARG 291.A O no hydrogen 3.276 N/A GLN 319.A NE2 PRO 363.A O no hydrogen 3.266 N/A GLN 319.A NE2 LEU 365.A O no hydrogen 2.884 N/A GLY 321.A N ASN 317.A O no hydrogen 2.719 N/A ARG 322.A NE SER 314.A OG no hydrogen 3.396 N/A HIS 323.A N ASP 315.A O no hydrogen 2.753 N/A THR 325.A N ARG 313.A O no hydrogen 2.978 N/A TRP 326.A N THR 346.A OG1 no hydrogen 3.045 N/A GLN 327.A N ALA 311.A O no hydrogen 2.942 N/A GLN 327.A NE2 PRO 108.A O no hydrogen 3.348 N/A THR 328.A N TYR 344.A O no hydrogen 2.888 N/A SER 329.A N GLU 309.A O no hydrogen 2.812 N/A SER 329.A OG SER 343.A OG no hydrogen 2.413 N/A ALA 330.A N ALA 342.A O no hydrogen 2.948 N/A GLY 331.A N THR 307.A O no hydrogen 2.755 N/A TRP 332.A N PHE 340.A O no hydrogen 2.833 N/A GLU 333.A N ASP 305.A O no hydrogen 2.855 N/A GLY 337.A N GLU 333.A OE2 no hydrogen 2.962 N/A TYR 338.A N ILE 335.A O no hydrogen 2.969 N/A ARG 339.A N GLU 378.A O no hydrogen 2.917 N/A ARG 339.A NE GLU 378.A OE1 no hydrogen 2.859 N/A ARG 339.A NH2 SER 15.A O no hydrogen 2.921 N/A ARG 339.A NH2 GLU 378.A OE1 no hydrogen 2.742 N/A PHE 340.A N TRP 332.A O no hydrogen 3.055 N/A ILE 341.A N ALA 376.A O no hydrogen 2.910 N/A ALA 342.A N ALA 330.A O no hydrogen 2.985 N/A SER 343.A N GLU 374.A O no hydrogen 2.778 N/A SER 343.A OG SER 329.A OG no hydrogen 2.413 N/A TYR 344.A N THR 328.A O no hydrogen 2.948 N/A GLY 345.A N GLN 372.A O no hydrogen 2.979 N/A THR 346.A N TRP 326.A O no hydrogen 2.854 N/A THR 346.A OG1 TRP 326.A O no hydrogen 3.358 N/A SER 347.A N SER 370.A O no hydrogen 3.030 N/A TYR 348.A N SER 110.A OG no hydrogen 3.156 N/A LYS 349.A N GLU 368.A O no hydrogen 2.829 N/A LYS 349.A NZ SER 69.A O no hydrogen 3.198 N/A LYS 349.A NZ GLY 87.A O no hydrogen 2.938 N/A LYS 349.A NZ ASP 116.A OD1 no hydrogen 2.878 N/A ALA 350.A N SER 115.A OG no hydrogen 2.980 N/A GLN 355.A N ASN 352.A OD1 no hydrogen 2.980 N/A LEU 356.A N ASN 352.A O no hydrogen 3.076 N/A LEU 356.A N LEU 353.A O no hydrogen 3.160 N/A TYR 357.A N LEU 353.A O no hydrogen 2.769 N/A GLY 358.A N GLY 354.A O no hydrogen 2.979 N/A GLY 361.A N GLY 358.A O no hydrogen 2.830 N/A ASN 362.A N GLN 355.A O no hydrogen 2.860 N/A LEU 365.A N ASN 362.A O no hydrogen 3.257 N/A GLU 368.A N LYS 349.A O no hydrogen 2.876 N/A LYS 369.A N SER 396.A O no hydrogen 3.060 N/A SER 370.A N SER 347.A O no hydrogen 2.774 N/A SER 370.A OG ASN 393.A OD1 no hydrogen 2.582 N/A LYS 371.A N ASP 394.A O no hydrogen 2.983 N/A GLN 372.A N GLY 345.A O no hydrogen 2.878 N/A GLN 372.A NE2 ILE 118.A O no hydrogen 2.758 N/A TRP 373.A N ARG 392.A O no hydrogen 2.978 N/A GLU 374.A N SER 343.A O no hydrogen 2.975 N/A GLY 375.A N GLY 390.A O no hydrogen 2.965 N/A ALA 376.A N ILE 341.A O no hydrogen 2.848 N/A PHE 377.A N ILE 388.A O no hydrogen 2.904 N/A GLU 378.A N ARG 339.A O no hydrogen 2.889 N/A GLY 379.A N TRP 386.A O no hydrogen 2.997 N/A LEU 380.A N GLY 337.A O no hydrogen 2.987 N/A THR 381.A N VAL 384.A O no hydrogen 2.868 N/A VAL 384.A N THR 381.A O no hydrogen 2.810 N/A ASN 385.A N ASN 424.A O no hydrogen 3.104 N/A TRP 386.A N GLY 379.A O no hydrogen 2.897 N/A ARG 387.A N THR 422.A O no hydrogen 3.035 N/A ARG 387.A NH2 LEU 18.A O no hydrogen 2.805 N/A ILE 388.A N PHE 377.A O no hydrogen 2.946 N/A SER 389.A N GLU 420.A O no hydrogen 2.942 N/A GLY 390.A N GLY 375.A O no hydrogen 2.915 N/A TYR 391.A N GLY 418.A O no hydrogen 2.968 N/A ARG 392.A N TRP 373.A O no hydrogen 2.943 N/A ARG 392.A NE ASP 394.A OD2 no hydrogen 2.966 N/A ASN 393.A N ILE 416.A O no hydrogen 2.835 N/A ASP 394.A N LYS 371.A O no hydrogen 2.763 N/A VAL 395.A N ALA 414.A O no hydrogen 2.797 N/A SER 396.A N LYS 369.A O no hydrogen 2.783 N/A LEU 398.A N GLY 412.A O no hydrogen 3.146 N/A ILE 399.A N GLU 368.A OE2 no hydrogen 2.795 N/A ASP 400.A N TYR 409.A O no hydrogen 2.822 N/A ASP 402.A N LYS 407.A O no hydrogen 2.935 N/A HIS 404.A ND1 ASP 402.A OD1 no hydrogen 3.140 N/A THR 405.A N ASP 402.A O no hydrogen 3.308 N/A THR 405.A OG1 ASP 402.A OD2 no hydrogen 3.323 N/A THR 405.A OG1 TYR 409.A OH no hydrogen 2.720 N/A TYR 408.A N TYR 360.A O no hydrogen 3.042 N/A TYR 409.A N ASP 400.A O no hydrogen 2.919 N/A TYR 409.A OH THR 405.A OG1 no hydrogen 2.720 N/A GLU 411.A N LEU 398.A O no hydrogen 2.919 N/A GLY 412.A N LEU 398.A O no hydrogen 3.246 N/A ALA 414.A N VAL 395.A O no hydrogen 2.917 N/A ARG 415.A N ARG 442.A O no hydrogen 2.824 N/A ILE 416.A N ASN 393.A O no hydrogen 2.898 N/A LYS 417.A N ASP 440.A O no hydrogen 3.023 N/A GLY 418.A N TYR 391.A O no hydrogen 2.907 N/A VAL 419.A N TYR 438.A O no hydrogen 2.920 N/A GLU 420.A N SER 389.A O no hydrogen 2.994 N/A ALA 421.A N TYR 436.A O no hydrogen 2.807 N/A THR 422.A N ARG 387.A O no hydrogen 2.801 N/A THR 422.A OG1 ARG 387.A O no hydrogen 3.429 N/A ALA 423.A N VAL 434.A O no hydrogen 2.996 N/A ASN 424.A N ASN 385.A O no hydrogen 2.955 N/A PHE 425.A N HIS 432.A O no hydrogen 3.158 N/A THR 427.A N LEU 430.A O no hydrogen 2.881 N/A THR 427.A OG1 HIS 432.A NE2 no hydrogen 2.812 N/A LEU 430.A N THR 427.A O no hydrogen 3.042 N/A THR 431.A N ASP 463.A O no hydrogen 2.823 N/A THR 431.A OG1 ASP 426.A OD1 no hydrogen 2.577 N/A HIS 432.A N PHE 425.A O no hydrogen 2.890 N/A HIS 432.A NE2 THR 427.A OG1 no hydrogen 2.812 N/A THR 433.A N GLN 461.A O no hydrogen 2.954 N/A VAL 434.A N ALA 423.A O no hydrogen 2.962 N/A SER 435.A N LYS 459.A O no hydrogen 2.909 N/A TYR 436.A N ALA 421.A O no hydrogen 2.916 N/A TYR 436.A OH GLN 456.A OE1 no hydrogen 2.652 N/A ASP 437.A N GLN 457.A O no hydrogen 3.037 N/A TYR 438.A N VAL 419.A O no hydrogen 2.901 N/A VAL 439.A N LYS 455.A O no hydrogen 2.837 N/A ASP 440.A N LYS 417.A O no hydrogen 2.838 N/A ARG 442.A N ARG 415.A O no hydrogen 3.022 N/A ARG 442.A NE ASP 440.A OD1 no hydrogen 3.062 N/A ARG 442.A NE ASP 440.A OD2 no hydrogen 3.567 N/A ARG 442.A NH1 ASP 447.A O no hydrogen 2.839 N/A ASN 443.A N THR 448.A O no hydrogen 2.797 N/A ALA 444.A N LYS 413.A O no hydrogen 2.937 N/A ILE 445.A N ASN 443.A OD1 no hydrogen 2.717 N/A THR 446.A N ASN 443.A OD1 no hydrogen 3.240 N/A LEU 450.A N ALA 441.A O no hydrogen 2.801 N/A ARG 452.A N TYR 482.A O no hydrogen 2.809 N/A ARG 453.A NE GLY 65.A O no hydrogen 3.416 N/A ARG 453.A NH1 LEU 451.A O no hydrogen 2.896 N/A ARG 453.A NH2 GLY 65.A O no hydrogen 3.071 N/A ARG 453.A NH2 ASN 67.A OD1 no hydrogen 2.708 N/A ALA 454.A N ASP 48.A OD2 no hydrogen 2.782 N/A GLN 457.A N ASP 437.A O no hydrogen 3.103 N/A GLN 457.A NE2 VAL 47.A O no hydrogen 2.881 N/A VAL 458.A N TYR 477.A O no hydrogen 3.040 N/A LYS 459.A N SER 435.A O no hydrogen 2.907 N/A LYS 459.A NZ ARG 42.A O no hydrogen 2.561 N/A LYS 459.A NZ LEU 44.A O no hydrogen 2.600 N/A LYS 459.A NZ VAL 47.A O no hydrogen 2.927 N/A TYR 460.A N TYR 475.A O no hydrogen 2.921 N/A TYR 460.A OH HIS 432.A ND1 no hydrogen 2.914 N/A GLN 461.A N THR 433.A O no hydrogen 2.859 N/A LEU 462.A N ILE 473.A O no hydrogen 2.908 N/A ASP 463.A N THR 431.A O no hydrogen 2.876 N/A TRP 464.A N TRP 471.A O no hydrogen 3.037 N/A LEU 466.A N PHE 469.A O no hydrogen 3.136 N/A ASP 470.A N ALA 507.A O no hydrogen 2.927 N/A TRP 471.A N TRP 464.A O no hydrogen 2.827 N/A GLY 472.A N ALA 505.A O no hydrogen 2.985 N/A ILE 473.A N LEU 462.A O no hydrogen 2.961 N/A THR 474.A N ASP 503.A O no hydrogen 2.911 N/A THR 474.A OG1 ASP 503.A OD2 no hydrogen 3.346 N/A TYR 475.A N TYR 460.A O no hydrogen 2.830 N/A TYR 475.A OH SER 500.A OG no hydrogen 2.997 N/A GLN 476.A N LEU 501.A O no hydrogen 2.961 N/A GLN 476.A NE2 ARG 42.A O no hydrogen 3.368 N/A GLN 476.A NE2 GLN 457.A OE1 no hydrogen 3.525 N/A TYR 477.A N VAL 458.A O no hydrogen 2.808 N/A LEU 478.A N VAL 499.A O no hydrogen 2.862 N/A GLY 479.A N GLN 456.A O no hydrogen 2.826 N/A THR 480.A OG1 MET 496.A O no hydrogen 3.380 N/A ARG 481.A N MET 496.A O no hydrogen 3.206 N/A ARG 481.A NH1 ASP 48.A OD1 no hydrogen 2.849 N/A ARG 481.A NH1 ARG 452.A O no hydrogen 2.937 N/A ASP 483.A N VAL 494.A O no hydrogen 3.110 N/A LYS 484.A N ASP 483.A OD1 no hydrogen 2.770 N/A ASP 485.A N GLN 492.A O no hydrogen 2.906 N/A SER 487.A N ASP 485.A OD1 no hydrogen 2.987 N/A SER 487.A OG ASP 485.A OD1 no hydrogen 2.613 N/A VAL 494.A N ASP 483.A O no hydrogen 2.761 N/A MET 496.A N ARG 481.A O no hydrogen 2.847 N/A VAL 499.A N LEU 478.A O no hydrogen 2.880 N/A SER 500.A OG TYR 475.A OH no hydrogen 2.997 N/A LEU 501.A N GLN 476.A O no hydrogen 2.815 N/A ASP 503.A N THR 474.A O no hydrogen 2.909 N/A LEU 504.A N ILE 520.A O no hydrogen 3.120 N/A ALA 505.A N GLY 472.A O no hydrogen 2.851 N/A VAL 506.A N GLY 518.A O no hydrogen 2.944 N/A ALA 507.A N ASP 470.A O no hydrogen 2.795 N/A TYR 508.A N VAL 516.A O no hydrogen 2.998 N/A THR 511.A N LEU 514.A O no hydrogen 3.165 N/A HIS 513.A N THR 511.A OG1 no hydrogen 3.087 N/A LEU 514.A N THR 511.A OG1 no hydrogen 2.842 N/A THR 515.A N SER 546.A O no hydrogen 3.023 N/A VAL 516.A N TYR 508.A O no hydrogen 3.037 N/A ARG 517.A N SER 544.A O no hydrogen 2.699 N/A GLY 518.A N VAL 506.A O no hydrogen 3.088 N/A LYS 519.A N THR 542.A O no hydrogen 2.861 N/A LYS 519.A NZ GLN 33.A O no hydrogen 2.773 N/A ILE 520.A N LEU 504.A O no hydrogen 2.937 N/A ALA 521.A N GLU 540.A O no hydrogen 2.771 N/A ASN 522.A N ASP 503.A OD1 no hydrogen 3.052 N/A ASN 522.A ND2 LYS 526.A O no hydrogen 2.915 N/A LEU 523.A N TRP 502.A O no hydrogen 2.823 N/A ASP 525.A N ASN 522.A O no hydrogen 3.225 N/A LYS 526.A N ASN 522.A OD1 no hydrogen 2.847 N/A THR 530.A OG1 GLN 51.A O no hydrogen 3.320 N/A TYR 532.A N ASP 483.A OD2 no hydrogen 3.014 N/A GLY 533.A N GLU 529.A OE1 no hydrogen 2.894 N/A TYR 534.A N VAL 531.A O no hydrogen 3.003 N/A GLN 535.A NE2 THR 536.A O no hydrogen 3.118 N/A THR 536.A OG1 TYR 528.A O no hydrogen 2.703 N/A ARG 539.A N ASP 525.A OD1 no hydrogen 2.940 N/A ARG 539.A NE LEU 523.A O no hydrogen 3.123 N/A ARG 539.A NH2 LEU 523.A O no hydrogen 2.903 N/A GLU 540.A N ALA 521.A O no hydrogen 3.002 N/A TYR 541.A N SER 141.A OG no hydrogen 2.747 N/A THR 542.A N LYS 519.A O no hydrogen 2.822 N/A LEU 543.A N TRP 139.A O no hydrogen 2.872 N/A SER 544.A N ARG 517.A O no hydrogen 2.737 N/A GLY 545.A N ALA 137.A O no hydrogen 2.925 N/A SER 546.A N THR 515.A O no hydrogen 2.907 N/A TYR 547.A N ILE 135.A O no hydrogen 2.759 N/A THR 548.A N HIS 513.A O no hydrogen 2.908 N/A PHE 549.A N THR 133.A O no hydrogen 3.037 N/A