Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4bwm_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ALA 3.A N VAL 38.A O no hydrogen 2.970 N/A TRP 5.A NE1 ASP 50.A OD2 no hydrogen 2.687 N/A ALA 11.A N PRO 8.A O no hydrogen 3.320 N/A PHE 12.A N ALA 33.A O no hydrogen 2.915 N/A VAL 13.A N ARG 55.A O no hydrogen 2.737 N/A GLY 14.A N ALA 31.A O no hydrogen 2.819 N/A VAL 16.A N ALA 29.A O no hydrogen 3.101 N/A SER 18.A N ASP 26.A O no hydrogen 2.954 N/A ARG 19.A NE GLU 21.A OE1 no hydrogen 2.812 N/A ARG 19.A NH2 GLU 21.A OE1 no hydrogen 3.441 N/A ARG 19.A NH2 GLU 21.A OE2 no hydrogen 3.006 N/A GLU 21.A N GLU 21.A OE1 no hydrogen 2.829 N/A TRP 24.A N GLU 21.A O no hydrogen 2.980 N/A ALA 25.A N PRO 22.A O no hydrogen 3.318 N/A ASP 26.A N SER 18.A OG no hydrogen 2.804 N/A LEU 27.A N TYR 45.A OH no hydrogen 2.969 N/A LEU 28.A N VAL 16.A O no hydrogen 2.914 N/A ALA 31.A N GLY 14.A O no hydrogen 2.894 N/A ALA 32.A N HIS 39.A O no hydrogen 2.870 N/A ALA 33.A N PHE 12.A O no hydrogen 2.744 N/A ARG 34.A N ARG 37.A O no hydrogen 2.910 N/A GLY 35.A N GLU 116.A OE2 no hydrogen 2.837 N/A GLY 36.A N GLU 116.A OE1 no hydrogen 3.098 N/A ARG 37.A N ARG 34.A O no hydrogen 3.211 N/A VAL 38.A N GLU 1.A O no hydrogen 3.080 N/A HIS 39.A N ALA 32.A O no hydrogen 2.715 N/A HIS 39.A ND1 PRO 4.A O no hydrogen 2.939 N/A ARG 40.A NE GLU 107.A OE2 no hydrogen 2.986 N/A ARG 40.A NH2 GLU 107.A OE1 no hydrogen 2.961 N/A ARG 40.A NH2 GLU 107.A OE2 no hydrogen 3.525 N/A ALA 41.A N LEU 30.A O no hydrogen 2.890 N/A TYR 45.A OH ASP 26.A OD1 no hydrogen 2.705 N/A ALA 47.A N GLU 43.A O no hydrogen 2.904 N/A LEU 48.A N PRO 44.A O no hydrogen 3.132 N/A ARG 49.A N LYS 46.A O no hydrogen 3.182 N/A ARG 49.A NH1 TYR 45.A O no hydrogen 2.915 N/A ASP 50.A N ALA 47.A O no hydrogen 2.975 N/A LEU 51.A N LEU 48.A O no hydrogen 3.200 N/A ALA 54.A N PRO 74.A O no hydrogen 2.842 N/A ARG 55.A NE ASP 77.A OD2 no hydrogen 3.083 N/A ARG 55.A NH1 GLY 10.A O no hydrogen 2.737 N/A ARG 55.A NH2 ASP 77.A OD2 no hydrogen 3.121 N/A GLY 56.A N ASP 77.A O no hydrogen 2.803 N/A LEU 57.A N SER 115.A OG no hydrogen 2.982 N/A LEU 58.A N ASP 78.A OD1 no hydrogen 3.326 N/A ALA 59.A N ASP 78.A OD2 no hydrogen 3.298 N/A LYS 60.A NZ.A ASP 61.A OD1 no hydrogen 3.079 N/A LYS 60.A NZ.A GLU 151.A OE1 no hydrogen 2.939 N/A LYS 60.A NZ.A PHE 270.A O no hydrogen 2.753 N/A LYS 60.A NZ.B ASP 61.A OD1 no hydrogen 3.321 N/A LYS 60.A NZ.B GLU 151.A OE1 no hydrogen 3.077 N/A LYS 60.A NZ.B PHE 270.A O no hydrogen 2.893 N/A ASP 61.A N LEU 58.A O no hydrogen 3.029 N/A SER 63.A N ALA 59.A O no hydrogen 3.029 N/A SER 63.A OG.A LEU 73.A O no hydrogen 2.707 N/A SER 63.A OG.B ALA 59.A O no hydrogen 3.342 N/A SER 63.A OG.B LEU 73.A O no hydrogen 2.686 N/A VAL 64.A N LYS 60.A O no hydrogen 2.856 N/A LEU 65.A N ASP 61.A O no hydrogen 3.129 N/A ALA 66.A N LEU 62.A O no hydrogen 2.826 N/A LEU 67.A N SER 63.A O no hydrogen 2.879 N/A ARG 68.A N VAL 64.A O no hydrogen 3.040 N/A ARG 68.A NE GLU 69.A OE2 no hydrogen 2.918 N/A ARG 68.A NH1 MET 23.A O no hydrogen 3.090 N/A ARG 68.A NH1 ALA 25.A O no hydrogen 2.786 N/A ARG 68.A NH2 ALA 25.A O no hydrogen 3.058 N/A ARG 68.A NH2 GLU 69.A OE2 no hydrogen 2.848 N/A GLU 69.A N LEU 65.A O no hydrogen 3.149 N/A GLY 70.A N LEU 67.A O no hydrogen 2.931 N/A LEU 71.A N ALA 66.A O no hydrogen 2.851 N/A GLY 76.A N ALA 54.A O no hydrogen 2.716 N/A ASP 78.A N TYR 136.A OH no hydrogen 3.384 N/A MET 80.A N ASP 78.A OD1 no hydrogen 2.868 N/A LEU 81.A N ASP 78.A O no hydrogen 2.964 N/A LEU 82.A N ASP 78.A O no hydrogen 3.399 N/A ALA 83.A N PRO 79.A O no hydrogen 2.854 N/A TYR 84.A N MET 80.A O no hydrogen 2.964 N/A TYR 84.A OH THR 275.A O no hydrogen 2.461 N/A LEU 85.A N LEU 81.A O no hydrogen 3.122 N/A LEU 86.A N LEU 82.A O no hydrogen 3.024 N/A ASP 87.A N ALA 83.A O no hydrogen 3.016 N/A SER 89.A N ASP 87.A OD1 no hydrogen 2.973 N/A SER 89.A OG ASP 87.A OD1 no hydrogen 2.880 N/A ASN 90.A N ASP 87.A O no hydrogen 2.873 N/A ASN 90.A ND2 ALA 83.A O no hydrogen 2.900 N/A ASN 90.A ND2 TYR 100.A OH no hydrogen 2.908 N/A GLU 94.A N GLU 94.A OE1 no hydrogen 2.812 N/A GLY 95.A N THR 92.A OG1 no hydrogen 2.968 N/A VAL 96.A N THR 92.A O no hydrogen 2.894 N/A ALA 97.A N PRO 93.A O no hydrogen 2.856 N/A ARG 98.A N GLU 94.A O no hydrogen 2.979 N/A ARG 99.A N GLY 95.A O no hydrogen 2.941 N/A ARG 99.A NH1 ASP 87.A OD2 no hydrogen 2.955 N/A ARG 99.A NH1 ASN 90.A OD1 no hydrogen 3.492 N/A TYR 100.A N VAL 96.A O no hydrogen 2.910 N/A GLY 101.A N ALA 97.A O no hydrogen 2.854 N/A THR 105.A OG1 GLU 110.A OE1 no hydrogen 2.669 N/A GLY 109.A N GLU 107.A OE2 no hydrogen 2.862 N/A GLU 110.A N GLU 107.A OE1 no hydrogen 2.865 N/A ARG 111.A N GLU 107.A O no hydrogen 2.963 N/A ARG 111.A NE THR 105.A O no hydrogen 2.697 N/A ARG 111.A NH1 PHE 15.A O no hydrogen 2.856 N/A ARG 111.A NH2 THR 105.A O no hydrogen 3.062 N/A ALA 112.A N ALA 108.A O no hydrogen 2.921 N/A ALA 113.A N GLY 109.A O no hydrogen 3.047 N/A LEU 114.A N GLU 110.A O no hydrogen 2.942 N/A SER 115.A N ARG 111.A O no hydrogen 2.966 N/A SER 115.A OG ARG 111.A O no hydrogen 2.966 N/A GLU 116.A N ALA 112.A O no hydrogen 3.138 N/A ARG 117.A N ALA 113.A O no hydrogen 3.010 N/A LEU 118.A N LEU 114.A O no hydrogen 2.755 N/A PHE 119.A N SER 115.A O no hydrogen 2.891 N/A ALA 120.A N GLU 116.A O no hydrogen 3.207 N/A ASN 121.A N ARG 117.A O no hydrogen 3.089 N/A LEU 122.A N LEU 118.A O no hydrogen 2.879 N/A TRP 123.A N PHE 119.A O no hydrogen 2.800 N/A GLY 124.A N ALA 120.A O no hydrogen 3.102 N/A ARG 125.A N ASN 121.A O no hydrogen 3.048 N/A ARG 125.A NE ASN 121.A OD1 no hydrogen 2.839 N/A LEU 126.A N LEU 122.A O no hydrogen 3.058 N/A LEU 126.A N TRP 123.A O no hydrogen 3.155 N/A GLU 127.A N GLY 124.A O no hydrogen 3.196 N/A GLU 129.A N LEU 126.A O no hydrogen 2.881 N/A ARG 131.A NH2 LEU 429.A O no hydrogen 3.482 N/A LEU 133.A N GLU 129.A O no hydrogen 2.955 N/A TRP 134.A N GLU 130.A O no hydrogen 2.886 N/A LEU 135.A N ARG 131.A O no hydrogen 3.069 N/A TYR 136.A N LEU 132.A O no hydrogen 2.930 N/A TYR 136.A OH ASP 77.A OD1 no hydrogen 2.545 N/A ARG 137.A N LEU 133.A O no hydrogen 2.937 N/A GLU 138.A N TRP 134.A O no hydrogen 2.804 N/A VAL 139.A N LEU 135.A O no hydrogen 2.885 N/A GLU 140.A N LEU 135.A O no hydrogen 2.789 N/A ARG 141.A N TYR 136.A O no hydrogen 2.920 N/A ARG 141.A NH1 ASP 77.A OD1 no hydrogen 2.849 N/A LEU 143.A N VAL 139.A O no hydrogen 2.868 N/A SER 144.A N GLU 140.A O no hydrogen 3.046 N/A SER 144.A N ARG 141.A O no hydrogen 3.224 N/A SER 144.A OG ARG 141.A O no hydrogen 2.564 N/A ALA 145.A N PRO 142.A O no hydrogen 3.113 N/A VAL 146.A N PRO 142.A O no hydrogen 3.423 N/A LEU 147.A N LEU 143.A O no hydrogen 2.839 N/A ALA 148.A N SER 144.A O no hydrogen 3.036 N/A HIS 149.A N ALA 145.A O no hydrogen 3.098 N/A MET 150.A N VAL 146.A O no hydrogen 2.961 N/A GLU 151.A N LEU 147.A O no hydrogen 2.916 N/A ALA 152.A N ALA 148.A O no hydrogen 2.942 N/A THR 153.A N HIS 149.A O no hydrogen 2.876 N/A THR 153.A OG1 HIS 149.A O no hydrogen 2.702 N/A GLY 154.A N MET 150.A O no hydrogen 3.065 N/A VAL 155.A N LEU 266.A O no hydrogen 2.851 N/A ARG 156.A NH1 ALA 306.A O no hydrogen 2.983 N/A ARG 156.A NH1 GLU 308.A OE2 no hydrogen 2.859 N/A ARG 156.A NH2 GLU 308.A OE2 no hydrogen 3.517 N/A ASP 158.A N ALA 303.A O no hydrogen 2.777 N/A TYR 161.A N ASP 158.A OD1 no hydrogen 3.123 N/A LEU 162.A N ASP 158.A O no hydrogen 3.056 N/A ARG 163.A N VAL 159.A O no hydrogen 2.855 N/A ALA 164.A N ALA 160.A O no hydrogen 3.036 N/A MET 165.A N TYR 161.A O no hydrogen 2.868 N/A SER 166.A N LEU 162.A O no hydrogen 2.906 N/A SER 166.A OG ASP 253.A OD1 no hydrogen 2.714 N/A LEU 167.A N ARG 163.A O no hydrogen 3.295 N/A GLU 168.A N ALA 164.A O no hydrogen 2.995 N/A VAL 169.A N MET 165.A O no hydrogen 2.835 N/A ALA 170.A N SER 166.A O no hydrogen 2.980 N/A GLU 171.A N LEU 167.A O no hydrogen 3.131 N/A GLU 172.A N GLU 168.A O no hydrogen 3.085 N/A ILE 173.A N VAL 169.A O no hydrogen 2.816 N/A ALA 174.A N ALA 170.A O no hydrogen 3.025 N/A ARG 175.A N GLU 171.A O no hydrogen 3.068 N/A LEU 176.A N GLU 172.A O no hydrogen 2.924 N/A GLU 177.A N ILE 173.A O no hydrogen 2.906 N/A ALA 178.A N ALA 174.A O no hydrogen 3.129 N/A GLU 179.A N ARG 175.A O no hydrogen 2.986 N/A VAL 180.A N LEU 176.A O no hydrogen 2.832 N/A PHE 181.A N GLU 177.A O no hydrogen 2.933 N/A ARG 182.A N ALA 178.A O no hydrogen 3.067 N/A ARG 182.A NE GLU 179.A OE1 no hydrogen 2.950 N/A ARG 182.A NH2 GLU 179.A OE1 no hydrogen 3.501 N/A ARG 182.A NH2 GLU 179.A OE2 no hydrogen 2.769 N/A LEU 183.A N GLU 179.A O no hydrogen 2.930 N/A ALA 184.A N VAL 180.A O no hydrogen 2.908 N/A GLY 185.A N ARG 182.A O no hydrogen 3.193 N/A HIS 186.A ND1 PRO 187.A O no hydrogen 3.280 N/A HIS 186.A NE2 GLU 203.A OE1 no hydrogen 2.579 N/A ASN 189.A N GLN 195.A OE1 no hydrogen 2.872 N/A ASN 191.A N ASN 189.A OD1 no hydrogen 3.091 N/A SER 192.A N ASN 189.A O no hydrogen 2.954 N/A ARG 193.A NH1 ASP 194.A OD1 no hydrogen 2.772 N/A ARG 193.A NH1 GLU 197.A OE1 no hydrogen 2.753 N/A ARG 193.A NH2 ARG 218.A O no hydrogen 2.789 N/A GLN 195.A N SER 192.A OG no hydrogen 3.144 N/A LEU 196.A N SER 192.A O no hydrogen 2.861 N/A GLU 197.A N ARG 193.A O no hydrogen 2.825 N/A ARG 198.A N ASP 194.A O no hydrogen 3.214 N/A ARG 198.A NE GLU 203.A OE2 no hydrogen 3.219 N/A VAL 199.A N GLN 195.A O no hydrogen 3.053 N/A LEU 200.A N LEU 196.A O no hydrogen 2.862 N/A PHE 201.A N GLU 197.A O no hydrogen 2.933 N/A ASP 202.A N ARG 198.A O no hydrogen 2.853 N/A GLU 203.A N ARG 198.A O no hydrogen 2.930 N/A LEU 204.A N VAL 199.A O no hydrogen 2.834 N/A LEU 206.A N LEU 200.A O no hydrogen 2.920 N/A LYS 211.A NZ GLY 216.A O no hydrogen 2.747 N/A THR 212.A N LYS 217.A O no hydrogen 2.719 N/A THR 212.A OG1 THR 215.A OG1 no hydrogen 3.053 N/A THR 215.A OG1 THR 212.A OG1 no hydrogen 3.053 N/A LYS 217.A N THR 212.A OG1 no hydrogen 2.858 N/A ARG 218.A N GLU 197.A OE2 no hydrogen 2.936 N/A ARG 218.A NE GLU 197.A OE2 no hydrogen 2.938 N/A ARG 218.A NH1 ASP 202.A OD1 no hydrogen 2.898 N/A ARG 218.A NH2 ASP 202.A OD1 no hydrogen 3.159 N/A ARG 218.A NH2 ASP 202.A OD2 no hydrogen 3.160 N/A SER 219.A N GLY 210.A O no hydrogen 2.914 N/A ARG 221.A N SER 219.A OG no hydrogen 3.058 N/A ARG 221.A NH2.A LYS 211.A O no hydrogen 3.177 N/A ARG 221.A NH2.B LYS 211.A O no hydrogen 3.290 N/A VAL 224.A N ARG 221.A O no hydrogen 2.952 N/A LEU 225.A N ARG 221.A O no hydrogen 3.156 N/A GLU 226.A N ALA 222.A O no hydrogen 2.740 N/A ALA 227.A N ALA 223.A O no hydrogen 3.293 N/A LEU 228.A N VAL 224.A O no hydrogen 3.084 N/A LEU 228.A N LEU 225.A O no hydrogen 2.951 N/A ARG 229.A N GLU 226.A O no hydrogen 3.322 N/A ARG 229.A NE GLU 226.A OE1 no hydrogen 2.411 N/A ARG 229.A NH2 GLU 226.A OE2 no hydrogen 3.164 N/A ALA 231.A N LEU 228.A O no hydrogen 2.988 N/A ILE 234.A N HIS 232.A ND1 no hydrogen 3.018 N/A VAL 235.A N HIS 232.A O no hydrogen 3.275 N/A ILE 238.A N ILE 234.A O no hydrogen 3.090 N/A LEU 239.A N VAL 235.A O no hydrogen 3.109 N/A GLN 240.A N GLU 236.A O no hydrogen 3.074 N/A TYR 241.A N LYS 237.A O no hydrogen 2.839 N/A TYR 241.A OH ASN 191.A OD1 no hydrogen 2.960 N/A ARG 242.A N ILE 238.A O no hydrogen 2.931 N/A ARG 242.A NH1 THR 220.A O no hydrogen 2.726 N/A ARG 242.A NH2 THR 220.A OG1 no hydrogen 2.919 N/A GLU 243.A N LEU 239.A O no hydrogen 3.262 N/A LEU 244.A N GLN 240.A O no hydrogen 3.007 N/A THR 245.A N TYR 241.A O no hydrogen 2.986 N/A THR 245.A OG1 TYR 241.A O no hydrogen 2.838 N/A LYS 246.A N ARG 242.A O no hydrogen 3.047 N/A LEU 247.A N GLU 243.A O no hydrogen 2.984 N/A LYS 248.A N LEU 244.A O no hydrogen 2.927 N/A LYS 248.A NZ ASP 253.A OD2 no hydrogen 2.608 N/A SER 249.A N THR 245.A O no hydrogen 3.210 N/A SER 249.A OG THR 245.A O no hydrogen 2.991 N/A SER 249.A OG LYS 246.A O no hydrogen 2.902 N/A THR 250.A N LYS 246.A O no hydrogen 3.000 N/A THR 250.A OG1 LYS 246.A O no hydrogen 2.973 N/A TYR 251.A N LEU 247.A O no hydrogen 2.956 N/A TYR 251.A OH ASN 286.A O no hydrogen 2.576 N/A ILE 252.A N LEU 247.A O no hydrogen 2.940 N/A ASP 253.A N LYS 248.A O no hydrogen 2.952 N/A LEU 255.A N TYR 251.A O no hydrogen 3.041 N/A ASP 257.A N PRO 254.A O no hydrogen 3.182 N/A LEU 258.A N LEU 255.A O no hydrogen 2.951 N/A ILE 259.A N PRO 256.A O no hydrogen 3.290 N/A HIS 260.A N ARG 265.A O no hydrogen 2.912 N/A ARG 262.A N HIS 260.A ND1 no hydrogen 3.039 N/A THR 263.A OG1 HIS 260.A O no hydrogen 3.511 N/A THR 263.A OG1 ARG 265.A O no hydrogen 3.553 N/A THR 263.A OG1 HIS 267.A NE2 no hydrogen 2.750 N/A GLY 264.A N HIS 260.A O no hydrogen 2.744 N/A ARG 265.A N THR 263.A OG1 no hydrogen 3.044 N/A ARG 265.A NE THR 153.A O no hydrogen 2.912 N/A ARG 265.A NH1 GLU 496.A OE2 no hydrogen 3.367 N/A ARG 265.A NH2 GLY 154.A O no hydrogen 2.799 N/A ARG 265.A NH2 GLU 496.A OE1 no hydrogen 2.776 N/A LEU 266.A N VAL 155.A O no hydrogen 2.819 N/A HIS 267.A ND1 GLU 151.A O no hydrogen 2.812 N/A HIS 267.A NE2 THR 263.A OG1 no hydrogen 2.750 N/A ARG 269.A N SER 283.A O no hydrogen 3.029 N/A PHE 270.A N GLU 151.A OE1 no hydrogen 3.333 N/A ASN 271.A N SER 281.A O no hydrogen 2.927 N/A GLN 272.A NE2 GLU 140.A O no hydrogen 3.004 N/A GLN 272.A NE2 GLU 140.A OE1 no hydrogen 2.734 N/A THR 273.A N ASN 271.A OD1 no hydrogen 2.996 N/A THR 273.A OG1 THR 91.A O no hydrogen 3.551 N/A THR 273.A OG1 ASN 271.A OD1 no hydrogen 3.513 N/A THR 275.A OG1 TYR 84.A OH no hydrogen 3.425 N/A THR 275.A OG1 ARG 279.A O.A no hydrogen 2.739 N/A THR 275.A OG1 ARG 279.A O.B no hydrogen 2.730 N/A GLY 278.A N THR 275.A OG1 no hydrogen 3.176 N/A ARG 279.A NH1.A HIS 490.A O no hydrogen 3.495 N/A ARG 279.A NH2.A HIS 490.A O no hydrogen 3.021 N/A ARG 279.A NH2.B GLU 321.A OE2 no hydrogen 2.758 N/A SER 281.A N ASN 271.A O no hydrogen 3.096 N/A SER 283.A N ARG 269.A O no hydrogen 2.932 N/A LEU 287.A N SER 282.A OG no hydrogen 2.901 N/A GLN 288.A N ASN 286.A OD1 no hydrogen 2.958 N/A ILE 290.A N LEU 287.A O no hydrogen 3.428 N/A THR 294.A OG1 GLU 243.A OE2 no hydrogen 2.714 N/A GLY 297.A N THR 294.A OG1 no hydrogen 3.117 N/A GLN 298.A N THR 294.A O no hydrogen 3.003 N/A ARG 299.A N PRO 295.A O no hydrogen 2.903 N/A ARG 299.A NE TYR 161.A OH no hydrogen 2.950 N/A ARG 299.A NH1 GLU 168.A OE1 no hydrogen 2.779 N/A ARG 299.A NH2 TYR 161.A OH no hydrogen 3.566 N/A ARG 299.A NH2 GLU 168.A OE1 no hydrogen 3.247 N/A ILE 300.A N LEU 296.A O no hydrogen 2.890 N/A ARG 301.A N GLY 297.A O no hydrogen 3.269 N/A ARG 301.A NH1 PRO 291.A O no hydrogen 2.774 N/A ARG 301.A NH2 ILE 290.A O no hydrogen 2.881 N/A ARG 302.A N GLN 298.A O no hydrogen 3.086 N/A ARG 302.A NH1 TYR 161.A OH no hydrogen 2.837 N/A ALA 303.A N ILE 300.A O no hydrogen 3.027 N/A PHE 304.A N ARG 301.A O no hydrogen 3.088 N/A ILE 305.A N ARG 156.A O no hydrogen 3.000 N/A ALA 306.A N GLU 531.A O no hydrogen 2.924 N/A GLU 307.A N GLU 496.A OE2 no hydrogen 2.778 N/A TRP 310.A N GLU 307.A O no hydrogen 2.900 N/A LEU 311.A N ALA 497.A O no hydrogen 2.824 N/A LEU 312.A N GLY 530.A O no hydrogen 2.753 N/A VAL 313.A N LEU 495.A O no hydrogen 2.841 N/A ALA 314.A N GLY 528.A O no hydrogen 2.950 N/A LEU 315.A N LEU 493.A O no hydrogen 2.846 N/A ASP 316.A N GLU 526.A O no hydrogen 2.893 N/A TYR 317.A N ASP 491.A O no hydrogen 2.896 N/A TYR 317.A OH MET 513.A O no hydrogen 2.719 N/A SER 318.A N GLU 524.A O no hydrogen 2.817 N/A SER 318.A OG GLU 524.A O no hydrogen 3.551 N/A SER 318.A OG GLU 526.A OE2 no hydrogen 3.273 N/A GLN 319.A NE2 ASP 343.A OD1 no hydrogen 3.259 N/A GLN 319.A NE2 ASP 343.A OD2 no hydrogen 3.287 N/A ARG 323.A N GLN 319.A O no hydrogen 3.081 N/A ARG 323.A NE SER 318.A O no hydrogen 2.848 N/A ARG 323.A NH1 PRO 522.A O no hydrogen 2.879 N/A VAL 324.A N ILE 320.A O no hydrogen 2.855 N/A LEU 325.A N GLU 321.A O no hydrogen 2.932 N/A ALA 326.A N LEU 322.A O no hydrogen 2.899 N/A HIS 327.A N ARG 323.A O no hydrogen 2.940 N/A LEU 328.A N VAL 324.A O no hydrogen 2.753 N/A SER 329.A N LEU 325.A O no hydrogen 2.903 N/A SER 329.A OG LEU 325.A O no hydrogen 2.722 N/A GLY 330.A N ALA 326.A O no hydrogen 2.914 N/A ASP 331.A N SER 329.A OG no hydrogen 3.072 N/A GLU 332.A N GLU 332.A OE1 no hydrogen 2.912 N/A ASN 333.A ND2 SER 405.A O no hydrogen 2.409 N/A LEU 334.A N ASP 331.A OD2 no hydrogen 2.896 N/A ILE 335.A N ASP 331.A O no hydrogen 2.845 N/A ARG 336.A N GLU 332.A O no hydrogen 2.921 N/A ARG 336.A NH1 ASN 333.A OD1 no hydrogen 2.845 N/A VAL 337.A N ASN 333.A O no hydrogen 3.168 N/A PHE 338.A N ILE 335.A O no hydrogen 3.204 N/A GLN 339.A N ILE 335.A O no hydrogen 2.812 N/A GLN 339.A NE2 ALA 520.A O no hydrogen 2.805 N/A GLU 340.A N ARG 336.A O no hydrogen 2.973 N/A GLY 341.A N PHE 338.A O no hydrogen 3.104 N/A ARG 342.A N VAL 337.A O no hydrogen 2.865 N/A ARG 342.A NE GLU 340.A OE1 no hydrogen 2.954 N/A PHE 344.A N GLN 319.A OE1 no hydrogen 3.240 N/A THR 346.A N ASP 343.A OD1 no hydrogen 3.052 N/A GLU 347.A N ASP 343.A O no hydrogen 2.912 N/A THR 348.A N PHE 344.A O no hydrogen 2.982 N/A THR 348.A OG1 PHE 344.A O no hydrogen 2.820 N/A THR 348.A OG1 HIS 345.A O no hydrogen 3.307 N/A ALA 349.A N HIS 345.A O no hydrogen 2.961 N/A SER 350.A N THR 346.A O no hydrogen 2.931 N/A SER 350.A OG VAL 355.A O no hydrogen 2.742 N/A TRP 351.A N GLU 347.A O no hydrogen 3.074 N/A MET 352.A N THR 348.A O no hydrogen 2.792 N/A PHE 353.A N ALA 349.A O no hydrogen 2.891 N/A VAL 355.A N SER 350.A O no hydrogen 3.301 N/A ALA 359.A N PRO 356.A O no hydrogen 2.889 N/A VAL 360.A N ARG 357.A O no hydrogen 3.107 N/A MET 364.A N ASP 361.A OD1 no hydrogen 2.966 N/A ARG 365.A N ASP 361.A O no hydrogen 2.860 N/A ARG 365.A NE ASP 343.A OD1 no hydrogen 3.410 N/A ARG 365.A NH2 ASP 343.A OD1 no hydrogen 2.964 N/A ARG 365.A NH2 ASP 343.A OD2 no hydrogen 2.676 N/A ARG 366.A N PRO 362.A O no hydrogen 2.956 N/A ALA 367.A N LEU 363.A O no hydrogen 3.100 N/A ALA 368.A N MET 364.A O no hydrogen 2.882 N/A LYS 369.A N ARG 365.A O no hydrogen 2.915 N/A THR 370.A N ARG 366.A O no hydrogen 3.274 N/A THR 370.A OG1 ARG 366.A O no hydrogen 3.318 N/A THR 370.A OG1 ALA 367.A O no hydrogen 2.429 N/A ILE 371.A N ALA 367.A O no hydrogen 3.203 N/A ASN 372.A N ALA 368.A O no hydrogen 2.779 N/A ASN 372.A ND2 HIS 345.A ND1 no hydrogen 3.116 N/A ASN 372.A ND2 THR 348.A OG1 no hydrogen 2.875 N/A PHE 373.A N LYS 369.A O no hydrogen 2.974 N/A GLY 374.A N THR 370.A O no hydrogen 3.145 N/A VAL 375.A N ILE 371.A O no hydrogen 2.849 N/A LEU 376.A N ASN 372.A O no hydrogen 2.861 N/A TYR 377.A N PHE 373.A O no hydrogen 3.051 N/A GLY 378.A N VAL 375.A O no hydrogen 3.425 N/A MET 379.A N GLY 374.A O no hydrogen 2.765 N/A ARG 383.A N SER 380.A OG no hydrogen 3.416 N/A ARG 383.A NE GLU 387.A OE2 no hydrogen 2.683 N/A LEU 384.A N SER 380.A O no hydrogen 3.070 N/A SER 385.A N ALA 381.A O no hydrogen 2.847 N/A SER 385.A OG ALA 381.A O no hydrogen 3.003 N/A SER 385.A OG HIS 382.A O no hydrogen 2.485 N/A GLN 386.A N HIS 382.A O no hydrogen 3.133 N/A GLU 387.A N ARG 383.A O no hydrogen 2.949 N/A LEU 388.A N LEU 384.A O no hydrogen 2.911 N/A ALA 389.A N GLN 386.A O no hydrogen 3.316 N/A ILE 390.A N SER 385.A O no hydrogen 2.893 N/A GLU 394.A N PRO 391.A O no hydrogen 3.102 N/A ALA 395.A N PRO 391.A O no hydrogen 3.190 N/A GLN 396.A N TYR 392.A O no hydrogen 2.934 N/A ALA 397.A N GLU 393.A O no hydrogen 3.026 N/A PHE 398.A N GLU 394.A O no hydrogen 2.862 N/A ILE 399.A N ALA 395.A O no hydrogen 2.994 N/A GLU 400.A N GLN 396.A O no hydrogen 3.268 N/A ARG 401.A N ALA 397.A O no hydrogen 3.036 N/A TYR 402.A N PHE 398.A O no hydrogen 2.787 N/A TYR 402.A OH ASN 372.A OD1 no hydrogen 2.741 N/A PHE 403.A N ILE 399.A O no hydrogen 3.147 N/A GLN 404.A N GLU 400.A O no hydrogen 3.007 N/A SER 405.A N ARG 401.A O no hydrogen 3.280 N/A SER 405.A N TYR 402.A O no hydrogen 3.074 N/A SER 405.A OG ARG 401.A O no hydrogen 3.453 N/A PHE 406.A N PHE 403.A O no hydrogen 3.097 N/A LYS 408.A N ASP 331.A OD1 no hydrogen 2.927 N/A LYS 408.A NZ GLU 332.A OE2 no hydrogen 2.844 N/A VAL 409.A N PHE 406.A O no hydrogen 3.140 N/A ARG 410.A NH1 GLU 400.A OE1 no hydrogen 2.922 N/A ARG 410.A NH1 GLU 400.A OE2 no hydrogen 3.391 N/A ARG 410.A NH2 GLU 400.A OE2 no hydrogen 3.039 N/A ALA 411.A N PRO 407.A O no hydrogen 3.420 N/A TRP 412.A N LYS 408.A O no hydrogen 2.916 N/A ILE 413.A N VAL 409.A O no hydrogen 2.970 N/A GLU 414.A N ARG 410.A O no hydrogen 3.062 N/A LYS 415.A N ALA 411.A O no hydrogen 2.978 N/A THR 416.A N TRP 412.A O no hydrogen 2.877 N/A THR 416.A OG1 TRP 412.A O no hydrogen 2.838 N/A LEU 417.A N ILE 413.A O no hydrogen 2.956 N/A GLU 418.A N GLU 414.A O no hydrogen 2.869 N/A GLU 419.A N LYS 415.A O no hydrogen 3.018 N/A GLY 420.A N THR 416.A O no hydrogen 2.962 N/A ARG 421.A N LEU 417.A O no hydrogen 2.875 N/A ARG 421.A NH2 GLU 451.A OE2 no hydrogen 3.175 N/A ARG 422.A N GLU 418.A O no hydrogen 3.218 N/A ARG 423.A N GLU 419.A O no hydrogen 2.838 N/A ARG 423.A NE GLU 419.A OE2 no hydrogen 2.647 N/A ARG 423.A NH2 GLU 419.A OE2 no hydrogen 2.978 N/A GLY 424.A N GLY 420.A O no hydrogen 2.756 N/A VAL 426.A N ARG 434.A O no hydrogen 2.989 N/A THR 428.A N ARG 432.A O no hydrogen 2.905 N/A THR 428.A OG1 ASP 465.A OD2 no hydrogen 2.756 N/A LEU 429.A N THR 462.A OG1 no hydrogen 2.928 N/A GLY 431.A N THR 428.A O no hydrogen 2.955 N/A ARG 432.A N THR 428.A OG1 no hydrogen 3.080 N/A ARG 432.A NE ASP 465.A OD1 no hydrogen 2.918 N/A ARG 432.A NH1 GLU 140.A OE2 no hydrogen 2.831 N/A ARG 432.A NH2 GLU 140.A OE2 no hydrogen 2.487 N/A ARG 432.A NH2 ASP 465.A OD1 no hydrogen 3.145 N/A ARG 433.A NE GLU 427.A OE2.A no hydrogen 3.247 N/A ARG 433.A NH1 GLU 129.A OE2 no hydrogen 3.261 N/A ARG 433.A NH2 GLU 129.A OE1 no hydrogen 2.623 N/A ARG 433.A NH2 GLU 129.A OE2 no hydrogen 3.479 N/A ARG 434.A N VAL 426.A O no hydrogen 2.996 N/A VAL 436.A N GLY 424.A O no hydrogen 2.867 N/A LEU 439.A N VAL 436.A O no hydrogen 3.222 N/A GLU 440.A N PRO 437.A O no hydrogen 3.434 N/A ALA 441.A N ASP 438.A O no hydrogen 2.943 N/A LYS 444.A NZ GLU 448.A OE1 no hydrogen 3.333 N/A LYS 444.A NZ GLU 448.A OE2 no hydrogen 3.141 N/A ARG 447.A N VAL 443.A O no hydrogen 2.905 N/A ARG 447.A NH1 ALA 441.A O no hydrogen 2.806 N/A ARG 447.A NH1 ARG 442.A O no hydrogen 3.007 N/A GLU 448.A N LYS 444.A O no hydrogen 2.897 N/A ALA 449.A N SER 445.A O no hydrogen 3.103 N/A ALA 450.A N VAL 446.A O no hydrogen 3.282 N/A GLU 451.A N ARG 447.A O no hydrogen 3.089 N/A ARG 452.A N GLU 448.A O no hydrogen 3.118 N/A LYS 453.A N ALA 449.A O no hydrogen 3.163 N/A ALA 454.A N ALA 450.A O no hydrogen 2.872 N/A PHE 455.A N GLU 451.A O no hydrogen 3.042 N/A ASN 456.A N ARG 452.A O no hydrogen 3.256 N/A ASN 456.A ND2 TYR 377.A O no hydrogen 3.081 N/A ASN 456.A ND2 ARG 452.A O no hydrogen 2.792 N/A MET 457.A N.A LYS 453.A O no hydrogen 3.049 N/A MET 457.A N.B LYS 453.A O no hydrogen 3.022 N/A GLN 460.A N ASN 456.A O no hydrogen 3.181 N/A GLY 461.A N MET 457.A O.A no hydrogen 2.729 N/A GLY 461.A N MET 457.A O.B no hydrogen 2.784 N/A THR 462.A N PRO 458.A O no hydrogen 3.116 N/A THR 462.A OG1 PRO 458.A O no hydrogen 2.609 N/A ALA 463.A N VAL 459.A O no hydrogen 3.114 N/A ALA 464.A N GLN 460.A O no hydrogen 3.037 N/A ASP 465.A N GLY 461.A O no hydrogen 2.842 N/A LEU 466.A N THR 462.A O no hydrogen 2.943 N/A MET 467.A N ALA 463.A O no hydrogen 3.143 N/A LYS 468.A N ALA 464.A O no hydrogen 3.009 N/A LYS 468.A NZ GLU 140.A OE2 no hydrogen 3.184 N/A LYS 468.A NZ GLY 278.A O no hydrogen 2.726 N/A LEU 469.A N ASP 465.A O no hydrogen 2.962 N/A ALA 470.A N LEU 466.A O no hydrogen 2.914 N/A MET 471.A N MET 467.A O no hydrogen 2.923 N/A VAL 472.A N LYS 468.A O no hydrogen 3.005 N/A LYS 473.A N LEU 469.A O no hydrogen 2.885 N/A LYS 473.A NZ VAL 516.A O no hydrogen 2.818 N/A LEU 474.A N ALA 470.A O no hydrogen 2.784 N/A PHE 475.A N MET 471.A O no hydrogen 2.942 N/A ARG 477.A NH2 LYS 473.A O no hydrogen 3.450 N/A LEU 478.A N LEU 474.A O no hydrogen 2.985 N/A GLU 479.A N PHE 475.A O no hydrogen 2.965 N/A GLU 480.A N PRO 476.A O no hydrogen 3.111 N/A MET 481.A N LEU 478.A O no hydrogen 2.903 N/A GLY 482.A N GLU 479.A O no hydrogen 3.130 N/A ALA 483.A N LEU 478.A O no hydrogen 3.044 N/A ARG 484.A N GLU 496.A O no hydrogen 2.793 N/A ARG 484.A NH1 GLU 307.A OE1 no hydrogen 2.780 N/A ARG 484.A NH1 GLU 496.A OE1 no hydrogen 2.800 N/A ARG 484.A NH2 GLU 307.A OE1 no hydrogen 3.218 N/A MET 485.A N HIS 149.A NE2 no hydrogen 3.053 N/A LEU 486.A N VAL 494.A O no hydrogen 2.888 N/A LEU 487.A N VAL 494.A O no hydrogen 3.183 N/A GLN 488.A NE2 HIS 490.A O no hydrogen 3.037 N/A GLN 488.A NE2 GLU 492.A O no hydrogen 2.951 N/A VAL 489.A N GLU 492.A O no hydrogen 3.118 N/A HIS 490.A NE2 GLN 288.A O no hydrogen 2.977 N/A GLU 492.A N VAL 489.A O no hydrogen 2.798 N/A LEU 493.A N LEU 315.A O no hydrogen 2.833 N/A VAL 494.A N LEU 487.A O no hydrogen 2.828 N/A LEU 495.A N VAL 313.A O no hydrogen 2.766 N/A GLU 496.A N ARG 484.A O no hydrogen 2.918 N/A ALA 497.A N LEU 311.A O no hydrogen 2.940 N/A LYS 499.A N GLY 309.A O no hydrogen 2.977 N/A LYS 499.A NZ TRP 310.A O no hydrogen 3.041 N/A LYS 499.A NZ GLU 531.A OE2 no hydrogen 2.938 N/A GLU 500.A N GLU 500.A OE1 no hydrogen 2.827 N/A ARG 501.A N PRO 498.A O no hydrogen 2.824 N/A ALA 502.A N LYS 499.A O no hydrogen 3.465 N/A VAL 505.A N ARG 501.A O no hydrogen 2.810 N/A ALA 506.A N ALA 502.A O no hydrogen 2.836 N/A ARG 507.A N GLU 503.A O no hydrogen 3.052 N/A LEU 508.A N ALA 504.A O no hydrogen 2.974 N/A ALA 509.A N VAL 505.A O no hydrogen 2.905 N/A LYS 510.A N ALA 506.A O no hydrogen 3.109 N/A LYS 510.A NZ GLU 514.A OE2 no hydrogen 2.713 N/A LYS 510.A NZ VAL 525.A O no hydrogen 2.760 N/A GLU 511.A N ARG 507.A O no hydrogen 3.172 N/A VAL 512.A N LEU 508.A O no hydrogen 2.981 N/A MET 513.A N ALA 509.A O no hydrogen 2.956 N/A GLU 514.A N LYS 510.A O no hydrogen 2.881 N/A GLY 515.A N GLU 511.A O no hydrogen 3.008 N/A VAL 516.A N MET 513.A O no hydrogen 3.448 N/A ALA 520.A N HIS 327.A ND1 no hydrogen 2.927 N/A VAL 525.A N GLU 514.A OE2 no hydrogen 2.883 N/A GLU 526.A N ASP 316.A O no hydrogen 2.988 N/A GLY 528.A N ALA 314.A O no hydrogen 2.990 N/A GLY 530.A N LEU 312.A O no hydrogen 3.004 N/A TRP 533.A N PHE 304.A O no hydrogen 2.857 N/A TRP 533.A NE1 GLU 492.A OE2 no hydrogen 2.798 N/A SER 535.A N ASP 532.A OD1 no hydrogen 2.932 N/A SER 535.A OG ASP 532.A OD1 no hydrogen 3.336 N/A SER 535.A OG ASP 532.A OD2 no hydrogen 2.897 N/A ALA 536.A N ASP 532.A O no hydrogen 3.020 N/A LYS 537.A N LEU 534.A O no hydrogen 2.954 N/A LYS 537.A NZ GLU 492.A OE1 no hydrogen 3.147 N/A GLU 538.A N LEU 534.A O no hydrogen 2.958 N/A