Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 2wmh_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ARG 4.A N GLY 148.A O no hydrogen 2.736 N/A ARG 4.A NE TYR 147.A O no hydrogen 2.804 N/A ARG 4.A NH1 PHE 111.A O no hydrogen 3.378 N/A ARG 4.A NH1 TYR 114.A O no hydrogen 2.940 N/A ARG 4.A NH1 LEU 117.A O no hydrogen 2.954 N/A ARG 4.A NH2 PHE 111.A O no hydrogen 2.970 N/A ASN 8.A N SER 11.A O no hydrogen 3.098 N/A ASN 9.A ND2 ALA 299.A O no hydrogen 2.918 N/A SER 11.A N ASN 8.A O no hydrogen 2.907 N/A SER 11.A OG THR 6.A O no hydrogen 2.857 N/A LEU 13.A N THR 262.A O no hydrogen 2.862 N/A LEU 14.A N TYR 47.A O no hydrogen 2.838 N/A LEU 15.A N TYR 264.A O no hydrogen 2.835 N/A SER 16.A N ALA 49.A O no hydrogen 3.204 N/A LEU 18.A N GLU 51.A O no hydrogen 2.784 N/A GLY 20.A N HIS 53.A O no hydrogen 2.750 N/A ASN 21.A N GLY 26.A O no hydrogen 2.915 N/A ASN 25.A ND2 LEU 27.A O no hydrogen 3.328 N/A GLY 26.A N ASN 23.A O no hydrogen 2.961 N/A TRP 28.A N TYR 19.A O no hydrogen 2.698 N/A TRP 28.A NE1 GLU 482.A OE1 no hydrogen 3.136 N/A ASN 31.A N TRP 28.A O no hydrogen 3.439 N/A ASN 31.A ND2 MET 274.A O no hydrogen 3.017 N/A THR 32.A N ASP 277.A OD1 no hydrogen 2.921 N/A THR 32.A OG1 ASP 277.A OD1 no hydrogen 3.513 N/A THR 32.A OG1 ASP 277.A OD2 no hydrogen 2.729 N/A GLY 35.A N THR 32.A OG1 no hydrogen 3.033 N/A ALA 36.A N THR 32.A O no hydrogen 2.901 N/A TRP 37.A N LEU 33.A O no hydrogen 3.075 N/A GLU 38.A N LYS 34.A O no hydrogen 2.892 N/A ALA 39.A N GLY 35.A O no hydrogen 3.005 N/A ALA 39.A N ALA 36.A O no hydrogen 3.148 N/A ILE 40.A N TRP 37.A O no hydrogen 3.169 N/A VAL 44.A N PRO 41.A O no hydrogen 2.867 N/A LYS 45.A N PRO 41.A O no hydrogen 2.934 N/A LYS 45.A NZ TRP 37.A O no hydrogen 3.009 N/A LYS 45.A NZ ILE 40.A O no hydrogen 2.659 N/A LYS 45.A NZ GLU 42.A OE2 no hydrogen 2.485 N/A TYR 47.A N VAL 44.A O no hydrogen 2.843 N/A ALA 48.A N LYS 45.A O no hydrogen 3.310 N/A ALA 49.A N LEU 14.A O no hydrogen 3.038 N/A ILE 50.A N PRO 88.A O no hydrogen 2.948 N/A GLU 51.A N SER 16.A O no hydrogen 2.948 N/A LEU 52.A N PHE 90.A O no hydrogen 2.813 N/A HIS 53.A N LEU 18.A O no hydrogen 2.922 N/A ALA 55.A N HIS 53.A ND1 no hydrogen 3.183 N/A LYS 56.A N GLY 20.A O no hydrogen 3.099 N/A LYS 56.A NZ ASN 21.A OD1 no hydrogen 3.067 N/A LYS 56.A NZ TRP 478.A O no hydrogen 2.984 N/A VAL 57.A N PRO 54.A O no hydrogen 2.870 N/A CYS 58.A N ALA 55.A O no hydrogen 2.952 N/A LYS 59.A NZ ASP 22.A OD2 no hydrogen 3.196 N/A LYS 59.A NZ LYS 56.A O no hydrogen 3.071 N/A CYS 63.A N ALA 55.A O no hydrogen 2.907 N/A ILE 64.A N THR 61.A O no hydrogen 3.081 N/A ARG 66.A N ILE 64.A O no hydrogen 2.920 N/A ARG 66.A NE LYS 59.A O no hydrogen 2.859 N/A ARG 66.A NH2 LYS 59.A O no hydrogen 3.081 N/A ASP 67.A N ASN 100.A O no hydrogen 2.793 N/A LEU 71.A N THR 68.A OG1 no hydrogen 2.839 N/A ARG 72.A N THR 68.A O no hydrogen 3.111 N/A ARG 72.A NE ASP 67.A OD1 no hydrogen 2.918 N/A ARG 72.A NH2 ASP 67.A OD2 no hydrogen 2.861 N/A GLU 73.A N LYS 69.A O no hydrogen 3.071 N/A TRP 74.A N GLU 70.A O no hydrogen 3.092 N/A TRP 74.A NE1 GLY 26.A O no hydrogen 2.907 N/A TYR 75.A N LEU 71.A O no hydrogen 3.027 N/A TYR 75.A OH VAL 92.A O no hydrogen 2.763 N/A VAL 76.A N ARG 72.A O no hydrogen 2.915 N/A LYS 77.A N GLU 73.A O no hydrogen 2.851 N/A LYS 77.A NZ ASN 25.A O no hydrogen 3.502 N/A MET 78.A N TRP 74.A O no hydrogen 3.031 N/A LEU 79.A N TYR 75.A O no hydrogen 2.805 N/A GLU 80.A N VAL 76.A O no hydrogen 2.910 N/A GLU 81.A N LYS 77.A O no hydrogen 3.144 N/A ALA 82.A N MET 78.A O no hydrogen 2.916 N/A GLN 83.A N LEU 79.A O no hydrogen 2.863 N/A GLN 83.A NE2 SER 115.A OG no hydrogen 2.994 N/A SER 84.A N GLU 80.A O no hydrogen 3.101 N/A SER 84.A OG GLU 80.A O no hydrogen 2.932 N/A LEU 85.A N GLU 81.A O no hydrogen 3.186 N/A LEU 85.A N ALA 82.A O no hydrogen 3.234 N/A ASN 86.A N GLN 83.A O no hydrogen 3.249 N/A ILE 87.A N ALA 82.A O no hydrogen 2.901 N/A VAL 89.A N VAL 116.A O no hydrogen 2.874 N/A PHE 90.A N ILE 50.A O no hydrogen 2.915 N/A LEU 91.A N GLY 119.A O no hydrogen 3.099 N/A VAL 92.A N LEU 52.A O no hydrogen 2.883 N/A ILE 93.A N LEU 121.A O no hydrogen 3.046 N/A MET 94.A N LEU 121.A O no hydrogen 3.328 N/A SER 95.A OG ILE 123.A O no hydrogen 2.711 N/A ALA 96.A N GLU 124.A O no hydrogen 2.913 N/A GLY 97.A N ASN 125.A OD1 no hydrogen 2.876 N/A GLU 98.A N SER 95.A O no hydrogen 3.192 N/A ASN 100.A N GLU 98.A OE2 no hydrogen 2.960 N/A THR 101.A OG1 TYR 140.A OH no hydrogen 2.661 N/A GLU 105.A N GLU 105.A OE1 no hydrogen 2.865 N/A LEU 107.A N PRO 103.A O no hydrogen 3.177 N/A ASP 108.A N PRO 104.A O no hydrogen 2.957 N/A GLU 109.A N GLU 105.A O no hydrogen 2.995 N/A GLN 110.A N TRP 106.A O no hydrogen 3.114 N/A PHE 111.A N LEU 107.A O no hydrogen 2.940 N/A GLN 112.A N ASP 108.A O no hydrogen 3.041 N/A GLN 112.A NE2 ASP 108.A OD1 no hydrogen 2.837 N/A LYS 113.A N GLU 109.A O no hydrogen 3.139 N/A TYR 114.A N GLN 110.A O no hydrogen 2.866 N/A TYR 114.A OH GLU 80.A OE2 no hydrogen 2.620 N/A VAL 116.A N GLN 83.A OE1 no hydrogen 3.183 N/A LEU 117.A N TYR 114.A O no hydrogen 3.219 N/A LYS 118.A N VAL 89.A O no hydrogen 2.810 N/A LYS 118.A NZ SER 115.A O no hydrogen 3.185 N/A VAL 120.A N HIS 150.A O no hydrogen 3.078 N/A LEU 121.A N LEU 91.A O no hydrogen 2.794 N/A ASN 122.A N ILE 152.A O no hydrogen 2.915 N/A ASN 122.A ND2 SER 137.A OG no hydrogen 2.985 N/A ILE 123.A N MET 94.A O no hydrogen 3.030 N/A GLU 124.A N HIS 154.A O no hydrogen 2.941 N/A ASN 125.A N ASP 155.A OD1 no hydrogen 2.773 N/A ASN 125.A ND2 ASN 122.A OD1 no hydrogen 3.041 N/A ASN 125.A ND2 ASP 155.A OD2 no hydrogen 2.826 N/A TRP 127.A NE1 GLU 124.A OE2 no hydrogen 2.742 N/A ILE 128.A N ASN 125.A O no hydrogen 2.991 N/A ASN 130.A ND2 GLY 97.A O no hydrogen 2.863 N/A GLN 132.A N ASN 130.A OD1 no hydrogen 2.753 N/A HIS 136.A N GLN 132.A O no hydrogen 2.931 N/A SER 137.A N LEU 133.A O no hydrogen 2.954 N/A SER 137.A OG LEU 133.A O no hydrogen 2.899 N/A ALA 138.A N ALA 134.A O no hydrogen 2.927 N/A LYS 139.A N PRO 135.A O no hydrogen 3.068 N/A TYR 140.A N HIS 136.A O no hydrogen 3.098 N/A TYR 140.A OH THR 101.A OG1 no hydrogen 2.661 N/A TYR 140.A OH VAL 102.A O no hydrogen 2.335 N/A LEU 141.A N SER 137.A O no hydrogen 2.820 N/A GLU 142.A N ALA 138.A O no hydrogen 3.025 N/A VAL 143.A N LYS 139.A O no hydrogen 3.179 N/A CYS 144.A N TYR 140.A O no hydrogen 2.885 N/A CYS 144.A SG TYR 140.A O no hydrogen 3.450 N/A ALA 145.A N LEU 141.A O no hydrogen 2.789 N/A LYS 146.A N GLU 142.A O no hydrogen 3.037 N/A LYS 146.A NZ ASP 108.A OD2 no hydrogen 2.694 N/A TYR 147.A N CYS 144.A O no hydrogen 3.091 N/A TYR 147.A OH ASP 108.A OD1 no hydrogen 2.514 N/A GLY 148.A N ALA 145.A O no hydrogen 3.450 N/A ALA 149.A N CYS 144.A O no hydrogen 2.885 N/A HIS 150.A N LYS 118.A O no hydrogen 3.019 N/A PHE 151.A N ASN 180.A O no hydrogen 2.799 N/A ILE 152.A N VAL 120.A O no hydrogen 2.911 N/A TRP 153.A N VAL 182.A O no hydrogen 2.935 N/A TRP 153.A NE1 ASP 155.A OD2 no hydrogen 2.778 N/A HIS 154.A N ASN 122.A O no hydrogen 2.840 N/A HIS 154.A ND1 THR 185.A O no hydrogen 3.284 N/A ASP 155.A N ALA 184.A O no hydrogen 2.911 N/A GLU 157.A N THR 196.A OG1 no hydrogen 3.060 N/A LYS 158.A N ASP 192.A OD2 no hydrogen 2.889 N/A LYS 158.A NZ ASP 192.A OD1 no hydrogen 3.173 N/A LYS 158.A NZ GLU 335.A OE1 no hydrogen 3.534 N/A LYS 158.A NZ GLU 335.A OE2 no hydrogen 2.753 N/A TRP 159.A NE1 GLU 157.A OE1 no hydrogen 2.793 N/A TRP 161.A N GLU 157.A O no hydrogen 3.170 N/A TRP 161.A NE1 ASP 155.A O no hydrogen 3.052 N/A GLU 162.A N LYS 158.A O no hydrogen 2.929 N/A THR 163.A N TRP 159.A O no hydrogen 2.977 N/A THR 163.A OG1 TRP 159.A O no hydrogen 2.701 N/A ILE 164.A N PHE 160.A O no hydrogen 2.920 N/A MET 165.A N TRP 161.A O no hydrogen 3.276 N/A ASN 166.A N GLU 162.A O no hydrogen 3.192 N/A ASN 166.A N THR 163.A O no hydrogen 3.275 N/A ASP 167.A N ILE 164.A O no hydrogen 3.178 N/A PHE 170.A N ASP 167.A OD2 no hydrogen 2.864 N/A PHE 171.A N ASP 167.A O no hydrogen 2.902 N/A GLU 172.A N PRO 168.A O no hydrogen 2.998 N/A ALA 173.A N THR 169.A O no hydrogen 3.023 N/A SER 174.A N PHE 170.A O no hydrogen 2.821 N/A SER 174.A OG PHE 170.A O no hydrogen 2.813 N/A GLN 175.A N PHE 171.A O no hydrogen 3.126 N/A LYS 176.A N GLU 172.A O no hydrogen 3.076 N/A TYR 177.A N ALA 173.A O no hydrogen 2.716 N/A HIS 178.A ND1 GLN 175.A O no hydrogen 3.214 N/A ASN 180.A N TYR 177.A O no hydrogen 2.863 N/A LEU 181.A N HIS 178.A O no hydrogen 3.199 N/A VAL 182.A N PHE 151.A O no hydrogen 2.910 N/A LEU 183.A N ASN 211.A O no hydrogen 3.427 N/A ALA 184.A N TRP 153.A O no hydrogen 2.873 N/A THR 185.A N GLY 213.A O no hydrogen 2.912 N/A LYS 186.A NZ GLU 124.A OE1 no hydrogen 2.743 N/A LYS 186.A NZ THR 188.A OG1 no hydrogen 2.728 N/A LYS 186.A NZ ASP 217.A OD2 no hydrogen 3.568 N/A ASN 187.A ND2 GLU 252.A OE1 no hydrogen 2.747 N/A THR 188.A OG1 ASP 217.A OD2 no hydrogen 2.599 N/A ILE 190.A N ASN 187.A O no hydrogen 3.359 N/A ASP 193.A N GLU 335.A O no hydrogen 2.986 N/A GLY 195.A N GLU 335.A OE1 no hydrogen 2.820 N/A THR 196.A N ASP 192.A O no hydrogen 2.827 N/A THR 196.A OG1 ASP 192.A O no hydrogen 2.749 N/A ASP 197.A N ASP 193.A O no hydrogen 3.237 N/A SER 198.A N ALA 194.A O no hydrogen 2.983 N/A SER 198.A OG ALA 194.A O no hydrogen 3.311 N/A SER 198.A OG TYR 327.A OH no hydrogen 2.864 N/A SER 198.A OG LEU 348.A O no hydrogen 2.629 N/A ILE 199.A N GLY 195.A O no hydrogen 2.915 N/A VAL 200.A N THR 196.A O no hydrogen 2.921 N/A SER 201.A N ASP 197.A O no hydrogen 3.082 N/A SER 201.A OG ASP 197.A O no hydrogen 2.770 N/A GLY 202.A N SER 198.A O no hydrogen 2.939 N/A PHE 203.A N ILE 199.A O no hydrogen 2.887 N/A TRP 204.A N VAL 200.A O no hydrogen 3.374 N/A LEU 205.A N SER 201.A O no hydrogen 2.979 N/A SER 206.A N GLY 202.A O no hydrogen 2.853 N/A SER 206.A OG GLY 202.A O no hydrogen 2.714 N/A GLY 207.A N TRP 204.A O no hydrogen 3.126 N/A LEU 208.A N PHE 203.A O no hydrogen 3.034 N/A CYS 209.A SG ASN 211.A O no hydrogen 3.386 N/A ASP 210.A N HIS 178.A O no hydrogen 2.862 N/A ASN 211.A ND2 ILE 7.A O no hydrogen 3.134 N/A TRP 212.A NE1 GLY 259.A O no hydrogen 3.134 N/A GLY 213.A N LEU 183.A O no hydrogen 3.155 N/A SER 214.A N VAL 263.A O no hydrogen 3.012 N/A SER 215.A N THR 185.A O no hydrogen 2.815 N/A THR 216.A N ASN 265.A O no hydrogen 2.843 N/A THR 218.A N GLU 267.A O no hydrogen 2.769 N/A THR 218.A OG1 TYR 241.A O no hydrogen 2.658 N/A THR 218.A OG1 GLU 267.A O no hydrogen 3.347 N/A TRP 219.A N ASP 217.A OD1 no hydrogen 2.919 N/A LYS 220.A N ASP 217.A O no hydrogen 3.054 N/A LYS 220.A NZ ASN 187.A OD1 no hydrogen 2.831 N/A LYS 220.A NZ ASP 217.A O no hydrogen 2.776 N/A LYS 220.A NZ GLU 252.A OE1 no hydrogen 3.127 N/A LYS 220.A NZ GLU 252.A OE2 no hydrogen 2.782 N/A TRP 221.A N THR 218.A O no hydrogen 3.012 N/A TRP 221.A NE1 THR 227.A O no hydrogen 2.844 N/A GLU 223.A N TRP 219.A O no hydrogen 2.978 N/A LYS 224.A N LYS 220.A O no hydrogen 2.978 N/A LYS 224.A NZ THR 336.A OG1 no hydrogen 2.860 N/A HIS 225.A N TRP 222.A O no hydrogen 2.917 N/A TYR 226.A N TRP 221.A O no hydrogen 2.979 N/A THR 227.A OG1 GLU 231.A OE1 no hydrogen 2.532 N/A ASN 228.A N GLU 231.A OE1 no hydrogen 3.133 N/A ASN 228.A ND2 THR 463.A OG1 no hydrogen 3.021 N/A THR 229.A N ASN 228.A OD1 no hydrogen 2.882 N/A PHE 230.A N ASN 413.A OD1 no hydrogen 2.784 N/A GLU 231.A N ASN 228.A O no hydrogen 2.914 N/A ARG 234.A NE GLU 231.A OE1 no hydrogen 2.945 N/A ARG 234.A NE GLU 231.A OE2 no hydrogen 3.370 N/A ARG 234.A NH2 GLU 231.A OE2 no hydrogen 3.124 N/A ARG 236.A NH1 TRP 222.A O no hydrogen 3.085 N/A MET 238.A N PHE 472.A O no hydrogen 2.739 N/A ARG 239.A N ASP 237.A OD1 no hydrogen 2.976 N/A ARG 239.A NE ASP 237.A OD1 no hydrogen 3.081 N/A ARG 239.A NE ASP 237.A OD2 no hydrogen 3.452 N/A ARG 239.A NH1 MET 465.A O no hydrogen 2.980 N/A ARG 239.A NH1 LEU 468.A O no hydrogen 3.057 N/A ARG 239.A NH2 ASP 237.A OD2 no hydrogen 2.887 N/A SER 240.A N ASP 237.A O no hydrogen 2.834 N/A SER 240.A OG TYR 226.A O no hydrogen 2.760 N/A SER 240.A OG ASP 237.A O no hydrogen 3.076 N/A TYR 241.A N MET 238.A O no hydrogen 2.944 N/A TYR 241.A OH GLU 482.A OE2 no hydrogen 2.674 N/A ALA 242.A N ARG 239.A O no hydrogen 3.009 N/A SER 243.A N SER 240.A O no hydrogen 3.220 N/A SER 243.A OG ARG 239.A O no hydrogen 2.745 N/A GLU 246.A N GLU 246.A OE1 no hydrogen 2.803 N/A SER 247.A N TYR 458.A O no hydrogen 2.979 N/A SER 247.A OG HIS 439.A O no hydrogen 2.628 N/A SER 247.A OG TYR 458.A O no hydrogen 3.276 N/A MET 248.A N PRO 245.A O no hydrogen 2.931 N/A ILE 249.A N PRO 245.A O no hydrogen 3.209 N/A MET 251.A N SER 247.A O no hydrogen 2.882 N/A GLU 252.A N MET 248.A O no hydrogen 2.942 N/A MET 253.A N ILE 249.A O no hydrogen 3.034 N/A MET 254.A N ALA 250.A O no hydrogen 2.785 N/A ASN 255.A N MET 251.A O no hydrogen 3.088 N/A ASN 255.A ND2 PRO 338.A O no hydrogen 2.829 N/A VAL 256.A N MET 253.A O no hydrogen 3.027 N/A TYR 257.A N MET 253.A O no hydrogen 2.876 N/A TYR 257.A OH ASN 297.A O no hydrogen 2.539 N/A TYR 257.A OH TYR 406.A OH no hydrogen 3.293 N/A THR 258.A N MET 254.A O no hydrogen 2.887 N/A THR 258.A OG1 MET 254.A O no hydrogen 2.893 N/A GLY 259.A N VAL 256.A O no hydrogen 2.930 N/A GLY 260.A N TYR 257.A O no hydrogen 2.986 N/A GLY 261.A N VAL 256.A O no hydrogen 2.865 N/A THR 262.A N TRP 212.A O no hydrogen 2.870 N/A THR 262.A OG1 ASN 211.A OD1 no hydrogen 2.705 N/A VAL 263.A N TRP 212.A O no hydrogen 3.364 N/A TYR 264.A N LEU 13.A O no hydrogen 2.929 N/A ASN 265.A N SER 214.A O no hydrogen 2.800 N/A ASN 265.A ND2 GLU 51.A OE1 no hydrogen 2.937 N/A ASN 265.A ND2 HIS 154.A NE2 no hydrogen 3.148 N/A PHE 266.A N ASN 265.A OD1 no hydrogen 2.848 N/A GLU 267.A N THR 216.A O no hydrogen 3.110 N/A CYS 268.A N THR 218.A OG1 no hydrogen 3.086 N/A TYR 271.A N CYS 268.A O no hydrogen 2.789 N/A TYR 271.A OH GLU 244.A O no hydrogen 2.672 N/A THR 272.A N CYS 268.A O no hydrogen 2.971 N/A PHE 273.A N ALA 269.A O no hydrogen 2.895 N/A MET 274.A N ALA 269.A O no hydrogen 3.018 N/A THR 275.A N VAL 278.A O no hydrogen 3.323 N/A THR 275.A OG1 ALA 486.A O no hydrogen 2.807 N/A ASN 276.A N TRP 29.A O no hydrogen 2.746 N/A ASN 276.A ND2 ASN 487.A OD1 no hydrogen 3.116 N/A ASN 276.A ND2 SER 490.A OG no hydrogen 2.859 N/A ASP 277.A N ASN 31.A OD1 no hydrogen 2.851 N/A VAL 278.A N THR 275.A O no hydrogen 2.872 N/A THR 280.A N PHE 273.A O no hydrogen 3.023 N/A THR 280.A OG1 TYR 271.A O no hydrogen 2.628 N/A THR 280.A OG1 PHE 273.A O no hydrogen 3.515 N/A PHE 283.A N THR 280.A OG1 no hydrogen 3.190 N/A THR 284.A N THR 280.A O no hydrogen 2.833 N/A THR 284.A OG1 THR 280.A O no hydrogen 3.479 N/A LYS 285.A N PRO 281.A O no hydrogen 2.800 N/A ILE 287.A N ALA 282.A O no hydrogen 2.836 N/A ILE 288.A N PHE 283.A O no hydrogen 2.854 N/A PHE 291.A N ILE 287.A O no hydrogen 2.877 N/A ARG 292.A N ILE 288.A O no hydrogen 2.891 N/A ARG 292.A NE ASP 43.A OD2 no hydrogen 2.905 N/A ARG 292.A NH2 ASP 43.A OD1 no hydrogen 2.826 N/A HIS 293.A N PRO 289.A O no hydrogen 3.151 N/A HIS 293.A NE2 TYR 406.A OH no hydrogen 2.739 N/A ALA 294.A N PHE 290.A O no hydrogen 2.959 N/A ILE 295.A N PHE 291.A O no hydrogen 2.940 N/A GLN 296.A N ARG 292.A O no hydrogen 2.950 N/A ASN 297.A N HIS 293.A O no hydrogen 2.862 N/A ASN 297.A ND2 HIS 293.A O no hydrogen 3.102 N/A SER 301.A N GLU 304.A OE1 no hydrogen 2.815 N/A SER 301.A OG GLU 304.A OE1 no hydrogen 3.312 N/A GLU 303.A N GLU 303.A OE1 no hydrogen 2.859 N/A GLU 304.A N SER 301.A OG no hydrogen 3.093 N/A VAL 305.A N SER 301.A O no hydrogen 2.953 N/A VAL 306.A N LYS 302.A O no hydrogen 2.857 N/A ASN 307.A N GLU 303.A O no hydrogen 2.891 N/A ARG 308.A N GLU 304.A O no hydrogen 3.107 N/A ARG 308.A NH1 THR 258.A O no hydrogen 3.007 N/A ARG 308.A NH2 THR 258.A O no hydrogen 2.972 N/A THR 309.A N VAL 306.A O no hydrogen 3.182 N/A THR 309.A OG1 VAL 305.A O no hydrogen 2.686 N/A LYS 310.A N TYR 388.A OH no hydrogen 2.845 N/A ALA 311.A N TYR 388.A OH no hydrogen 3.130 N/A VAL 312.A N LYS 368.A O no hydrogen 2.949 N/A PHE 313.A N PRO 349.A O no hydrogen 2.967 N/A TRP 314.A N LEU 370.A O no hydrogen 2.785 N/A TRP 314.A NE1 ILE 355.A O no hydrogen 2.854 N/A ASN 315.A N ILE 351.A O no hydrogen 2.914 N/A ASN 315.A ND2 GLU 162.A OE2 no hydrogen 3.066 N/A ARG 319.A NE GLU 353.A OE2 no hydrogen 2.850 N/A ARG 319.A NH2 GLU 353.A OE1 no hydrogen 2.846 N/A ILE 320.A N ASN 315.A OD1 no hydrogen 2.800 N/A SER 321.A N GLU 162.A OE2 no hydrogen 3.171 N/A SER 321.A OG GLU 162.A OE1 no hydrogen 2.653 N/A SER 321.A OG GLU 162.A OE2 no hydrogen 3.320 N/A SER 322.A N ARG 319.A O no hydrogen 2.838 N/A SER 322.A OG ARG 319.A O no hydrogen 2.571 N/A LEU 323.A N ILE 320.A O no hydrogen 2.989 N/A PHE 326.A N LEU 323.A O no hydrogen 3.169 N/A TYR 327.A OH SER 198.A OG no hydrogen 2.864 N/A GLN 328.A N GLY 325.A O no hydrogen 3.196 N/A GLN 328.A NE2 ASN 333.A O no hydrogen 2.969 N/A LEU 330.A N TYR 327.A O no hydrogen 3.077 N/A TYR 331.A N TYR 327.A O no hydrogen 3.019 N/A SER 332.A N TYR 327.A O no hydrogen 3.143 N/A ASP 334.A N SER 332.A OG no hydrogen 3.201 N/A THR 336.A N ASP 334.A OD1 no hydrogen 2.994 N/A THR 336.A OG1 ASP 334.A OD1 no hydrogen 2.597 N/A THR 336.A OG1 ASP 334.A OD2 no hydrogen 3.262 N/A MET 337.A N ASP 334.A O no hydrogen 3.269 N/A TYR 340.A N TYR 408.A OH no hydrogen 2.918 N/A TYR 340.A OH ASP 197.A OD2 no hydrogen 2.431 N/A ASN 341.A N TYR 331.A O no hydrogen 2.946 N/A ASN 341.A ND2 TYR 331.A O no hydrogen 3.431 N/A ASN 342.A ND2 LEU 330.A O no hydrogen 3.304 N/A ARG 344.A N ASN 342.A OD1 no hydrogen 3.166 N/A ARG 344.A NE TYR 388.A O no hydrogen 2.763 N/A ARG 344.A NH2 ASN 385.A O no hydrogen 3.400 N/A ARG 344.A NH2 TYR 388.A O no hydrogen 3.064 N/A TYR 345.A OH ASN 385.A OD1 no hydrogen 2.537 N/A HIS 346.A N GLY 343.A O no hydrogen 3.170 N/A HIS 346.A NE2 ARG 400.A O no hydrogen 3.324 N/A LEU 348.A N TYR 331.A OH no hydrogen 2.935 N/A VAL 350.A N SER 198.A O no hydrogen 3.126 N/A ILE 351.A N PHE 313.A O no hydrogen 2.767 N/A HIS 352.A NE2 GLU 162.A O no hydrogen 2.874 N/A LYS 354.A N HIS 352.A ND1 no hydrogen 3.057 N/A ILE 355.A N HIS 352.A O no hydrogen 3.080 N/A ILE 360.A N ASP 356.A O no hydrogen 3.173 N/A SER 361.A N LYS 357.A O no hydrogen 3.023 N/A SER 361.A OG LYS 357.A O no hydrogen 3.318 N/A SER 362.A N GLU 358.A O no hydrogen 3.050 N/A ILE 363.A N LYS 359.A O no hydrogen 2.889 N/A PHE 364.A N ILE 360.A O no hydrogen 2.763 N/A ALA 367.A N PHE 364.A O no hydrogen 3.005 N/A LYS 368.A N LYS 310.A O no hydrogen 2.911 N/A LYS 368.A NZ GLU 376.A OE2 no hydrogen 3.108 N/A LEU 370.A N VAL 312.A O no hydrogen 2.850 N/A THR 371.A N SER 374.A OG no hydrogen 2.864 N/A THR 371.A OG1 GLU 317.A OE1 no hydrogen 2.715 N/A LYS 372.A NZ SER 322.A OG no hydrogen 2.782 N/A ASN 373.A N THR 371.A OG1 no hydrogen 3.273 N/A SER 374.A N THR 371.A O no hydrogen 3.063 N/A SER 374.A OG THR 371.A O no hydrogen 3.279 N/A GLU 376.A N GLU 376.A OE1 no hydrogen 2.860 N/A LEU 377.A N SER 374.A O no hydrogen 3.109 N/A SER 378.A N GLU 375.A O no hydrogen 3.143 N/A SER 378.A OG GLU 375.A O no hydrogen 2.988 N/A SER 379.A N GLU 376.A O no hydrogen 3.064 N/A LYS 380.A NZ PHE 326.A O no hydrogen 2.757 N/A LYS 380.A NZ GLN 328.A O no hydrogen 2.814 N/A TYR 383.A N SER 379.A O no hydrogen 2.870 N/A LEU 384.A N LYS 380.A O no hydrogen 3.022 N/A ASN 385.A N VAL 381.A O no hydrogen 2.869 N/A SER 386.A N ASN 382.A O no hydrogen 3.064 N/A SER 386.A N TYR 383.A O no hydrogen 2.954 N/A SER 386.A OG TYR 383.A O no hydrogen 2.662 N/A LEU 387.A N LEU 384.A O no hydrogen 3.012 N/A TYR 388.A N LEU 384.A O no hydrogen 2.901 N/A LYS 390.A NZ GLU 393.A OE1 no hydrogen 3.466 N/A TYR 392.A OH ASN 342.A OD1 no hydrogen 3.413 N/A TYR 392.A OH GLY 396.A O no hydrogen 2.732 N/A GLU 393.A N MET 421.A O no hydrogen 3.124 N/A ASP 395.A N GLN 419.A O no hydrogen 2.980 N/A GLY 396.A N GLN 419.A O no hydrogen 3.179 N/A TYR 397.A N TYR 408.A O no hydrogen 2.945 N/A ALA 398.A N TYR 392.A OH no hydrogen 3.222 N/A GLN 399.A N TYR 406.A O no hydrogen 2.754 N/A GLN 399.A NE2 THR 258.A OG1 no hydrogen 2.906 N/A ARG 400.A NE GLY 402.A O no hydrogen 3.024 N/A ARG 400.A NH1 GLU 446.A OE2 no hydrogen 2.827 N/A ARG 400.A NH2 GLU 446.A OE2 no hydrogen 2.948 N/A VAL 401.A N SER 404.A O no hydrogen 2.826 N/A ASN 403.A ND2 GLU 446.A O no hydrogen 2.861 N/A SER 404.A N VAL 401.A O no hydrogen 2.946 N/A TRP 405.A N VAL 444.A O no hydrogen 2.825 N/A TRP 405.A NE1 PRO 423.A O no hydrogen 2.989 N/A TYR 406.A N GLN 399.A O no hydrogen 2.902 N/A TYR 406.A OH HIS 293.A NE2 no hydrogen 2.739 N/A ILE 407.A N ALA 442.A O no hydrogen 2.973 N/A TYR 408.A N TYR 397.A O no hydrogen 2.966 N/A TYR 408.A OH ASN 255.A OD1 no hydrogen 2.714 N/A ASN 409.A N THR 440.A O no hydrogen 3.152 N/A ASN 409.A ND2 LYS 416.A O no hydrogen 3.006 N/A ASN 409.A ND2 LEU 436.A O no hydrogen 2.993 N/A SER 410.A N GLN 418.A OE1 no hydrogen 2.847 N/A SER 410.A OG GLN 418.A OE1 no hydrogen 3.402 N/A ASN 411.A N ASN 409.A OD1 no hydrogen 2.856 N/A ASN 411.A ND2 LYS 416.A O no hydrogen 2.983 N/A LYS 416.A N ILE 414.A O no hydrogen 2.966 N/A ASN 417.A ND2 ASP 435.A OD1 no hydrogen 3.334 N/A GLN 418.A N LEU 436.A O no hydrogen 2.994 N/A GLN 418.A NE2 SER 410.A OG no hydrogen 3.074 N/A GLN 419.A N ASP 395.A OD1 no hydrogen 2.933 N/A GLN 419.A NE2 ASP 435.A OD1 no hydrogen 2.940 N/A VAL 420.A N LEU 434.A O no hydrogen 2.974 N/A MET 421.A N GLU 393.A O no hydrogen 2.809 N/A LEU 422.A N LEU 432.A O no hydrogen 2.716 N/A MET 424.A N LYS 430.A O no hydrogen 3.102 N/A TYR 425.A N GLU 446.A OE1 no hydrogen 3.175 N/A TYR 425.A N GLU 446.A OE2 no hydrogen 2.902 N/A THR 426.A N GLU 446.A OE1 no hydrogen 3.086 N/A THR 426.A OG1 ASN 428.A OD1 no hydrogen 2.764 N/A THR 426.A OG1 GLU 446.A OE1 no hydrogen 2.683 N/A THR 429.A OG1 LYS 510.A O no hydrogen 3.039 N/A LYS 430.A N LYS 510.A O no hydrogen 2.871 N/A LYS 430.A N GLY 511.A O no hydrogen 3.211 N/A SER 431.A N LYS 510.A O no hydrogen 3.235 N/A LEU 432.A N LEU 422.A O no hydrogen 2.876 N/A SER 433.A N THR 508.A O no hydrogen 2.801 N/A LEU 434.A N VAL 420.A O no hydrogen 2.969 N/A ASP 435.A N THR 506.A O no hydrogen 2.986 N/A LEU 436.A N GLN 418.A O no hydrogen 2.852 N/A THR 437.A OG1 PRO 438.A O no hydrogen 3.332 N/A THR 437.A OG1 THR 440.A OG1 no hydrogen 3.162 N/A HIS 439.A NE2 ALA 412.A O no hydrogen 2.735 N/A THR 440.A OG1 THR 437.A O no hydrogen 2.843 N/A THR 440.A OG1 THR 437.A OG1 no hydrogen 3.162 N/A TYR 441.A N ASN 456.A O no hydrogen 2.982 N/A ALA 442.A N ILE 407.A O no hydrogen 2.855 N/A VAL 443.A N LEU 454.A O no hydrogen 2.830 N/A VAL 444.A N TRP 405.A O no hydrogen 2.894 N/A LYS 445.A N HIS 452.A O no hydrogen 2.827 N/A LYS 445.A NZ ASN 297.A OD1 no hydrogen 3.267 N/A GLU 446.A N ASN 403.A O no hydrogen 2.905 N/A ASN 447.A N ASN 450.A O no hydrogen 2.912 N/A LEU 451.A N ILE 553.A O no hydrogen 2.886 N/A HIS 452.A N LYS 445.A O no hydrogen 2.890 N/A ILE 453.A N MET 551.A O no hydrogen 2.846 N/A LEU 454.A N VAL 443.A O no hydrogen 2.839 N/A LEU 455.A N VAL 549.A O no hydrogen 2.768 N/A ASN 456.A N TYR 441.A O no hydrogen 3.062 N/A ASN 457.A N GLY 547.A O no hydrogen 3.301 N/A ASN 457.A ND2 ARG 503.A O no hydrogen 3.643 N/A ASN 457.A ND2 HIS 545.A O no hydrogen 2.891 N/A TYR 458.A N ASN 456.A OD1 no hydrogen 2.950 N/A TYR 458.A OH ASP 499.A OD2 no hydrogen 2.707 N/A ARG 459.A N ASN 546.A OD1 no hydrogen 2.914 N/A ARG 459.A NH1 HIS 439.A ND1 no hydrogen 2.926 N/A THR 460.A N GLU 246.A OE1 no hydrogen 3.095 N/A THR 460.A OG1 GLU 246.A OE1 no hydrogen 3.531 N/A THR 460.A OG1 GLU 246.A OE2 no hydrogen 2.658 N/A ASP 461.A N VAL 498.A O no hydrogen 2.769 N/A LYS 462.A NZ GLU 246.A OE1 no hydrogen 2.880 N/A LYS 462.A NZ THR 460.A O no hydrogen 2.955 N/A LYS 462.A NZ THR 460.A OG1 no hydrogen 2.982 N/A THR 463.A N ASP 461.A OD1 no hydrogen 3.055 N/A THR 463.A OG1 ASP 461.A OD1 no hydrogen 2.517 N/A THR 463.A OG1 ASP 461.A OD2 no hydrogen 3.527 N/A TRP 466.A N LYS 462.A O no hydrogen 3.098 N/A TRP 466.A NE1 SER 243.A OG no hydrogen 2.918 N/A ALA 467.A N ALA 464.A O no hydrogen 3.165 N/A LEU 468.A N MET 465.A O no hydrogen 3.348 N/A ASP 473.A N ASN 471.A OD1 no hydrogen 3.115 N/A LYS 476.A N ASP 473.A O no hydrogen 2.818 N/A SER 477.A N ALA 474.A O no hydrogen 3.007 N/A SER 477.A OG ALA 474.A O no hydrogen 2.989 N/A TRP 478.A N GLU 482.A OE1 no hydrogen 2.696 N/A LYS 479.A N LYS 476.A O no hydrogen 2.969 N/A GLU 481.A N GLU 481.A OE1 no hydrogen 2.713 N/A LEU 483.A N LYS 479.A O no hydrogen 3.354 N/A GLU 484.A N LYS 480.A O no hydrogen 2.874 N/A LEU 485.A N GLU 481.A O no hydrogen 3.072 N/A ALA 486.A N GLU 482.A O no hydrogen 2.982 N/A ASN 487.A N LEU 483.A O no hydrogen 2.737 N/A TRP 488.A N GLU 484.A O no hydrogen 2.959 N/A ILE 489.A N LEU 485.A O no hydrogen 2.957 N/A SER 490.A N ALA 486.A O no hydrogen 3.151 N/A SER 490.A OG ASN 487.A O no hydrogen 3.014 N/A LYS 491.A N TRP 488.A O no hydrogen 3.110 N/A ASN 492.A N TRP 488.A O no hydrogen 2.898 N/A ASN 492.A ND2 TRP 488.A O no hydrogen 3.022 N/A TYR 493.A OH GLU 246.A OE2 no hydrogen 2.644 N/A SER 494.A N ILE 489.A O no hydrogen 2.897 N/A SER 494.A OG ILE 489.A O no hydrogen 3.315 N/A ILE 495.A N ASN 492.A O no hydrogen 3.111 N/A ASN 496.A N ASN 492.A O no hydrogen 2.723 N/A ARG 503.A N HIS 545.A O no hydrogen 2.929 N/A ARG 503.A NE THR 437.A OG1 no hydrogen 2.960 N/A ARG 503.A NH1 PRO 438.A O no hydrogen 2.949 N/A ARG 503.A NH1 ASN 457.A O no hydrogen 2.788 N/A ARG 503.A NH2 ASN 457.A O no hydrogen 3.082 N/A THR 505.A N VAL 543.A O no hydrogen 2.797 N/A THR 506.A N ASP 435.A O no hydrogen 3.212 N/A LEU 507.A N ILE 541.A O no hydrogen 2.879 N/A THR 508.A N SER 433.A O no hydrogen 2.974 N/A LEU 509.A N TYR 539.A O no hydrogen 2.746 N/A LYS 510.A N SER 431.A O no hydrogen 2.916 N/A GLY 511.A N HIS 537.A O no hydrogen 3.007 N/A HIS 512.A N HIS 537.A O no hydrogen 3.013 N/A ASN 518.A N SER 552.A O no hydrogen 3.152 N/A SER 520.A N GLU 550.A O no hydrogen 2.909 N/A ASP 522.A N MET 548.A O no hydrogen 2.920 N/A HIS 525.A N ASP 522.A O no hydrogen 3.010 N/A THR 527.A N ASN 544.A O no hydrogen 2.910 N/A THR 527.A OG1 ASN 544.A OD1 no hydrogen 2.901 N/A THR 529.A N THR 542.A O no hydrogen 2.937 N/A ASN 531.A N THR 540.A O no hydrogen 2.814 N/A ASP 533.A N VAL 538.A O no hydrogen 2.866 N/A GLU 534.A N GLU 534.A OE1 no hydrogen 2.633 N/A ASN 535.A N ASP 533.A OD1 no hydrogen 3.013 N/A THR 536.A N ASP 533.A OD1 no hydrogen 3.237 N/A VAL 538.A N ASP 533.A O no hydrogen 3.200 N/A TYR 539.A N LEU 509.A O no hydrogen 2.933 N/A TYR 539.A OH GLU 530.A OE2 no hydrogen 2.725 N/A THR 540.A N ASN 531.A O no hydrogen 2.751 N/A ILE 541.A N LEU 507.A O no hydrogen 2.767 N/A THR 542.A N THR 529.A O no hydrogen 2.872 N/A VAL 543.A N THR 505.A O no hydrogen 2.866 N/A ASN 544.A N THR 527.A O no hydrogen 2.780 N/A ASN 544.A ND2 THR 504.A OG1 no hydrogen 2.891 N/A HIS 545.A N ARG 503.A O no hydrogen 2.850 N/A ASN 546.A N HIS 525.A O no hydrogen 3.046 N/A ASN 546.A ND2 ARG 459.A O no hydrogen 3.030 N/A ASN 546.A ND2 ASP 501.A O no hydrogen 3.161 N/A GLY 547.A N ASN 457.A OD1 no hydrogen 2.827 N/A MET 548.A N ASP 522.A OD2 no hydrogen 2.952 N/A VAL 549.A N LEU 455.A O no hydrogen 2.881 N/A GLU 550.A N SER 520.A O no hydrogen 2.879 N/A MET 551.A N ILE 453.A O no hydrogen 2.847 N/A SER 552.A N ASN 518.A O no hydrogen 2.875 N/A ILE 553.A N LEU 451.A O no hydrogen 2.985 N/A