Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 8y6h_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): VAL 3.A N ARG 305.A O no hydrogen 3.264 N/A MET 8.A N SER 4.A O no hydrogen 2.917 N/A PHE 9.A N PHE 6.A O no hydrogen 3.246 N/A ARG 10.A NH1 ASP 316.A OD1 no hydrogen 3.458 N/A ARG 10.A NH1 ASP 316.A OD2 no hydrogen 3.513 N/A ARG 10.A NH2 ASP 316.A OD1 no hydrogen 2.751 N/A SER 12.A OG PHE 9.A O no hydrogen 2.553 N/A LYS 17.A N ASN 13.A O no hydrogen 2.955 N/A LEU 18.A N TRP 14.A O no hydrogen 2.920 N/A TYR 19.A N LEU 15.A O no hydrogen 2.885 N/A MET 20.A N ASP 16.A O no hydrogen 2.928 N/A VAL 21.A N LYS 17.A O no hydrogen 2.957 N/A VAL 22.A N LEU 18.A O no hydrogen 2.950 N/A GLY 23.A N TYR 19.A O no hydrogen 2.837 N/A THR 24.A N MET 20.A O no hydrogen 2.906 N/A THR 24.A OG1 MET 20.A O no hydrogen 2.693 N/A LEU 25.A N VAL 21.A O no hydrogen 3.007 N/A ALA 26.A N VAL 22.A O no hydrogen 2.924 N/A ALA 27.A N GLY 23.A O no hydrogen 2.876 N/A ILE 28.A N THR 24.A O no hydrogen 2.944 N/A ILE 29.A N LEU 25.A O no hydrogen 2.991 N/A HIS 30.A N ALA 26.A O no hydrogen 2.847 N/A HIS 30.A ND1 GLN 90.A OE1 no hydrogen 2.837 N/A GLY 31.A N ALA 27.A O no hydrogen 2.888 N/A ALA 32.A N ILE 28.A O no hydrogen 2.980 N/A GLY 33.A N HIS 30.A O no hydrogen 3.218 N/A MET 37.A N GLY 33.A O no hydrogen 3.201 N/A MET 38.A N LEU 34.A O no hydrogen 2.963 N/A LEU 39.A N PRO 35.A O no hydrogen 2.952 N/A VAL 40.A N LEU 36.A O no hydrogen 2.975 N/A PHE 41.A N MET 37.A O no hydrogen 2.866 N/A GLY 42.A N MET 38.A O no hydrogen 2.935 N/A GLU 43.A N LEU 39.A O no hydrogen 3.103 N/A MET 44.A N VAL 40.A O no hydrogen 2.972 N/A THR 45.A N PHE 41.A O no hydrogen 2.929 N/A THR 45.A OG1 PHE 41.A O no hydrogen 2.971 N/A ASP 46.A N GLY 42.A O no hydrogen 2.981 N/A ILE 47.A N GLU 43.A O no hydrogen 3.023 N/A PHE 48.A N MET 44.A O no hydrogen 3.078 N/A ALA 49.A N THR 45.A O no hydrogen 2.882 N/A ASN 50.A N ASP 46.A O no hydrogen 2.933 N/A ASN 50.A ND2 ASP 46.A O no hydrogen 2.925 N/A ALA 51.A N ILE 47.A O no hydrogen 3.065 N/A GLY 52.A N PHE 48.A O no hydrogen 2.963 N/A ASN 53.A N ALA 49.A O no hydrogen 2.926 N/A ASN 53.A ND2 PHE 361.A O no hydrogen 3.602 N/A LEU 54.A N ASN 50.A O no hydrogen 3.002 N/A GLU 55.A N ALA 51.A O no hydrogen 2.971 N/A ASP 56.A N GLY 52.A O no hydrogen 2.934 N/A LEU 57.A N ASN 53.A O no hydrogen 2.972 N/A MET 58.A N LEU 54.A O no hydrogen 2.962 N/A SER 59.A N ASP 56.A O no hydrogen 3.465 N/A LEU 65.A N PHE 62.A O no hydrogen 3.510 N/A ASP 68.A N ASN 64.A O no hydrogen 2.896 N/A MET 69.A N LEU 65.A O no hydrogen 2.913 N/A THR 70.A N GLU 66.A O no hydrogen 3.039 N/A THR 70.A OG1 GLU 67.A O no hydrogen 2.638 N/A ARG 71.A NH2 TYR 75.A OH no hydrogen 3.448 N/A ALA 73.A N MET 69.A O no hydrogen 2.900 N/A TYR 74.A N THR 70.A O no hydrogen 2.982 N/A TYR 75.A N ARG 71.A O no hydrogen 2.946 N/A TYR 76.A N TYR 72.A O no hydrogen 2.893 N/A SER 77.A N ALA 73.A O no hydrogen 2.914 N/A SER 77.A OG ALA 73.A O no hydrogen 2.795 N/A GLY 78.A N TYR 74.A O no hydrogen 2.847 N/A ILE 79.A N TYR 75.A O no hydrogen 2.980 N/A GLY 80.A N TYR 76.A O no hydrogen 2.905 N/A ALA 81.A N SER 77.A O no hydrogen 2.877 N/A GLY 82.A N GLY 78.A O no hydrogen 2.929 N/A VAL 83.A N ILE 79.A O no hydrogen 2.877 N/A LEU 84.A N GLY 80.A O no hydrogen 2.864 N/A VAL 85.A N ALA 81.A O no hydrogen 3.046 N/A ALA 86.A N GLY 82.A O no hydrogen 2.898 N/A ALA 87.A N VAL 83.A O no hydrogen 2.807 N/A TYR 88.A N LEU 84.A O no hydrogen 3.016 N/A TYR 88.A OH HIS 532.A ND1 no hydrogen 3.069 N/A ILE 89.A N VAL 85.A O no hydrogen 2.992 N/A GLN 90.A N ALA 86.A O no hydrogen 2.911 N/A VAL 91.A N ALA 87.A O no hydrogen 3.034 N/A SER 92.A N TYR 88.A O no hydrogen 2.904 N/A PHE 93.A N ILE 89.A O no hydrogen 2.872 N/A TRP 94.A N GLN 90.A O no hydrogen 3.052 N/A CYS 95.A N VAL 91.A O no hydrogen 3.006 N/A CYS 95.A SG VAL 91.A O no hydrogen 3.473 N/A CYS 95.A SG ASP 134.A OD1 no hydrogen 3.111 N/A LEU 96.A N SER 92.A O no hydrogen 2.924 N/A ALA 97.A N PHE 93.A O no hydrogen 2.977 N/A ALA 98.A N TRP 94.A O no hydrogen 2.998 N/A GLY 99.A N CYS 95.A O no hydrogen 2.879 N/A ARG 100.A N LEU 96.A O no hydrogen 2.983 N/A ARG 100.A NE ASP 16.A OD1 no hydrogen 2.540 N/A ARG 100.A NH2 ASN 13.A OD1 no hydrogen 3.390 N/A GLN 101.A N ALA 97.A O no hydrogen 3.047 N/A ILE 102.A N ALA 98.A O no hydrogen 2.876 N/A HIS 103.A N GLY 99.A O no hydrogen 2.934 N/A LYS 104.A N ARG 100.A O no hydrogen 3.040 N/A ILE 105.A N GLN 101.A O no hydrogen 2.877 N/A ARG 106.A N ILE 102.A O no hydrogen 2.881 N/A LYS 107.A N HIS 103.A O no hydrogen 3.034 N/A GLN 108.A N LYS 104.A O no hydrogen 2.927 N/A PHE 109.A N ILE 105.A O no hydrogen 2.822 N/A PHE 110.A N ARG 106.A O no hydrogen 3.009 N/A HIS 111.A N LYS 107.A O no hydrogen 2.936 N/A HIS 111.A ND1 GLU 513.A OE1 no hydrogen 3.117 N/A HIS 111.A ND1 GLU 513.A OE2 no hydrogen 3.386 N/A ALA 112.A N GLN 108.A O no hydrogen 2.907 N/A ILE 113.A N PHE 109.A O no hydrogen 2.873 N/A MET 114.A N HIS 111.A O no hydrogen 3.401 N/A ARG 115.A N HIS 111.A O no hydrogen 2.945 N/A GLN 116.A NE2 ALA 112.A O no hydrogen 2.801 N/A GLN 116.A NE2 ASN 317.A OD1 no hydrogen 3.028 N/A LEU 121.A N ASN 118.A O no hydrogen 3.093 N/A THR 122.A N ASN 118.A O no hydrogen 2.948 N/A THR 122.A N THR 119.A O no hydrogen 3.126 N/A THR 122.A OG1 ASN 118.A O no hydrogen 3.288 N/A THR 122.A OG1 THR 119.A O no hydrogen 3.538 N/A ASP 123.A N THR 119.A O no hydrogen 2.862 N/A ASP 124.A N THR 119.A O no hydrogen 3.287 N/A SER 126.A OG ASP 123.A O no hydrogen 2.470 N/A LYS 127.A N ASP 123.A O no hydrogen 2.922 N/A ILE 128.A N ASP 124.A O no hydrogen 2.972 N/A ASN 129.A N VAL 125.A O no hydrogen 2.918 N/A GLU 130.A N SER 126.A O no hydrogen 2.908 N/A GLY 131.A N LYS 127.A O no hydrogen 2.968 N/A GLY 131.A N ILE 128.A O no hydrogen 3.008 N/A ILE 132.A N ILE 128.A O no hydrogen 2.988 N/A ILE 136.A N GLY 133.A O no hydrogen 3.283 N/A MET 138.A N ASP 134.A O no hydrogen 2.899 N/A PHE 139.A N LYS 135.A O no hydrogen 2.918 N/A PHE 140.A N ILE 136.A O no hydrogen 3.020 N/A GLN 141.A N GLY 137.A O no hydrogen 2.913 N/A SER 142.A N MET 138.A O no hydrogen 2.895 N/A SER 142.A OG MET 138.A O no hydrogen 3.067 N/A MET 143.A N PHE 139.A O no hydrogen 2.951 N/A ALA 144.A N PHE 140.A O no hydrogen 2.955 N/A THR 145.A N GLN 141.A O no hydrogen 2.906 N/A THR 145.A OG1 GLY 31.A O no hydrogen 2.875 N/A THR 145.A OG1 GLN 141.A O no hydrogen 3.071 N/A PHE 146.A N SER 142.A O no hydrogen 2.925 N/A PHE 147.A N MET 143.A O no hydrogen 2.967 N/A THR 148.A N ALA 144.A O no hydrogen 2.890 N/A THR 148.A OG1 ALA 144.A O no hydrogen 2.689 N/A GLY 149.A N THR 145.A O no hydrogen 2.873 N/A PHE 150.A N PHE 146.A O no hydrogen 3.003 N/A ILE 151.A N PHE 147.A O no hydrogen 2.921 N/A VAL 152.A N THR 148.A O no hydrogen 2.911 N/A GLY 153.A N GLY 149.A O no hydrogen 2.907 N/A PHE 154.A N PHE 150.A O no hydrogen 2.928 N/A THR 155.A N ILE 151.A O no hydrogen 2.916 N/A THR 155.A OG1 ILE 151.A O no hydrogen 3.036 N/A ARG 156.A N VAL 152.A O no hydrogen 2.929 N/A GLY 157.A N GLY 153.A O no hydrogen 2.862 N/A THR 161.A N GLY 157.A O no hydrogen 2.966 N/A THR 161.A OG1 GLY 153.A O no hydrogen 2.671 N/A THR 161.A OG1 GLY 157.A O no hydrogen 2.364 N/A LEU 162.A N TRP 158.A O no hydrogen 2.865 N/A VAL 163.A N LYS 159.A O no hydrogen 3.038 N/A ILE 164.A N LEU 160.A O no hydrogen 2.974 N/A LEU 165.A N THR 161.A O no hydrogen 2.796 N/A ALA 166.A N LEU 162.A O no hydrogen 3.002 N/A ILE 167.A N ILE 164.A O no hydrogen 3.077 N/A SER 168.A N ILE 164.A O no hydrogen 2.890 N/A SER 168.A N LEU 165.A O no hydrogen 2.982 N/A SER 168.A OG ILE 164.A O no hydrogen 2.480 N/A LEU 171.A N ILE 167.A O no hydrogen 3.171 N/A GLY 172.A N SER 168.A O no hydrogen 2.870 N/A LEU 173.A N PRO 169.A O no hydrogen 2.928 N/A SER 174.A N VAL 170.A O no hydrogen 2.862 N/A SER 174.A OG VAL 170.A O no hydrogen 3.008 N/A ALA 175.A N LEU 171.A O no hydrogen 2.923 N/A ALA 176.A N GLY 172.A O no hydrogen 2.908 N/A VAL 177.A N LEU 173.A O no hydrogen 2.922 N/A TRP 178.A N SER 174.A O no hydrogen 2.876 N/A ALA 179.A N ALA 175.A O no hydrogen 2.922 N/A LYS 180.A N ALA 176.A O no hydrogen 2.913 N/A ILE 181.A N VAL 177.A O no hydrogen 2.898 N/A LEU 182.A N TRP 178.A O no hydrogen 2.968 N/A SER 183.A N ALA 179.A O no hydrogen 2.903 N/A SER 183.A OG ALA 179.A O no hydrogen 2.557 N/A SER 184.A N LYS 180.A O no hydrogen 2.959 N/A SER 184.A OG LYS 180.A O no hydrogen 2.908 N/A LYS 188.A N SER 184.A O no hydrogen 3.224 N/A GLU 189.A N PHE 185.A O no hydrogen 3.192 N/A LEU 190.A N THR 186.A O no hydrogen 2.957 N/A LEU 191.A N ASP 187.A O no hydrogen 2.909 N/A ALA 192.A N LYS 188.A O no hydrogen 2.945 N/A TYR 193.A OH TYR 223.A OH no hydrogen 2.186 N/A ALA 194.A N LEU 191.A O no hydrogen 3.139 N/A GLY 197.A N TYR 193.A O no hydrogen 2.797 N/A ALA 198.A N ALA 194.A O no hydrogen 3.085 N/A ALA 200.A N ALA 196.A O no hydrogen 2.949 N/A GLU 201.A N GLY 197.A O no hydrogen 2.892 N/A GLU 202.A N ALA 198.A O no hydrogen 2.899 N/A VAL 203.A N VAL 199.A O no hydrogen 2.936 N/A LEU 204.A N ALA 200.A O no hydrogen 2.908 N/A ALA 205.A N GLU 201.A O no hydrogen 2.895 N/A ALA 206.A N VAL 203.A O no hydrogen 3.065 N/A VAL 210.A N ALA 206.A O no hydrogen 3.294 N/A ILE 211.A N ILE 207.A O no hydrogen 2.929 N/A ALA 212.A N ARG 208.A O no hydrogen 2.926 N/A PHE 213.A N THR 209.A O no hydrogen 2.928 N/A GLY 215.A N VAL 210.A O no hydrogen 3.155 N/A GLN 216.A NE2 LEU 419.A O no hydrogen 3.134 N/A LYS 218.A N GLY 215.A O no hydrogen 3.221 N/A GLU 219.A N GLY 215.A O no hydrogen 2.908 N/A LEU 220.A N GLN 216.A O no hydrogen 2.966 N/A ARG 222.A N LYS 218.A O no hydrogen 2.962 N/A ARG 222.A NH1 GLU 202.A OE2 no hydrogen 2.398 N/A ARG 222.A NH1 GLU 219.A OE1 no hydrogen 2.871 N/A ARG 222.A NH2 GLU 202.A OE2 no hydrogen 2.908 N/A TYR 223.A N GLU 219.A O no hydrogen 2.964 N/A TYR 223.A OH TYR 193.A OH no hydrogen 2.186 N/A ASN 224.A N LEU 220.A O no hydrogen 2.861 N/A LYS 225.A N GLU 221.A O no hydrogen 2.882 N/A ASN 226.A N ARG 222.A O no hydrogen 3.077 N/A LEU 227.A N TYR 223.A O no hydrogen 2.843 N/A GLU 228.A N ASN 224.A O no hydrogen 2.943 N/A ALA 230.A N ASN 226.A O no hydrogen 3.009 N/A LYS 231.A N LEU 227.A O no hydrogen 2.886 N/A ARG 232.A N GLU 228.A O no hydrogen 2.917 N/A ILE 233.A N GLU 229.A O no hydrogen 2.961 N/A GLY 234.A N ALA 230.A O no hydrogen 2.957 N/A ILE 235.A N LYS 231.A O no hydrogen 2.887 N/A LYS 236.A N ARG 232.A O no hydrogen 2.941 N/A LYS 237.A N ILE 233.A O no hydrogen 2.914 N/A ALA 238.A N GLY 234.A O no hydrogen 2.925 N/A ILE 239.A N ILE 235.A O no hydrogen 2.944 N/A THR 240.A N LYS 236.A O no hydrogen 2.932 N/A THR 240.A OG1 LYS 236.A O no hydrogen 3.221 N/A THR 240.A OG1 LYS 237.A O no hydrogen 3.486 N/A ALA 241.A N LYS 237.A O no hydrogen 2.930 N/A ASN 242.A ND2 ALA 238.A O no hydrogen 2.269 N/A ILE 243.A N ILE 239.A O no hydrogen 2.914 N/A SER 244.A N THR 240.A O no hydrogen 2.938 N/A SER 244.A OG THR 240.A O no hydrogen 2.856 N/A ILE 245.A N ALA 241.A O no hydrogen 2.988 N/A GLY 246.A N ASN 242.A O no hydrogen 2.871 N/A ALA 247.A N ILE 243.A O no hydrogen 2.941 N/A ALA 248.A N SER 244.A O no hydrogen 2.979 N/A PHE 249.A N ILE 245.A O no hydrogen 2.992 N/A LEU 250.A N GLY 246.A O no hydrogen 2.911 N/A LEU 251.A N ALA 247.A O no hydrogen 2.897 N/A ILE 252.A N ALA 248.A O no hydrogen 2.963 N/A TYR 253.A N PHE 249.A O no hydrogen 3.037 N/A ALA 254.A N LEU 250.A O no hydrogen 2.892 N/A SER 255.A N LEU 251.A O no hydrogen 2.884 N/A SER 255.A OG LEU 251.A O no hydrogen 2.785 N/A TYR 256.A N ILE 252.A O no hydrogen 3.004 N/A ALA 257.A N TYR 253.A O no hydrogen 2.962 N/A LEU 258.A N ALA 254.A O no hydrogen 2.913 N/A ALA 259.A N SER 255.A O no hydrogen 2.895 N/A PHE 260.A N TYR 256.A O no hydrogen 2.908 N/A TRP 261.A N ALA 257.A O no hydrogen 2.909 N/A TYR 262.A N LEU 258.A O no hydrogen 2.994 N/A GLY 263.A N ALA 259.A O no hydrogen 2.834 N/A THR 264.A N PHE 260.A O no hydrogen 2.872 N/A THR 264.A OG1 PHE 260.A O no hydrogen 2.683 N/A THR 264.A OG1 TRP 261.A O no hydrogen 2.818 N/A THR 265.A N TRP 261.A O no hydrogen 3.006 N/A THR 265.A OG1 TRP 261.A O no hydrogen 3.120 N/A LEU 266.A N TYR 262.A O no hydrogen 2.976 N/A VAL 267.A N GLY 263.A O no hydrogen 2.878 N/A LEU 268.A N THR 264.A O no hydrogen 2.875 N/A SER 269.A N THR 265.A O no hydrogen 2.966 N/A SER 269.A OG LEU 266.A O no hydrogen 3.296 N/A GLY 270.A N VAL 267.A O no hydrogen 3.156 N/A GLU 271.A N LEU 266.A O no hydrogen 3.014 N/A TYR 272.A N LEU 266.A O no hydrogen 3.060 N/A SER 273.A N GLN 276.A OE1 no hydrogen 3.333 N/A SER 273.A OG ASP 46.A OD2 no hydrogen 2.790 N/A GLY 275.A N ASP 46.A OD1 no hydrogen 2.981 N/A GLN 276.A NE2 ARG 156.A O no hydrogen 2.548 N/A VAL 277.A N SER 273.A O no hydrogen 2.967 N/A LEU 278.A N ILE 274.A O no hydrogen 2.963 N/A THR 279.A N GLY 275.A O no hydrogen 2.925 N/A THR 279.A OG1 MET 38.A O no hydrogen 3.055 N/A THR 279.A OG1 GLY 275.A O no hydrogen 3.209 N/A VAL 280.A N GLN 276.A O no hydrogen 3.011 N/A PHE 281.A N VAL 277.A O no hydrogen 2.915 N/A PHE 282.A N LEU 278.A O no hydrogen 2.950 N/A SER 283.A N THR 279.A O no hydrogen 2.959 N/A SER 283.A OG THR 279.A O no hydrogen 3.207 N/A VAL 284.A N VAL 280.A O no hydrogen 2.987 N/A LEU 285.A N PHE 281.A O no hydrogen 2.908 N/A ILE 286.A N PHE 282.A O no hydrogen 2.950 N/A GLY 287.A N SER 283.A O no hydrogen 2.978 N/A ALA 288.A N VAL 284.A O no hydrogen 2.939 N/A PHE 289.A N LEU 285.A O no hydrogen 2.981 N/A SER 290.A N ILE 286.A O no hydrogen 2.938 N/A SER 290.A OG ILE 286.A O no hydrogen 3.191 N/A VAL 291.A N GLY 287.A O no hydrogen 3.082 N/A GLN 293.A N PHE 289.A O no hydrogen 3.018 N/A ALA 294.A N VAL 291.A O no hydrogen 2.934 N/A SER 295.A N GLY 292.A O no hydrogen 3.193 N/A SER 295.A OG GLY 292.A O no hydrogen 2.964 N/A SER 297.A OG LYS 135.A O no hydrogen 2.834 N/A GLU 299.A N SER 295.A O no hydrogen 3.058 N/A ALA 300.A N PRO 296.A O no hydrogen 2.855 N/A PHE 301.A N SER 297.A O no hydrogen 2.935 N/A ALA 302.A N ILE 298.A O no hydrogen 2.979 N/A ASN 303.A N GLU 299.A O no hydrogen 2.947 N/A ALA 304.A N ALA 300.A O no hydrogen 2.873 N/A ARG 305.A N PHE 301.A O no hydrogen 2.973 N/A ARG 305.A NE VAL 3.A O no hydrogen 2.815 N/A GLY 306.A N ALA 302.A O no hydrogen 2.928 N/A ALA 307.A N ASN 303.A O no hydrogen 2.894 N/A ALA 308.A N ALA 304.A O no hydrogen 2.908 N/A TYR 309.A N GLY 306.A O no hydrogen 3.307 N/A PHE 312.A N ALA 308.A O no hydrogen 2.880 N/A LYS 313.A N TYR 309.A O no hydrogen 2.933 N/A ILE 314.A N GLU 310.A O no hydrogen 2.986 N/A ILE 315.A N ILE 311.A O no hydrogen 2.904 N/A ASP 316.A N PHE 312.A O no hydrogen 2.898 N/A ASP 316.A N LYS 313.A O no hydrogen 3.100 N/A ASN 317.A N LYS 313.A O no hydrogen 2.956 N/A TRP 320.A N SER 318.A OG no hydrogen 3.219 N/A ARG 321.A N SER 318.A OG no hydrogen 3.007 N/A ILE 322.A N SER 318.A O no hydrogen 3.057 N/A MET 323.A N PHE 319.A O no hydrogen 3.244 N/A LYS 324.A N TRP 320.A O no hydrogen 3.165 N/A LEU 325.A N ILE 322.A O no hydrogen 2.913 N/A ASN 326.A N MET 323.A O no hydrogen 2.920 N/A THR 328.A OG1 GLU 329.A OE1 no hydrogen 3.126 N/A THR 328.A OG1 GLU 329.A OE2 no hydrogen 2.892 N/A GLU 329.A N ASN 326.A O no hydrogen 3.488 N/A TRP 330.A N LEU 327.A O no hydrogen 3.335 N/A PHE 333.A N GLU 329.A O no hydrogen 3.004 N/A VAL 334.A N TRP 330.A O no hydrogen 2.862 N/A VAL 335.A N PRO 331.A O no hydrogen 3.020 N/A GLY 336.A N TYR 332.A O no hydrogen 2.875 N/A VAL 337.A N PHE 333.A O no hydrogen 2.878 N/A PHE 338.A N VAL 334.A O no hydrogen 3.003 N/A CYS 339.A N VAL 335.A O no hydrogen 2.942 N/A CYS 339.A SG VAL 335.A O no hydrogen 3.202 N/A ALA 340.A N GLY 336.A O no hydrogen 2.843 N/A ILE 341.A N VAL 337.A O no hydrogen 2.948 N/A ILE 342.A N PHE 338.A O no hydrogen 3.021 N/A ASN 343.A N CYS 339.A O no hydrogen 2.837 N/A ASN 343.A ND2 GLN 395.A OE1 no hydrogen 2.776 N/A GLY 344.A N ALA 340.A O no hydrogen 2.895 N/A GLY 345.A N ILE 341.A O no hydrogen 2.952 N/A LEU 346.A N ASN 343.A O no hydrogen 3.318 N/A GLN 347.A N GLY 344.A O no hydrogen 3.469 N/A ALA 349.A N GLY 345.A O no hydrogen 3.428 N/A PHE 350.A N LEU 346.A O no hydrogen 2.986 N/A ALA 351.A N GLN 347.A O no hydrogen 2.919 N/A ILE 352.A N PRO 348.A O no hydrogen 2.953 N/A ILE 353.A N ALA 349.A O no hydrogen 2.981 N/A PHE 354.A N PHE 350.A O no hydrogen 2.826 N/A SER 355.A N ALA 351.A O no hydrogen 2.946 N/A SER 355.A OG ALA 351.A O no hydrogen 3.269 N/A SER 355.A OG ILE 352.A O no hydrogen 3.029 N/A LYS 356.A N ILE 352.A O no hydrogen 2.931 N/A ILE 357.A N ILE 353.A O no hydrogen 2.941 N/A ILE 358.A N PHE 354.A O no hydrogen 3.033 N/A GLY 359.A N SER 355.A O no hydrogen 2.851 N/A VAL 360.A N LYS 356.A O no hydrogen 2.952 N/A PHE 361.A N ILE 358.A O no hydrogen 2.946 N/A THR 362.A N GLY 359.A O no hydrogen 3.308 N/A THR 362.A OG1 GLY 359.A O no hydrogen 3.148 N/A ARG 363.A NH1 GLU 568.A OE1 no hydrogen 2.998 N/A ARG 363.A NH2 GLU 568.A OE1 no hydrogen 3.403 N/A ASP 366.A N ASP 365.A OD1 no hydrogen 2.722 N/A LYS 370.A N ASP 366.A O no hydrogen 2.915 N/A LYS 370.A NZ VAL 360.A O no hydrogen 2.932 N/A LYS 370.A NZ ARG 363.A O no hydrogen 2.909 N/A ARG 371.A N PRO 367.A O no hydrogen 2.951 N/A GLN 372.A N GLU 368.A O no hydrogen 2.954 N/A ASN 373.A N THR 369.A O no hydrogen 2.948 N/A SER 374.A N LYS 370.A O no hydrogen 2.950 N/A SER 374.A OG LYS 370.A O no hydrogen 2.510 N/A ASN 375.A N ARG 371.A O no hydrogen 2.953 N/A LEU 376.A N GLN 372.A O no hydrogen 2.948 N/A PHE 377.A N ASN 373.A O no hydrogen 2.957 N/A SER 378.A N SER 374.A O no hydrogen 2.977 N/A SER 378.A OG SER 374.A O no hydrogen 2.735 N/A LEU 379.A N ASN 375.A O no hydrogen 2.990 N/A LEU 380.A N LEU 376.A O no hydrogen 2.918 N/A PHE 381.A N PHE 377.A O no hydrogen 2.974 N/A LEU 382.A N SER 378.A O no hydrogen 3.088 N/A ALA 383.A N LEU 379.A O no hydrogen 2.917 N/A LEU 384.A N LEU 380.A O no hydrogen 2.899 N/A GLY 385.A N PHE 381.A O no hydrogen 2.988 N/A ILE 386.A N LEU 382.A O no hydrogen 2.996 N/A ILE 387.A N ALA 383.A O no hydrogen 2.941 N/A SER 388.A N LEU 384.A O no hydrogen 2.881 N/A SER 388.A OG LEU 384.A O no hydrogen 3.393 N/A SER 388.A OG GLY 385.A O no hydrogen 2.794 N/A PHE 389.A N GLY 385.A O no hydrogen 2.951 N/A ILE 390.A N ILE 386.A O no hydrogen 3.036 N/A THR 391.A N ILE 387.A O no hydrogen 2.885 N/A THR 391.A OG1 ILE 387.A O no hydrogen 2.753 N/A THR 391.A OG1 SER 388.A O no hydrogen 3.486 N/A PHE 392.A N SER 388.A O no hydrogen 2.859 N/A PHE 393.A N PHE 389.A O no hydrogen 2.999 N/A LEU 394.A N ILE 390.A O no hydrogen 2.917 N/A GLN 395.A N THR 391.A O no hydrogen 2.873 N/A GLN 395.A NE2 GLN 451.A OE1 no hydrogen 3.111 N/A GLY 396.A N PHE 392.A O no hydrogen 3.021 N/A PHE 397.A N PHE 393.A O no hydrogen 2.831 N/A THR 398.A N LEU 394.A O no hydrogen 2.888 N/A THR 398.A OG1 LEU 394.A O no hydrogen 2.521 N/A THR 398.A OG1 GLN 395.A O no hydrogen 3.206 N/A PHE 399.A N GLN 395.A O no hydrogen 3.040 N/A GLY 400.A N GLY 396.A O no hydrogen 2.883 N/A LYS 401.A N PHE 397.A O no hydrogen 2.863 N/A ALA 402.A N THR 398.A O no hydrogen 2.969 N/A GLY 403.A N PHE 399.A O no hydrogen 2.923 N/A GLU 404.A N GLY 400.A O no hydrogen 2.902 N/A ILE 405.A N LYS 401.A O no hydrogen 2.953 N/A LEU 406.A N ALA 402.A O no hydrogen 2.959 N/A THR 407.A N GLY 403.A O no hydrogen 2.886 N/A THR 407.A OG1 GLY 403.A O no hydrogen 2.584 N/A LYS 408.A N GLU 404.A O no hydrogen 2.942 N/A LYS 408.A NZ ASN 224.A OD1 no hydrogen 3.299 N/A LYS 408.A NZ GLU 228.A OE2 no hydrogen 2.469 N/A ARG 409.A N ILE 405.A O no hydrogen 2.989 N/A ARG 409.A NH1 THR 328.A OG1 no hydrogen 3.259 N/A ARG 409.A NH2 GLU 329.A OE1 no hydrogen 2.701 N/A LEU 410.A N LEU 406.A O no hydrogen 2.873 N/A ARG 411.A N THR 407.A O no hydrogen 2.929 N/A ARG 411.A NE LEU 431.A O no hydrogen 3.029 N/A ARG 411.A NH2 ALA 432.A O no hydrogen 3.119 N/A TYR 412.A N LYS 408.A O no hydrogen 2.919 N/A MET 413.A N ARG 409.A O no hydrogen 2.971 N/A VAL 414.A N LEU 410.A O no hydrogen 2.886 N/A PHE 415.A N ARG 411.A O no hydrogen 2.944 N/A ARG 416.A N TYR 412.A O no hydrogen 2.899 N/A SER 417.A N MET 413.A O no hydrogen 2.957 N/A SER 417.A OG MET 413.A O no hydrogen 3.530 N/A SER 417.A OG VAL 414.A O no hydrogen 2.941 N/A SER 417.A OG ILE 607.A O no hydrogen 2.847 N/A MET 418.A N VAL 414.A O no hydrogen 2.925 N/A LEU 419.A N PHE 415.A O no hydrogen 2.899 N/A ARG 420.A N ARG 416.A O no hydrogen 2.954 N/A GLN 421.A NE2 SER 417.A O no hydrogen 2.667 N/A GLY 425.A N THR 423.A OG1 no hydrogen 3.309 N/A LEU 427.A N THR 423.A O no hydrogen 2.942 N/A THR 428.A N THR 424.A O no hydrogen 2.900 N/A THR 428.A OG1 THR 424.A O no hydrogen 2.823 N/A THR 428.A OG1 GLY 425.A O no hydrogen 2.728 N/A THR 429.A N GLY 425.A O no hydrogen 2.942 N/A THR 429.A OG1 GLY 425.A O no hydrogen 3.194 N/A THR 429.A OG1 ALA 426.A O no hydrogen 2.500 N/A ARG 430.A N ALA 426.A O no hydrogen 2.895 N/A ARG 430.A NH1 ASP 434.A OD2 no hydrogen 2.883 N/A LEU 431.A N LEU 427.A O no hydrogen 2.976 N/A ALA 432.A N THR 428.A O no hydrogen 2.880 N/A ASN 433.A N THR 429.A O no hydrogen 2.876 N/A ASP 434.A N THR 429.A O no hydrogen 3.340 N/A ALA 435.A N ARG 430.A O no hydrogen 3.237 N/A GLN 437.A N ASP 434.A O no hydrogen 3.476 N/A LYS 439.A NZ THR 407.A OG1 no hydrogen 3.324 N/A GLY 440.A N GLN 437.A O no hydrogen 3.031 N/A ALA 441.A N VAL 438.A O no hydrogen 3.101 N/A ILE 442.A N LYS 439.A O no hydrogen 3.032 N/A SER 444.A N LYS 439.A O no hydrogen 3.441 N/A SER 444.A OG LYS 439.A O no hydrogen 3.519 N/A LEU 446.A N ILE 442.A O no hydrogen 2.908 N/A ALA 447.A N GLY 443.A O no hydrogen 2.904 N/A VAL 448.A N SER 444.A O no hydrogen 2.956 N/A ILE 449.A N ARG 445.A O no hydrogen 2.979 N/A THR 450.A N LEU 446.A O no hydrogen 2.928 N/A THR 450.A OG1 LEU 446.A O no hydrogen 2.816 N/A GLN 451.A N ALA 447.A O no hydrogen 2.954 N/A ASN 452.A N VAL 448.A O no hydrogen 2.945 N/A ASN 452.A ND2 SER 588.A OG no hydrogen 3.149 N/A ILE 453.A N ILE 449.A O no hydrogen 2.927 N/A ALA 454.A N THR 450.A O no hydrogen 2.965 N/A ASN 455.A N GLN 451.A O no hydrogen 2.935 N/A ASN 455.A ND2 GLY 580.A O no hydrogen 3.035 N/A LEU 456.A N ASN 452.A O no hydrogen 2.915 N/A GLY 457.A N ILE 453.A O no hydrogen 2.878 N/A THR 458.A OG1 ALA 454.A O no hydrogen 3.006 N/A GLY 459.A N ASN 455.A O no hydrogen 2.943 N/A ILE 460.A N LEU 456.A O no hydrogen 2.870 N/A ILE 461.A N GLY 457.A O no hydrogen 2.965 N/A ILE 462.A N THR 458.A O no hydrogen 2.996 N/A SER 463.A N GLY 459.A O no hydrogen 2.886 N/A SER 463.A OG GLY 459.A O no hydrogen 2.533 N/A PHE 464.A N ILE 460.A O no hydrogen 2.886 N/A ILE 465.A N ILE 461.A O no hydrogen 3.009 N/A TYR 466.A N ILE 462.A O no hydrogen 2.984 N/A GLY 467.A N SER 463.A O no hydrogen 2.851 N/A GLN 469.A N GLN 469.A OE1 no hydrogen 2.896 N/A THR 471.A N GLY 467.A O no hydrogen 2.985 N/A THR 471.A OG1 SER 463.A O no hydrogen 2.787 N/A THR 471.A OG1 GLY 467.A O no hydrogen 2.485 N/A LEU 472.A N TRP 468.A O no hydrogen 2.866 N/A LEU 473.A N GLN 469.A O no hydrogen 3.033 N/A LEU 474.A N LEU 470.A O no hydrogen 2.931 N/A LEU 475.A N THR 471.A O no hydrogen 2.904 N/A ALA 476.A N LEU 473.A O no hydrogen 3.265 N/A ILE 477.A N LEU 474.A O no hydrogen 3.141 N/A VAL 478.A N LEU 474.A O no hydrogen 3.008 N/A ILE 481.A N ILE 477.A O no hydrogen 2.952 N/A ALA 482.A N VAL 478.A O no hydrogen 2.953 N/A ILE 483.A N PRO 479.A O no hydrogen 2.942 N/A ALA 484.A N ILE 480.A O no hydrogen 2.822 N/A GLY 485.A N ILE 481.A O no hydrogen 2.990 N/A VAL 486.A N ALA 482.A O no hydrogen 2.985 N/A VAL 487.A N ILE 483.A O no hydrogen 2.861 N/A GLU 488.A N ALA 484.A O no hydrogen 2.899 N/A MET 489.A N GLY 485.A O no hydrogen 3.020 N/A LYS 490.A N VAL 486.A O no hydrogen 2.941 N/A MET 491.A N VAL 487.A O no hydrogen 2.863 N/A LEU 492.A N GLU 488.A O no hydrogen 2.964 N/A SER 493.A N MET 489.A O no hydrogen 2.928 N/A SER 493.A OG MET 489.A O no hydrogen 3.328 N/A SER 493.A OG LYS 490.A O no hydrogen 3.052 N/A GLY 494.A N MET 491.A O no hydrogen 3.243 N/A GLN 495.A N SER 493.A OG no hydrogen 3.313 N/A GLU 499.A N LYS 496.A O no hydrogen 3.187 N/A GLY 502.A N GLU 499.A O no hydrogen 3.127 N/A LYS 503.A N GLY 500.A O no hydrogen 3.491 N/A THR 506.A N GLY 502.A O no hydrogen 2.875 N/A THR 506.A OG1 GLY 502.A O no hydrogen 2.573 N/A GLU 507.A N LYS 503.A O no hydrogen 2.900 N/A GLU 513.A N GLU 509.A O no hydrogen 2.968 N/A HIS 514.A N GLN 510.A O no hydrogen 2.889 N/A MET 515.A N LYS 511.A O no hydrogen 2.896 N/A TYR 516.A N PHE 512.A O no hydrogen 2.956 N/A ALA 517.A N GLU 513.A O no hydrogen 2.892 N/A GLN 518.A N HIS 514.A O no hydrogen 2.947 N/A SER 519.A N MET 515.A O no hydrogen 2.894 N/A LEU 520.A N TYR 516.A O no hydrogen 3.008 N/A LEU 520.A N ALA 517.A O no hydrogen 3.246 N/A GLN 521.A N GLN 518.A O no hydrogen 3.376 N/A TYR 524.A N LEU 520.A O no hydrogen 2.956 N/A ARG 525.A N GLN 521.A O no hydrogen 2.966 N/A ASN 526.A N VAL 522.A O no hydrogen 2.921 N/A SER 527.A N PRO 523.A O no hydrogen 2.916 N/A SER 527.A OG TYR 524.A O no hydrogen 3.071 N/A LEU 528.A N TYR 524.A O no hydrogen 2.962 N/A ARG 529.A N ARG 525.A O no hydrogen 2.948 N/A LYS 530.A N ASN 526.A O no hydrogen 2.877 N/A ALA 531.A N SER 527.A O no hydrogen 2.944 N/A HIS 532.A ND1 TYR 88.A OH no hydrogen 3.069 N/A ILE 533.A N ARG 529.A O no hydrogen 2.978 N/A PHE 534.A N LYS 530.A O no hydrogen 2.861 N/A GLY 535.A N ALA 531.A O no hydrogen 2.929 N/A ILE 536.A N HIS 532.A O no hydrogen 2.981 N/A THR 537.A N ILE 533.A O no hydrogen 2.979 N/A THR 537.A OG1 ILE 533.A O no hydrogen 2.888 N/A PHE 538.A N PHE 534.A O no hydrogen 2.884 N/A SER 539.A N GLY 535.A O no hydrogen 2.937 N/A SER 539.A OG GLY 535.A O no hydrogen 3.303 N/A SER 539.A OG ILE 536.A O no hydrogen 3.050 N/A PHE 540.A N ILE 536.A O no hydrogen 2.941 N/A THR 541.A N THR 537.A O no hydrogen 3.016 N/A THR 541.A OG1 THR 537.A O no hydrogen 3.122 N/A THR 541.A OG1 PHE 538.A O no hydrogen 2.990 N/A GLN 542.A N PHE 538.A O no hydrogen 2.900 N/A ALA 543.A N SER 539.A O no hydrogen 2.918 N/A MET 544.A N PHE 540.A O no hydrogen 3.004 N/A MET 545.A N GLN 542.A O no hydrogen 3.147 N/A PHE 547.A N ALA 543.A O no hydrogen 2.970 N/A SER 548.A N MET 544.A O no hydrogen 2.937 N/A SER 548.A OG MET 545.A O no hydrogen 2.672 N/A GLY 551.A N PHE 547.A O no hydrogen 3.009 N/A CYS 552.A N SER 548.A O no hydrogen 2.875 N/A PHE 553.A N TYR 549.A O no hydrogen 2.962 N/A ARG 554.A N ALA 550.A O no hydrogen 2.966 N/A ARG 554.A NH1 ARG 554.A O no hydrogen 2.957 N/A PHE 555.A N GLY 551.A O no hydrogen 3.063 N/A GLY 556.A N CYS 552.A O no hydrogen 2.827 N/A ALA 557.A N PHE 553.A O no hydrogen 2.861 N/A TYR 558.A N ARG 554.A O no hydrogen 3.093 N/A LEU 559.A N PHE 555.A O no hydrogen 2.973 N/A VAL 560.A N GLY 556.A O no hydrogen 2.848 N/A ALA 561.A N ALA 557.A O no hydrogen 2.910 N/A HIS 562.A N TYR 558.A O no hydrogen 2.993 N/A HIS 562.A ND1 TYR 558.A O no hydrogen 3.141 N/A LYS 563.A N VAL 560.A O no hydrogen 3.262 N/A LYS 563.A NZ ALA 561.A O no hydrogen 3.441 N/A LEU 564.A N LEU 559.A O no hydrogen 2.958 N/A ASP 569.A N SER 566.A OG no hydrogen 3.376 N/A VAL 570.A N SER 566.A O no hydrogen 2.967 N/A LEU 571.A N PHE 567.A O no hydrogen 2.902 N/A LEU 572.A N GLU 568.A O no hydrogen 2.921 N/A VAL 573.A N ASP 569.A O no hydrogen 2.925 N/A PHE 574.A N VAL 570.A O no hydrogen 2.927 N/A SER 575.A N LEU 571.A O no hydrogen 2.891 N/A ALA 576.A N LEU 572.A O no hydrogen 2.869 N/A VAL 577.A N VAL 573.A O no hydrogen 2.886 N/A VAL 578.A N PHE 574.A O no hydrogen 2.864 N/A PHE 579.A N SER 575.A O no hydrogen 2.949 N/A GLY 580.A N ALA 576.A O no hydrogen 2.832 N/A ALA 581.A N VAL 577.A O no hydrogen 2.922 N/A MET 582.A N VAL 578.A O no hydrogen 3.007 N/A ALA 583.A N PHE 579.A O no hydrogen 2.895 N/A VAL 584.A N GLY 580.A O no hydrogen 2.818 N/A GLY 585.A N ALA 581.A O no hydrogen 2.981 N/A GLN 586.A N MET 582.A O no hydrogen 2.965 N/A VAL 587.A N ALA 583.A O no hydrogen 2.902 N/A SER 588.A N VAL 584.A O no hydrogen 2.888 N/A SER 588.A OG VAL 584.A O no hydrogen 2.298 N/A SER 589.A N GLY 585.A O no hydrogen 2.992 N/A SER 589.A OG GLN 586.A O no hydrogen 2.868 N/A PHE 590.A N VAL 587.A O no hydrogen 3.072 N/A ALA 591.A N SER 588.A O no hydrogen 3.206 N/A ALA 597.A N ASP 593.A O no hydrogen 2.908 N/A LYS 598.A N TYR 594.A O no hydrogen 2.912 N/A ILE 599.A N ALA 595.A O no hydrogen 2.982 N/A SER 600.A N LYS 596.A O no hydrogen 2.888 N/A SER 600.A OG GLN 437.A OE1 no hydrogen 3.126 N/A SER 600.A OG LYS 596.A O no hydrogen 2.625 N/A ALA 601.A N ALA 597.A O no hydrogen 2.927 N/A ALA 602.A N LYS 598.A O no hydrogen 2.923 N/A HIS 603.A N ILE 599.A O no hydrogen 2.982 N/A ILE 604.A N SER 600.A O no hydrogen 2.909 N/A ILE 605.A N ALA 601.A O no hydrogen 2.906 N/A MET 606.A N ALA 602.A O no hydrogen 2.931 N/A ILE 607.A N HIS 603.A O no hydrogen 2.996 N/A ILE 608.A N ILE 604.A O no hydrogen 2.929 N/A GLU 609.A N ILE 605.A O no hydrogen 2.894 N/A LYS 610.A N MET 606.A O no hydrogen 2.933 N/A