Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 2e6k_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): THR 5.A N ARG 1.A O no hydrogen 3.143 N/A THR 5.A OG1 ARG 1.A O no hydrogen 2.860 N/A LEU 6.A N ASP 2.A O no hydrogen 2.773 N/A SER 7.A N LEU 3.A O no hydrogen 2.695 N/A SER 7.A OG LEU 3.A O no hydrogen 2.922 N/A VAL 8.A N GLU 4.A O no hydrogen 2.774 N/A ASN 9.A N THR 5.A O no hydrogen 3.033 N/A ALA 10.A N LEU 6.A O no hydrogen 3.004 N/A ILE 11.A N SER 7.A O no hydrogen 3.046 N/A ARG 12.A N VAL 8.A O no hydrogen 2.974 N/A ARG 12.A NH2 ASN 9.A OD1 no hydrogen 3.081 N/A PHE 13.A N ASN 9.A O no hydrogen 2.769 N/A LEU 14.A N ALA 10.A O no hydrogen 2.959 N/A ALA 15.A N ILE 11.A O no hydrogen 3.089 N/A ILE 16.A N ARG 12.A O no hydrogen 2.919 N/A ASP 17.A N PHE 13.A O no hydrogen 2.769 N/A ALA 18.A N LEU 14.A O no hydrogen 3.087 N/A VAL 19.A N ALA 15.A O no hydrogen 3.204 N/A GLU 20.A N ILE 16.A O no hydrogen 2.927 N/A LYS 21.A N ASP 17.A O no hydrogen 2.894 N/A LYS 21.A NZ LYS 83.A O no hydrogen 2.737 N/A ALA 22.A N ALA 18.A O no hydrogen 3.061 N/A ARG 23.A N GLU 20.A O no hydrogen 3.059 N/A SER 24.A N VAL 19.A O no hydrogen 3.260 N/A TYR 35.A N ALA 31.A O no hydrogen 2.961 N/A TYR 35.A OH HIS 285.A NE2 no hydrogen 2.881 N/A LEU 36.A N PRO 32.A O no hydrogen 3.114 N/A LEU 37.A N LEU 33.A O no hydrogen 2.952 N/A PHE 38.A N ALA 34.A O no hydrogen 3.155 N/A ARG 39.A N TYR 35.A O no hydrogen 3.000 N/A ARG 39.A NH2 ARG 39.A O no hydrogen 3.055 N/A GLU 40.A N LEU 36.A O no hydrogen 2.993 N/A VAL 41.A N LEU 36.A O no hydrogen 2.986 N/A HIS 43.A ND1 TYR 75.A OH no hydrogen 2.622 N/A HIS 43.A NE2 PHE 38.A O no hydrogen 2.713 N/A ASN 44.A ND2 GLN 294.A OE1 no hydrogen 2.639 N/A LEU 46.A N ASN 44.A OD1 no hydrogen 2.840 N/A ASP 47.A N ASN 44.A O no hydrogen 2.797 N/A ASP 49.A N ASP 47.A OD2 no hydrogen 3.243 N/A TRP 50.A N ASP 47.A O no hydrogen 3.073 N/A ARG 53.A N TRP 50.A O no hydrogen 3.074 N/A ARG 53.A NE GLU 105.A OE2 no hydrogen 2.732 N/A ARG 53.A NH1 GLU 105.A OE1 no hydrogen 2.711 N/A ARG 53.A NH1 GLU 105.A OE2 no hydrogen 3.369 N/A ARG 53.A NH2 TRP 50.A O no hydrogen 3.080 N/A ASP 54.A N ARG 42.A O no hydrogen 3.017 N/A ARG 55.A N TYR 143.A O no hydrogen 2.969 N/A ARG 55.A NH1 PRO 51.A O no hydrogen 3.128 N/A ARG 55.A NH2 PRO 51.A O no hydrogen 3.392 N/A ARG 55.A NH2 HIS 404.A O no hydrogen 3.258 N/A VAL 57.A N TYR 145.A O no hydrogen 2.779 N/A SER 59.A OG ASP 152.A OD2 no hydrogen 2.630 N/A ALA 60.A N LEU 147.A O no hydrogen 3.358 N/A GLY 63.A N ALA 60.A O no hydrogen 3.068 N/A SER 64.A OG GLY 94.A O no hydrogen 2.654 N/A LEU 66.A N SER 64.A O no hydrogen 2.778 N/A TYR 67.A N SER 64.A O no hydrogen 2.937 N/A TYR 67.A OH PRO 93.A O no hydrogen 2.702 N/A VAL 69.A N LEU 65.A O no hydrogen 3.408 N/A LEU 70.A N LEU 66.A O no hydrogen 2.946 N/A HIS 71.A N TYR 67.A O no hydrogen 2.969 N/A HIS 71.A ND1 LEU 77.A O no hydrogen 2.635 N/A HIS 71.A NE2 TYR 283.A OH no hydrogen 2.903 N/A LEU 72.A N ALA 68.A O no hydrogen 2.903 N/A THR 73.A N VAL 69.A O no hydrogen 3.079 N/A THR 73.A OG1 VAL 69.A O no hydrogen 2.649 N/A THR 73.A OG1 LEU 70.A O no hydrogen 3.330 N/A GLY 74.A N HIS 71.A O no hydrogen 3.352 N/A TYR 75.A N LEU 70.A O no hydrogen 3.035 N/A TYR 75.A OH HIS 43.A ND1 no hydrogen 2.622 N/A LEU 77.A N TYR 75.A O no hydrogen 2.752 N/A GLU 81.A N PRO 78.A O no hydrogen 2.740 N/A LEU 82.A N PRO 78.A O no hydrogen 3.420 N/A LYS 83.A N LEU 79.A O no hydrogen 2.956 N/A SER 84.A N GLU 81.A O no hydrogen 2.795 N/A SER 84.A OG GLU 80.A O no hydrogen 3.003 N/A PHE 85.A N LEU 82.A O no hydrogen 3.384 N/A ARG 86.A N THR 92.A O no hydrogen 2.851 N/A ARG 86.A NH2 SER 24.A OG no hydrogen 2.855 N/A GLN 87.A N SER 84.A O no hydrogen 2.923 N/A GLN 87.A NE2 PHE 85.A O no hydrogen 3.043 N/A SER 90.A N GLN 87.A O no hydrogen 3.070 N/A SER 90.A OG SER 84.A O no hydrogen 3.015 N/A SER 90.A OG GLN 87.A O no hydrogen 3.280 N/A SER 90.A OG THR 92.A OG1 no hydrogen 3.166 N/A LYS 91.A N GLU 81.A OE1 no hydrogen 2.837 N/A THR 92.A N SER 90.A OG no hydrogen 3.086 N/A THR 92.A OG1 GLU 81.A O no hydrogen 2.775 N/A THR 92.A OG1 SER 90.A OG no hydrogen 3.166 N/A ARG 98.A N THR 107.A OG1 no hydrogen 2.789 N/A HIS 100.A N GLU 97.A O no hydrogen 3.018 N/A HIS 100.A NE2 SER 90.A O no hydrogen 2.813 N/A THR 101.A OG1 LYS 91.A O no hydrogen 2.659 N/A VAL 104.A N THR 101.A O no hydrogen 3.248 N/A THR 108.A N PRO 96.A O no hydrogen 3.360 N/A THR 108.A OG1 LEU 58.A O no hydrogen 2.619 N/A GLY 112.A N ASP 152.A OD2 no hydrogen 2.819 N/A GLN 113.A N PRO 110.A O no hydrogen 3.358 N/A ILE 115.A N SER 59.A OG no hydrogen 2.796 N/A SER 116.A N GLY 112.A O no hydrogen 3.174 N/A SER 116.A OG GLY 112.A O no hydrogen 2.654 N/A THR 117.A N GLN 113.A O no hydrogen 2.869 N/A THR 117.A OG1 GLN 113.A O no hydrogen 2.607 N/A ALA 118.A N GLY 114.A O no hydrogen 3.037 N/A VAL 119.A N SER 116.A O no hydrogen 3.021 N/A GLY 120.A N THR 117.A O no hydrogen 2.936 N/A LEU 121.A N THR 117.A O no hydrogen 3.232 N/A ALA 122.A N ALA 118.A O no hydrogen 2.945 N/A LEU 123.A N VAL 119.A O no hydrogen 2.859 N/A ALA 124.A N GLY 120.A O no hydrogen 2.892 N/A GLU 125.A N LEU 121.A O no hydrogen 3.108 N/A ARG 126.A N ALA 122.A O no hydrogen 3.078 N/A ARG 126.A NH2 ARG 126.A O no hydrogen 3.000 N/A LYS 127.A N LEU 123.A O no hydrogen 2.940 N/A LYS 127.A NZ PRO 381.A O no hydrogen 3.275 N/A LYS 127.A NZ GLY 383.A O no hydrogen 2.653 N/A LEU 128.A N ALA 124.A O no hydrogen 2.918 N/A ALA 129.A N GLU 125.A O no hydrogen 2.864 N/A ALA 130.A N ARG 126.A O no hydrogen 3.171 N/A GLU 131.A N LYS 127.A O no hydrogen 2.996 N/A PHE 132.A N LEU 128.A O no hydrogen 3.011 N/A ASN 133.A N ALA 129.A O no hydrogen 2.838 N/A ASN 133.A ND2 VAL 140.A O no hydrogen 3.107 N/A ARG 134.A N HIS 137.A O no hydrogen 2.952 N/A ARG 134.A NH1 GLU 131.A O no hydrogen 3.469 N/A ARG 134.A NH2 GLU 131.A O no hydrogen 3.148 N/A ARG 134.A NH2 ASN 133.A O no hydrogen 2.710 N/A HIS 137.A N ARG 134.A O no hydrogen 2.633 N/A VAL 140.A N ASN 133.A OD1 no hydrogen 2.974 N/A ASP 141.A N ASP 52.A OD1 no hydrogen 2.803 N/A HIS 142.A N GLU 125.A OE2 no hydrogen 3.181 N/A HIS 142.A ND1 ASP 52.A OD1 no hydrogen 2.862 N/A HIS 142.A NE2 HIS 404.A NE2 no hydrogen 2.751 N/A TYR 143.A N ASP 54.A OD1 no hydrogen 2.779 N/A THR 144.A N LYS 171.A O no hydrogen 3.010 N/A TYR 145.A N ARG 55.A O no hydrogen 2.792 N/A VAL 146.A N ILE 173.A O no hydrogen 2.942 N/A LEU 147.A N VAL 57.A O no hydrogen 2.985 N/A ALA 148.A N PHE 175.A O no hydrogen 2.782 N/A SER 149.A N ASP 152.A OD1 no hydrogen 2.773 N/A SER 149.A OG ASP 152.A OD1 no hydrogen 3.230 N/A LEU 153.A N SER 149.A O no hydrogen 3.292 N/A SER 157.A N GLU 154.A O no hydrogen 3.160 N/A SER 157.A OG ASP 152.A O no hydrogen 2.729 N/A SER 157.A OG GLU 154.A O no hydrogen 2.680 N/A GLU 159.A N GLY 155.A O no hydrogen 3.029 N/A ALA 160.A N VAL 156.A O no hydrogen 2.891 N/A ALA 161.A N SER 157.A O no hydrogen 2.826 N/A SER 162.A N GLY 158.A O no hydrogen 2.907 N/A LEU 163.A N GLU 159.A O no hydrogen 3.172 N/A ALA 164.A N ALA 160.A O no hydrogen 2.815 N/A GLY 165.A N ALA 161.A O no hydrogen 3.035 N/A HIS 166.A N SER 162.A O no hydrogen 3.043 N/A TRP 167.A N LEU 163.A O no hydrogen 2.790 N/A GLY 168.A N GLY 165.A O no hydrogen 3.088 N/A LEU 169.A N ALA 164.A O no hydrogen 3.134 N/A SER 170.A N GLY 168.A O no hydrogen 2.878 N/A LYS 171.A NZ GLU 125.A OE2 no hydrogen 2.718 N/A LYS 171.A NZ ASP 141.A OD1 no hydrogen 2.508 N/A LEU 172.A N LEU 169.A O no hydrogen 3.325 N/A ILE 173.A N THR 144.A O no hydrogen 2.764 N/A VAL 174.A N THR 232.A O no hydrogen 2.812 N/A PHE 175.A N VAL 146.A O no hydrogen 2.651 N/A TRP 176.A N ILE 234.A O no hydrogen 2.852 N/A TRP 176.A NE1 ASP 150.A OD1 no hydrogen 2.630 N/A ASP 177.A N ALA 148.A O no hydrogen 2.926 N/A ASP 178.A N VAL 236.A O no hydrogen 3.063 N/A ARG 180.A NE ASP 178.A OD1 no hydrogen 2.653 N/A ARG 180.A NE ASP 178.A OD2 no hydrogen 3.346 N/A ARG 180.A NH1 ASP 178.A OD2 no hydrogen 3.110 N/A ILE 181.A N ASN 179.A OD1 no hydrogen 2.850 N/A SER 182.A N GLY 185.A O no hydrogen 2.802 N/A SER 182.A OG THR 187.A OG1 no hydrogen 2.846 N/A GLY 185.A N SER 182.A O no hydrogen 3.251 N/A THR 187.A N ARG 180.A O no hydrogen 2.932 N/A THR 187.A OG1 ASP 150.A OD2 no hydrogen 3.071 N/A THR 187.A OG1 SER 182.A OG no hydrogen 2.846 N/A LEU 189.A N PRO 186.A O no hydrogen 3.128 N/A ALA 190.A N THR 187.A O no hydrogen 3.084 N/A PHE 191.A N THR 187.A O no hydrogen 2.911 N/A ALA 197.A N ASP 194.A OD1 no hydrogen 3.052 N/A ARG 198.A N ASP 194.A O no hydrogen 2.984 N/A ARG 198.A NE GLU 193.A OE1 no hydrogen 2.666 N/A ARG 198.A NH1 TYR 202.A OH no hydrogen 2.954 N/A ARG 198.A NH2 LEU 153.A O no hydrogen 2.936 N/A ARG 198.A NH2 GLU 193.A OE1 no hydrogen 2.916 N/A TYR 199.A N VAL 195.A O no hydrogen 3.091 N/A ARG 200.A N LEU 196.A O no hydrogen 2.980 N/A ARG 200.A NH2 THR 206.A OG1 no hydrogen 2.828 N/A ALA 201.A N ALA 197.A O no hydrogen 3.111 N/A TYR 202.A N ARG 198.A O no hydrogen 3.203 N/A GLY 203.A N ARG 200.A O no hydrogen 2.883 N/A TRP 204.A N TYR 199.A O no hydrogen 3.025 N/A TRP 204.A NE1 ALA 161.A O no hydrogen 2.878 N/A GLN 205.A N PRO 231.A O no hydrogen 2.906 N/A LEU 207.A N LEU 233.A O no hydrogen 2.972 N/A VAL 209.A N ALA 235.A O no hydrogen 2.866 N/A VAL 212.A N ARG 237.A O no hydrogen 2.898 N/A ASN 213.A N ASP 211.A OD2 no hydrogen 2.841 N/A ASP 214.A N ASP 211.A O no hydrogen 3.002 N/A ALA 217.A N ASP 214.A OD1 no hydrogen 2.991 N/A LEU 218.A N ASP 214.A O no hydrogen 3.223 N/A ARG 219.A N LEU 215.A O no hydrogen 2.985 N/A ARG 219.A NE GLU 40.A OE1 no hydrogen 2.650 N/A ARG 219.A NH1 GLU 4.A OE2 no hydrogen 2.842 N/A ARG 219.A NH1 GLU 40.A OE2 no hydrogen 2.938 N/A ARG 219.A NH2 GLU 216.A OE2 no hydrogen 2.908 N/A LYS 220.A N GLU 216.A O no hydrogen 3.103 N/A ALA 221.A N ALA 217.A O no hydrogen 3.127 N/A ILE 222.A N LEU 218.A O no hydrogen 3.045 N/A LYS 223.A N ARG 219.A O no hydrogen 3.046 N/A LEU 224.A N LYS 220.A O no hydrogen 3.083 N/A ALA 225.A N ALA 221.A O no hydrogen 2.998 N/A LYS 226.A N ILE 222.A O no hydrogen 3.124 N/A LEU 227.A N LYS 223.A O no hydrogen 3.226 N/A LEU 227.A N LEU 224.A O no hydrogen 3.156 N/A ASP 228.A N LEU 224.A O no hydrogen 3.194 N/A ASP 228.A N ALA 225.A O no hydrogen 3.096 N/A ARG 230.A N ASP 228.A OD2 no hydrogen 2.710 N/A ARG 230.A NE ASP 228.A OD1 no hydrogen 3.300 N/A ARG 230.A NE ASP 228.A OD2 no hydrogen 2.701 N/A ARG 230.A NH1 ASP 228.A OD1 no hydrogen 2.681 N/A THR 232.A N LEU 172.A O no hydrogen 3.042 N/A THR 232.A OG1 ARG 230.A O no hydrogen 3.523 N/A LEU 233.A N GLN 205.A O no hydrogen 2.943 N/A ILE 234.A N VAL 174.A O no hydrogen 2.778 N/A ALA 235.A N LEU 207.A O no hydrogen 2.906 N/A VAL 236.A N TRP 176.A O no hydrogen 2.815 N/A ARG 237.A N VAL 209.A O no hydrogen 2.875 N/A SER 238.A OG ASP 177.A OD1 no hydrogen 2.669 N/A HIS 239.A ND1 ASP 248.A OD1 no hydrogen 2.769 N/A GLY 241.A N GLY 28.A O no hydrogen 2.904 N/A GLY 243.A N GLN 247.A OE1 no hydrogen 2.952 N/A SER 244.A N GLY 241.A O no hydrogen 3.029 N/A SER 244.A OG GLY 241.A O no hydrogen 2.857 N/A LYS 246.A N SER 244.A OG no hydrogen 3.199 N/A LYS 246.A NZ PRO 256.A O no hydrogen 3.330 N/A LYS 246.A NZ LEU 257.A O no hydrogen 3.098 N/A GLN 247.A N SER 244.A O no hydrogen 3.204 N/A GLN 247.A NE2 ASP 248.A OD2 no hydrogen 3.026 N/A ASP 248.A N ILE 240.A O no hydrogen 2.832 N/A LYS 251.A N SER 249.A OG no hydrogen 3.177 N/A ALA 252.A N SER 249.A O no hydrogen 2.904 N/A HIS 253.A N ALA 250.A O no hydrogen 3.070 N/A GLY 258.A N GLU 20.A OE1 no hydrogen 3.095 N/A VAL 262.A N GLY 258.A O no hydrogen 3.002 N/A GLU 263.A N PRO 259.A O no hydrogen 3.121 N/A ALA 264.A N GLU 260.A O no hydrogen 3.022 N/A THR 265.A N ALA 261.A O no hydrogen 2.835 N/A THR 265.A OG1 ALA 261.A O no hydrogen 2.531 N/A ARG 266.A N VAL 262.A O no hydrogen 2.913 N/A ARG 266.A NE TYR 273.A O no hydrogen 3.027 N/A ARG 266.A NH1 ASP 17.A OD1 no hydrogen 3.407 N/A ARG 266.A NH1 ASP 17.A OD2 no hydrogen 3.055 N/A ARG 266.A NH1 TYR 273.A O no hydrogen 3.078 N/A ARG 266.A NH2 ASP 17.A OD1 no hydrogen 3.137 N/A ARG 267.A N GLU 263.A O no hydrogen 2.976 N/A ASN 268.A N ALA 264.A O no hydrogen 2.738 N/A ASN 268.A ND2 GLY 243.A O no hydrogen 2.970 N/A LEU 269.A N THR 265.A O no hydrogen 2.840 N/A GLY 270.A N ARG 267.A O no hydrogen 3.228 N/A TRP 271.A N ARG 266.A O no hydrogen 2.793 N/A PHE 276.A N ASP 17.A OD2 no hydrogen 3.332 N/A VAL 277.A N PRO 274.A O no hydrogen 3.003 N/A VAL 282.A N PRO 279.A O no hydrogen 2.855 N/A TYR 283.A N PRO 279.A O no hydrogen 3.432 N/A TYR 283.A OH HIS 71.A NE2 no hydrogen 2.903 N/A ARG 284.A N GLU 280.A O no hydrogen 2.846 N/A HIS 285.A N GLU 281.A O no hydrogen 3.039 N/A HIS 285.A NE2 TYR 35.A OH no hydrogen 2.881 N/A ARG 287.A NE ASP 286.A OD1 no hydrogen 2.550 N/A ARG 287.A NE ASP 286.A OD2 no hydrogen 3.247 N/A ARG 287.A NH2 ASP 286.A OD2 no hydrogen 3.300 N/A ARG 291.A N ARG 287.A O no hydrogen 3.117 N/A ALA 292.A N GLU 288.A O no hydrogen 3.033 N/A TRP 293.A N LYS 289.A O no hydrogen 2.852 N/A GLN 294.A N GLY 290.A O no hydrogen 2.968 N/A GLN 294.A NE2 ASP 47.A OD1 no hydrogen 2.752 N/A GLU 295.A N ARG 291.A O no hydrogen 2.725 N/A ALA 296.A N ALA 292.A O no hydrogen 3.028 N/A TRP 297.A N TRP 293.A O no hydrogen 2.996 N/A TRP 297.A NE1 VAL 139.A O no hydrogen 2.920 N/A GLU 298.A N GLN 294.A O no hydrogen 2.834 N/A LYS 299.A N GLU 295.A O no hydrogen 2.992 N/A ALA 300.A N ALA 296.A O no hydrogen 3.068 N/A LEU 301.A N TRP 297.A O no hydrogen 2.987 N/A GLU 302.A N GLU 298.A O no hydrogen 3.161 N/A ALA 303.A N LYS 299.A O no hydrogen 3.158 N/A TYR 304.A N ALA 300.A O no hydrogen 2.963 N/A TYR 304.A OH PHE 132.A O no hydrogen 2.577 N/A ALA 305.A N LEU 301.A O no hydrogen 2.761 N/A ARG 306.A N GLU 302.A O no hydrogen 3.126 N/A ARG 306.A N ALA 303.A O no hydrogen 2.987 N/A ALA 307.A N ALA 303.A O no hydrogen 2.993 N/A TYR 308.A N TYR 304.A O no hydrogen 2.618 N/A HIS 312.A N TYR 308.A O no hydrogen 2.882 N/A GLN 313.A N PRO 309.A O no hydrogen 3.012 N/A GLU 314.A N ASP 310.A O no hydrogen 3.132 N/A LEU 315.A N LEU 311.A O no hydrogen 2.828 N/A ARG 316.A NE GLU 314.A OE1 no hydrogen 2.873 N/A ARG 316.A NH1 GLU 321.A O no hydrogen 2.786 N/A ARG 316.A NH1 GLU 355.A OE2 no hydrogen 2.902 N/A ARG 316.A NH2 GLU 314.A OE1 no hydrogen 3.470 N/A ARG 316.A NH2 GLU 314.A OE2 no hydrogen 2.763 N/A ARG 316.A NH2 GLU 355.A OE1 no hydrogen 3.112 N/A ARG 317.A N GLU 314.A O no hydrogen 2.966 N/A ARG 317.A NE GLY 406.A O no hydrogen 3.008 N/A ARG 317.A NH1 GLU 131.A OE1 no hydrogen 3.011 N/A ARG 317.A NH2 GLU 131.A OE1 no hydrogen 3.547 N/A ARG 317.A NH2 GLU 131.A OE2 no hydrogen 2.940 N/A ARG 317.A NH2 GLY 406.A O no hydrogen 3.150 N/A LEU 318.A N LEU 315.A O no hydrogen 2.838 N/A ARG 319.A N ARG 316.A O no hydrogen 3.208 N/A GLY 320.A N ARG 317.A O no hydrogen 2.934 N/A GLU 321.A N ARG 316.A O no hydrogen 3.073 N/A PHE 332.A N TYR 473.A OH no hydrogen 3.346 N/A ILE 336.A N VAL 499.A O no hydrogen 3.093 N/A THR 338.A N THR 495.A OG1 no hydrogen 2.982 N/A THR 338.A OG1 THR 495.A OG1 no hydrogen 3.415 N/A ARG 339.A NE ARG 496.A O no hydrogen 3.255 N/A ARG 339.A NH1 SER 366.A O no hydrogen 3.005 N/A ARG 339.A NH2 ARG 496.A O no hydrogen 3.510 N/A ALA 341.A N ALA 337.A O no hydrogen 2.919 N/A SER 342.A N THR 338.A O no hydrogen 2.702 N/A GLY 343.A N ARG 339.A O no hydrogen 3.035 N/A ARG 344.A N ALA 340.A O no hydrogen 2.878 N/A ARG 344.A NH1 SER 331.A O no hydrogen 2.427 N/A ALA 345.A N ALA 341.A O no hydrogen 2.868 N/A LEU 346.A N SER 342.A O no hydrogen 2.872 N/A ASN 347.A N GLY 343.A O no hydrogen 2.999 N/A LEU 348.A N ARG 344.A O no hydrogen 3.322 N/A LEU 349.A N ALA 345.A O no hydrogen 2.864 N/A ALA 350.A N LEU 346.A O no hydrogen 2.910 N/A ARG 352.A N LEU 349.A O no hydrogen 2.976 N/A ARG 352.A NH2 PRO 324.A O no hydrogen 3.145 N/A LEU 353.A N ALA 350.A O no hydrogen 2.901 N/A GLU 355.A N GLU 355.A OE1 no hydrogen 2.664 N/A LEU 356.A N LEU 353.A O no hydrogen 3.073 N/A LEU 357.A N ARG 408.A O no hydrogen 2.922 N/A GLY 358.A N ARG 384.A O no hydrogen 3.044 N/A SER 360.A N LEU 386.A O no hydrogen 3.201 N/A SER 360.A OG GLY 412.A O no hydrogen 3.195 N/A ALA 361.A N GLY 412.A O no hydrogen 3.072 N/A LEU 363.A N SER 360.A OG no hydrogen 3.080 N/A THR 364.A OG1 TYR 385.A OH no hydrogen 2.626 N/A ASN 367.A N LEU 363.A O no hydrogen 2.638 N/A ASN 368.A N THR 364.A O no hydrogen 3.170 N/A THR 369.A OG1 GLY 359.A O no hydrogen 3.555 N/A THR 369.A OG1 TYR 385.A OH no hydrogen 2.828 N/A LYS 370.A NZ ASP 375.A OD1 no hydrogen 2.790 N/A GLU 372.A N ASN 347.A OD1 no hydrogen 2.668 N/A PHE 376.A N TYR 385.A O no hydrogen 2.793 N/A SER 377.A N ASN 380.A O no hydrogen 3.246 N/A ARG 378.A NH2 GLU 229.A OE1 no hydrogen 3.474 N/A ASN 380.A N SER 377.A O no hydrogen 3.135 N/A GLY 383.A N ASN 380.A O no hydrogen 3.046 N/A ARG 384.A NE PRO 354.A O no hydrogen 2.698 N/A ARG 384.A NH2 PRO 354.A O no hydrogen 3.403 N/A TYR 385.A N GLU 374.A O no hydrogen 2.939 N/A TYR 385.A OH THR 364.A OG1 no hydrogen 2.626 N/A TYR 385.A OH THR 369.A OG1 no hydrogen 2.828 N/A LEU 386.A N GLY 358.A O no hydrogen 2.715 N/A HIS 387.A NE2 ASP 375.A OD1 no hydrogen 2.966 N/A HIS 387.A NE2 ASP 375.A OD2 no hydrogen 3.069 N/A PHE 388.A N SER 360.A O no hydrogen 3.053 N/A ARG 391.A N GLY 389.A O no hydrogen 2.742 N/A ARG 391.A NH1 SER 162.A OG no hydrogen 2.932 N/A ARG 391.A NH2 PHE 388.A O no hydrogen 2.916 N/A HIS 393.A NE2 GLN 113.A OE1 no hydrogen 2.927 N/A ALA 394.A N GLU 159.A OE1 no hydrogen 2.889 N/A ALA 396.A N HIS 393.A O no hydrogen 3.078 N/A ILE 397.A N ALA 394.A O no hydrogen 2.693 N/A ASN 399.A N GLY 395.A O no hydrogen 2.945 N/A ASN 399.A ND2 ALA 423.A O no hydrogen 2.877 N/A GLY 400.A N ALA 396.A O no hydrogen 2.925 N/A LEU 401.A N ILE 397.A O no hydrogen 2.810 N/A ASN 402.A N LEU 398.A O no hydrogen 2.960 N/A ASN 402.A ND2 TYR 407.A O no hydrogen 3.480 N/A LEU 403.A N ASN 399.A O no hydrogen 2.848 N/A HIS 404.A N GLY 400.A O no hydrogen 3.120 N/A HIS 404.A ND1 GLY 405.A O no hydrogen 2.789 N/A HIS 404.A NE2 HIS 142.A NE2 no hydrogen 2.751 N/A TYR 407.A OH GLU 131.A OE2 no hydrogen 2.419 N/A ARG 408.A N GLU 355.A O no hydrogen 2.986 N/A ARG 408.A NE PRO 432.A O no hydrogen 2.931 N/A ARG 408.A NH1 LEU 483.A O no hydrogen 2.789 N/A ARG 408.A NH2 PRO 432.A O no hydrogen 3.160 N/A ARG 408.A NH2 ALA 482.A O no hydrogen 2.697 N/A TYR 410.A N LEU 357.A O no hydrogen 2.982 N/A TYR 410.A OH THR 369.A O no hydrogen 2.616 N/A GLY 411.A N VAL 434.A O no hydrogen 3.358 N/A GLY 412.A N GLY 359.A O no hydrogen 2.887 N/A THR 413.A N VAL 436.A O no hydrogen 3.071 N/A LEU 415.A N THR 438.A O no hydrogen 2.849 N/A PHE 417.A N PHE 414.A O no hydrogen 2.885 N/A SER 418.A N LEU 415.A O no hydrogen 2.900 N/A SER 418.A OG LEU 415.A O no hydrogen 2.749 N/A ASP 419.A N VAL 416.A O no hydrogen 3.408 N/A TYR 420.A N PHE 417.A O no hydrogen 3.018 N/A ARG 421.A NH1 SER 458.A O no hydrogen 3.181 N/A ARG 425.A N ARG 421.A O no hydrogen 2.888 N/A LEU 426.A N PRO 422.A O no hydrogen 2.971 N/A ALA 427.A N ALA 423.A O no hydrogen 3.073 N/A ALA 428.A N ILE 424.A O no hydrogen 3.149 N/A LEU 429.A N ARG 425.A O no hydrogen 2.870 N/A VAL 431.A N ALA 427.A O no hydrogen 2.976 N/A THR 433.A N VAL 431.A O no hydrogen 2.877 N/A THR 433.A OG1 ASN 399.A OD1 no hydrogen 2.781 N/A THR 433.A OG1 ASN 402.A OD1 no hydrogen 3.072 N/A PHE 435.A N THR 490.A O no hydrogen 2.875 N/A VAL 436.A N GLY 411.A O no hydrogen 2.961 N/A PHE 437.A N LEU 492.A O no hydrogen 2.844 N/A THR 438.A N THR 413.A O no hydrogen 3.099 N/A THR 438.A OG1 ASN 367.A OD1 no hydrogen 3.080 N/A THR 438.A OG1 HIS 439.A ND1 no hydrogen 2.677 N/A HIS 439.A ND1 THR 438.A OG1 no hydrogen 2.677 N/A ASP 440.A N LEU 494.A O no hydrogen 3.087 N/A ALA 443.A N SER 441.A OG no hydrogen 2.992 N/A LEU 444.A N SER 441.A O no hydrogen 2.907 N/A GLY 445.A N ILE 442.A O no hydrogen 2.962 N/A GLU 446.A N GLU 446.A OE1 no hydrogen 2.816 N/A GLY 448.A N GLY 445.A O no hydrogen 3.232 N/A THR 450.A OG1 HIS 451.A ND1 no hydrogen 2.955 N/A HIS 451.A N GLY 448.A O no hydrogen 2.915 N/A HIS 451.A ND1 THR 450.A OG1 no hydrogen 2.955 N/A GLN 452.A N PRO 449.A O no hydrogen 3.332 N/A GLN 452.A NE2 ALA 606.A O no hydrogen 2.961 N/A VAL 454.A N HIS 456.A ND1 no hydrogen 3.364 N/A GLU 455.A N GLU 455.A OE1 no hydrogen 2.539 N/A HIS 456.A NE2 ASP 419.A OD2 no hydrogen 2.669 N/A SER 458.A OG HIS 456.A O no hydrogen 3.083 N/A LEU 459.A N HIS 456.A O no hydrogen 3.052 N/A ARG 460.A N LEU 457.A O no hydrogen 2.937 N/A ARG 460.A NH1 GLU 584.A OE1 no hydrogen 3.051 N/A ARG 460.A NH2 GLU 584.A OE2 no hydrogen 2.548 N/A ASN 463.A ND2 ALA 428.A O no hydrogen 2.838 N/A ASN 463.A ND2 GLU 487.A O no hydrogen 2.952 N/A PHE 465.A N PRO 489.A O no hydrogen 3.184 N/A VAL 466.A N GLU 560.A OE2 no hydrogen 2.902 N/A ILE 467.A N ALA 491.A O no hydrogen 2.872 N/A ARG 468.A N PRO 557.A O no hydrogen 2.827 N/A ARG 468.A NE ASP 440.A OD2 no hydrogen 2.673 N/A ARG 468.A NH1 THR 530.A OG1 no hydrogen 2.937 N/A ARG 468.A NH1 GLU 533.A OE1 no hydrogen 2.772 N/A ARG 468.A NH2 ASP 440.A OD2 no hydrogen 2.814 N/A ARG 468.A NH2 GLU 533.A OE1 no hydrogen 2.934 N/A ALA 470.A N GLU 474.A OE1 no hydrogen 2.730 N/A TYR 473.A N ASP 471.A OD2 no hydrogen 3.092 N/A TYR 473.A OH PHE 332.A O no hydrogen 3.384 N/A GLU 474.A N ASP 471.A OD1 no hydrogen 2.941 N/A THR 475.A N ASP 471.A O no hydrogen 2.976 N/A THR 475.A OG1 ASP 471.A O no hydrogen 2.818 N/A PHE 476.A N ALA 472.A O no hydrogen 3.377 N/A PHE 476.A N TYR 473.A O no hydrogen 3.100 N/A TYR 477.A N TYR 473.A O no hydrogen 3.341 N/A ALA 478.A N GLU 474.A O no hydrogen 2.693 N/A TRP 479.A N THR 475.A O no hydrogen 3.081 N/A TRP 479.A NE1 SER 342.A OG no hydrogen 2.815 N/A LEU 480.A N PHE 476.A O no hydrogen 3.270 N/A VAL 481.A N TYR 477.A O no hydrogen 2.962 N/A ALA 482.A N ALA 478.A O no hydrogen 3.052 N/A LEU 483.A N TRP 479.A O no hydrogen 2.941 N/A ARG 484.A N LEU 480.A O no hydrogen 2.951 N/A ARG 485.A N VAL 481.A O no hydrogen 2.941 N/A ARG 485.A NE PRO 489.A O no hydrogen 3.052 N/A ARG 485.A NH1 ASN 463.A OD1 no hydrogen 2.938 N/A ARG 485.A NH1 PRO 489.A O no hydrogen 3.132 N/A LYS 486.A NZ GLY 320.A O no hydrogen 3.207 N/A GLU 487.A N GLU 487.A OE2 no hydrogen 2.664 N/A THR 490.A N THR 433.A O no hydrogen 3.087 N/A ALA 491.A N PHE 465.A O no hydrogen 2.706 N/A LEU 492.A N PHE 435.A O no hydrogen 2.841 N/A VAL 493.A N ILE 467.A O no hydrogen 2.743 N/A LEU 494.A N PHE 437.A O no hydrogen 2.686 N/A THR 495.A N THR 338.A OG1 no hydrogen 2.683 N/A THR 495.A OG1 THR 338.A OG1 no hydrogen 3.415 N/A THR 495.A OG1 GLN 497.A O no hydrogen 2.724 N/A ARG 496.A NH1 LEU 444.A O no hydrogen 2.954 N/A GLN 497.A N GLN 497.A OE1 no hydrogen 2.728 N/A VAL 499.A N ILE 336.A O no hydrogen 3.154 N/A LEU 502.A N ASP 471.A OD2 no hydrogen 2.790 N/A LYS 506.A N SER 503.A OG no hydrogen 2.980 N/A LYS 506.A NZ LEU 517.A O no hydrogen 2.902 N/A ALA 507.A N SER 503.A O no hydrogen 3.068 N/A GLY 509.A N LYS 506.A O no hydrogen 2.791 N/A LEU 510.A N ALA 507.A O no hydrogen 2.879 N/A LEU 511.A N ARG 508.A O no hydrogen 3.098 N/A ARG 512.A N GLY 509.A O no hydrogen 2.841 N/A GLY 513.A N LEU 510.A O no hydrogen 2.608 N/A TYR 515.A N SER 555.A O no hydrogen 3.063 N/A TYR 515.A OH GLU 474.A OE2 no hydrogen 2.653 N/A LEU 517.A N VAL 553.A O no hydrogen 2.652 N/A GLU 518.A N VAL 553.A O no hydrogen 3.298 N/A VAL 520.A N ASP 519.A OD1 no hydrogen 2.657 N/A GLN 524.A N ARG 550.A O no hydrogen 2.733 N/A VAL 526.A N PRO 579.A O no hydrogen 2.919 N/A LEU 527.A N ARG 552.A O no hydrogen 2.995 N/A VAL 528.A N VAL 581.A O no hydrogen 2.793 N/A ALA 529.A N VAL 554.A O no hydrogen 3.001 N/A THR 530.A OG1 GLU 584.A OE2 no hydrogen 2.570 N/A GLY 531.A N ARG 468.A O no hydrogen 3.073 N/A SER 532.A OG GLU 533.A OE2 no hydrogen 2.736 N/A GLU 533.A N THR 530.A O no hydrogen 3.107 N/A VAL 534.A N GLY 531.A O no hydrogen 3.046 N/A HIS 535.A N SER 532.A O no hydrogen 3.187 N/A ALA 537.A N GLU 533.A O no hydrogen 2.868 N/A LEU 538.A N VAL 534.A O no hydrogen 2.956 N/A ARG 539.A N HIS 535.A O no hydrogen 3.304 N/A ALA 540.A N LEU 536.A O no hydrogen 3.011 N/A GLN 541.A N ALA 537.A O no hydrogen 2.849 N/A ALA 542.A N LEU 538.A O no hydrogen 3.226 N/A LEU 543.A N ARG 539.A O no hydrogen 3.137 N/A LEU 544.A N ALA 540.A O no hydrogen 2.887 N/A ARG 545.A N GLN 541.A O no hydrogen 2.828 N/A GLU 546.A N ALA 542.A O no hydrogen 2.937 N/A LYS 547.A N LEU 544.A O no hydrogen 2.891 N/A GLY 548.A N ARG 545.A O no hydrogen 3.028 N/A VAL 549.A N LEU 544.A O no hydrogen 3.010 N/A ARG 550.A N GLN 524.A OE1 no hydrogen 2.948 N/A ARG 550.A NE GLU 521.A O no hydrogen 3.001 N/A ARG 550.A NE GLU 522.A O no hydrogen 3.444 N/A ARG 550.A NH2 GLU 522.A O no hydrogen 3.431 N/A ARG 552.A N GLY 525.A O no hydrogen 3.062 N/A ARG 552.A NE ASP 519.A OD1 no hydrogen 3.088 N/A ARG 552.A NH1 GLU 572.A O no hydrogen 2.711 N/A ARG 552.A NH1 VAL 573.A O no hydrogen 2.879 N/A ARG 552.A NH2 ASP 519.A OD1 no hydrogen 3.382 N/A VAL 553.A N GLU 518.A O no hydrogen 2.855 N/A VAL 554.A N LEU 527.A O no hydrogen 2.980 N/A SER 555.A N TYR 515.A O no hydrogen 2.979 N/A SER 555.A OG GLU 474.A OE2 no hydrogen 2.622 N/A LEU 556.A N ALA 529.A O no hydrogen 2.793 N/A SER 558.A N GLY 513.A O no hydrogen 3.091 N/A SER 558.A OG VAL 466.A O no hydrogen 3.394 N/A SER 558.A OG GLU 560.A OE2 no hydrogen 2.909 N/A LEU 561.A N SER 558.A OG no hydrogen 3.250 N/A PHE 562.A N SER 558.A O no hydrogen 3.026 N/A ALA 563.A N PHE 559.A O no hydrogen 2.916 N/A ALA 564.A N GLU 560.A O no hydrogen 3.152 N/A ALA 564.A N LEU 561.A O no hydrogen 3.072 N/A GLN 565.A N PHE 562.A O no hydrogen 3.016 N/A GLN 565.A NE2 LEU 561.A O no hydrogen 2.855 N/A TYR 569.A OH GLY 514.A O no hydrogen 2.609 N/A ARG 570.A N PRO 566.A O no hydrogen 3.252 N/A ARG 570.A NH1 GLN 565.A O no hydrogen 3.039 N/A LYS 571.A N GLU 567.A O no hydrogen 3.078 N/A GLU 572.A N ALA 568.A O no hydrogen 3.029 N/A VAL 573.A N TYR 569.A O no hydrogen 3.069 N/A LEU 574.A N ARG 570.A O no hydrogen 2.894 N/A LEU 578.A N PRO 575.A O no hydrogen 3.200 N/A VAL 580.A N HIS 596.A ND1 no hydrogen 2.744 N/A VAL 581.A N VAL 526.A O no hydrogen 2.861 N/A ALA 582.A N LYS 597.A O no hydrogen 2.895 N/A VAL 583.A N VAL 528.A O no hydrogen 2.806 N/A GLU 584.A N VAL 599.A O no hydrogen 3.200 N/A ALA 585.A N GLU 533.A OE1 no hydrogen 2.829 N/A GLY 586.A N GLU 584.A O no hydrogen 2.683 N/A ALA 587.A N VAL 454.A O no hydrogen 2.825 N/A SER 588.A N ASP 602.A OD2 no hydrogen 2.958 N/A SER 588.A OG ASP 602.A OD1 no hydrogen 2.567 N/A SER 588.A OG ASP 602.A OD2 no hydrogen 3.488 N/A GLY 590.A N GLU 592.A OE2 no hydrogen 3.055 N/A TRP 591.A N SER 588.A O no hydrogen 3.106 N/A TRP 591.A NE1 GLU 584.A OE1 no hydrogen 2.927 N/A GLU 592.A N GLU 592.A OE2 no hydrogen 2.789 N/A ARG 593.A N GLY 590.A O no hydrogen 3.175 N/A TYR 594.A N TRP 591.A O no hydrogen 2.886 N/A ALA 595.A N TRP 591.A O no hydrogen 2.833 N/A HIS 596.A N VAL 580.A O no hydrogen 2.821 N/A LYS 597.A N VAL 580.A O no hydrogen 3.398 N/A LYS 597.A NZ SER 630.A OG no hydrogen 2.762 N/A VAL 599.A N ALA 582.A O no hydrogen 2.802 N/A LEU 601.A N GLY 586.A O no hydrogen 2.724 N/A ARG 603.A NE PHE 604.A O no hydrogen 2.940 N/A ARG 603.A NH1 PHE 604.A O no hydrogen 3.340 N/A ARG 603.A NH1 GLY 605.A O no hydrogen 3.170 N/A ALA 606.A N GLN 452.A OE1 no hydrogen 2.859 N/A SER 607.A OG GLU 446.A O no hydrogen 2.596 N/A VAL 613.A N PRO 609.A O no hydrogen 2.784 N/A TYR 614.A OH GLU 533.A OE2 no hydrogen 2.663 N/A GLU 615.A N PRO 611.A O no hydrogen 2.769 N/A ARG 616.A N GLU 612.A O no hydrogen 2.834 N/A ARG 616.A NH1 GLU 612.A OE2 no hydrogen 3.323 N/A LEU 617.A N VAL 613.A O no hydrogen 3.210 N/A GLY 618.A N GLU 615.A O no hydrogen 2.936 N/A PHE 619.A N TYR 614.A O no hydrogen 3.159 N/A ARG 623.A N THR 620.A OG1 no hydrogen 3.163 N/A VAL 624.A N THR 620.A O no hydrogen 3.263 N/A ALA 625.A N PRO 621.A O no hydrogen 2.969 N/A GLU 626.A N GLU 622.A O no hydrogen 2.988 N/A ALA 627.A N ARG 623.A O no hydrogen 2.885 N/A PHE 628.A N VAL 624.A O no hydrogen 2.993 N/A LEU 629.A N ALA 625.A O no hydrogen 2.831 N/A SER 630.A N GLU 626.A O no hydrogen 3.003 N/A SER 630.A OG ALA 627.A O no hydrogen 2.585 N/A LEU 631.A N PHE 628.A O no hydrogen 2.670 N/A VAL 632.A N LEU 629.A O no hydrogen 3.375 N/A