Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 6ys1_AAA.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ALA 4.A N SER 1.A O no hydrogen 3.347 N/A GLN 6.A N VAL 3.A O no hydrogen 3.014 N/A LYS 7.A NZ LEU 251.A O no hydrogen 2.955 N/A TYR 8.A N GLU 250.A O no hydrogen 2.928 N/A ASP 9.A N ARG 33.A O no hydrogen 2.917 N/A TYR 10.A N ARG 33.A O no hydrogen 3.178 N/A ILE 11.A N GLU 256.A O no hydrogen 3.087 N/A LEU 12.A N LEU 35.A O no hydrogen 2.777 N/A VAL 13.A N ILE 258.A O no hydrogen 2.900 N/A GLY 14.A N LEU 37.A O no hydrogen 2.716 N/A GLY 15.A N GLU 38.A OE1 no hydrogen 2.733 N/A THR 17.A OG1 GLY 88.A O no hydrogen 3.513 N/A CYS 20.A N GLY 16.A O no hydrogen 2.881 N/A CYS 20.A SG GLY 15.A O no hydrogen 3.552 N/A CYS 20.A SG GLY 16.A O no hydrogen 3.313 N/A LEU 22.A N ALA 18.A O no hydrogen 2.950 N/A ALA 23.A N ALA 19.A O no hydrogen 2.768 N/A ASN 24.A N CYS 20.A O no hydrogen 3.209 N/A ASN 24.A ND2 TYR 204.A O no hydrogen 2.896 N/A ARG 25.A N VAL 21.A O no hydrogen 2.933 N/A ARG 25.A NE GLU 550.A OE1 no hydrogen 2.724 N/A ARG 25.A NH2 GLU 550.A OE1 no hydrogen 3.336 N/A ARG 25.A NH2 GLU 550.A OE2 no hydrogen 2.876 N/A LEU 26.A N LEU 22.A O no hydrogen 2.762 N/A SER 27.A N ALA 23.A O no hydrogen 3.303 N/A SER 27.A OG ALA 23.A O no hydrogen 2.569 N/A SER 27.A OG ASN 24.A O no hydrogen 3.312 N/A ALA 28.A N ARG 25.A O no hydrogen 3.426 N/A SER 31.A N ASP 29.A OD1 no hydrogen 2.991 N/A SER 31.A OG ASP 29.A OD1 no hydrogen 2.696 N/A SER 31.A OG ASP 29.A OD2 no hydrogen 3.548 N/A ARG 33.A N ASP 9.A OD2 no hydrogen 2.839 N/A VAL 34.A N ASN 213.A O no hydrogen 2.761 N/A LEU 35.A N TYR 10.A O no hydrogen 2.934 N/A VAL 36.A N GLN 215.A O no hydrogen 2.888 N/A LEU 37.A N LEU 12.A O no hydrogen 3.015 N/A GLU 38.A N LEU 217.A O no hydrogen 2.895 N/A GLY 40.A N GLU 38.A OE2 no hydrogen 2.763 N/A ASN 43.A N ASP 42.A OD1 no hydrogen 2.802 N/A ASN 43.A ND2 LEU 87.A O no hydrogen 2.943 N/A ASN 43.A ND2 ASP 199.A OD2 no hydrogen 3.266 N/A ASP 47.A N SER 45.A OG no hydrogen 3.022 N/A VAL 48.A N SER 45.A O no hydrogen 3.152 N/A LYS 49.A NZ THR 44.A O no hydrogen 3.299 N/A ILE 50.A N ARG 46.A O no hydrogen 3.223 N/A ALA 52.A N LEU 347.A O no hydrogen 3.003 N/A ALA 53.A N ILE 50.A O no hydrogen 3.019 N/A ILE 54.A N PRO 51.A O no hydrogen 2.965 N/A THR 55.A N ALA 52.A O no hydrogen 3.414 N/A THR 55.A OG1 ALA 52.A O no hydrogen 2.914 N/A ARG 56.A N ALA 53.A O no hydrogen 2.867 N/A ARG 56.A NH1 ASP 47.A OD1 no hydrogen 2.920 N/A ARG 56.A NH2 GLN 393.A OE1 no hydrogen 2.650 N/A LEU 57.A N ILE 54.A O no hydrogen 2.958 N/A ARG 59.A N TYR 80.A OH no hydrogen 2.989 N/A SER 60.A OG LEU 57.A O no hydrogen 2.716 N/A LEU 62.A N SER 60.A OG no hydrogen 3.003 N/A ASP 63.A N SER 60.A O no hydrogen 3.112 N/A TRP 64.A N ARG 83.A O no hydrogen 2.884 N/A ASN 65.A N ASP 63.A OD2 no hydrogen 2.806 N/A SER 68.A N ILE 79.A O no hydrogen 2.835 N/A SER 68.A OG GLU 69.A O no hydrogen 2.700 N/A GLU 69.A N LEU 431.A O no hydrogen 2.766 N/A GLN 71.A N ARG 77.A O no hydrogen 2.782 N/A GLN 73.A N GLN 73.A OE1 no hydrogen 2.762 N/A GLN 73.A NE2 TYR 435.A O no hydrogen 2.737 N/A LEU 74.A N GLN 71.A O no hydrogen 3.131 N/A ARG 77.A NE LEU 74.A O no hydrogen 3.049 N/A ARG 77.A NE ARG 488.A O no hydrogen 3.362 N/A ARG 77.A NH2 ARG 488.A O no hydrogen 3.017 N/A ARG 77.A NH2 ILE 491.A O no hydrogen 2.921 N/A GLN 78.A NE2 SER 68.A O no hydrogen 2.861 N/A ILE 79.A N SER 68.A OG no hydrogen 2.800 N/A TYR 80.A OH ASP 63.A OD2 no hydrogen 2.634 N/A MET 81.A N LEU 66.A O no hydrogen 2.984 N/A ARG 83.A N ASP 63.A OD1 no hydrogen 2.901 N/A ARG 83.A NE ALA 82.A O no hydrogen 2.654 N/A ARG 83.A NH1 ALA 496.A O no hydrogen 3.359 N/A ARG 83.A NH2 ALA 496.A O no hydrogen 2.938 N/A GLY 84.A N SER 90.A OG no hydrogen 3.015 N/A ARG 85.A N LEU 62.A O no hydrogen 2.846 N/A LEU 87.A N PRO 41.A O no hydrogen 3.123 N/A GLY 88.A N GLY 15.A O no hydrogen 2.812 N/A GLY 89.A N LEU 86.A O no hydrogen 2.767 N/A SER 91.A N GLY 88.A O no hydrogen 3.011 N/A SER 91.A OG GLY 88.A O no hydrogen 2.655 N/A ALA 92.A N GLY 89.A O no hydrogen 3.102 N/A THR 93.A N SER 90.A O no hydrogen 3.101 N/A THR 96.A N ASN 94.A OD1 no hydrogen 2.912 N/A THR 96.A OG1 ALA 95.A O no hydrogen 2.662 N/A TYR 98.A N GLN 189.A O no hydrogen 2.891 N/A ARG 100.A NE TYR 98.A OH no hydrogen 3.011 N/A ARG 100.A NH1 TYR 137.A O no hydrogen 2.690 N/A ARG 100.A NH2 TYR 98.A OH no hydrogen 2.808 N/A ARG 100.A NH2 TYR 137.A O no hydrogen 3.000 N/A ALA 102.A N ASP 105.A OD2 no hydrogen 2.861 N/A ASP 105.A N ALA 102.A O no hydrogen 2.945 N/A TYR 106.A N ALA 103.A O no hydrogen 2.966 N/A TYR 106.A OH ARG 100.A O no hydrogen 2.666 N/A ASP 107.A N ALA 103.A O no hydrogen 3.113 N/A ALA 108.A N GLY 104.A O no hydrogen 2.931 N/A TRP 109.A N TYR 106.A O no hydrogen 2.997 N/A TRP 109.A NE1 LYS 535.A O no hydrogen 2.769 N/A GLY 110.A N ASP 107.A O no hydrogen 2.999 N/A TRP 114.A N VAL 111.A O no hydrogen 2.948 N/A TRP 114.A NE1 ASN 515.A O no hydrogen 3.034 N/A SER 115.A N ASP 118.A OD2 no hydrogen 2.879 N/A SER 115.A OG ASP 118.A OD2 no hydrogen 2.792 N/A SER 116.A N ASP 107.A OD1 no hydrogen 2.902 N/A SER 116.A OG ASP 107.A OD1 no hydrogen 3.185 N/A SER 116.A OG ASP 107.A OD2 no hydrogen 2.787 N/A ASP 118.A N SER 115.A OG no hydrogen 3.185 N/A VAL 119.A N SER 115.A O no hydrogen 3.022 N/A LEU 120.A N SER 116.A O no hydrogen 3.188 N/A TRP 122.A N VAL 119.A O no hydrogen 2.946 N/A PHE 123.A N VAL 119.A O no hydrogen 3.172 N/A VAL 124.A N LEU 120.A O no hydrogen 3.056 N/A GLN 125.A N SER 121.A O no hydrogen 2.890 N/A ALA 126.A N PHE 123.A O no hydrogen 3.246 N/A GLU 127.A N VAL 124.A O no hydrogen 3.185 N/A THR 128.A N MET 144.A O no hydrogen 3.264 N/A THR 128.A OG1 GLY 142.A O no hydrogen 2.667 N/A ASN 129.A ND2 GLU 127.A OE2 no hydrogen 2.832 N/A ASN 129.A ND2 GLN 189.A OE1 no hydrogen 2.779 N/A ALA 130.A N VAL 146.A O no hydrogen 2.853 N/A ASP 131.A N ASN 129.A OD1 no hydrogen 2.999 N/A PHE 132.A N ASN 129.A OD1 no hydrogen 3.273 N/A GLY 135.A N HIS 138.A O no hydrogen 3.071 N/A HIS 138.A ND1 GLU 127.A OE2 no hydrogen 2.556 N/A HIS 138.A NE2 ASP 174.A OD2 no hydrogen 2.737 N/A GLY 139.A N GLU 127.A OE1 no hydrogen 2.802 N/A GLY 141.A N THR 128.A OG1 no hydrogen 2.903 N/A GLY 142.A N GLU 127.A O no hydrogen 3.119 N/A MET 144.A N ALA 126.A O no hydrogen 2.879 N/A ARG 145.A NH1 GLY 142.A O no hydrogen 3.080 N/A ARG 145.A NH1 MET 144.A O no hydrogen 3.024 N/A VAL 146.A N THR 128.A O no hydrogen 2.924 N/A GLU 147.A N VAL 190.A O no hydrogen 2.862 N/A ASN 148.A N ASP 131.A OD2 no hydrogen 2.846 N/A ARG 150.A NE GLY 343.A O no hydrogen 2.722 N/A ARG 150.A NH2 GLY 342.A O no hydrogen 2.795 N/A TYR 151.A OH HIS 323.A ND1 no hydrogen 2.677 N/A ASN 153.A N HIS 157.A ND1 no hydrogen 3.143 N/A ASN 153.A ND2 TYR 151.A OH no hydrogen 2.964 N/A ASN 153.A ND2 ILE 318.A O no hydrogen 2.791 N/A LEU 156.A N ASN 153.A OD1 no hydrogen 2.894 N/A ALA 159.A N GLN 155.A O no hydrogen 3.355 N/A PHE 160.A N LEU 156.A O no hydrogen 3.038 N/A PHE 161.A N HIS 157.A O no hydrogen 3.407 N/A LYS 162.A N THR 158.A O no hydrogen 2.967 N/A ALA 163.A N ALA 159.A O no hydrogen 2.898 N/A ALA 164.A N PHE 160.A O no hydrogen 2.921 N/A GLU 165.A N PHE 161.A O no hydrogen 2.980 N/A GLU 166.A N LYS 162.A O no hydrogen 2.884 N/A VAL 167.A N ALA 163.A O no hydrogen 3.092 N/A GLY 168.A N GLU 165.A O no hydrogen 2.933 N/A LEU 169.A N ALA 164.A O no hydrogen 2.974 N/A ASN 172.A N TYR 185.A O no hydrogen 2.834 N/A ASN 172.A ND2 HIS 182.A O no hydrogen 3.190 N/A ASN 172.A ND2 ALA 183.A O no hydrogen 3.405 N/A ASP 174.A N ASN 172.A OD1 no hydrogen 2.991 N/A ASN 176.A N ASP 174.A OD1 no hydrogen 2.978 N/A ASP 177.A N ASP 174.A O no hydrogen 3.048 N/A TRP 178.A NE1 GLY 101.A O no hydrogen 2.959 N/A SER 179.A N ASP 177.A OD1 no hydrogen 2.826 N/A SER 179.A OG ASP 177.A OD1 no hydrogen 2.601 N/A HIS 180.A ND1 ASN 172.A OD1 no hydrogen 2.885 N/A ALA 183.A N ASP 181.A OD2 no hydrogen 3.069 N/A GLY 184.A N PHE 357.A O no hydrogen 2.848 N/A TYR 185.A N THR 170.A O no hydrogen 3.002 N/A GLY 186.A N GLY 355.A O no hydrogen 2.917 N/A PHE 188.A N ASP 353.A O no hydrogen 3.036 N/A GLN 189.A NE2 ASN 129.A OD1 no hydrogen 2.960 N/A GLN 189.A NE2 ASN 148.A OD1 no hydrogen 2.993 N/A VAL 190.A N GLU 147.A O no hydrogen 2.865 N/A MET 191.A N THR 96.A O no hydrogen 2.736 N/A GLN 192.A NE2 THR 96.A OG1 no hydrogen 3.201 N/A GLN 192.A NE2 THR 348.A O no hydrogen 2.994 N/A ASP 193.A N THR 196.A O no hydrogen 2.805 N/A LYS 194.A N GLU 147.A OE1 no hydrogen 2.760 N/A GLY 195.A N GLU 147.A OE2 no hydrogen 2.995 N/A THR 196.A N ASP 193.A O no hydrogen 3.137 N/A THR 196.A OG1 TYR 339.A OH no hydrogen 3.332 N/A ARG 197.A N LYS 49.A O no hydrogen 2.911 N/A ARG 197.A NE VAL 48.A O no hydrogen 2.762 N/A ARG 197.A NH1 SER 91.A O no hydrogen 3.192 N/A ARG 197.A NH1 ASN 94.A O no hydrogen 2.864 N/A ARG 197.A NH1 ASN 94.A OD1 no hydrogen 3.120 N/A ARG 197.A NH2 ASN 94.A O no hydrogen 2.836 N/A ALA 198.A N MET 191.A O no hydrogen 2.956 N/A MET 200.A N SER 91.A OG no hydrogen 2.973 N/A ARG 202.A N ASP 199.A OD1 no hydrogen 2.777 N/A ARG 202.A NH1 ASP 193.A OD2 no hydrogen 3.030 N/A ARG 202.A NH1 GLN 203.A OE1 no hydrogen 2.808 N/A ARG 202.A NH2 ASP 193.A OD2 no hydrogen 3.444 N/A GLN 203.A N ASP 199.A O no hydrogen 2.935 N/A GLN 203.A NE2 PRO 143.A O no hydrogen 2.908 N/A TYR 204.A N MET 200.A O no hydrogen 2.882 N/A TYR 204.A OH GLU 550.A OE2 no hydrogen 2.618 N/A LEU 205.A N MET 200.A O no hydrogen 3.261 N/A LEU 205.A N TYR 201.A O no hydrogen 3.193 N/A LYS 206.A N TYR 201.A O no hydrogen 2.770 N/A VAL 208.A N LEU 205.A O no hydrogen 2.965 N/A LEU 209.A N LYS 206.A O no hydrogen 3.505 N/A ARG 211.A N VAL 208.A O no hydrogen 2.976 N/A ARG 211.A NH1 ASN 24.A O no hydrogen 2.765 N/A ARG 211.A NH1 SER 27.A OG no hydrogen 2.945 N/A ASN 213.A N ASN 213.A OD1 no hydrogen 2.702 N/A ASN 213.A ND2 SER 27.A O no hydrogen 2.933 N/A ASN 213.A ND2 LYS 32.A O no hydrogen 2.828 N/A LEU 214.A N ARG 211.A O no hydrogen 3.327 N/A GLN 215.A N VAL 34.A O no hydrogen 2.922 N/A LEU 217.A N VAL 36.A O no hydrogen 2.901 N/A GLY 219.A N GLY 40.A O no hydrogen 3.033 N/A ALA 220.A N GLU 38.A O no hydrogen 2.791 N/A ALA 221.A N SER 238.A O no hydrogen 2.939 N/A THR 223.A N GLU 236.A O no hydrogen 2.922 N/A THR 223.A OG1 GLU 236.A OE2 no hydrogen 2.701 N/A VAL 225.A N SER 273.A OG no hydrogen 2.738 N/A ASN 226.A N GLY 234.A O no hydrogen 2.971 N/A ASN 226.A ND2 SER 248.A OG no hydrogen 2.978 N/A ASP 228.A N GLN 231.A O no hydrogen 2.895 N/A LYS 229.A NZ GLU 523.A OE2 no hydrogen 3.362 N/A GLN 231.A N ASP 228.A O no hydrogen 3.052 N/A ALA 232.A N GLU 523.A O no hydrogen 2.874 N/A LEU 233.A N ASN 226.A O no hydrogen 2.819 N/A VAL 235.A N ALA 249.A O no hydrogen 2.998 N/A GLU 236.A N LYS 224.A O no hydrogen 2.934 N/A PHE 237.A N LEU 247.A O no hydrogen 2.859 N/A SER 238.A N ALA 221.A O no hydrogen 2.907 N/A SER 238.A OG GLY 241.A O no hydrogen 2.652 N/A ASP 240.A N SER 238.A OG no hydrogen 3.140 N/A GLY 244.A N GLY 241.A O no hydrogen 3.058 N/A ARG 246.A NH1 GLU 236.A OE2 no hydrogen 2.785 N/A LEU 247.A N PHE 237.A O no hydrogen 2.748 N/A ALA 249.A N VAL 235.A O no hydrogen 2.858 N/A LEU 251.A N LEU 233.A O no hydrogen 2.846 N/A ALA 252.A N TYR 8.A O no hydrogen 2.793 N/A GLY 255.A N ALA 252.A O no hydrogen 2.919 N/A GLU 256.A N ASP 9.A O no hydrogen 2.947 N/A VAL 257.A N GLY 524.A O no hydrogen 2.949 N/A ILE 258.A N ILE 11.A O no hydrogen 2.825 N/A MET 259.A N ARG 526.A O no hydrogen 2.774 N/A CYS 260.A N VAL 13.A O no hydrogen 2.773 N/A CYS 260.A SG ILE 258.A O no hydrogen 3.841 N/A CYS 260.A SG VAL 528.A O no hydrogen 3.606 N/A ALA 261.A N THR 266.A OG1 no hydrogen 3.004 N/A GLY 262.A N ASP 529.A OD2 no hydrogen 2.887 N/A THR 266.A N GLY 262.A O no hydrogen 2.785 N/A THR 266.A OG1 GLY 262.A O no hydrogen 3.344 N/A THR 266.A OG1 ASP 529.A OD2 no hydrogen 2.677 N/A LEU 269.A N HIS 265.A O no hydrogen 2.838 N/A LEU 270.A N THR 266.A O no hydrogen 2.889 N/A LYS 271.A N PRO 267.A O no hydrogen 3.030 N/A LYS 271.A NZ GLU 280.A OE1 no hydrogen 2.561 N/A LYS 271.A NZ VAL 295.A O no hydrogen 3.133 N/A LYS 271.A NZ VAL 418.A O no hydrogen 2.851 N/A HIS 272.A N PHE 268.A O no hydrogen 3.094 N/A SER 273.A N LEU 270.A O no hydrogen 2.848 N/A SER 273.A OG LEU 269.A O no hydrogen 2.707 N/A GLY 274.A N LYS 271.A O no hydrogen 3.079 N/A VAL 275.A N LEU 270.A O no hydrogen 2.895 N/A GLY 276.A N SER 290.A O no hydrogen 3.017 N/A SER 278.A N ASN 291.A OD1 no hydrogen 3.074 N/A GLU 280.A N PRO 277.A O no hydrogen 2.947 N/A LEU 281.A N PRO 277.A O no hydrogen 3.265 N/A LYS 282.A N SER 278.A O no hydrogen 2.828 N/A GLU 283.A N ALA 279.A O no hydrogen 3.201 N/A PHE 284.A N LEU 281.A O no hydrogen 3.173 N/A GLY 285.A N LYS 282.A O no hydrogen 2.833 N/A ILE 286.A N LEU 281.A O no hydrogen 2.980 N/A VAL 289.A N GLY 274.A O no hydrogen 2.689 N/A SER 290.A N GLY 274.A O no hydrogen 2.986 N/A SER 290.A OG HIS 520.A O no hydrogen 2.829 N/A LEU 292.A N GLY 276.A O no hydrogen 2.977 N/A VAL 295.A N LEU 292.A O no hydrogen 3.337 N/A GLY 296.A N THR 500.A O no hydrogen 2.735 N/A GLN 297.A N GLY 294.A O no hydrogen 2.979 N/A ASN 298.A ND2 GLY 499.A O no hydrogen 2.989 N/A ASN 298.A ND2 PRO 534.A O no hydrogen 3.224 N/A LEU 299.A N GLY 416.A O no hydrogen 3.116 N/A GLN 300.A N THR 498.A O no hydrogen 2.846 N/A GLN 302.A N ASP 301.A OD1 no hydrogen 2.905 N/A GLN 302.A NE2 CYS 410.A O no hydrogen 3.043 N/A GLN 302.A NE2 GLY 539.A O no hydrogen 2.958 N/A ALA 304.A N HIS 492.A O no hydrogen 2.799 N/A CYS 305.A N LEU 407.A O no hydrogen 2.945 N/A THR 307.A N MET 405.A O no hydrogen 2.965 N/A ALA 308.A N PHE 472.A O no hydrogen 2.924 N/A ALA 309.A N ILE 403.A O no hydrogen 2.952 N/A VAL 311.A N SER 401.A O no hydrogen 3.073 N/A LYS 312.A N TYR 466.A O no hydrogen 2.780 N/A LYS 312.A NZ GLU 465.A O no hydrogen 2.690 N/A TYR 315.A N LYS 312.A O no hydrogen 2.859 N/A TYR 315.A OH GLU 465.A OE2 no hydrogen 2.496 N/A ASP 316.A N GLU 313.A O no hydrogen 3.082 N/A GLY 317.A N SER 401.A OG no hydrogen 3.104 N/A ILE 318.A N TYR 315.A O no hydrogen 3.264 N/A ALA 319.A N ASP 322.A OD2 no hydrogen 2.978 N/A ILE 320.A N PRO 374.A O no hydrogen 2.777 N/A ASP 322.A N ALA 319.A O no hydrogen 2.839 N/A HIS 323.A N ALA 319.A O no hydrogen 3.136 N/A HIS 323.A ND1 TYR 151.A OH no hydrogen 2.677 N/A ILE 324.A N ILE 320.A O no hydrogen 2.951 N/A TYR 325.A N SER 321.A O no hydrogen 2.952 N/A TYR 325.A OH PHE 389.A O no hydrogen 2.659 N/A ASN 326.A N GLN 330.A O no hydrogen 2.878 N/A LYS 328.A N ASN 326.A OD1 no hydrogen 2.931 N/A GLY 329.A N ASN 326.A O no hydrogen 3.045 N/A GLN 330.A N ASN 326.A OD1 no hydrogen 2.938 N/A ARG 332.A N ILE 324.A O no hydrogen 2.764 N/A ARG 332.A NE.A ASP 322.A O no hydrogen 2.633 N/A ARG 332.A NH1.B ASP 322.A O no hydrogen 2.762 N/A ARG 332.A NH2.A ASP 322.A O no hydrogen 3.293 N/A ILE 336.A N ARG 332.A O no hydrogen 3.170 N/A ALA 337.A N LYS 333.A O no hydrogen 2.876 N/A SER 338.A N ARG 334.A O no hydrogen 2.886 N/A SER 338.A OG ARG 334.A O no hydrogen 3.004 N/A TYR 339.A N ALA 335.A O no hydrogen 2.934 N/A LEU 340.A N ILE 336.A O no hydrogen 2.974 N/A LEU 341.A N ALA 337.A O no hydrogen 2.861 N/A GLY 343.A N TYR 339.A O no hydrogen 2.983 N/A ARG 344.A N SER 338.A O no hydrogen 3.097 N/A GLY 345.A N ARG 150.A O no hydrogen 3.239 N/A THR 348.A N GLY 345.A O no hydrogen 3.004 N/A THR 348.A OG1 GLY 345.A O no hydrogen 2.721 N/A SER 349.A N GLY 346.A O no hydrogen 3.181 N/A SER 349.A OG ASP 353.A OD2 no hydrogen 2.642 N/A THR 350.A OG1 ALA 95.A O no hydrogen 2.634 N/A GLY 351.A N SER 349.A OG no hydrogen 2.894 N/A CYS 352.A SG ARG 354.A O no hydrogen 3.060 N/A CYS 352.A SG PHE 372.A O no hydrogen 3.626 N/A ARG 354.A NH2 HIS 157.A O no hydrogen 3.488 N/A GLY 355.A N GLY 186.A O no hydrogen 3.107 N/A ALA 356.A N VAL 370.A O no hydrogen 2.868 N/A PHE 357.A N GLY 184.A O no hydrogen 2.978 N/A VAL 358.A N LEU 368.A O no hydrogen 2.831 N/A ARG 359.A NE GLN 363.A O no hydrogen 2.851 N/A ARG 359.A NH1 ASP 181.A OD1 no hydrogen 3.513 N/A ARG 359.A NH1 ASP 181.A OD2 no hydrogen 2.715 N/A ARG 359.A NH2 ASP 181.A OD1 no hydrogen 2.824 N/A ARG 359.A NH2 ASP 181.A OD2 no hydrogen 3.506 N/A ARG 359.A NH2 ALA 364.A O no hydrogen 2.786 N/A THR 360.A N ASP 367.A OD1 no hydrogen 2.751 N/A THR 360.A OG1 ASP 367.A OD1 no hydrogen 3.298 N/A THR 360.A OG1 ASP 367.A OD2 no hydrogen 2.550 N/A ALA 361.A N GLN 363.A OE1 no hydrogen 2.814 N/A GLN 363.A N GLN 363.A OE1 no hydrogen 2.777 N/A GLN 363.A NE2 THR 360.A OG1 no hydrogen 3.123 N/A LEU 368.A N VAL 358.A O no hydrogen 3.055 N/A GLN 369.A N ILE 408.A O no hydrogen 2.844 N/A GLN 369.A NE2 GLN 540.A OE1 no hydrogen 3.035 N/A VAL 370.A N ALA 356.A O no hydrogen 2.804 N/A LYS 371.A N GLN 406.A O no hydrogen 2.878 N/A PHE 372.A N ARG 354.A O no hydrogen 3.085 N/A VAL 373.A N THR 404.A O no hydrogen 2.875 N/A ALA 377.A N THR 404.A OG1 no hydrogen 2.839 N/A LEU 378.A N THR 385.A OG1 no hydrogen 2.955 N/A SER 384.A N ASP 381.A OD1 no hydrogen 3.002 N/A THR 385.A N ASP 381.A O no hydrogen 3.068 N/A THR 385.A OG1 ASP 379.A OD2 no hydrogen 2.780 N/A TYR 386.A N GLY 382.A O no hydrogen 2.987 N/A TYR 386.A OH THR 350.A O no hydrogen 2.550 N/A VAL 387.A N VAL 383.A O no hydrogen 3.079 N/A ARG 388.A N SER 384.A O no hydrogen 2.870 N/A ARG 388.A NE ASP 379.A OD2 no hydrogen 2.770 N/A ARG 388.A NH2 ASP 379.A OD1 no hydrogen 2.834 N/A PHE 389.A N THR 385.A O no hydrogen 2.829 N/A ALA 390.A N TYR 386.A O no hydrogen 3.011 N/A LYS 391.A N VAL 387.A O no hydrogen 3.071 N/A PHE 392.A N PHE 389.A O no hydrogen 3.231 N/A SER 394.A N GLY 329.A O no hydrogen 2.787 N/A GLN 395.A N PHE 392.A O no hydrogen 3.200 N/A GLN 395.A NE2.B GLN 393.A O no hydrogen 2.981 N/A GLY 396.A N LYS 328.A O no hydrogen 2.950 N/A LYS 398.A NZ ASP 316.A OD1 no hydrogen 2.818 N/A LYS 398.A NZ ASP 322.A OD1 no hydrogen 2.961 N/A LYS 398.A NZ TRP 399.A O no hydrogen 3.235 N/A TRP 399.A NE1 MET 376.A O no hydrogen 2.838 N/A SER 401.A OG ASP 316.A OD1 no hydrogen 3.322 N/A SER 401.A OG ASP 322.A OD1 no hydrogen 3.324 N/A SER 401.A OG ASP 322.A OD2 no hydrogen 2.638 N/A ILE 403.A N ALA 309.A O no hydrogen 2.826 N/A THR 404.A N VAL 373.A O no hydrogen 2.919 N/A THR 404.A OG1 GLY 375.A O no hydrogen 2.622 N/A MET 405.A N THR 307.A O no hydrogen 2.892 N/A GLN 406.A N LYS 371.A O no hydrogen 2.873 N/A GLN 406.A NE2 HIS 492.A NE2 no hydrogen 2.984 N/A LEU 407.A N CYS 305.A O no hydrogen 2.765 N/A ILE 408.A N GLN 369.A O no hydrogen 2.863 N/A ALA 409.A N PRO 303.A O no hydrogen 3.007 N/A CYS 410.A N ASP 367.A O no hydrogen 3.072 N/A CYS 410.A SG PRO 366.A O no hydrogen 3.413 N/A ARG 411.A NE ASP 105.A OD1 no hydrogen 2.786 N/A ARG 411.A NH1 PRO 366.A O no hydrogen 2.694 N/A ARG 411.A NH2 ASP 105.A OD2 no hydrogen 2.866 N/A GLN 413.A N ASP 443.A OD1 no hydrogen 2.828 N/A GLN 413.A N ASP 443.A OD2 no hydrogen 3.224 N/A GLN 413.A NE2.B ARG 411.A O no hydrogen 2.957 N/A SER 414.A N ASP 443.A OD2 no hydrogen 2.806 N/A SER 414.A OG ASP 438.A OD1 no hydrogen 3.275 N/A SER 414.A OG ASP 443.A OD2 no hydrogen 2.692 N/A GLY 416.A N LEU 299.A O no hydrogen 2.747 N/A SER 417.A N SER 432.A O no hydrogen 2.862 N/A VAL 418.A N GLY 296.A O no hydrogen 2.812 N/A GLY 419.A N LYS 430.A O no hydrogen 2.777 N/A LYS 421.A NZ GLU 69.A OE2 no hydrogen 2.987 N/A ASP 424.A N SER 422.A OG no hydrogen 3.037 N/A PHE 426.A N ASP 424.A OD1 no hydrogen 2.865 N/A ALA 427.A N ASP 424.A O no hydrogen 3.126 N/A LYS 430.A N GLY 419.A O no hydrogen 2.909 N/A SER 432.A N SER 417.A O no hydrogen 2.898 N/A SER 432.A OG GLN 71.A OE1 no hydrogen 2.975 N/A TYR 435.A OH ASP 301.A OD2 no hydrogen 2.491 N/A THR 437.A N GLY 434.A O no hydrogen 3.303 N/A THR 437.A OG1 GLY 434.A O no hydrogen 2.583 N/A ASP 438.A N SER 414.A OG no hydrogen 2.979 N/A LYS 439.A NZ ASP 440.A OD2 no hydrogen 3.529 N/A GLY 441.A N ASP 438.A O no hydrogen 3.072 N/A ALA 442.A N ASP 438.A OD2 no hydrogen 2.827 N/A ASP 443.A N ASP 438.A OD1 no hydrogen 3.105 N/A ALA 445.A N GLY 441.A O no hydrogen 3.072 N/A THR 446.A N ALA 442.A O no hydrogen 2.790 N/A THR 446.A OG1 ASP 367.A OD2 no hydrogen 2.762 N/A THR 446.A OG1 ALA 442.A O no hydrogen 3.061 N/A LEU 447.A N ASP 443.A O no hydrogen 3.077 N/A ARG 448.A N LEU 444.A O no hydrogen 2.898 N/A ARG 448.A NE ASP 484.A OD1 no hydrogen 2.821 N/A ARG 448.A NH2 ASP 484.A OD1 no hydrogen 3.228 N/A ARG 448.A NH2 ASP 484.A OD2 no hydrogen 3.112 N/A LYS 449.A N ALA 445.A O no hydrogen 2.879 N/A GLY 450.A N THR 446.A O no hydrogen 2.762 N/A ILE 451.A N LEU 447.A O no hydrogen 2.936 N/A HIS 452.A N ARG 448.A O no hydrogen 3.110 N/A TRP 453.A N LYS 449.A O no hydrogen 2.866 N/A ALA 454.A N GLY 450.A O no hydrogen 2.856 N/A ARG 455.A N ILE 451.A O no hydrogen 2.850 N/A ARG 455.A NE GLU 470.A OE2 no hydrogen 2.888 N/A ARG 455.A NH1 VAL 477.A O no hydrogen 2.795 N/A ARG 455.A NH2 GLU 470.A OE1 no hydrogen 2.770 N/A ARG 455.A NH2 VAL 477.A O no hydrogen 2.814 N/A ASP 456.A N HIS 452.A O no hydrogen 2.921 N/A VAL 457.A N TRP 453.A O no hydrogen 2.897 N/A ALA 458.A N ALA 454.A O no hydrogen 2.963 N/A ARG 459.A N ARG 455.A O no hydrogen 2.912 N/A ARG 459.A NH1 ASP 456.A OD1 no hydrogen 3.228 N/A ARG 459.A NH2 ASP 456.A OD1 no hydrogen 2.510 N/A SER 460.A N VAL 457.A O no hydrogen 3.160 N/A SER 460.A OG GLU 166.A OE1 no hydrogen 3.187 N/A SER 460.A OG VAL 457.A O no hydrogen 2.728 N/A SER 461.A OG.A GLU 166.A OE1 no hydrogen 3.450 N/A SER 461.A OG.A GLU 166.A OE2 no hydrogen 2.550 N/A ALA 462.A N GLU 166.A OE1 no hydrogen 2.920 N/A SER 464.A N SER 460.A O no hydrogen 2.808 N/A SER 464.A OG ALA 458.A O no hydrogen 3.146 N/A SER 464.A OG ARG 459.A O no hydrogen 2.474 N/A SER 464.A OG SER 460.A O no hydrogen 2.904 N/A GLU 465.A N SER 461.A O no hydrogen 3.160 N/A TYR 466.A N LEU 463.A O no hydrogen 2.898 N/A LEU 467.A N SER 464.A O no hydrogen 3.145 N/A ASP 468.A N PRO 310.A O no hydrogen 2.966 N/A LEU 471.A N ALA 308.A O no hydrogen 2.779 N/A PHE 472.A N ALA 308.A O no hydrogen 3.111 N/A GLY 474.A N GLU 470.A OE1 no hydrogen 2.619 N/A VAL 477.A N GLY 474.A O no hydrogen 3.050 N/A VAL 478.A N GLN 482.A OE1 no hydrogen 2.909 N/A SER 479.A N GLN 482.A OE1 no hydrogen 3.001 N/A GLN 482.A N SER 479.A OG no hydrogen 3.020 N/A ILE 483.A N SER 479.A O no hydrogen 2.966 N/A ASP 484.A N ASP 480.A O no hydrogen 2.934 N/A GLU 485.A N ASP 481.A O no hydrogen 3.147 N/A TYR 486.A N GLN 482.A O no hydrogen 3.022 N/A TYR 486.A OH LEU 306.A O no hydrogen 2.630 N/A ILE 487.A N ILE 483.A O no hydrogen 2.909 N/A ARG 488.A N ASP 484.A O no hydrogen 2.965 N/A ARG 488.A NE.A GLN 73.A O no hydrogen 3.154 N/A ARG 488.A NH1.B GLU 485.A OE2 no hydrogen 2.784 N/A ARG 489.A N GLU 485.A O no hydrogen 3.032 N/A ARG 489.A NE GLU 485.A OE1 no hydrogen 2.873 N/A SER 490.A N ILE 487.A O no hydrogen 3.127 N/A SER 490.A OG TYR 486.A O no hydrogen 2.706 N/A ILE 491.A N ILE 487.A O no hydrogen 2.817 N/A HIS 492.A N ALA 304.A O no hydrogen 2.846 N/A HIS 492.A ND1 SER 490.A O no hydrogen 2.816 N/A SER 493.A OG ASP 301.A OD1 no hydrogen 3.515 N/A SER 493.A OG ASP 301.A OD2 no hydrogen 2.592 N/A SER 493.A OG ASN 495.A OD1 no hydrogen 3.495 N/A SER 494.A N GLN 302.A O no hydrogen 2.975 N/A SER 494.A OG GLN 302.A O no hydrogen 2.875 N/A SER 494.A OG GLN 302.A OE1 no hydrogen 3.531 N/A ASN 495.A N SER 493.A OG no hydrogen 2.776 N/A ALA 496.A N ASP 301.A OD1 no hydrogen 2.928 N/A THR 498.A N GLN 300.A O no hydrogen 2.857 N/A GLY 499.A N ALA 530.A O no hydrogen 3.165 N/A THR 500.A OG1 ALA 263.A O no hydrogen 2.640 N/A CYS 501.A N SER 531.A O.A no hydrogen 2.844 N/A CYS 501.A N SER 531.A O.B no hydrogen 2.811 N/A LYS 502.A NZ SER 510.A OG no hydrogen 3.013 N/A MET 503.A N VAL 532.A O no hydrogen 2.940 N/A GLY 504.A N VAL 513.A O no hydrogen 3.076 N/A ASP 508.A N ASN 505.A O no hydrogen 2.849 N/A SER 510.A N ASP 508.A OD1 no hydrogen 2.947 N/A SER 510.A OG ASP 508.A OD1 no hydrogen 2.635 N/A SER 511.A N ASP 508.A O no hydrogen 3.201 N/A SER 511.A OG.A ASP 508.A O no hydrogen 3.210 N/A SER 511.A OG.A HIS 520.A NE2 no hydrogen 2.653 N/A SER 511.A OG.B ASN 505.A O no hydrogen 3.423 N/A SER 511.A OG.B ASP 508.A O no hydrogen 2.600 N/A VAL 512.A N LYS 502.A O no hydrogen 2.758 N/A VAL 513.A N LYS 502.A O no hydrogen 3.260 N/A ASP 514.A N ARG 518.A O no hydrogen 3.004 N/A ASN 515.A ND2 GLU 112.A O no hydrogen 2.943 N/A GLN 516.A N ASP 514.A OD1 no hydrogen 2.817 N/A GLN 516.A NE2 ASN 515.A OD1 no hydrogen 2.840 N/A GLN 516.A NE2 ILE 562.A O no hydrogen 2.968 N/A LEU 517.A N ASP 514.A O no hydrogen 2.879 N/A ARG 518.A N ASP 514.A OD1 no hydrogen 3.002 N/A ARG 518.A NE ASP 514.A OD2 no hydrogen 2.962 N/A ARG 518.A NH2 ASP 514.A OD2 no hydrogen 2.963 N/A VAL 519.A N LEU 525.A O no hydrogen 2.977 N/A HIS 520.A N VAL 512.A O no hydrogen 3.060 N/A HIS 520.A NE2 SER 511.A OG.A no hydrogen 2.653 N/A VAL 522.A N VAL 519.A O no hydrogen 3.474 N/A GLU 523.A N ALA 230.A O no hydrogen 2.794 N/A ARG 526.A N VAL 257.A O no hydrogen 2.948 N/A ARG 526.A NE GLU 256.A OE1 no hydrogen 2.846 N/A ARG 526.A NH1 GLN 516.A O no hydrogen 2.911 N/A ARG 526.A NH2 GLU 256.A OE1 no hydrogen 3.512 N/A ARG 526.A NH2 GLU 256.A OE2 no hydrogen 2.993 N/A VAL 527.A N LEU 517.A O no hydrogen 3.004 N/A VAL 528.A N MET 259.A O no hydrogen 2.933 N/A SER 531.A N.A ASP 529.A OD1 no hydrogen 2.845 N/A SER 531.A N.B ASP 529.A OD1 no hydrogen 2.853 N/A SER 531.A OG.A ASP 529.A OD1 no hydrogen 2.638 N/A SER 531.A OG.B ASP 529.A OD1 no hydrogen 2.571 N/A VAL 532.A N ASP 529.A O no hydrogen 3.226 N/A VAL 533.A N ALA 530.A O no hydrogen 3.268 N/A ILE 536.A N GLN 300.A OE1 no hydrogen 2.788 N/A GLY 538.A N ASP 105.A OD2 no hydrogen 3.082 N/A GLN 540.A NE2 GLN 369.A OE1 no hydrogen 2.987 N/A VAL 545.A N THR 541.A O no hydrogen 3.186 N/A VAL 546.A N GLY 542.A O no hydrogen 3.070 N/A MET 547.A N ALA 543.A O no hydrogen 2.988 N/A ILE 548.A N PRO 544.A O no hydrogen 2.966 N/A ALA 549.A N VAL 545.A O no hydrogen 2.918 N/A GLU 550.A N VAL 546.A O no hydrogen 2.824 N/A ARG 551.A N MET 547.A O no hydrogen 2.955 N/A ARG 551.A NH1 GLY 113.A O no hydrogen 2.624 N/A ARG 551.A NH2 GLY 113.A O no hydrogen 2.737 N/A ALA 552.A N ILE 548.A O no hydrogen 2.795 N/A ALA 553.A N ALA 549.A O no hydrogen 2.897 N/A ALA 554.A N GLU 550.A O no hydrogen 3.138 N/A LEU 555.A N ARG 551.A O no hydrogen 2.904 N/A LEU 556.A N ALA 552.A O no hydrogen 2.865 N/A THR 557.A N ALA 553.A O no hydrogen 2.945 N/A THR 557.A OG1 ALA 553.A O no hydrogen 2.930 N/A THR 557.A OG1 ALA 554.A O no hydrogen 3.278 N/A GLY 558.A N LEU 555.A O no hydrogen 3.111 N/A LYS 559.A N ALA 554.A O no hydrogen 2.869 N/A ALA 560.A N ALA 554.A O no hydrogen 3.206 N/A SER 565.A OG GLU 112.A OE2 no hydrogen 2.303 N/A