Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3kr4_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): SER 2.A N ASN 227.A OD1 no hydrogen 2.996 N/A GLN 6.A NE2 ASP 11.A O no hydrogen 2.936 N/A VAL 7.A N ASP 11.A OD2 no hydrogen 2.850 N/A VAL 8.A N ASP 11.A OD2 no hydrogen 3.120 N/A ASP 11.A N VAL 8.A O no hydrogen 3.037 N/A GLU 18.A N GLN 211.A OE1 no hydrogen 2.764 N/A TYR 19.A OH GLU 231.A OE2 no hydrogen 2.436 N/A THR 21.A N HIS 24.A ND1 no hydrogen 3.322 N/A THR 21.A OG1 HIS 24.A ND1 no hydrogen 2.959 N/A THR 21.A OG1 TYR 203.A OH no hydrogen 2.715 N/A HIS 24.A N THR 21.A O no hydrogen 2.932 N/A HIS 24.A ND1 THR 21.A OG1 no hydrogen 2.959 N/A ASP 25.A N PRO 22.A O no hydrogen 3.152 N/A ILE 26.A N ILE 23.A O no hydrogen 3.141 N/A LYS 27.A N LYS 180.A O no hydrogen 2.825 N/A GLN 29.A N LEU 182.A O no hydrogen 2.864 N/A TYR 31.A N VAL 184.A O no hydrogen 2.747 N/A ILE 33.A N ILE 186.A O no hydrogen 3.040 N/A LYS 34.A N ASP 32.A OD1 no hydrogen 2.946 N/A GLY 35.A N ASP 32.A O no hydrogen 3.187 N/A GLY 36.A N ILE 33.A O no hydrogen 2.944 N/A CYS 37.A N LYS 63.A O no hydrogen 2.798 N/A CYS 37.A SG LYS 63.A O no hydrogen 3.546 N/A ASN 38.A N TYR 185.A OH no hydrogen 3.134 N/A GLU 41.A N GLU 41.A OE1 no hydrogen 2.830 N/A LEU 43.A N LYS 137.A O no hydrogen 3.022 N/A THR 44.A N ALA 102.A O no hydrogen 3.075 N/A ILE 45.A N THR 139.A O no hydrogen 2.819 N/A PHE 46.A N GLY 104.A O no hydrogen 2.954 N/A LEU 47.A N VAL 141.A O no hydrogen 2.825 N/A VAL 48.A N VAL 106.A O no hydrogen 3.217 N/A ASN 50.A N GLY 109.A O no hydrogen 2.938 N/A ASN 50.A ND2 PRO 57.A O no hydrogen 3.085 N/A GLY 52.A N SER 110.A O no hydrogen 3.242 N/A GLY 56.A N LYS 53.A O no hydrogen 2.861 N/A VAL 58.A N PHE 81.A O no hydrogen 2.910 N/A SER 61.A N GLU 143.A OE1 no hydrogen 2.806 N/A SER 61.A OG GLU 143.A OE1 no hydrogen 3.141 N/A SER 62.A N GLU 143.A OE2 no hydrogen 2.868 N/A SER 62.A OG GLU 143.A OE2 no hydrogen 2.491 N/A ASN 65.A N CYS 37.A O no hydrogen 2.691 N/A ASN 65.A ND2 GLY 35.A O no hydrogen 3.087 N/A ASN 65.A ND2 ASN 38.A OD1 no hydrogen 3.277 N/A ASP 66.A N VAL 64.A O no hydrogen 2.789 N/A LYS 67.A N ASP 96.A OD2 no hydrogen 2.889 N/A GLN 68.A N ASP 96.A OD1 no hydrogen 3.027 N/A VAL 69.A N ASP 66.A OD2 no hydrogen 2.898 N/A SER 70.A N ASP 66.A O no hydrogen 2.906 N/A SER 70.A OG ASP 66.A O no hydrogen 2.682 N/A GLU 71.A N LYS 67.A O no hydrogen 2.880 N/A PHE 72.A N GLN 68.A O no hydrogen 2.951 N/A LEU 73.A N VAL 69.A O no hydrogen 2.917 N/A LYS 74.A N GLU 71.A O no hydrogen 3.134 N/A LYS 74.A NZ GLU 71.A OE2 no hydrogen 2.732 N/A ASN 77.A ND2 PHE 72.A O no hydrogen 3.035 N/A MET 78.A N LYS 74.A O no hydrogen 3.016 N/A GLU 79.A N ASP 75.A O no hydrogen 2.918 N/A PHE 81.A N MET 78.A O no hydrogen 2.916 N/A VAL 83.A N GLY 56.A O no hydrogen 2.892 N/A LYS 84.A N ASN 82.A OD1 no hydrogen 2.848 N/A GLY 86.A N GLY 107.A O no hydrogen 2.956 N/A THR 87.A N LYS 84.A O no hydrogen 2.892 N/A LYS 89.A N TYR 105.A O no hydrogen 3.239 N/A PHE 91.A N VAL 103.A O no hydrogen 2.626 N/A MET 93.A N VAL 101.A O no hydrogen 3.198 N/A ASN 95.A N ASN 99.A O no hydrogen 3.101 N/A ASN 95.A ND2 VAL 39.A O no hydrogen 3.415 N/A ASP 96.A N ASP 66.A OD1 no hydrogen 2.690 N/A ASP 96.A N ASP 66.A OD2 no hydrogen 3.332 N/A ASN 97.A N ASN 95.A OD1 no hydrogen 2.902 N/A LYS 98.A N ASN 95.A O no hydrogen 2.956 N/A ASN 99.A N ASN 95.A OD1 no hydrogen 3.015 N/A VAL 101.A N MET 93.A O no hydrogen 2.723 N/A VAL 103.A N PHE 91.A O no hydrogen 2.951 N/A GLY 104.A N THR 44.A O no hydrogen 2.910 N/A TYR 105.A N LYS 89.A O no hydrogen 3.228 N/A TYR 105.A OH ASN 82.A O no hydrogen 2.980 N/A VAL 106.A N PHE 46.A O no hydrogen 2.967 N/A GLY 107.A N THR 87.A O no hydrogen 2.733 N/A CYS 108.A N VAL 48.A O no hydrogen 2.748 N/A CYS 108.A SG VAL 106.A O no hydrogen 3.760 N/A GLY 109.A N VAL 83.A O no hydrogen 2.869 N/A SER 115.A N ASP 118.A OD2 no hydrogen 3.035 N/A ASP 118.A N SER 115.A OG no hydrogen 3.143 N/A MET 119.A N SER 115.A O no hydrogen 2.883 N/A LYS 120.A N GLU 116.A O no hydrogen 3.032 N/A LYS 120.A NZ GLU 161.A OE2 no hydrogen 3.489 N/A ARG 121.A N ALA 117.A O no hydrogen 3.147 N/A VAL 122.A N ASP 118.A O no hydrogen 3.021 N/A VAL 123.A N MET 119.A O no hydrogen 2.885 N/A LEU 124.A N LYS 120.A O no hydrogen 2.793 N/A SER 125.A N ARG 121.A O no hydrogen 3.041 N/A SER 125.A OG GLY 86.A O no hydrogen 2.515 N/A SER 125.A OG ARG 121.A O no hydrogen 3.530 N/A LEU 126.A N VAL 122.A O no hydrogen 2.956 N/A VAL 127.A N VAL 123.A O no hydrogen 2.820 N/A THR 128.A N LEU 124.A O no hydrogen 3.074 N/A THR 128.A OG1 SER 125.A O no hydrogen 2.635 N/A MET 129.A N SER 125.A O no hydrogen 3.310 N/A LEU 130.A N LEU 126.A O no hydrogen 3.134 N/A LEU 130.A N VAL 127.A O no hydrogen 2.864 N/A HIS 131.A N VAL 127.A O no hydrogen 2.929 N/A LYS 134.A NZ GLU 177.A OE2 no hydrogen 3.547 N/A LYS 137.A NZ GLU 41.A OE2 no hydrogen 3.411 N/A LEU 138.A N HIS 181.A O no hydrogen 3.052 N/A THR 139.A N LEU 43.A O no hydrogen 2.733 N/A VAL 140.A N GLY 183.A O no hydrogen 2.883 N/A VAL 141.A N ILE 45.A O no hydrogen 2.841 N/A PHE 142.A N TYR 185.A O no hydrogen 2.944 N/A GLU 143.A N LEU 47.A O no hydrogen 2.978 N/A LEU 150.A N ASP 147.A OD1 no hydrogen 2.753 N/A PHE 151.A N ASP 147.A O no hydrogen 2.837 N/A ARG 152.A N LYS 148.A O no hydrogen 2.914 N/A ARG 152.A NE GLU 156.A OE2 no hydrogen 2.719 N/A ARG 152.A NH1 ASN 149.A OD1 no hydrogen 2.873 N/A ARG 152.A NH1 GLU 195.A OE1 no hydrogen 3.087 N/A ARG 152.A NH2 THR 434.A O no hydrogen 2.832 N/A PHE 153.A N ASN 149.A O no hydrogen 2.921 N/A PHE 154.A N LEU 150.A O no hydrogen 2.921 N/A LEU 155.A N PHE 151.A O no hydrogen 3.240 N/A GLU 156.A N ARG 152.A O no hydrogen 2.929 N/A THR 157.A N PHE 153.A O no hydrogen 2.938 N/A THR 157.A OG1 PHE 153.A O no hydrogen 2.682 N/A LEU 158.A N PHE 154.A O no hydrogen 2.884 N/A PHE 159.A N LEU 155.A O no hydrogen 2.839 N/A TYR 160.A N GLU 156.A O no hydrogen 2.858 N/A TYR 160.A OH PRO 503.A O no hydrogen 2.661 N/A GLU 161.A N THR 157.A O no hydrogen 2.854 N/A TYR 162.A N LEU 158.A O no hydrogen 2.974 N/A MET 163.A N PHE 159.A O no hydrogen 3.143 N/A THR 164.A N TYR 178.A OH no hydrogen 3.007 N/A ARG 167.A N ASP 165.A OD1 no hydrogen 3.150 N/A ARG 167.A NE ASP 165.A OD1 no hydrogen 2.862 N/A ARG 167.A NE ASP 165.A OD2 no hydrogen 3.166 N/A ARG 167.A NH1 PRO 16.A O no hydrogen 2.803 N/A ARG 167.A NH1 GLN 211.A O no hydrogen 3.112 N/A ARG 167.A NH2 ASP 165.A OD2 no hydrogen 2.673 N/A ARG 167.A NH2 GLN 211.A O no hydrogen 2.837 N/A LYS 169.A N GLU 166.A O no hydrogen 3.112 N/A LYS 169.A NZ ASP 172.A OD2 no hydrogen 2.933 N/A LYS 173.A NZ LYS 169.A O no hydrogen 3.072 N/A ASN 174.A N GLU 166.A OE2 no hydrogen 2.976 N/A ILE 179.A N TYR 162.A OH no hydrogen 3.018 N/A LYS 180.A N SER 136.A O no hydrogen 2.781 N/A HIS 181.A N SER 136.A O no hydrogen 3.247 N/A LEU 182.A N LYS 27.A O no hydrogen 2.812 N/A GLY 183.A N LEU 138.A O no hydrogen 2.955 N/A VAL 184.A N GLN 29.A O no hydrogen 2.779 N/A TYR 185.A N VAL 140.A O no hydrogen 2.866 N/A ILE 186.A N TYR 31.A O no hydrogen 3.072 N/A ALA 189.A N ASP 32.A OD2 no hydrogen 3.091 N/A THR 191.A N ASN 188.A O no hydrogen 3.171 N/A THR 191.A OG1 ASN 188.A O no hydrogen 2.785 N/A TYR 192.A N ALA 189.A O no hydrogen 2.850 N/A TYR 192.A OH VAL 146.A O no hydrogen 2.631 N/A LYS 193.A N ALA 189.A O no hydrogen 3.155 N/A GLU 195.A N TYR 192.A O no hydrogen 2.852 N/A VAL 196.A N LYS 193.A O no hydrogen 3.104 N/A LYS 198.A NZ GLU 513.A OE2 no hydrogen 2.725 N/A ALA 199.A N GLU 195.A O no hydrogen 2.800 N/A ARG 200.A N VAL 196.A O no hydrogen 3.030 N/A ARG 200.A NE GLU 197.A OE1 no hydrogen 3.097 N/A ARG 200.A NH1 ILE 23.A O no hydrogen 3.080 N/A ARG 200.A NH1 ILE 26.A O no hydrogen 2.791 N/A ARG 200.A NH2 ILE 26.A O no hydrogen 3.319 N/A ARG 200.A NH2 GLU 197.A OE2 no hydrogen 2.992 N/A VAL 201.A N GLU 197.A O no hydrogen 2.973 N/A TYR 202.A N LYS 198.A O no hydrogen 2.986 N/A TYR 202.A OH GLU 513.A OE2 no hydrogen 2.464 N/A TYR 203.A N ALA 199.A O no hydrogen 2.813 N/A TYR 203.A OH THR 21.A OG1 no hydrogen 2.715 N/A PHE 204.A N ARG 200.A O no hydrogen 3.190 N/A GLY 205.A N VAL 201.A O no hydrogen 2.940 N/A THR 206.A N TYR 202.A O no hydrogen 3.027 N/A THR 206.A OG1 TYR 202.A O no hydrogen 2.594 N/A TYR 207.A N TYR 203.A O no hydrogen 2.741 N/A TYR 208.A N PHE 204.A O no hydrogen 2.748 N/A ALA 209.A N GLY 205.A O no hydrogen 3.057 N/A SER 210.A N THR 206.A O no hydrogen 2.877 N/A SER 210.A OG TYR 160.A OH no hydrogen 3.076 N/A GLN 211.A N TYR 207.A O no hydrogen 2.869 N/A GLN 211.A NE2 GLU 18.A O no hydrogen 2.917 N/A LEU 212.A N TYR 208.A O no hydrogen 3.130 N/A ILE 213.A N ALA 209.A O no hydrogen 2.804 N/A ALA 214.A N SER 210.A O no hydrogen 2.809 N/A ALA 215.A N GLN 211.A O no hydrogen 3.100 N/A SER 217.A OG THR 292.A O no hydrogen 2.511 N/A TYR 219.A N PRO 216.A O no hydrogen 2.830 N/A CYS 220.A N PRO 216.A O no hydrogen 2.797 N/A CYS 220.A SG LEU 212.A O no hydrogen 3.908 N/A ASN 221.A N SER 224.A OG no hydrogen 3.095 N/A SER 224.A N ASN 221.A OD1 no hydrogen 2.810 N/A SER 224.A OG TYR 219.A O no hydrogen 2.550 N/A SER 224.A OG ASN 221.A O no hydrogen 3.451 N/A LEU 225.A N ASN 221.A O no hydrogen 2.896 N/A SER 226.A N PRO 222.A O no hydrogen 3.189 N/A SER 226.A OG PRO 222.A O no hydrogen 2.911 N/A SER 226.A OG VAL 223.A O no hydrogen 3.031 N/A ASN 227.A N VAL 223.A O no hydrogen 2.947 N/A ASN 227.A ND2 SER 2.A O no hydrogen 2.902 N/A ALA 228.A N SER 224.A O no hydrogen 2.986 N/A ALA 229.A N LEU 225.A O no hydrogen 3.024 N/A VAL 230.A N SER 226.A O no hydrogen 2.879 N/A GLU 231.A N ASN 227.A O no hydrogen 2.981 N/A LEU 232.A N ALA 228.A O no hydrogen 2.902 N/A ALA 233.A N ALA 229.A O no hydrogen 2.979 N/A GLN 234.A N VAL 230.A O no hydrogen 3.001 N/A GLN 234.A NE2 TYR 240.A OH no hydrogen 3.471 N/A LYS 235.A N GLU 231.A O no hydrogen 3.044 N/A LEU 236.A N LEU 232.A O no hydrogen 2.948 N/A LEU 238.A N ALA 233.A O no hydrogen 2.950 N/A GLU 239.A N THR 273.A O no hydrogen 2.978 N/A LYS 241.A N HIS 271.A O no hydrogen 2.819 N/A LYS 241.A NZ HIS 271.A ND1 no hydrogen 3.208 N/A LEU 243.A N PHE 269.A O no hydrogen 2.954 N/A LEU 248.A N GLY 244.A O no hydrogen 2.959 N/A GLU 249.A N VAL 245.A O no hydrogen 2.748 N/A GLU 250.A N LYS 246.A O no hydrogen 3.081 N/A LEU 251.A N GLU 247.A O no hydrogen 2.968 N/A LYS 252.A N GLU 249.A O no hydrogen 2.836 N/A MET 253.A N LEU 248.A O no hydrogen 3.164 N/A GLY 254.A N LYS 252.A O no hydrogen 2.862 N/A TYR 256.A N ASP 383.A OD2 no hydrogen 2.902 N/A TYR 256.A OH VAL 344.A O no hydrogen 2.604 N/A LEU 257.A N MET 253.A O no hydrogen 2.922 N/A SER 258.A N GLY 254.A O no hydrogen 3.027 N/A SER 258.A OG GLY 254.A O no hydrogen 2.711 N/A VAL 259.A N ALA 255.A O no hydrogen 3.425 N/A LYS 261.A N SER 258.A O no hydrogen 3.271 N/A SER 263.A N GLY 260.A O no hydrogen 2.984 N/A SER 263.A OG TYR 265.A O no hydrogen 3.403 N/A SER 263.A OG GLU 346.A OE1 no hydrogen 2.750 N/A TYR 265.A N SER 263.A OG no hydrogen 2.931 N/A ASN 267.A ND2 TYR 256.A O no hydrogen 3.144 N/A LYS 268.A N VAL 344.A O no hydrogen 3.362 N/A PHE 269.A N LEU 243.A O no hydrogen 2.851 N/A ILE 270.A N SER 342.A O no hydrogen 2.800 N/A HIS 271.A N LYS 241.A O no hydrogen 2.905 N/A HIS 271.A ND1 TYR 387.A OH no hydrogen 2.646 N/A HIS 271.A NE2 HIS 339.A ND1 no hydrogen 2.873 N/A LEU 272.A N PHE 340.A O no hydrogen 2.765 N/A THR 273.A N GLU 239.A O no hydrogen 2.976 N/A THR 273.A OG1 HIS 339.A ND1 no hydrogen 3.262 N/A TYR 274.A N ILE 338.A O no hydrogen 2.908 N/A TYR 274.A OH PRO 333.A O no hydrogen 2.671 N/A SER 276.A N VAL 336.A O no hydrogen 2.937 N/A SER 276.A OG PRO 333.A O no hydrogen 2.611 N/A SER 276.A OG VAL 336.A O no hydrogen 2.783 N/A LYS 281.A N ASN 335.A O no hydrogen 2.763 N/A LYS 282.A NZ ASP 518.A OD1 no hydrogen 2.828 N/A LYS 283.A N ASP 394.A OD2 no hydrogen 2.839 N/A ILE 284.A N GLU 337.A O no hydrogen 2.960 N/A ALA 285.A N TYR 395.A O no hydrogen 2.929 N/A LEU 286.A N HIS 339.A O no hydrogen 2.806 N/A VAL 287.A N VAL 397.A O no hydrogen 2.901 N/A GLY 288.A N LEU 341.A O no hydrogen 3.006 N/A LYS 289.A N ILE 399.A O no hydrogen 3.061 N/A LYS 289.A NZ ASP 314.A OD1 no hydrogen 3.259 N/A LYS 289.A NZ ASP 314.A OD2 no hydrogen 3.242 N/A LYS 289.A NZ GLU 376.A OE2 no hydrogen 3.227 N/A LYS 289.A NZ THR 401.A O no hydrogen 3.093 N/A ILE 291.A N ASP 314.A O no hydrogen 3.146 N/A THR 292.A N CYS 345.A O no hydrogen 2.938 N/A THR 292.A OG1 CYS 345.A O no hydrogen 3.564 N/A SER 295.A N ASN 347.A O no hydrogen 3.004 N/A SER 295.A OG ASN 347.A O no hydrogen 2.727 N/A GLY 296.A N ASP 294.A OD1 no hydrogen 2.990 N/A GLY 297.A N SER 295.A OG no hydrogen 2.985 N/A TYR 298.A OH SER 350.A O no hydrogen 2.929 N/A ASN 299.A N THR 373.A OG1 no hydrogen 2.907 N/A LYS 301.A N SER 295.A O no hydrogen 2.911 N/A LYS 301.A NZ ASP 374.A OD1 no hydrogen 2.852 N/A LYS 301.A NZ ASP 374.A OD2 no hydrogen 2.758 N/A SER 306.A N ALA 303.A O no hydrogen 2.881 N/A SER 306.A OG ALA 303.A O no hydrogen 2.577 N/A LEU 310.A N MET 307.A O no hydrogen 2.961 N/A MET 311.A N ILE 308.A O no hydrogen 3.130 N/A LYS 312.A NZ ALA 214.A O no hydrogen 2.950 N/A PHE 313.A N LEU 310.A O no hydrogen 2.945 N/A ASP 314.A N MET 311.A O no hydrogen 3.221 N/A SER 316.A N PHE 313.A O no hydrogen 3.051 N/A SER 316.A OG PHE 313.A O no hydrogen 2.573 N/A SER 316.A OG SER 495.A OG no hydrogen 2.698 N/A CYS 318.A N LYS 289.A O no hydrogen 3.001 N/A ALA 319.A N MET 315.A O no hydrogen 2.886 N/A ALA 320.A N SER 316.A O no hydrogen 2.951 N/A VAL 321.A N GLY 317.A O no hydrogen 3.039 N/A LEU 322.A N CYS 318.A O no hydrogen 2.948 N/A GLY 323.A N ALA 319.A O no hydrogen 2.754 N/A CYS 324.A N ALA 320.A O no hydrogen 2.843 N/A CYS 324.A SG THR 512.A OG1 no hydrogen 3.557 N/A ALA 325.A N VAL 321.A O no hydrogen 2.841 N/A TYR 326.A N LEU 322.A O no hydrogen 3.031 N/A CYS 327.A N GLY 323.A O no hydrogen 3.093 N/A CYS 327.A SG VAL 201.A O no hydrogen 3.690 N/A CYS 327.A SG GLY 323.A O no hydrogen 3.551 N/A VAL 328.A N CYS 324.A O no hydrogen 2.841 N/A GLY 329.A N ALA 325.A O no hydrogen 2.789 N/A THR 330.A N TYR 326.A O no hydrogen 3.042 N/A THR 330.A N CYS 327.A O no hydrogen 3.267 N/A THR 330.A OG1 TYR 326.A O no hydrogen 2.808 N/A LEU 331.A N CYS 327.A O no hydrogen 2.798 N/A LYS 332.A N VAL 328.A O no hydrogen 2.838 N/A VAL 336.A N SER 276.A OG no hydrogen 2.932 N/A GLU 337.A N LYS 282.A O no hydrogen 2.983 N/A ILE 338.A N TYR 274.A O no hydrogen 2.786 N/A HIS 339.A N ILE 284.A O no hydrogen 2.765 N/A HIS 339.A ND1 HIS 271.A NE2 no hydrogen 2.873 N/A HIS 339.A NE2 GLU 337.A OE2 no hydrogen 2.551 N/A PHE 340.A N LEU 272.A O no hydrogen 2.761 N/A LEU 341.A N LEU 286.A O no hydrogen 2.842 N/A SER 342.A N ILE 270.A O no hydrogen 3.050 N/A SER 342.A OG GLY 288.A O no hydrogen 2.754 N/A VAL 344.A N LYS 268.A O no hydrogen 3.105 N/A CYS 345.A N GLY 290.A O no hydrogen 3.058 N/A ASN 347.A N PHE 293.A O no hydrogen 2.877 N/A ASN 347.A ND2 ASP 294.A OD1 no hydrogen 2.781 N/A ASN 347.A ND2 THR 373.A O no hydrogen 3.171 N/A ASN 352.A N SER 350.A OG no hydrogen 2.932 N/A SER 353.A N SER 350.A O no hydrogen 3.259 N/A SER 353.A OG MET 348.A O no hydrogen 2.845 N/A SER 353.A OG SER 350.A O no hydrogen 3.408 N/A TYR 354.A OH THR 373.A O no hydrogen 2.666 N/A ARG 355.A N ASP 358.A OD2 no hydrogen 2.926 N/A ARG 355.A NE ASP 358.A OD1 no hydrogen 3.198 N/A ARG 355.A NH2 ASP 358.A OD2 no hydrogen 3.037 N/A GLY 357.A N VAL 370.A O no hydrogen 2.648 N/A ASP 358.A N ARG 355.A O no hydrogen 2.942 N/A ILE 360.A N ILE 368.A O no hydrogen 2.954 N/A ALA 362.A N LYS 366.A O no hydrogen 2.937 N/A SER 363.A N ASP 383.A OD1 no hydrogen 2.781 N/A SER 363.A OG ASP 383.A OD1 no hydrogen 2.753 N/A GLY 365.A N ALA 362.A O no hydrogen 2.863 N/A LYS 366.A N ASN 364.A OD1 no hydrogen 3.120 N/A LYS 366.A NZ GLU 479.A O no hydrogen 3.064 N/A THR 367.A N ASP 458.A OD2 no hydrogen 2.982 N/A ILE 368.A N ILE 360.A O no hydrogen 2.799 N/A GLU 369.A N ILE 459.A O no hydrogen 2.885 N/A VAL 370.A N ASP 358.A O no hydrogen 2.812 N/A GLY 371.A N GLN 461.A OE1 no hydrogen 2.679 N/A ASN 372.A N GLN 461.A OE1 no hydrogen 3.022 N/A THR 373.A N ASN 299.A OD1 no hydrogen 2.702 N/A THR 373.A OG1 GLY 296.A O no hydrogen 2.691 N/A THR 373.A OG1 ASN 299.A OD1 no hydrogen 3.283 N/A ASP 374.A N ASN 372.A OD1 no hydrogen 2.864 N/A ALA 375.A N ASN 372.A O no hydrogen 2.928 N/A GLU 376.A N GLU 376.A OE1 no hydrogen 2.899 N/A ARG 378.A NH1 GLN 461.A O no hydrogen 3.087 N/A LEU 379.A N GLU 376.A O no hydrogen 3.156 N/A THR 380.A N GLU 376.A O no hydrogen 3.170 N/A THR 380.A OG1 GLY 377.A O no hydrogen 2.880 N/A LEU 381.A N GLY 377.A O no hydrogen 2.877 N/A ALA 382.A N ARG 378.A O no hydrogen 2.955 N/A ALA 384.A N THR 380.A O no hydrogen 3.111 N/A LEU 385.A N LEU 381.A O no hydrogen 2.853 N/A VAL 386.A N ALA 382.A O no hydrogen 3.124 N/A TYR 387.A N ASP 383.A O no hydrogen 3.121 N/A TYR 387.A OH HIS 271.A ND1 no hydrogen 2.646 N/A ALA 388.A N ALA 384.A O no hydrogen 2.892 N/A GLU 389.A N LEU 385.A O no hydrogen 2.907 N/A LYS 390.A N VAL 386.A O no hydrogen 3.180 N/A LEU 391.A N ALA 388.A O no hydrogen 3.055 N/A GLY 392.A N GLU 389.A O no hydrogen 3.114 N/A ASP 394.A N LYS 283.A O no hydrogen 2.789 N/A TYR 395.A N LYS 283.A O no hydrogen 3.422 N/A ILE 396.A N ALA 485.A O no hydrogen 2.956 N/A VAL 397.A N ALA 285.A O no hydrogen 2.986 N/A ASP 398.A N ALA 487.A O no hydrogen 2.914 N/A ILE 399.A N VAL 287.A O no hydrogen 2.738 N/A ALA 400.A N ILE 489.A O no hydrogen 2.946 N/A THR 401.A OG1 ASP 314.A OD1 no hydrogen 2.628 N/A LEU 402.A N ASP 490.A OD1 no hydrogen 3.042 N/A THR 403.A N ASP 490.A OD1 no hydrogen 3.407 N/A THR 403.A OG1 SER 470.A OG no hydrogen 2.592 N/A THR 403.A OG1 ASP 490.A OD2 no hydrogen 2.644 N/A MET 406.A N THR 403.A O no hydrogen 3.130 N/A LEU 407.A N GLY 404.A O no hydrogen 2.950 N/A TYR 408.A N ALA 405.A O no hydrogen 2.889 N/A SER 409.A N MET 406.A O no hydrogen 3.188 N/A SER 409.A OG ALA 405.A O no hydrogen 3.541 N/A SER 409.A OG MET 406.A O no hydrogen 3.371 N/A LEU 410.A N MET 406.A O no hydrogen 2.988 N/A GLY 411.A N MET 406.A O no hydrogen 2.909 N/A ALA 415.A N PRO 438.A O no hydrogen 3.040 N/A GLY 416.A N ASP 490.A O no hydrogen 3.309 N/A VAL 417.A N TRP 440.A O no hydrogen 2.848 N/A PHE 418.A N HIS 488.A O no hydrogen 2.948 N/A ASN 420.A N TRP 486.A O no hydrogen 2.969 N/A ASN 420.A ND2 THR 484.A O no hydrogen 2.969 N/A LEU 424.A N ASN 421.A OD1 no hydrogen 2.888 N/A ILE 425.A N ASN 421.A O no hydrogen 3.027 N/A ASN 426.A N GLU 422.A O no hydrogen 2.894 N/A LYS 427.A N GLU 423.A O no hydrogen 3.162 N/A LYS 427.A NZ TYR 395.A OH no hydrogen 2.631 N/A LYS 427.A NZ ASP 518.A OD2 no hydrogen 2.675 N/A ILE 428.A N LEU 424.A O no hydrogen 3.039 N/A LEU 429.A N ILE 425.A O no hydrogen 2.891 N/A GLN 430.A N ASN 426.A O no hydrogen 2.853 N/A SER 431.A N LYS 427.A O no hydrogen 2.975 N/A SER 431.A OG LYS 427.A O no hydrogen 2.904 N/A SER 432.A N ILE 428.A O no hydrogen 2.863 N/A SER 432.A OG GLU 437.A O no hydrogen 2.621 N/A LYS 433.A N LEU 429.A O no hydrogen 3.064 N/A THR 434.A N GLN 430.A O no hydrogen 2.994 N/A THR 434.A OG1 SER 431.A O no hydrogen 3.549 N/A THR 434.A OG1 GLU 513.A OE1 no hydrogen 2.693 N/A SER 435.A N SER 431.A O no hydrogen 2.782 N/A SER 435.A OG SER 431.A O no hydrogen 2.821 N/A SER 435.A OG SER 432.A O no hydrogen 3.453 N/A GLU 437.A N SER 435.A OG no hydrogen 3.262 N/A TRP 440.A N ALA 415.A O no hydrogen 2.700 N/A LEU 442.A N VAL 417.A O no hydrogen 2.809 N/A TYR 448.A N ILE 445.A O no hydrogen 3.135 N/A ARG 449.A N ASN 446.A O no hydrogen 2.911 N/A ARG 449.A NE GLU 479.A OE2 no hydrogen 3.045 N/A ARG 449.A NH1 ARG 449.A O no hydrogen 2.931 N/A ARG 449.A NH1 ASN 453.A OD1 no hydrogen 2.936 N/A THR 451.A N TYR 448.A O no hydrogen 3.000 N/A THR 451.A OG1 TYR 448.A O no hydrogen 2.747 N/A THR 451.A OG1 SER 463.A OG no hydrogen 2.688 N/A LEU 452.A N ARG 449.A O no hydrogen 2.846 N/A ASN 453.A N ALA 450.A O no hydrogen 3.124 N/A SER 454.A OG GLU 369.A OE1 no hydrogen 2.533 N/A SER 454.A OG ASN 460.A OD1 no hydrogen 3.257 N/A TYR 456.A N SER 454.A OG no hydrogen 3.328 N/A ALA 457.A N SER 454.A OG no hydrogen 3.094 N/A ASP 458.A N THR 367.A OG1 no hydrogen 2.868 N/A ILE 459.A N THR 367.A O no hydrogen 3.030 N/A ASN 460.A N LEU 452.A O no hydrogen 2.642 N/A GLN 461.A N GLU 369.A O no hydrogen 3.033 N/A GLN 461.A NE2 ASN 372.A O no hydrogen 2.933 N/A GLN 461.A NE2 ALA 375.A O no hydrogen 2.790 N/A SER 463.A OG THR 451.A OG1 no hydrogen 2.688 N/A VAL 466.A N SER 463.A OG no hydrogen 2.874 N/A SER 470.A OG THR 403.A OG1 no hydrogen 2.592 N/A VAL 472.A N ALA 468.A O no hydrogen 3.009 N/A ALA 473.A N SER 469.A O no hydrogen 2.849 N/A SER 474.A N SER 470.A O no hydrogen 3.180 N/A SER 474.A OG SER 470.A O no hydrogen 2.987 N/A LEU 475.A N ILE 471.A O no hydrogen 2.988 N/A PHE 476.A N VAL 472.A O no hydrogen 3.068 N/A LEU 477.A N ALA 473.A O no hydrogen 2.924 N/A LYS 478.A N SER 474.A O no hydrogen 2.941 N/A GLU 479.A N PHE 476.A O no hydrogen 3.158 N/A PHE 480.A N LEU 477.A O no hydrogen 2.877 N/A VAL 481.A N LYS 478.A O no hydrogen 3.331 N/A GLN 482.A N GLU 389.A OE1 no hydrogen 2.718 N/A ASN 483.A N GLU 389.A OE2 no hydrogen 2.744 N/A THR 484.A OG1 GLU 389.A OE2 no hydrogen 2.555 N/A TRP 486.A N ASN 420.A OD1 no hydrogen 2.801 N/A TRP 486.A NE1 ASP 398.A OD2 no hydrogen 2.789 N/A ALA 487.A N ILE 396.A O no hydrogen 2.980 N/A HIS 488.A N PHE 418.A O no hydrogen 2.730 N/A HIS 488.A ND1 ASP 398.A OD1 no hydrogen 2.624 N/A ILE 489.A N ASP 398.A O no hydrogen 2.855 N/A ASP 490.A N GLY 416.A O no hydrogen 2.867 N/A ILE 491.A N ALA 400.A O no hydrogen 2.765 N/A ALA 492.A N ASP 490.A OD1 no hydrogen 3.203 N/A VAL 494.A N ILE 491.A O no hydrogen 3.222 N/A SER 495.A N ILE 491.A O no hydrogen 3.059 N/A SER 495.A OG SER 316.A OG no hydrogen 2.698 N/A ASN 497.A N LYS 502.A O no hydrogen 2.761 N/A ALA 500.A N ASN 497.A OD1 no hydrogen 3.045 N/A ARG 501.A N ASN 497.A O no hydrogen 2.757 N/A LYS 502.A N ASN 497.A O no hydrogen 3.314 N/A LYS 502.A NZ GLU 161.A OE1 no hydrogen 2.552 N/A LYS 504.A N SER 495.A O no hydrogen 2.923 N/A LYS 504.A NZ THR 412.A O no hydrogen 2.750 N/A LYS 504.A NZ VAL 494.A O no hydrogen 3.151 N/A GLY 507.A N GLU 437.A OE1 no hydrogen 3.080 N/A GLY 507.A N GLU 437.A OE2 no hydrogen 3.123 N/A ARG 509.A NH1 GLU 156.A OE1 no hydrogen 2.822 N/A LEU 510.A N GLU 437.A OE1 no hydrogen 2.895 N/A LEU 511.A N GLY 507.A O no hydrogen 2.811 N/A THR 512.A N VAL 508.A O no hydrogen 2.929 N/A THR 512.A OG1 VAL 508.A O no hydrogen 2.880 N/A GLU 513.A N ARG 509.A O no hydrogen 2.781 N/A PHE 514.A N LEU 510.A O no hydrogen 3.065 N/A VAL 515.A N LEU 511.A O no hydrogen 3.019 N/A LEU 516.A N THR 512.A O no hydrogen 2.868 N/A ASN 517.A N GLU 513.A O no hydrogen 2.897 N/A ASP 518.A N VAL 515.A O no hydrogen 3.301 N/A