Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1k9d_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): TYR 1.A OH ASP 178.A OD2 no hydrogen 2.451 N/A GLU 2.A N PRO 441.A O no hydrogen 2.867 N/A CYS 4.A SG GLU 2.A O no hydrogen 4.004 N/A TRP 5.A NE1 SER 185.A OG no hydrogen 2.797 N/A LEU 6.A N PRO 3.A O no hydrogen 3.010 N/A ARG 7.A NE GLN 477.A O no hydrogen 3.027 N/A TYR 8.A N GLN 122.A OE1 no hydrogen 2.806 N/A TYR 8.A OH GLU 37.A OE2 no hydrogen 2.565 N/A ARG 10.A NE SER 44.A O.A no hydrogen 2.774 N/A ARG 10.A NE SER 44.A O.B no hydrogen 2.736 N/A ARG 10.A NH2 ARG 43.A O no hydrogen 3.432 N/A LYS 11.A N MET 45.A O no hydrogen 2.909 N/A LYS 11.A NZ LEU 121.A O no hydrogen 2.746 N/A LYS 11.A NZ GLN 122.A O no hydrogen 3.193 N/A TYR 14.A N ASP 12.A OD1 no hydrogen 2.746 N/A SER 15.A N ASP 12.A O no hydrogen 3.233 N/A SER 15.A OG ASP 12.A OD1 no hydrogen 2.921 N/A ARG 16.A NE LYS 11.A O no hydrogen 3.309 N/A ARG 16.A NE ASP 12.A O no hydrogen 3.307 N/A ARG 16.A NH1 GLU 47.A OE1.A no hydrogen 2.807 N/A ARG 16.A NH2 LYS 11.A O no hydrogen 2.864 N/A GLU 20.A N ASN 61.A O no hydrogen 2.869 N/A GLU 21.A N ASN 61.A O no hydrogen 3.234 N/A ILE 22.A N GLN 51.A O no hydrogen 2.858 N/A VAL 23.A N ILE 63.A O no hydrogen 2.802 N/A ALA 24.A N VAL 53.A O no hydrogen 2.796 N/A LYS 25.A N LEU 65.A O no hydrogen 3.090 N/A LYS 25.A NZ GLN 54.A O no hydrogen 3.040 N/A ARG 26.A NE.A THR 67.A OG1 no hydrogen 3.116 N/A ARG 26.A NE.B ASP 107.A OD1 no hydrogen 3.334 N/A ARG 26.A NH2.A THR 67.A OG1 no hydrogen 2.787 N/A ARG 26.A NH2.B ASP 107.A OD2 no hydrogen 2.932 N/A SER 28.A OG ASP 107.A OD2 no hydrogen 2.533 N/A PHE 31.A N SER 28.A OG no hydrogen 3.382 N/A GLN 32.A N SER 28.A O no hydrogen 2.930 N/A GLN 32.A NE2 THR 27.A O no hydrogen 2.726 N/A ALA 33.A N PRO 29.A O no hydrogen 2.961 N/A ALA 34.A N ILE 30.A O no hydrogen 2.963 N/A VAL 35.A N PHE 31.A O no hydrogen 2.832 N/A GLU 36.A N.A GLN 32.A O no hydrogen 2.924 N/A GLU 36.A N.B GLN 32.A O no hydrogen 2.928 N/A GLU 37.A N ALA 33.A O no hydrogen 2.991 N/A LEU 38.A N ALA 34.A O no hydrogen 3.006 N/A GLN 39.A N VAL 35.A O no hydrogen 2.840 N/A LYS 40.A N GLU 36.A O.A no hydrogen 2.902 N/A LYS 40.A N GLU 36.A O.B no hydrogen 2.882 N/A GLY 41.A N GLU 37.A O no hydrogen 2.849 N/A LEU 42.A N LEU 38.A O no hydrogen 2.908 N/A ARG 43.A N GLN 39.A O no hydrogen 2.964 N/A ARG 43.A NE GLU 49.A OE2 no hydrogen 2.920 N/A SER 44.A N.A LYS 40.A O no hydrogen 3.041 N/A SER 44.A N.B LYS 40.A O no hydrogen 3.046 N/A SER 44.A OG.A TYR 8.A O no hydrogen 2.624 N/A SER 44.A OG.B LYS 40.A O no hydrogen 3.212 N/A MET 45.A N GLY 41.A O no hydrogen 2.898 N/A MET 46.A N.A LEU 42.A O no hydrogen 2.819 N/A MET 46.A N.B LEU 42.A O no hydrogen 2.800 N/A GLU 47.A N.A ARG 43.A O no hydrogen 3.037 N/A ILE 48.A N LEU 42.A O no hydrogen 3.510 N/A GLN 51.A N GLU 20.A O no hydrogen 2.880 N/A VAL 53.A N ILE 22.A O no hydrogen 2.863 N/A GLU 58.A N GLU 58.A OE1 no hydrogen 2.862 N/A THR 59.A N ASN 57.A OD1 no hydrogen 2.886 N/A THR 59.A OG1 ASN 57.A OD1 no hydrogen 2.889 N/A ALA 60.A N ASN 57.A O no hydrogen 2.934 N/A ASN 61.A N GLU 20.A OE1 no hydrogen 2.917 N/A ASN 61.A ND2 GLU 20.A OE2 no hydrogen 2.828 N/A SER 62.A N.A PHE 98.A O no hydrogen 2.977 N/A SER 62.A N.B PHE 98.A O no hydrogen 2.975 N/A SER 62.A OG.A ALA 60.A O no hydrogen 2.986 N/A ILE 63.A N GLU 21.A O no hydrogen 3.079 N/A TRP 64.A N ILE 100.A O no hydrogen 2.715 N/A LEU 65.A N VAL 23.A O no hydrogen 2.779 N/A GLY 66.A N ILE 102.A O no hydrogen 3.242 N/A THR 67.A N ASP 70.A OD2 no hydrogen 2.813 N/A THR 67.A OG1 ASP 70.A OD2 no hydrogen 2.829 N/A ASP 70.A N THR 67.A O no hydrogen 2.857 N/A GLU 71.A N LEU 68.A O no hydrogen 3.012 N/A ARG 75.A N GLU 78.A OE2 no hydrogen 2.938 N/A GLU 78.A N GLU 78.A OE1 no hydrogen 2.731 N/A GLY 79.A N ARG 75.A O no hydrogen 3.237 N/A THR 80.A N LEU 77.A O no hydrogen 2.985 N/A THR 80.A OG1 LEU 77.A O no hydrogen 2.591 N/A LEU 81.A N GLU 78.A O no hydrogen 3.158 N/A VAL 82.A N GLN 135.A OE1 no hydrogen 2.944 N/A HIS 83.A N GLN 135.A OE1 no hydrogen 2.932 N/A HIS 83.A NE2 GLU 85.A OE1 no hydrogen 2.992 N/A GLY 86.A N HIS 83.A O no hydrogen 2.940 N/A TYR 87.A N GLU 134.A O no hydrogen 2.927 N/A TYR 87.A OH HIS 116.A ND1 no hydrogen 2.625 N/A VAL 88.A N ILE 103.A O no hydrogen 2.671 N/A ILE 89.A N ILE 132.A O no hydrogen 2.817 N/A ARG 90.A N TYR 101.A O no hydrogen 3.026 N/A ARG 90.A NE GLU 78.A OE1 no hydrogen 3.065 N/A ARG 90.A NH2 GLU 71.A OE2 no hydrogen 3.566 N/A ARG 90.A NH2 GLU 78.A OE2 no hydrogen 2.792 N/A SER 91.A N.A LEU 130.A O no hydrogen 2.987 N/A SER 91.A N.B LEU 130.A O no hydrogen 2.985 N/A SER 91.A OG.A ALA 128.A O no hydrogen 3.128 N/A SER 91.A OG.A LEU 130.A O no hydrogen 3.551 N/A SER 91.A OG.B ILE 127.A O no hydrogen 2.938 N/A SER 91.A OG.B ALA 128.A O no hydrogen 3.532 N/A ASP 92.A N ARG 99.A O no hydrogen 2.865 N/A ASP 94.A N ASP 92.A OD1 no hydrogen 3.001 N/A GLY 96.A N ASP 94.A OD2 no hydrogen 2.884 N/A PHE 98.A N ASN 61.A OD1 no hydrogen 2.923 N/A ARG 99.A NH1 ASP 92.A OD2 no hydrogen 3.314 N/A ARG 99.A NH2 GLU 58.A O no hydrogen 2.777 N/A ILE 100.A N SER 62.A O.A no hydrogen 3.031 N/A ILE 100.A N SER 62.A O.B no hydrogen 3.044 N/A TYR 101.A N ARG 90.A O no hydrogen 2.877 N/A TYR 101.A OH ASP 92.A OD2 no hydrogen 3.192 N/A ILE 102.A N TRP 64.A O no hydrogen 2.787 N/A ILE 103.A N VAL 88.A O no hydrogen 2.800 N/A GLY 104.A N GLY 66.A O no hydrogen 3.021 N/A LYS 105.A N GLY 86.A O no hydrogen 2.924 N/A THR 106.A OG1 PRO 84.A O no hydrogen 2.471 N/A VAL 110.A N THR 106.A O no hydrogen 3.297 N/A LEU 111.A N ASP 107.A O no hydrogen 3.080 N/A TYR 112.A N ALA 108.A O no hydrogen 2.954 N/A GLY 113.A N GLY 109.A O no hydrogen 2.929 N/A VAL 114.A N VAL 110.A O no hydrogen 2.902 N/A PHE 115.A N LEU 111.A O no hydrogen 3.079 N/A HIS 116.A N TYR 112.A O no hydrogen 3.018 N/A HIS 116.A ND1 TYR 87.A OH no hydrogen 2.625 N/A PHE 117.A N GLY 113.A O no hydrogen 2.826 N/A LEU 118.A N VAL 114.A O no hydrogen 2.896 N/A ARG 119.A N PHE 115.A O no hydrogen 2.860 N/A LEU 120.A N HIS 116.A O no hydrogen 2.962 N/A LEU 121.A N PHE 117.A O no hydrogen 3.147 N/A GLN 122.A N LEU 118.A O no hydrogen 2.930 N/A GLN 122.A NE2 TRP 5.A O no hydrogen 2.883 N/A GLN 122.A NE2 GLN 477.A OE1 no hydrogen 2.848 N/A MET 123.A N.A ARG 119.A O no hydrogen 2.991 N/A MET 123.A N.B ARG 119.A O no hydrogen 2.979 N/A GLY 124.A N LEU 121.A O no hydrogen 2.993 N/A GLU 125.A N.A LEU 120.A O no hydrogen 2.957 N/A GLU 125.A N.B LEU 120.A O no hydrogen 2.962 N/A ALA 128.A N ASN 126.A OD1 no hydrogen 2.864 N/A LEU 130.A N SER 91.A OG.B no hydrogen 2.995 N/A ILE 132.A N ILE 89.A O no hydrogen 2.733 N/A GLU 134.A N TYR 87.A O no hydrogen 2.974 N/A LYS 137.A N.A TRP 461.A O no hydrogen 2.893 N/A LYS 137.A N.B TRP 461.A O no hydrogen 2.894 N/A LYS 137.A NZ.B ASN 462.A OD1 no hydrogen 3.472 N/A ASN 138.A ND2 ALA 460.A O no hydrogen 2.803 N/A ARG 139.A NH1 ARG 427.A O no hydrogen 3.109 N/A LEU 140.A N SER 429.A O no hydrogen 3.017 N/A ARG 141.A N ASN 189.A OD1 no hydrogen 3.057 N/A ARG 141.A NE GLY 187.A O no hydrogen 2.725 N/A ARG 141.A NH1 GLU 85.A OE1 no hydrogen 2.888 N/A ARG 141.A NH1 ASN 138.A O no hydrogen 2.874 N/A ARG 141.A NH2 GLU 85.A OE2 no hydrogen 2.846 N/A ARG 141.A NH2 GLY 187.A O no hydrogen 2.921 N/A MET 142.A N ILE 431.A O no hydrogen 2.899 N/A ILE 143.A N ALA 190.A O no hydrogen 3.058 N/A ASN 144.A N GLY 433.A O no hydrogen 2.783 N/A ASN 144.A ND2 SER 192.A OG no hydrogen 2.951 N/A HIS 145.A N SER 192.A O no hydrogen 2.950 N/A HIS 145.A ND1 ASP 147.A OD1 no hydrogen 2.866 N/A HIS 145.A NE2 TYR 179.A OH no hydrogen 2.668 N/A ASN 148.A N SER 152.A O no hydrogen 2.730 N/A ASN 148.A ND2 SER 152.A OG no hydrogen 3.112 N/A MET 149.A N GLU 202.A OE2 no hydrogen 2.745 N/A GLY 151.A N ASN 148.A O no hydrogen 3.166 N/A SER 152.A N ASP 150.A OD1 no hydrogen 2.868 N/A SER 152.A OG ASP 150.A OD1 no hydrogen 2.626 N/A GLU 154.A N TRP 146.A O no hydrogen 2.994 N/A ARG 155.A NH1 GLY 516.A O no hydrogen 2.866 N/A ARG 155.A NH2 GLY 516.A O no hydrogen 3.390 N/A GLY 156.A N ILE 153.A O no hydrogen 3.020 N/A ARG 160.A N SER 439.A OG no hydrogen 3.024 N/A SER 161.A N GLY 151.A O no hydrogen 2.783 N/A SER 161.A OG ASP 147.A OD2 no hydrogen 2.593 N/A PHE 163.A N SER 161.A OG no hydrogen 2.986 N/A PHE 164.A N SER 161.A OG no hydrogen 3.078 N/A VAL 165.A N GLN 168.A O no hydrogen 2.947 N/A ASP 167.A N MET 149.A O no hydrogen 2.773 N/A GLN 168.A N VAL 165.A O no hydrogen 2.879 N/A VAL 170.A N PHE 163.A O no hydrogen 2.917 N/A GLN 174.A NE2 ASP 178.A OD2 no hydrogen 3.193 N/A ARG 175.A NH1 SER 439.A O no hydrogen 2.896 N/A ARG 175.A NH2 ASP 440.A O no hydrogen 2.864 N/A LYS 177.A N ASN 173.A O.A no hydrogen 3.076 N/A LYS 177.A N ASN 173.A O.B no hydrogen 3.047 N/A LYS 177.A NZ GLU 36.A OE2.B no hydrogen 2.745 N/A ASP 178.A N GLN 174.A O no hydrogen 3.123 N/A TYR 179.A N ARG 175.A O no hydrogen 2.845 N/A TYR 179.A OH HIS 145.A NE2 no hydrogen 2.668 N/A ALA 180.A N ILE 176.A O no hydrogen 2.886 N/A ARG 181.A N LYS 177.A O no hydrogen 3.005 N/A ARG 181.A NE GLU 37.A OE1 no hydrogen 2.807 N/A ARG 181.A NH1 ASP 178.A OD1 no hydrogen 2.886 N/A ARG 181.A NH2 GLU 37.A OE1 no hydrogen 3.540 N/A ARG 181.A NH2 GLU 37.A OE2 no hydrogen 2.995 N/A LEU 182.A N ASP 178.A O no hydrogen 3.081 N/A LEU 183.A N TYR 179.A O no hydrogen 2.922 N/A ALA 184.A N ALA 180.A O no hydrogen 2.843 N/A SER 185.A N ARG 181.A O no hydrogen 2.927 N/A SER 185.A OG LEU 182.A O no hydrogen 2.545 N/A VAL 186.A N LEU 183.A O no hydrogen 3.189 N/A GLY 187.A N ALA 184.A O no hydrogen 2.998 N/A ILE 188.A N LEU 183.A O no hydrogen 2.976 N/A ASN 189.A N ARG 141.A O no hydrogen 2.954 N/A ASN 189.A ND2 GLU 85.A OE1 no hydrogen 3.530 N/A ASN 189.A ND2 GLU 85.A OE2 no hydrogen 2.946 N/A ASN 189.A ND2 ARG 139.A O no hydrogen 2.981 N/A ILE 191.A N LYS 227.A O no hydrogen 2.928 N/A SER 192.A N ILE 143.A O no hydrogen 3.026 N/A SER 192.A OG ILE 143.A O no hydrogen 3.561 N/A ILE 193.A N PHE 229.A O no hydrogen 3.422 N/A ASN 194.A ND2 SER 231.A O no hydrogen 2.979 N/A ASN 195.A N ASP 147.A O no hydrogen 2.907 N/A ASN 195.A ND2 ASN 148.A OD1 no hydrogen 3.069 N/A ASN 195.A ND2 GLU 154.A OE1 no hydrogen 2.841 N/A ASN 197.A N ASN 195.A OD1 no hydrogen 2.960 N/A ASN 197.A ND2 GLU 154.A OE1 no hydrogen 3.181 N/A THR 201.A OG1 ASP 167.A OD1 no hydrogen 3.515 N/A GLU 202.A N GLU 202.A OE1 no hydrogen 2.652 N/A THR 203.A N HIS 199.A O no hydrogen 2.978 N/A THR 203.A OG1 HIS 199.A O no hydrogen 2.796 N/A LYS 204.A N THR 201.A O no hydrogen 2.951 N/A LEU 205.A N GLU 202.A O no hydrogen 3.008 N/A THR 207.A N LYS 204.A O no hydrogen 3.061 N/A THR 207.A OG1 LYS 204.A O no hydrogen 2.632 N/A PHE 210.A N THR 207.A O no hydrogen 3.140 N/A LEU 211.A N THR 207.A O no hydrogen 2.934 N/A VAL 214.A N PHE 210.A O no hydrogen 2.993 N/A ALA 215.A N LEU 211.A O no hydrogen 2.825 N/A GLU 216.A N PRO 212.A O no hydrogen 3.104 N/A VAL 217.A N ASP 213.A O no hydrogen 3.104 N/A ALA 218.A N VAL 214.A O no hydrogen 2.870 N/A ASP 219.A N ALA 215.A O no hydrogen 2.797 N/A ILE 220.A N GLU 216.A O no hydrogen 3.407 N/A PHE 221.A N VAL 217.A O no hydrogen 3.118 N/A ARG 222.A N ALA 218.A O no hydrogen 2.847 N/A ARG 222.A NE ASP 270.A OD1 no hydrogen 3.228 N/A ARG 222.A NE ASP 270.A OD2 no hydrogen 2.783 N/A ARG 222.A NH1 ASP 219.A OD1 no hydrogen 2.690 N/A ARG 222.A NH2 ASP 270.A OD1 no hydrogen 2.872 N/A THR 223.A N.A ASP 219.A O no hydrogen 3.365 N/A THR 223.A N.A ILE 220.A O no hydrogen 3.193 N/A THR 223.A N.B ASP 219.A O no hydrogen 3.373 N/A THR 223.A N.B ILE 220.A O no hydrogen 3.207 N/A THR 223.A OG1.A ASP 219.A O no hydrogen 3.180 N/A THR 223.A OG1.B ILE 220.A O no hydrogen 2.525 N/A TYR 224.A N PHE 221.A O no hydrogen 2.979 N/A GLY 225.A N ARG 222.A O no hydrogen 3.073 N/A ILE 226.A N PHE 221.A O no hydrogen 2.892 N/A LYS 227.A N ASN 189.A O no hydrogen 2.940 N/A PHE 229.A N ILE 191.A O no hydrogen 2.690 N/A LEU 230.A N GLY 273.A O no hydrogen 3.246 N/A SER 231.A N ASN 194.A OD1 no hydrogen 2.979 N/A SER 231.A OG ASN 194.A O no hydrogen 2.666 N/A ILE 232.A N VAL 275.A O no hydrogen 3.077 N/A ASN 233.A ND2 THR 203.A OG1 no hydrogen 2.983 N/A ASN 233.A ND2 GLU 239.A OE2 no hydrogen 2.720 N/A TYR 234.A OH GLY 291.A O no hydrogen 2.857 N/A ALA 235.A N ASN 233.A OD1 no hydrogen 2.818 N/A SER 236.A N ASN 233.A O no hydrogen 2.904 N/A SER 236.A OG ASN 233.A O no hydrogen 2.626 N/A ILE 238.A N ALA 235.A O no hydrogen 2.882 N/A GLU 239.A N ALA 235.A O no hydrogen 3.069 N/A ILE 240.A N SER 236.A O no hydrogen 2.815 N/A GLY 241.A N SER 236.A O no hydrogen 3.033 N/A LEU 243.A N PRO 237.A O no hydrogen 2.932 N/A ALA 246.A N TYR 284.A OH no hydrogen 3.000 N/A ASP 247.A N THR 245.A OG1 no hydrogen 3.054 N/A LEU 249.A N ASP 247.A OD1 no hydrogen 2.942 N/A ASP 250.A N ASP 247.A O no hydrogen 2.960 N/A VAL 253.A N ASP 250.A OD2 no hydrogen 3.044 N/A ARG 254.A N ASP 250.A O no hydrogen 3.086 N/A ARG 254.A NH1 PRO 248.A O no hydrogen 2.932 N/A TRP 255.A N PRO 251.A O no hydrogen 3.011 N/A TRP 256.A N GLU 252.A O.A no hydrogen 2.877 N/A TRP 256.A N GLU 252.A O.B no hydrogen 2.827 N/A TRP 257.A N VAL 253.A O no hydrogen 3.121 N/A LYS 258.A N ARG 254.A O no hydrogen 3.161 N/A GLU 259.A N TRP 255.A O no hydrogen 2.889 N/A THR 260.A N TRP 256.A O no hydrogen 2.874 N/A THR 260.A OG1 TRP 256.A O no hydrogen 3.059 N/A ALA 261.A N TRP 257.A O no hydrogen 2.848 N/A LYS 262.A N LYS 258.A O no hydrogen 2.977 N/A ARG 263.A N GLU 259.A O no hydrogen 2.957 N/A ARG 263.A NE ILE 206.A O no hydrogen 3.181 N/A ARG 263.A NH2 ILE 206.A O no hydrogen 2.790 N/A ARG 263.A NH2 THR 260.A OG1 no hydrogen 3.106 N/A ILE 264.A N THR 260.A O no hydrogen 2.998 N/A TYR 265.A N ALA 261.A O no hydrogen 3.019 N/A TYR 265.A OH PHE 271.A O no hydrogen 2.755 N/A GLN 266.A N ARG 263.A O no hydrogen 3.148 N/A TYR 267.A N ILE 264.A O no hydrogen 2.951 N/A TYR 267.A OH ASP 208.A OD1 no hydrogen 2.609 N/A ILE 268.A N ILE 264.A O no hydrogen 2.797 N/A PHE 271.A N ILE 268.A O no hydrogen 3.043 N/A GLY 272.A N THR 228.A O no hydrogen 2.805 N/A PHE 274.A N LEU 305.A O no hydrogen 2.931 N/A VAL 275.A N LEU 230.A O no hydrogen 2.999 N/A VAL 276.A N ILE 307.A O no hydrogen 2.726 N/A LYS 277.A NZ ASN 197.A OD1 no hydrogen 2.667 N/A GLY 280.A N THR 283.A OG1 no hydrogen 2.733 N/A THR 283.A N GLY 280.A O no hydrogen 2.872 N/A TYR 284.A N PRO 281.A O no hydrogen 3.066 N/A GLY 285.A N PHE 282.A O no hydrogen 3.101 N/A ARG 286.A N PRO 281.A O no hydrogen 2.944 N/A ARG 286.A NE ASP 247.A OD1 no hydrogen 2.976 N/A ARG 286.A NE ASP 247.A OD2 no hydrogen 3.388 N/A ARG 286.A NH2 ASP 247.A OD2 no hydrogen 2.812 N/A ASP 287.A N GLU 290.A OE1 no hydrogen 2.928 N/A GLU 290.A N ASP 287.A OD1 no hydrogen 2.772 N/A GLY 291.A N ASP 287.A O no hydrogen 2.999 N/A ALA 292.A N HIS 288.A O no hydrogen 2.822 N/A ASN 293.A N ALA 289.A O no hydrogen 2.809 N/A ASN 293.A ND2 GLN 340.A O no hydrogen 2.814 N/A MET 294.A N GLU 290.A O no hydrogen 3.309 N/A ALA 296.A N ALA 292.A O no hydrogen 2.915 N/A GLU 297.A N ASN 293.A O no hydrogen 2.866 N/A ALA 298.A N MET 294.A O no hydrogen 3.327 N/A LEU 299.A N LEU 295.A O no hydrogen 3.168 N/A ALA 300.A N ALA 296.A O no hydrogen 2.821 N/A PHE 302.A N LEU 299.A O no hydrogen 2.896 N/A GLY 303.A N ALA 300.A O no hydrogen 3.135 N/A GLY 304.A N LEU 299.A O no hydrogen 3.152 N/A LEU 305.A N GLY 272.A O no hydrogen 2.866 N/A VAL 306.A N ASN 344.A O no hydrogen 2.910 N/A ILE 307.A N PHE 274.A O no hydrogen 2.743 N/A TRP 308.A N ILE 346.A O.A no hydrogen 2.892 N/A TRP 308.A N ILE 346.A O.B no hydrogen 2.894 N/A ARG 309.A N VAL 276.A O no hydrogen 3.024 N/A ARG 309.A NE GLU 377.A OE1 no hydrogen 2.850 N/A ARG 309.A NH2 GLU 377.A OE1 no hydrogen 3.348 N/A ARG 309.A NH2 GLU 377.A OE2 no hydrogen 2.957 N/A CYS 310.A N GLN 348.A O no hydrogen 2.792 N/A VAL 312.A N CYS 310.A O no hydrogen 2.769 N/A GLN 317.A N HIS 530.A O no hydrogen 2.878 N/A ARG 320.A N ASP 318.A OD1 no hydrogen 2.796 N/A ARG 320.A NH1 ASP 318.A OD1 no hydrogen 2.931 N/A ARG 320.A NH1 ASP 318.A OD2 no hydrogen 3.275 N/A ASP 321.A N ASP 318.A O no hydrogen 3.200 N/A THR 323.A N ASP 321.A OD1 no hydrogen 2.949 N/A THR 323.A OG1 ASP 321.A OD1 no hydrogen 2.575 N/A THR 323.A OG1 ASP 321.A OD2 no hydrogen 3.134 N/A THR 324.A OG1 ASP 321.A O no hydrogen 3.025 N/A THR 324.A OG1 ASP 321.A OD2 no hydrogen 3.491 N/A ARG 326.A NH1 TRP 531.A O no hydrogen 2.909 N/A ARG 326.A NH2 MET 354.A O no hydrogen 3.543 N/A ALA 327.A N ASP 325.A OD1 no hydrogen 2.995 N/A LYS 328.A N ASP 325.A O no hydrogen 3.034 N/A LYS 328.A NZ THR 552.A O no hydrogen 2.726 N/A ALA 329.A N ARG 326.A O no hydrogen 3.087 N/A ASP 332.A N LYS 328.A O no hydrogen 3.013 N/A HIS 333.A N ALA 329.A O no hydrogen 2.978 N/A PHE 334.A N ALA 330.A O no hydrogen 3.013 N/A LYS 335.A N TYR 331.A O no hydrogen 2.866 N/A LYS 335.A NZ ALA 368.A O no hydrogen 2.728 N/A LEU 337.A N PHE 334.A O no hydrogen 2.892 N/A ASP 338.A N LYS 335.A O no hydrogen 3.062 N/A GLY 339.A N THR 372.A OG1 no hydrogen 3.317 N/A GLN 340.A N LEU 337.A O no hydrogen 2.977 N/A ARG 342.A N ASN 293.A OD1 no hydrogen 2.762 N/A ASN 344.A ND2 ALA 296.A O no hydrogen 2.969 N/A ASN 344.A ND2 GLY 304.A O no hydrogen 3.069 N/A VAL 345.A N ARG 342.A O no hydrogen 3.170 N/A ILE 346.A N.A VAL 306.A O no hydrogen 2.862 N/A ILE 346.A N.B VAL 306.A O no hydrogen 2.864 N/A LEU 347.A N ASN 373.A O no hydrogen 3.021 N/A GLN 348.A N TRP 308.A O no hydrogen 2.812 N/A GLN 348.A NE2 ASN 144.A OD1 no hydrogen 2.838 N/A GLN 348.A NE2 GLU 377.A OE1 no hydrogen 2.910 N/A ILE 349.A N MET 375.A O.A no hydrogen 2.906 N/A ILE 349.A N MET 375.A O.B no hydrogen 2.918 N/A LYS 350.A NZ ASP 355.A OD1 no hydrogen 2.741 N/A ASN 351.A N GLU 377.A O no hydrogen 3.152 N/A MET 354.A N GLU 360.A OE1 no hydrogen 2.918 N/A ASP 355.A N GLU 360.A OE2 no hydrogen 2.782 N/A GLN 357.A N GLU 360.A OE2 no hydrogen 2.830 N/A GLN 357.A NE2 ASP 355.A O no hydrogen 2.950 N/A ARG 359.A NE GLU 501.A OE1 no hydrogen 3.422 N/A ARG 359.A NE GLU 501.A OE2 no hydrogen 2.774 N/A ARG 359.A NH1 GLU 400.A OE1 no hydrogen 3.082 N/A ARG 359.A NH2 GLU 501.A OE1 no hydrogen 2.891 N/A SER 363.A N ASN 351.A O no hydrogen 2.958 N/A SER 363.A OG LYS 350.A O no hydrogen 2.723 N/A PHE 366.A N SER 363.A O no hydrogen 3.285 N/A ALA 368.A N LEU 365.A O no hydrogen 3.044 N/A LYS 371.A N ASP 338.A OD1 no hydrogen 3.097 N/A LYS 371.A N ASP 338.A OD2 no hydrogen 3.448 N/A THR 372.A N MET 369.A O no hydrogen 3.122 N/A THR 372.A OG1 ASP 338.A OD1 no hydrogen 2.681 N/A ASN 373.A ND2 GLU 343.A O no hydrogen 2.889 N/A ASN 373.A ND2 VAL 345.A O no hydrogen 3.102 N/A GLN 374.A NE2 LEU 365.A O no hydrogen 3.027 N/A MET 375.A N.A LEU 347.A O no hydrogen 2.925 N/A MET 375.A N.B LEU 347.A O no hydrogen 2.943 N/A MET 376.A N GLY 430.A O no hydrogen 3.116 N/A GLU 377.A N ILE 349.A O no hydrogen 2.812 N/A VAL 378.A N ALA 432.A O no hydrogen 2.830 N/A GLN 379.A NE2 GLU 383.A OE1 no hydrogen 2.913 N/A ILE 380.A N VAL 434.A O no hydrogen 2.999 N/A THR 381.A N VAL 434.A O no hydrogen 3.223 N/A THR 381.A OG1 ARG 155.A O no hydrogen 2.648 N/A GLN 382.A N GLN 388.A OE1 no hydrogen 3.011 N/A GLN 382.A NE2 THR 385.A O no hydrogen 2.917 N/A GLN 382.A NE2 HIS 390.A O no hydrogen 3.051 N/A GLU 383.A N THR 381.A O no hydrogen 2.964 N/A TYR 384.A OH ASP 355.A OD2 no hydrogen 2.894 N/A THR 385.A N GLN 382.A O no hydrogen 3.286 N/A GLN 387.A N GLN 382.A O no hydrogen 2.673 N/A GLN 387.A NE2 GLU 383.A O no hydrogen 3.055 N/A GLN 387.A NE2 HIS 517.A O no hydrogen 2.852 N/A GLN 388.A NE2 THR 444.A O no hydrogen 3.032 N/A LYS 389.A N GLY 386.A O no hydrogen 2.841 N/A HIS 390.A N GLY 386.A O no hydrogen 3.170 N/A HIS 390.A ND1 TYR 503.A OH no hydrogen 2.764 N/A HIS 390.A NE2 HIS 642.A ND1 no hydrogen 2.776 N/A LEU 391.A N GLN 639.A OE1 no hydrogen 2.843 N/A PHE 393.A N SER 496.A OG no hydrogen 2.809 N/A LEU 394.A N ASN 452.A OD1 no hydrogen 2.887 N/A TRP 398.A N LEU 394.A O no hydrogen 3.068 N/A LYS 399.A N ILE 395.A O no hydrogen 2.956 N/A LYS 399.A NZ LEU 465.A O no hydrogen 2.695 N/A GLU 400.A N PRO 396.A O no hydrogen 3.123 N/A VAL 401.A N GLN 397.A O no hydrogen 3.133 N/A LEU 402.A N TRP 398.A O no hydrogen 2.839 N/A ASP 403.A N LYS 399.A O no hydrogen 2.795 N/A PHE 404.A N VAL 401.A O no hydrogen 3.145 N/A THR 406.A N SER 413.A O no hydrogen 3.020 N/A THR 406.A OG1 SER 413.A O no hydrogen 2.748 N/A TYR 407.A N ASP 405.A OD1 no hydrogen 2.913 N/A ALA 408.A N THR 406.A OG1 no hydrogen 3.073 N/A LYS 409.A N SER 413.A OG no hydrogen 2.912 N/A LYS 409.A NZ LEU 423.A O no hydrogen 2.662 N/A GLY 410.A N TYR 407.A O no hydrogen 3.030 N/A GLY 412.A N ASP 405.A OD2 no hydrogen 2.742 N/A SER 413.A N ASP 405.A OD1 no hydrogen 2.901 N/A SER 413.A OG GLY 410.A O no hydrogen 2.793 N/A GLU 414.A N GLU 414.A OE1 no hydrogen 2.756 N/A VAL 415.A N PHE 404.A O no hydrogen 2.944 N/A LYS 416.A N LEU 402.A O no hydrogen 2.946 N/A LYS 416.A NZ ASP 403.A OD1 no hydrogen 2.845 N/A LYS 416.A NZ ASP 464.A OD1 no hydrogen 2.763 N/A LYS 417.A N GLU 414.A O no hydrogen 2.864 N/A LYS 417.A NZ GLY 412.A O no hydrogen 3.041 N/A LYS 417.A NZ GLU 414.A OE1 no hydrogen 3.107 N/A VAL 418.A N GLU 414.A O no hydrogen 3.256 N/A VAL 418.A N VAL 415.A O no hydrogen 2.855 N/A ILE 419.A N VAL 415.A O no hydrogen 2.971 N/A ASP 420.A N LYS 416.A O no hydrogen 2.941 N/A GLY 421.A N VAL 418.A O no hydrogen 3.218 N/A SER 422.A N ASP 420.A OD1 no hydrogen 2.771 N/A SER 422.A OG LYS 417.A O no hydrogen 3.432 N/A SER 422.A OG ASP 420.A OD1 no hydrogen 2.817 N/A LEU 423.A N LYS 417.A O no hydrogen 3.005 N/A TYR 426.A N GLY 421.A O no hydrogen 3.018 N/A TYR 426.A OH MET 369.A O no hydrogen 2.696 N/A TYR 428.A N ASN 373.A OD1 no hydrogen 3.445 N/A SER 429.A OG ILE 419.A O no hydrogen 2.742 N/A ILE 431.A N LEU 140.A O no hydrogen 2.916 N/A ALA 432.A N MET 376.A O no hydrogen 2.736 N/A GLY 433.A N MET 142.A O no hydrogen 2.809 N/A VAL 434.A N VAL 378.A O no hydrogen 2.930 N/A SER 435.A N ASN 144.A O no hydrogen 2.806 N/A ASN 436.A ND2 ALA 449.A O no hydrogen 3.148 N/A ILE 437.A N SER 435.A OG no hydrogen 3.149 N/A GLY 438.A N TRP 443.A O no hydrogen 2.834 N/A SER 439.A N ARG 160.A O no hydrogen 2.711 N/A ASP 440.A N ALA 158.A O no hydrogen 2.998 N/A ASN 442.A ND2 GLY 445.A O no hydrogen 2.864 N/A ASN 442.A ND2 THR 447.A OG1 no hydrogen 3.380 N/A TRP 443.A N ASP 440.A O no hydrogen 2.800 N/A TRP 443.A NE1 GLU 2.A O no hydrogen 2.795 N/A THR 444.A N ASN 442.A O no hydrogen 2.701 N/A THR 444.A OG1 ASN 442.A O no hydrogen 3.538 N/A THR 444.A OG1 HIS 446.A O no hydrogen 2.718 N/A GLY 445.A N ASN 442.A OD1 no hydrogen 2.969 N/A HIS 446.A N THR 444.A O no hydrogen 2.779 N/A LEU 448.A N HIS 446.A ND1 no hydrogen 3.126 N/A ALA 449.A N HIS 446.A O no hydrogen 2.806 N/A GLN 450.A N THR 447.A O no hydrogen 3.182 N/A GLN 450.A NE2 GLU 2.A OE1 no hydrogen 2.968 N/A GLN 450.A NE2 ASN 442.A O no hydrogen 2.853 N/A ALA 451.A N LEU 448.A O no hydrogen 3.163 N/A ASN 452.A N ALA 449.A O no hydrogen 2.900 N/A ASN 452.A ND2 CYS 392.A O no hydrogen 2.980 N/A TYR 454.A N GLN 450.A O no hydrogen 3.117 N/A TYR 454.A OH GLU 473.A OE1 no hydrogen 2.706 N/A GLY 455.A N ALA 451.A O no hydrogen 2.786 N/A PHE 456.A N ASN 452.A O no hydrogen 2.913 N/A GLY 457.A N LEU 453.A O no hydrogen 3.250 N/A ARG 458.A N TYR 454.A O no hydrogen 3.077 N/A ARG 458.A NE GLU 473.A OE1 no hydrogen 2.816 N/A ARG 458.A NH2 GLU 473.A OE1 no hydrogen 3.489 N/A ARG 458.A NH2 GLU 473.A OE2 no hydrogen 3.013 N/A LEU 459.A N GLY 455.A O no hydrogen 3.017 N/A ALA 460.A N PHE 456.A O no hydrogen 2.853 N/A TRP 461.A N GLY 457.A O no hydrogen 2.981 N/A TRP 461.A NE1 GLU 134.A OE1 no hydrogen 2.832 N/A ASN 462.A N ARG 458.A O no hydrogen 2.914 N/A ASP 464.A N ASN 462.A OD1 no hydrogen 2.985 N/A LEU 465.A N ASN 462.A O no hydrogen 3.073 N/A SER 466.A N GLU 469.A OE2 no hydrogen 2.930 N/A SER 466.A OG GLU 469.A OE2 no hydrogen 3.460 N/A GLU 469.A N SER 466.A OG no hydrogen 2.976 N/A ILE 470.A N SER 466.A O no hydrogen 3.129 N/A ALA 471.A N ALA 467.A O no hydrogen 2.907 N/A ASN 472.A N GLU 468.A O no hydrogen 2.926 N/A GLU 473.A N GLU 469.A O no hydrogen 2.911 N/A TRP 474.A N ILE 470.A O no hydrogen 3.025 N/A VAL 475.A N ALA 471.A O no hydrogen 2.912 N/A VAL 476.A N ASN 472.A O no hydrogen 3.054 N/A GLN 477.A N GLU 473.A O no hydrogen 3.091 N/A GLN 477.A NE2 TYR 454.A OH no hydrogen 2.874 N/A GLN 477.A NE2 GLU 473.A O no hydrogen 3.083 N/A THR 478.A N TRP 474.A O no hydrogen 2.922 N/A THR 478.A OG1 TRP 474.A O no hydrogen 2.805 N/A PHE 479.A N VAL 475.A O no hydrogen 2.607 N/A GLY 480.A N VAL 476.A O no hydrogen 2.908 N/A VAL 485.A N ASP 482.A OD2 no hydrogen 3.094 N/A VAL 486.A N ASP 482.A O no hydrogen 2.889 N/A GLU 487.A N SER 483.A O no hydrogen 2.989 N/A THR 488.A N GLN 484.A O no hydrogen 2.926 N/A THR 488.A OG1 GLN 484.A O no hydrogen 2.817 N/A ILE 489.A N VAL 485.A O no hydrogen 2.941 N/A SER 490.A N VAL 486.A O no hydrogen 2.961 N/A SER 490.A OG VAL 486.A O no hydrogen 2.580 N/A TRP 491.A N GLU 487.A O no hydrogen 3.014 N/A MET 492.A N THR 488.A O no hydrogen 2.948 N/A LEU 493.A N ILE 489.A O no hydrogen 2.946 N/A LEU 494.A N SER 490.A O no hydrogen 2.873 N/A SER 495.A N.A TRP 491.A O no hydrogen 2.976 N/A SER 495.A N.B TRP 491.A O no hydrogen 2.967 N/A SER 495.A OG.A TRP 491.A O no hydrogen 2.712 N/A SER 495.A OG.A MET 492.A O no hydrogen 3.342 N/A SER 495.A OG.B TRP 491.A O no hydrogen 2.793 N/A SER 496.A N MET 492.A O no hydrogen 2.917 N/A SER 496.A N LEU 493.A O no hydrogen 3.301 N/A SER 496.A OG LEU 493.A O no hydrogen 2.687 N/A TRP 497.A NE1 VAL 358.A O.A no hydrogen 2.886 N/A TRP 497.A NE1 VAL 358.A O.B no hydrogen 2.822 N/A ILE 499.A N SER 495.A O.A no hydrogen 3.139 N/A ILE 499.A N SER 495.A O.B no hydrogen 3.150 N/A TYR 500.A N SER 496.A O no hydrogen 2.959 N/A GLU 501.A N TRP 497.A O no hydrogen 2.878 N/A ASN 502.A N ARG 498.A O no hydrogen 2.837 N/A ASN 502.A ND2 GLN 609.A OE1 no hydrogen 2.890 N/A TYR 503.A OH HIS 390.A ND1 no hydrogen 2.764 N/A THR 504.A N GLU 501.A O no hydrogen 3.075 N/A THR 504.A OG1 TYR 500.A O no hydrogen 2.927 N/A THR 504.A OG1 GLU 501.A O no hydrogen 3.311 N/A SER 505.A OG.B GLY 510.A O no hydrogen 2.663 N/A VAL 509.A N PRO 506.A O no hydrogen 3.111 N/A TRP 511.A N GLN 357.A OE1 no hydrogen 2.750 N/A ASN 514.A N GLY 520.A O no hydrogen 2.981 N/A ASN 514.A ND2 TYR 519.A O no hydrogen 2.898 N/A GLY 516.A N TYR 526.A OH no hydrogen 2.988 N/A HIS 517.A NE2 TYR 519.A O no hydrogen 3.063 N/A HIS 518.A ND1 GLU 383.A OE2 no hydrogen 2.686 N/A HIS 518.A NE2 TYR 526.A OH no hydrogen 2.779 N/A ASN 522.A N MET 512.A O no hydrogen 2.937 N/A ASN 522.A ND2 ASN 514.A OD1 no hydrogen 2.879 N/A GLY 525.A N ASN 522.A O no hydrogen 2.902 N/A TYR 526.A OH HIS 518.A NE2 no hydrogen 2.779 N/A GLU 527.A N ASP 524.A O no hydrogen 3.083 N/A SER 529.A N TYR 526.A O no hydrogen 3.124 N/A SER 529.A OG TYR 526.A O no hydrogen 2.830 N/A TRP 531.A N SER 529.A OG no hydrogen 3.313 N/A GLY 532.A N TYR 534.A OH no hydrogen 3.074 N/A THR 533.A OG1 THR 533.A O no hydrogen 2.593 N/A TYR 534.A OH SER 529.A O no hydrogen 2.705 N/A HIS 535.A N GLU 527.A OE1 no hydrogen 2.882 N/A HIS 535.A NE2 VAL 523.A O no hydrogen 2.861 N/A TYR 536.A N GLU 527.A OE2 no hydrogen 2.793 N/A ALA 537.A N HIS 535.A ND1 no hydrogen 3.027 N/A ASP 538.A N GLY 541.A O no hydrogen 2.931 N/A ASP 540.A N ASP 538.A OD1 no hydrogen 2.891 N/A GLY 541.A N ASP 538.A OD1 no hydrogen 2.836 N/A ILE 542.A N VAL 583.A O no hydrogen 2.847 N/A GLY 543.A N HIS 535.A O no hydrogen 2.788 N/A VAL 544.A N LEU 578.A O no hydrogen 3.059 N/A ARG 546.A N PHE 580.A O no hydrogen 2.864 N/A ARG 546.A NE ASP 325.A OD1 no hydrogen 3.149 N/A ARG 546.A NE ASP 325.A OD2 no hydrogen 2.843 N/A ARG 546.A NH1 PHE 579.A O no hydrogen 2.789 N/A ARG 546.A NH2 ASP 325.A OD1 no hydrogen 3.041 N/A THR 547.A N ASP 545.A OD1 no hydrogen 3.175 N/A THR 547.A OG1 ASP 545.A OD1 no hydrogen 2.663 N/A THR 547.A OG1 THR 550.A OG1 no hydrogen 3.208 N/A VAL 548.A N GLU 567.A OE1 no hydrogen 2.908 N/A VAL 548.A N GLU 567.A OE2 no hydrogen 3.170 N/A ALA 549.A N GLU 567.A OE2 no hydrogen 2.997 N/A THR 550.A N THR 547.A OG1 no hydrogen 3.130 N/A THR 550.A OG1 ASP 545.A OD1 no hydrogen 3.536 N/A THR 550.A OG1 ASP 545.A OD2 no hydrogen 2.602 N/A THR 550.A OG1 THR 547.A OG1 no hydrogen 3.208 N/A THR 552.A N ASP 545.A O no hydrogen 3.068 N/A THR 552.A OG1 ASP 325.A OD2 no hydrogen 2.729 N/A GLY 553.A N THR 547.A O no hydrogen 2.894 N/A TYR 554.A N THR 552.A OG1 no hydrogen 3.375 N/A TYR 554.A OH TYR 558.A OH no hydrogen 2.846 N/A THR 555.A N ARG 546.A O no hydrogen 3.202 N/A THR 555.A OG1 GLU 567.A OE1 no hydrogen 2.716 N/A ALA 556.A N GLY 553.A O no hydrogen 3.155 N/A GLN 557.A N TYR 554.A O no hydrogen 3.016 N/A GLN 557.A NE2 LYS 328.A O no hydrogen 3.187 N/A TYR 558.A N THR 555.A O no hydrogen 3.191 N/A TYR 558.A OH VAL 362.A O no hydrogen 2.587 N/A TYR 558.A OH TYR 554.A OH no hydrogen 2.846 N/A GLU 561.A N GLU 561.A OE1 no hydrogen 2.546 N/A ASN 562.A ND2 ASP 405.A O no hydrogen 2.812 N/A ALA 563.A N PHE 559.A O no hydrogen 2.910 N/A ALA 564.A N PRO 560.A O no hydrogen 2.955 N/A MET 565.A N GLU 561.A O no hydrogen 3.383 N/A TYR 566.A N ASN 562.A O no hydrogen 3.059 N/A GLU 567.A N ALA 563.A O no hydrogen 2.866 N/A SER 568.A N ALA 564.A O no hydrogen 3.288 N/A ASP 570.A N SER 568.A OG no hydrogen 3.177 N/A THR 571.A N SER 568.A OG no hydrogen 3.357 N/A THR 571.A OG1 MET 565.A O no hydrogen 2.755 N/A CYS 572.A N SER 568.A O no hydrogen 2.924 N/A CYS 572.A SG TYR 566.A O no hydrogen 4.017 N/A CYS 572.A SG PRO 573.A O no hydrogen 3.781 N/A GLU 575.A N GLU 575.A OE1 no hydrogen 2.807 N/A LEU 576.A N PRO 573.A O no hydrogen 3.167 N/A LEU 577.A N ASP 574.A O no hydrogen 3.016 N/A LEU 578.A N LEU 507.A O no hydrogen 3.064 N/A PHE 579.A N LEU 576.A O no hydrogen 2.962 N/A PHE 580.A N LEU 577.A O no hydrogen 3.175 N/A HIS 581.A N LEU 577.A O no hydrogen 2.803 N/A HIS 581.A NE2 TYR 566.A O no hydrogen 2.641 N/A HIS 582.A ND1 GLY 543.A O no hydrogen 2.664 N/A VAL 583.A N ILE 542.A O no hydrogen 2.854 N/A TYR 585.A N ASP 540.A O no hydrogen 2.969 N/A TYR 585.A OH ASP 538.A O no hydrogen 2.772 N/A HIS 587.A N PRO 584.A O no hydrogen 2.995 N/A ARG 588.A NH1.A GLY 592.A O no hydrogen 2.692 N/A LEU 589.A N GLU 593.A O no hydrogen 2.766 N/A HIS 590.A N ASP 574.A OD1 no hydrogen 2.964 N/A HIS 590.A NE2 ASP 570.A O no hydrogen 2.665 N/A SER 591.A N ASP 574.A OD2 no hydrogen 3.179 N/A SER 591.A OG GLU 593.A OE1 no hydrogen 2.720 N/A GLY 592.A N LEU 589.A O no hydrogen 2.877 N/A GLU 593.A N SER 591.A OG no hydrogen 3.291 N/A VAL 595.A N HIS 587.A O no hydrogen 2.884 N/A ILE 596.A N TYR 585.A O no hydrogen 3.027 N/A GLN 597.A N THR 594.A OG1 no hydrogen 3.073 N/A GLN 597.A NE2 ASN 601.A OD1 no hydrogen 2.875 N/A GLN 597.A NE2 ASP 662.A OD1 no hydrogen 2.807 N/A HIS 598.A N THR 594.A O no hydrogen 2.955 N/A HIS 598.A ND1 GLU 593.A OE1 no hydrogen 2.691 N/A ILE 599.A N VAL 595.A O no hydrogen 3.132 N/A TYR 600.A N ILE 596.A O no hydrogen 3.121 N/A TYR 600.A OH ILE 660.A O no hydrogen 2.658 N/A ASN 601.A N GLN 597.A O no hydrogen 2.758 N/A ASN 601.A ND2 GLU 593.A OE2 no hydrogen 2.867 N/A THR 602.A N HIS 598.A O no hydrogen 2.948 N/A THR 602.A OG1 ASN 502.A O no hydrogen 2.915 N/A THR 602.A OG1 HIS 598.A O no hydrogen 3.247 N/A THR 602.A OG1 ILE 599.A O no hydrogen 3.395 N/A THR 602.A OG1 HIS 603.A ND1 no hydrogen 3.246 N/A HIS 603.A N ILE 599.A O no hydrogen 3.188 N/A HIS 603.A ND1 ILE 599.A O no hydrogen 2.674 N/A HIS 603.A NE2 THR 504.A O no hydrogen 2.607 N/A PHE 604.A N TYR 600.A O no hydrogen 2.987 N/A GLU 605.A N ASN 601.A O no hydrogen 2.910 N/A GLY 606.A N THR 602.A O no hydrogen 2.764 N/A GLU 608.A N.A PHE 604.A O no hydrogen 3.434 N/A GLU 608.A N.B PHE 604.A O no hydrogen 3.450 N/A GLN 609.A N GLU 605.A O no hydrogen 2.928 N/A ALA 610.A N GLY 606.A O no hydrogen 2.934 N/A LYS 611.A N VAL 607.A O no hydrogen 2.945 N/A LYS 611.A NZ GLU 608.A OE2.B no hydrogen 3.250 N/A GLN 612.A N GLU 608.A O.A no hydrogen 3.077 N/A GLN 612.A N GLU 608.A O.B no hydrogen 3.096 N/A LEU 613.A N GLN 609.A O no hydrogen 3.013 N/A ARG 614.A N ALA 610.A O no hydrogen 3.220 N/A ARG 614.A NH1 THR 637.A OG1 no hydrogen 3.424 N/A LYS 615.A N LYS 611.A O no hydrogen 2.907 N/A ARG 616.A N GLN 612.A O no hydrogen 2.871 N/A ARG 616.A NH2 GLU 487.A OE1 no hydrogen 2.821 N/A ARG 616.A NH2 THR 488.A OG1 no hydrogen 3.038 N/A TRP 617.A N LEU 613.A O no hydrogen 3.123 N/A TRP 617.A NE1 TYR 629.A O no hydrogen 3.008 N/A GLU 618.A N ARG 614.A O no hydrogen 2.954 N/A GLN 619.A N LYS 615.A O no hydrogen 3.199 N/A LEU 620.A N TRP 617.A O no hydrogen 2.869 N/A LYS 621.A N GLU 618.A O no hydrogen 3.151 N/A LYS 621.A NZ GLU 626.A OE2 no hydrogen 3.154 N/A LYS 623.A N LEU 620.A O no hydrogen 2.857 N/A LYS 623.A NZ ASP 482.A OD1 no hydrogen 3.167 N/A LYS 623.A NZ ASP 482.A OD2 no hydrogen 2.982 N/A LYS 623.A NZ GLN 484.A OE1 no hydrogen 2.671 N/A LYS 627.A NZ ASP 631.A OD1 no hydrogen 3.107 N/A ARG 628.A N ASP 625.A OD1 no hydrogen 2.883 N/A ARG 628.A NE ASP 625.A OD2 no hydrogen 2.645 N/A ARG 628.A NH1 THR 478.A O no hydrogen 2.925 N/A ARG 628.A NH2 THR 478.A O no hydrogen 3.102 N/A ARG 628.A NH2 ASP 625.A OD2 no hydrogen 3.304 N/A TYR 629.A N ASP 625.A O no hydrogen 2.955 N/A HIS 630.A N GLU 626.A O no hydrogen 2.994 N/A HIS 630.A NE2 GLU 626.A OE1 no hydrogen 2.746 N/A ASP 631.A N LYS 627.A O no hydrogen 2.963 N/A VAL 632.A N ARG 628.A O no hydrogen 3.039 N/A LEU 633.A N TYR 629.A O no hydrogen 2.957 N/A GLU 634.A N.A HIS 630.A O no hydrogen 2.871 N/A GLU 634.A N.B HIS 630.A O no hydrogen 2.871 N/A ARG 635.A N ASP 631.A O no hydrogen 3.403 N/A ARG 635.A NH1 GLN 388.A O no hydrogen 2.788 N/A LEU 636.A N VAL 632.A O no hydrogen 2.860 N/A THR 637.A N LEU 633.A O no hydrogen 2.938 N/A THR 637.A OG1 LEU 633.A O no hydrogen 3.278 N/A ILE 638.A N GLU 634.A O.A no hydrogen 3.074 N/A ILE 638.A N GLU 634.A O.B no hydrogen 3.074 N/A GLN 639.A N ARG 635.A O no hydrogen 2.764 N/A GLN 639.A NE2 TYR 503.A OH no hydrogen 2.959 N/A VAL 640.A N LEU 636.A O no hydrogen 2.956 N/A GLU 641.A N THR 637.A O no hydrogen 3.096 N/A HIS 642.A N ILE 638.A O no hydrogen 2.992 N/A HIS 642.A ND1 HIS 390.A NE2 no hydrogen 2.776 N/A ALA 643.A N GLN 639.A O no hydrogen 2.770 N/A LYS 644.A N VAL 640.A O no hydrogen 3.177 N/A LYS 644.A NZ GLU 641.A OE2 no hydrogen 2.966 N/A TRP 646.A N HIS 642.A O no hydrogen 2.949 N/A ARG 647.A N ALA 643.A O no hydrogen 2.855 N/A ARG 647.A NE ASP 648.A OD1 no hydrogen 2.894 N/A ARG 647.A NH2 ASP 648.A OD1 no hydrogen 3.377 N/A ARG 647.A NH2 ASP 648.A OD2 no hydrogen 3.201 N/A ASP 648.A N LYS 644.A O no hydrogen 2.981 N/A VAL 649.A N GLU 645.A O no hydrogen 2.925 N/A ILE 650.A N TRP 646.A O no hydrogen 3.133 N/A ASN 651.A N ARG 647.A O no hydrogen 2.912 N/A THR 652.A N ASP 648.A O no hydrogen 2.886 N/A THR 652.A OG1 ASP 648.A O no hydrogen 3.011 N/A THR 652.A OG1 TYR 669.A O no hydrogen 2.673 N/A TYR 653.A N VAL 649.A O no hydrogen 2.920 N/A TYR 653.A OH ASP 524.A OD1 no hydrogen 2.619 N/A PHE 654.A N ILE 650.A O no hydrogen 3.065 N/A TYR 655.A N ASN 651.A O no hydrogen 2.869 N/A ARG 656.A N THR 652.A O no hydrogen 2.830 N/A ARG 656.A NE ARG 670.A O no hydrogen 2.830 N/A ARG 656.A NH2 ARG 670.A OXT no hydrogen 2.826 N/A LYS 657.A N TYR 653.A O no hydrogen 3.064 N/A LYS 657.A NZ ALA 537.A O no hydrogen 2.908 N/A LYS 657.A NZ TYR 653.A OH no hydrogen 2.805 N/A SER 658.A N PHE 654.A O no hydrogen 2.775 N/A SER 658.A OG PHE 654.A O no hydrogen 2.641 N/A GLY 659.A N TYR 655.A O no hydrogen 2.740 N/A ILE 660.A N SER 658.A OG no hydrogen 3.115 N/A ASP 662.A N ASP 661.A OD1.A no hydrogen 2.639 N/A GLN 663.A N GLN 597.A OE1 no hydrogen 2.801 N/A GLY 665.A N ASP 662.A O no hydrogen 3.097 N/A ARG 666.A N ASP 662.A OD2 no hydrogen 2.848 N/A ARG 666.A NE ASP 662.A OD2 no hydrogen 2.886 N/A ARG 666.A NH1 GLU 605.A OE2 no hydrogen 2.918 N/A ARG 666.A NH2 ASN 601.A OD1 no hydrogen 2.882 N/A ARG 666.A NH2 ASP 662.A OD1 no hydrogen 2.851 N/A