Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4iih_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): SER 4.A OG ASN 238.A OD1 no hydrogen 3.334 N/A PHE 7.A N SER 239.A OG no hydrogen 2.978 N/A SER 10.A OG ASN 243.A OD1 no hydrogen 2.711 N/A TRP 12.A NE1 GLY 653.A O no hydrogen 2.914 N/A ALA 13.A N ASP 311.A OD1 no hydrogen 2.829 N/A ASN 14.A N GLN 253.A OE1 no hydrogen 2.821 N/A TRP 19.A N GLN 16.A O no hydrogen 2.822 N/A ALA 20.A N GLY 17.A O no hydrogen 3.481 N/A TYR 23.A N TRP 19.A O no hydrogen 2.813 N/A GLN 24.A N ALA 20.A O no hydrogen 3.167 N/A ARG 25.A N GLU 21.A O no hydrogen 2.966 N/A ARG 25.A NH2 ASP 326.A OD2 no hydrogen 2.748 N/A ALA 26.A N ALA 22.A O no hydrogen 2.878 N/A VAL 27.A N TYR 23.A O no hydrogen 2.914 N/A ALA 28.A N GLN 24.A O no hydrogen 3.067 N/A ILE 29.A N ARG 25.A O no hydrogen 3.108 N/A VAL 30.A N ALA 26.A O no hydrogen 2.783 N/A SER 31.A N VAL 27.A O no hydrogen 2.760 N/A SER 31.A OG VAL 27.A O no hydrogen 2.681 N/A GLN 32.A N ILE 29.A O no hydrogen 3.044 N/A GLN 32.A NE2 ALA 28.A O no hydrogen 3.270 N/A MET 33.A N VAL 30.A O no hydrogen 2.992 N/A THR 34.A N GLU 37.A OE1 no hydrogen 2.960 N/A THR 34.A OG1 ASP 36.A OD1 no hydrogen 2.624 N/A LYS 38.A N THR 34.A O no hydrogen 3.066 N/A LYS 38.A NZ ASP 310.A OD1 no hydrogen 2.715 N/A LYS 38.A NZ PHE 658.A O no hydrogen 2.678 N/A VAL 39.A N LEU 35.A O no hydrogen 2.923 N/A ASN 40.A N ASP 36.A O no hydrogen 3.129 N/A ASN 40.A ND2 GLY 58.A O no hydrogen 2.836 N/A LEU 41.A N GLU 37.A O no hydrogen 3.291 N/A THR 42.A N VAL 39.A O no hydrogen 2.926 N/A THR 42.A OG1 VAL 39.A O no hydrogen 2.558 N/A THR 42.A OG1 THR 43.A OG1 no hydrogen 2.924 N/A THR 43.A OG1 VAL 39.A O no hydrogen 3.515 N/A THR 43.A OG1 THR 42.A OG1 no hydrogen 2.924 N/A GLY 44.A N SER 277.A O no hydrogen 2.910 N/A THR 45.A N GLN 55.A O no hydrogen 2.855 N/A THR 45.A OG1 GLU 50.A OE2 no hydrogen 2.721 N/A THR 45.A OG1 GLN 55.A O no hydrogen 3.374 N/A GLY 46.A N PRO 279.A O no hydrogen 3.057 N/A TRP 47.A N ASP 281.A OD2 no hydrogen 2.913 N/A LEU 49.A N GLY 46.A O no hydrogen 3.264 N/A LYS 51.A N GLN 55.A OE1 no hydrogen 2.915 N/A CYS 52.A N GLN 55.A OE1 no hydrogen 2.952 N/A CYS 52.A SG GLN 55.A OE1 no hydrogen 3.716 N/A VAL 53.A N GLN 70.A OE1 no hydrogen 2.785 N/A GLY 54.A N LEU 69.A O no hydrogen 3.081 N/A THR 56.A N MET 67.A O no hydrogen 2.976 N/A VAL 59.A N ILE 64.A O no hydrogen 2.851 N/A ARG 61.A NE GLU 37.A OE2 no hydrogen 2.712 N/A ARG 61.A NH2 GLN 32.A O no hydrogen 2.721 N/A ARG 61.A NH2 GLU 37.A OE1 no hydrogen 2.698 N/A ARG 61.A NH2 GLU 37.A OE2 no hydrogen 3.455 N/A LEU 62.A N VAL 59.A O no hydrogen 3.092 N/A ASN 63.A N PRO 60.A O no hydrogen 2.908 N/A ILE 64.A N VAL 59.A O no hydrogen 3.106 N/A MET 67.A N THR 56.A OG1 no hydrogen 3.130 N/A CYS 68.A N ASP 117.A OD2 no hydrogen 2.856 N/A CYS 68.A SG GLY 115.A O no hydrogen 3.977 N/A LEU 69.A N GLY 54.A O no hydrogen 2.797 N/A GLN 70.A N VAL 118.A O no hydrogen 2.929 N/A GLN 70.A NE2 ARG 77.A O no hydrogen 2.860 N/A GLN 70.A NE2 SER 336.A OG no hydrogen 2.831 N/A SER 72.A N GLY 75.A O no hydrogen 2.804 N/A SER 72.A OG GLY 75.A O no hydrogen 2.761 N/A SER 72.A OG THR 432.A O no hydrogen 3.384 N/A LEU 74.A N SER 72.A OG no hydrogen 3.013 N/A GLY 75.A N SER 72.A O no hydrogen 3.405 N/A ARG 77.A N ASP 71.A O no hydrogen 2.896 N/A ARG 77.A NH2 ASP 416.A OD1 no hydrogen 3.107 N/A ARG 77.A NH2 ASP 416.A OD2 no hydrogen 3.279 N/A ASP 80.A N SER 79.A OG no hydrogen 2.742 N/A ASN 82.A ND2 SER 83.A O no hydrogen 2.948 N/A ASN 82.A ND2 GLU 434.A O no hydrogen 2.998 N/A SER 83.A N GLU 110.A OE1 no hydrogen 2.732 N/A SER 83.A OG GLU 110.A OE2 no hydrogen 2.610 N/A ALA 84.A N GLN 555.A OE1 no hydrogen 2.848 N/A PHE 85.A N LEU 74.A O no hydrogen 2.895 N/A ALA 87.A N LEU 552.A O no hydrogen 3.010 N/A VAL 89.A N TRP 137.A O no hydrogen 3.032 N/A ASN 90.A ND2 SER 378.A OG no hydrogen 3.102 N/A ASN 90.A ND2 ALA 550.A O no hydrogen 2.841 N/A VAL 91.A N ALA 87.A O no hydrogen 3.242 N/A ALA 92.A N GLY 88.A O no hydrogen 2.971 N/A ALA 93.A N VAL 89.A O no hydrogen 2.978 N/A THR 94.A N ASN 90.A O no hydrogen 3.041 N/A THR 94.A N VAL 91.A O no hydrogen 2.971 N/A THR 94.A OG1 VAL 91.A O no hydrogen 2.630 N/A TRP 95.A N ALA 92.A O no hydrogen 2.938 N/A TRP 95.A NE1 LYS 574.A O no hydrogen 3.003 N/A ASP 96.A N THR 94.A OG1 no hydrogen 3.005 N/A LYS 97.A NZ PHE 773.A O no hydrogen 2.764 N/A LYS 97.A NZ ASP 774.A OD1 no hydrogen 2.827 N/A ASN 98.A N ASP 96.A OD1 no hydrogen 2.973 N/A LEU 99.A N ASP 96.A OD1 no hydrogen 3.204 N/A ALA 100.A N ASP 96.A O no hydrogen 2.973 N/A TYR 101.A N LYS 97.A O no hydrogen 2.984 N/A TYR 101.A OH ASP 160.A OD2 no hydrogen 2.422 N/A LEU 102.A N ASN 98.A O no hydrogen 2.809 N/A ARG 103.A N LEU 99.A O no hydrogen 2.849 N/A ARG 103.A NE PRO 86.A O no hydrogen 2.986 N/A ARG 103.A NH2 PRO 86.A O no hydrogen 2.985 N/A GLY 104.A N ALA 100.A O no hydrogen 3.004 N/A GLN 105.A N TYR 101.A O no hydrogen 2.812 N/A ALA 106.A N LEU 102.A O no hydrogen 2.879 N/A MET 107.A N ARG 103.A O no hydrogen 2.952 N/A GLY 108.A N GLY 104.A O no hydrogen 2.743 N/A GLN 109.A N GLN 105.A O no hydrogen 2.962 N/A GLU 110.A N ALA 106.A O no hydrogen 3.212 N/A PHE 111.A N MET 107.A O no hydrogen 2.894 N/A SER 112.A N GLY 108.A O no hydrogen 2.754 N/A ASP 113.A N GLN 109.A O no hydrogen 2.983 N/A LYS 114.A N GLU 110.A O no hydrogen 3.233 N/A LYS 114.A N PHE 111.A O no hydrogen 3.024 N/A LYS 114.A NZ ASP 80.A O no hydrogen 2.752 N/A LYS 114.A NZ ASP 80.A OD1 no hydrogen 2.938 N/A LYS 114.A NZ VAL 361.A O no hydrogen 2.834 N/A GLY 115.A N SER 112.A O no hydrogen 2.964 N/A ILE 116.A N PHE 111.A O no hydrogen 3.168 N/A ASP 117.A N CYS 68.A O no hydrogen 3.006 N/A VAL 118.A N CYS 68.A O no hydrogen 3.057 N/A GLN 119.A N VAL 164.A O no hydrogen 2.845 N/A GLN 119.A NE2 SER 72.A O no hydrogen 2.906 N/A LEU 120.A N GLN 70.A O no hydrogen 2.840 N/A GLY 121.A N GLN 119.A O no hydrogen 2.927 N/A ALA 124.A N LYS 168.A O no hydrogen 2.761 N/A GLY 125.A N LYS 168.A O no hydrogen 3.198 N/A LEU 127.A N GLU 174.A OE2 no hydrogen 2.775 N/A GLY 128.A N GLU 174.A OE1 no hydrogen 2.902 N/A ARG 129.A N GLU 174.A OE1 no hydrogen 2.828 N/A ARG 129.A NE GLU 607.A OE1 no hydrogen 3.496 N/A ARG 129.A NE GLU 607.A OE2 no hydrogen 2.686 N/A ARG 129.A NH2 GLU 607.A OE1 no hydrogen 2.948 N/A SER 130.A OG ASP 588.A O no hydrogen 2.728 N/A GLY 133.A N SER 130.A O no hydrogen 3.055 N/A GLY 134.A N ASP 499.A OD1 no hydrogen 2.944 N/A ARG 135.A NE GLU 138.A OE2 no hydrogen 2.790 N/A ARG 135.A NH2 GLU 138.A OE2 no hydrogen 3.001 N/A ASN 136.A ND2 SER 130.A O no hydrogen 2.800 N/A TRP 137.A NE1 GLY 134.A O no hydrogen 2.830 N/A GLU 138.A N ARG 135.A O no hydrogen 3.082 N/A GLY 139.A N ASN 136.A O no hydrogen 3.041 N/A SER 141.A N THR 147.A OG1 no hydrogen 2.780 N/A SER 141.A OG PRO 576.A O no hydrogen 2.579 N/A ASP 143.A N SER 141.A OG no hydrogen 2.999 N/A LEU 146.A N ASP 143.A OD2 no hydrogen 2.853 N/A THR 147.A N ASP 143.A O no hydrogen 3.059 N/A THR 147.A OG1 SER 141.A O no hydrogen 2.622 N/A THR 147.A OG1 ASP 143.A O no hydrogen 3.163 N/A GLY 148.A N PRO 144.A O no hydrogen 2.733 N/A VAL 149.A N ALA 145.A O no hydrogen 3.115 N/A LEU 150.A N LEU 146.A O no hydrogen 3.202 N/A PHE 151.A N THR 147.A O no hydrogen 2.761 N/A ALA 152.A N GLY 148.A O no hydrogen 2.990 N/A GLU 153.A N VAL 149.A O no hydrogen 2.990 N/A THR 154.A N LEU 150.A O no hydrogen 2.889 N/A THR 154.A OG1 LEU 150.A O no hydrogen 2.637 N/A ILE 155.A N PHE 151.A O no hydrogen 3.054 N/A LYS 156.A N ALA 152.A O no hydrogen 2.936 N/A LYS 156.A NZ ALA 218.A O no hydrogen 3.298 N/A GLY 157.A N GLU 153.A O no hydrogen 2.956 N/A ILE 158.A N THR 154.A O no hydrogen 2.980 N/A GLN 159.A N ILE 155.A O no hydrogen 2.935 N/A GLN 159.A NE2 GLY 219.A O no hydrogen 2.776 N/A ASP 160.A N LYS 156.A O no hydrogen 2.855 N/A ALA 161.A N GLY 157.A O no hydrogen 3.226 N/A ALA 161.A N ILE 158.A O no hydrogen 3.105 N/A GLY 162.A N GLN 159.A O no hydrogen 2.827 N/A VAL 163.A N ILE 158.A O no hydrogen 3.411 N/A VAL 164.A N ASP 117.A O no hydrogen 2.961 N/A ALA 165.A N GLN 159.A OE1 no hydrogen 2.811 N/A THR 166.A N GLY 121.A O no hydrogen 2.975 N/A THR 166.A OG1 GLN 119.A O no hydrogen 2.903 N/A ALA 167.A N ALA 222.A O no hydrogen 3.010 N/A LYS 168.A N PRO 122.A O no hydrogen 3.210 N/A LYS 168.A NZ LEU 120.A O no hydrogen 2.814 N/A HIS 169.A N GLY 125.A O no hydrogen 2.756 N/A HIS 169.A ND1 GLY 125.A O no hydrogen 2.790 N/A TYR 170.A N MET 224.A O no hydrogen 2.732 N/A TYR 170.A OH THR 241.A O no hydrogen 2.770 N/A ILE 171.A N SER 226.A OG no hydrogen 3.065 N/A GLN 175.A NE2 HIS 177.A O no hydrogen 2.911 N/A GLN 175.A NE2 VAL 591.A O no hydrogen 2.740 N/A GLU 176.A N ASP 499.A OD1 no hydrogen 2.819 N/A HIS 177.A N ASP 499.A OD2 no hydrogen 2.864 N/A HIS 177.A ND1 ASP 499.A OD2 no hydrogen 2.582 N/A ARG 179.A N GLU 176.A O no hydrogen 3.096 N/A ARG 179.A NE GLU 183.A OE1 no hydrogen 3.324 N/A ARG 179.A NE GLU 183.A OE2 no hydrogen 2.772 N/A ARG 179.A NH1 GLU 488.A OE1 no hydrogen 2.944 N/A ARG 179.A NH2 GLU 183.A OE1 no hydrogen 2.788 N/A ARG 179.A NH2 GLU 183.A OE2 no hydrogen 3.564 N/A ARG 179.A NH2 GLU 488.A OE1 no hydrogen 3.086 N/A GLN 180.A NE2 GLY 261.A O no hydrogen 3.620 N/A ALA 184.A N GLN 180.A O no hydrogen 2.945 N/A ALA 185.A N VAL 181.A O no hydrogen 3.017 N/A GLY 186.A N ALA 182.A O no hydrogen 2.934 N/A TYR 187.A N GLU 183.A O no hydrogen 3.180 N/A TYR 187.A N ALA 184.A O no hydrogen 3.048 N/A TYR 187.A OH GLY 489.A O no hydrogen 2.525 N/A GLY 188.A N ALA 185.A O no hydrogen 2.720 N/A PHE 189.A N ALA 184.A O no hydrogen 2.767 N/A SER 192.A OG ASP 193.A OD2 no hydrogen 3.468 N/A SER 192.A OG ASN 598.A O no hydrogen 3.402 N/A THR 194.A N TYR 234.A OH no hydrogen 3.355 N/A THR 194.A OG1 TYR 227.A O no hydrogen 2.770 N/A ILE 195.A N PHE 178.A O no hydrogen 2.883 N/A SER 196.A N PRO 601.A O no hydrogen 2.967 N/A SER 196.A OG ASN 198.A OD1 no hydrogen 2.623 N/A SER 197.A N GLN 229.A O no hydrogen 2.794 N/A SER 197.A OG LEU 172.A O no hydrogen 2.603 N/A ASN 198.A N ASP 603.A O no hydrogen 2.855 N/A ASN 198.A ND2 GLN 602.A OE1 no hydrogen 2.910 N/A ASN 198.A ND2 ASP 604.A OD1 no hydrogen 2.880 N/A LYS 202.A NZ GLU 206.A OE1 no hydrogen 2.719 N/A LYS 202.A NZ GLU 206.A OE2 no hydrogen 3.356 N/A LYS 202.A NZ GLU 765.A OE2 no hydrogen 2.756 N/A THR 203.A N ASP 200.A OD2 no hydrogen 2.949 N/A THR 203.A OG1 ASP 200.A OD1 no hydrogen 2.761 N/A THR 203.A OG1 ASP 200.A OD2 no hydrogen 3.212 N/A ILE 204.A N ASP 200.A O no hydrogen 3.111 N/A HIS 205.A N ASP 201.A O no hydrogen 3.211 N/A HIS 205.A ND1 ASP 201.A O no hydrogen 2.839 N/A HIS 205.A NE2 GLU 249.A OE1 no hydrogen 2.610 N/A GLU 206.A N LYS 202.A O no hydrogen 2.933 N/A MET 207.A N THR 203.A O no hydrogen 2.877 N/A LEU 209.A N ILE 204.A O no hydrogen 2.768 N/A TRP 210.A N MET 207.A O no hydrogen 3.274 N/A ALA 213.A N LEU 209.A O no hydrogen 3.016 N/A ASP 214.A N TRP 210.A O no hydrogen 3.139 N/A ALA 215.A N PRO 211.A O no hydrogen 2.949 N/A VAL 216.A N PHE 212.A O no hydrogen 2.931 N/A ARG 217.A N ALA 213.A O no hydrogen 2.888 N/A ARG 217.A NH1 SER 725.A O no hydrogen 3.235 N/A ALA 218.A N ASP 214.A O no hydrogen 2.913 N/A GLY 219.A N VAL 216.A O no hydrogen 2.923 N/A VAL 220.A N ALA 215.A O no hydrogen 3.088 N/A GLY 221.A N GLN 159.A OE1 no hydrogen 2.918 N/A ALA 222.A N ALA 165.A O no hydrogen 3.151 N/A ILE 223.A N PHE 255.A O no hydrogen 2.914 N/A MET 224.A N ALA 167.A O no hydrogen 2.939 N/A CYS 225.A N MET 257.A O no hydrogen 2.959 N/A CYS 225.A SG MET 257.A O no hydrogen 3.332 N/A SER 226.A OG ILE 171.A O no hydrogen 3.309 N/A SER 226.A OG ASN 228.A OD1 no hydrogen 2.707 N/A TYR 227.A OH TRP 260.A O no hydrogen 2.815 N/A ASN 228.A ND2 ILE 171.A O no hydrogen 2.993 N/A ASN 228.A ND2 GLN 229.A O no hydrogen 2.968 N/A GLN 229.A N ILE 195.A O no hydrogen 2.862 N/A GLN 229.A NE2 THR 194.A O no hydrogen 2.926 N/A ILE 230.A N SER 233.A O no hydrogen 2.941 N/A ASN 231.A N SER 197.A O no hydrogen 2.882 N/A ASN 231.A ND2 PHE 3.A O no hydrogen 2.964 N/A ASN 232.A N SER 196.A OG no hydrogen 2.787 N/A ASN 232.A ND2 ALA 2.A O no hydrogen 2.940 N/A ASN 232.A ND2 GLN 602.A OE1 no hydrogen 3.126 N/A SER 233.A N ILE 230.A O no hydrogen 3.064 N/A TYR 234.A OH ASP 193.A OD1 no hydrogen 2.626 N/A GLY 235.A N ASN 228.A O no hydrogen 2.920 N/A CYS 236.A SG SER 226.A O no hydrogen 3.850 N/A GLN 237.A N TYR 234.A O no hydrogen 2.912 N/A ASN 238.A ND2 SER 4.A OG no hydrogen 3.309 N/A ASN 238.A ND2 ILE 230.A O no hydrogen 3.206 N/A ASN 238.A ND2 SER 233.A O no hydrogen 3.024 N/A THR 241.A N ASN 238.A OD1 no hydrogen 2.899 N/A THR 241.A OG1 ASN 238.A O no hydrogen 3.416 N/A LEU 242.A N ASN 238.A O no hydrogen 2.824 N/A ASN 243.A N SER 239.A O no hydrogen 2.733 N/A ASN 243.A ND2 PHE 7.A O no hydrogen 2.939 N/A ASN 243.A ND2 LEU 271.A O no hydrogen 3.162 N/A LYS 244.A N SER 239.A O no hydrogen 2.991 N/A LYS 244.A NZ TYR 240.A OH no hydrogen 3.201 N/A LYS 244.A NZ GLN 803.A OE1 no hydrogen 3.476 N/A LEU 245.A N TYR 240.A O no hydrogen 2.781 N/A LEU 246.A N THR 241.A O no hydrogen 2.974 N/A LYS 247.A N LEU 242.A O no hydrogen 2.959 N/A LYS 247.A NZ GLY 273.A O no hydrogen 2.777 N/A LYS 247.A NZ ASP 275.A OD1 no hydrogen 3.309 N/A LYS 247.A NZ ASP 275.A OD2 no hydrogen 2.760 N/A ALA 248.A N ASN 243.A O no hydrogen 2.815 N/A GLU 249.A N LYS 244.A O no hydrogen 2.682 N/A LEU 250.A N LEU 245.A O no hydrogen 2.887 N/A PHE 252.A N LEU 246.A O no hydrogen 3.078 N/A GLN 253.A NE2 GLY 251.A O no hydrogen 3.028 N/A PHE 255.A N GLY 221.A O no hydrogen 3.053 N/A VAL 256.A N ASP 275.A OD2 no hydrogen 2.842 N/A MET 257.A N ILE 223.A O no hydrogen 2.781 N/A SER 258.A N MET 276.A O no hydrogen 2.902 N/A SER 258.A OG ASP 259.A O no hydrogen 3.106 N/A SER 258.A OG MET 278.A O no hydrogen 3.135 N/A ASP 259.A N CYS 225.A O no hydrogen 3.197 N/A TRP 260.A N ASP 259.A OD1 no hydrogen 2.839 N/A TRP 260.A NE1 VAL 53.A O no hydrogen 2.678 N/A ALA 262.A N ASP 259.A O no hydrogen 2.959 N/A HIS 263.A ND1 SER 277.A OG no hydrogen 2.677 N/A HIS 263.A NE2 SER 269.A OG no hydrogen 2.765 N/A SER 265.A OG GLN 237.A OE1 no hydrogen 2.707 N/A SER 269.A N SER 265.A OG no hydrogen 2.994 N/A SER 269.A OG HIS 263.A NE2 no hydrogen 2.765 N/A SER 269.A OG SER 265.A O no hydrogen 2.588 N/A SER 269.A OG GLY 266.A O no hydrogen 3.025 N/A ALA 270.A N GLY 266.A O no hydrogen 3.117 N/A LEU 271.A N VAL 267.A O no hydrogen 3.046 N/A ALA 272.A N GLY 268.A O no hydrogen 2.947 N/A GLY 273.A N ALA 270.A O no hydrogen 3.461 N/A LEU 274.A N SER 269.A O no hydrogen 3.024 N/A ASP 275.A N VAL 256.A O no hydrogen 2.822 N/A MET 276.A N VAL 256.A O no hydrogen 2.872 N/A SER 277.A N THR 42.A O no hydrogen 2.690 N/A SER 277.A OG HIS 263.A ND1 no hydrogen 2.677 N/A MET 278.A N SER 258.A OG no hydrogen 2.881 N/A ILE 282.A N THR 288.A O no hydrogen 2.995 N/A ASP 285.A N ASP 281.A OD2 no hydrogen 2.739 N/A SER 286.A N THR 283.A O no hydrogen 2.995 N/A SER 286.A OG THR 283.A O no hydrogen 3.006 N/A SER 286.A OG THR 288.A O no hydrogen 3.355 N/A SER 286.A OG THR 288.A OG1 no hydrogen 2.860 N/A THR 288.A N SER 286.A OG no hydrogen 3.271 N/A THR 288.A OG1 SER 286.A OG no hydrogen 2.860 N/A SER 289.A OG GLY 280.A O no hydrogen 2.665 N/A TRP 291.A N SER 289.A OG no hydrogen 2.976 N/A TRP 291.A NE1 GLY 266.A O no hydrogen 2.996 N/A GLY 292.A N THR 43.A OG1 no hydrogen 3.034 N/A THR 293.A N TYR 681.A O no hydrogen 2.896 N/A THR 293.A OG1 TYR 681.A O no hydrogen 3.341 N/A THR 293.A OG1 TRP 683.A O no hydrogen 2.730 N/A ASN 294.A N TRP 291.A O no hydrogen 3.069 N/A ASN 294.A ND2 SER 289.A O no hydrogen 2.806 N/A LEU 295.A N GLY 292.A O no hydrogen 2.923 N/A THR 296.A N GLY 292.A O no hydrogen 3.251 N/A THR 296.A OG1 GLY 292.A O no hydrogen 3.449 N/A THR 296.A OG1 PRO 682.A O no hydrogen 2.498 N/A ILE 297.A N THR 293.A O no hydrogen 2.980 N/A ALA 298.A N ASN 294.A O no hydrogen 2.852 N/A VAL 299.A N LEU 295.A O no hydrogen 3.124 N/A VAL 299.A N THR 296.A O no hydrogen 3.263 N/A LEU 300.A N THR 296.A O no hydrogen 2.975 N/A ASN 301.A N ILE 297.A O no hydrogen 2.828 N/A ASN 301.A ND2 TYR 698.A OH no hydrogen 2.970 N/A GLY 302.A N VAL 299.A O no hydrogen 3.060 N/A THR 303.A N ALA 298.A O no hydrogen 2.956 N/A THR 303.A N ASN 301.A OD1 no hydrogen 3.005 N/A THR 303.A OG1 ASN 301.A OD1 no hydrogen 2.845 N/A VAL 304.A N ALA 298.A O no hydrogen 2.877 N/A GLN 306.A NE2 ASP 310.A OD1 no hydrogen 3.495 N/A GLN 306.A NE2 ASP 310.A OD2 no hydrogen 2.687 N/A GLN 306.A NE2 PHE 658.A O no hydrogen 3.663 N/A GLN 306.A NE2 GLY 659.A O no hydrogen 3.171 N/A ARG 308.A N PRO 305.A O no hydrogen 2.944 N/A ARG 308.A NH1 ALA 270.A O no hydrogen 2.934 N/A ARG 308.A NH1 LEU 274.A O no hydrogen 3.060 N/A ARG 308.A NH1 ASP 275.A OD1 no hydrogen 3.448 N/A ARG 308.A NH2 ASP 275.A OD1 no hydrogen 2.866 N/A ARG 308.A NH2 ASP 311.A OD2 no hydrogen 3.096 N/A ASP 310.A N GLN 306.A O no hydrogen 2.885 N/A ASP 311.A N TRP 307.A O no hydrogen 2.932 N/A MET 312.A N ARG 308.A O no hydrogen 3.040 N/A ALA 313.A N VAL 309.A O no hydrogen 3.039 N/A VAL 314.A N ASP 310.A O no hydrogen 2.863 N/A ARG 315.A N ASP 311.A O no hydrogen 2.835 N/A ARG 315.A NE ASP 311.A OD2 no hydrogen 2.804 N/A ARG 315.A NH1 PHE 252.A O no hydrogen 2.764 N/A ARG 315.A NH1 GLY 254.A O no hydrogen 2.794 N/A ARG 315.A NH2 PRO 11.A O no hydrogen 2.872 N/A ARG 315.A NH2 PHE 252.A O no hydrogen 3.546 N/A ILE 316.A N MET 312.A O no hydrogen 2.923 N/A MET 317.A N ALA 313.A O no hydrogen 2.916 N/A ALA 318.A N VAL 314.A O no hydrogen 2.858 N/A ALA 319.A N ARG 315.A O no hydrogen 3.049 N/A TYR 320.A N ILE 316.A O no hydrogen 3.184 N/A TYR 321.A N MET 317.A O no hydrogen 2.843 N/A LYS 322.A N ALA 318.A O no hydrogen 2.756 N/A LYS 322.A NZ GLU 18.A OE2 no hydrogen 2.678 N/A LYS 322.A NZ GLY 219.A O no hydrogen 3.383 N/A VAL 323.A N ALA 319.A O no hydrogen 3.329 N/A GLY 324.A N TYR 321.A O no hydrogen 2.806 N/A ARG 325.A N TYR 320.A O no hydrogen 3.077 N/A ARG 325.A NE ASP 117.A OD1 no hydrogen 2.872 N/A ARG 325.A NH1 SER 112.A OG no hydrogen 2.715 N/A ARG 325.A NH1 GLY 162.A O no hydrogen 2.933 N/A ARG 325.A NH2 SER 112.A O no hydrogen 3.248 N/A ARG 327.A N GLY 324.A O no hydrogen 2.911 N/A LEU 328.A N ARG 325.A O no hydrogen 2.958 N/A ASN 333.A N LYS 114.A O no hydrogen 2.949 N/A ASN 333.A ND2 ASP 113.A O no hydrogen 3.033 N/A ASN 333.A ND2 GLN 330.A OE1 no hydrogen 3.099 N/A SER 335.A N ASN 358.A OD1 no hydrogen 2.969 N/A SER 336.A N LYS 51.A O no hydrogen 2.959 N/A SER 336.A OG LYS 51.A O no hydrogen 2.807 N/A TRP 337.A N SER 335.A OG no hydrogen 3.062 N/A TRP 337.A NE1 GLU 50.A O no hydrogen 2.731 N/A ARG 339.A NH1 ASP 78.A O no hydrogen 2.991 N/A ARG 339.A NH1 SER 335.A O no hydrogen 3.363 N/A ARG 339.A NH2 SER 335.A O no hydrogen 2.756 N/A ARG 339.A NH2 ASN 358.A OD1 no hydrogen 3.043 N/A ASP 340.A N THR 338.A OG1 no hydrogen 3.092 N/A GLY 343.A N GLU 355.A O no hydrogen 2.925 N/A LYS 345.A N PRO 353.A O no hydrogen 2.802 N/A TYR 346.A N GLU 351.A O no hydrogen 3.012 N/A TYR 348.A N GLU 48.A O no hydrogen 2.861 N/A GLN 350.A N PHE 347.A O no hydrogen 3.094 N/A GLN 350.A NE2 PHE 347.A O no hydrogen 2.855 N/A GLU 351.A N TYR 346.A O no hydrogen 3.193 N/A GLU 355.A N GLY 343.A O no hydrogen 2.983 N/A VAL 357.A N GLU 341.A O no hydrogen 2.826 N/A ASN 358.A N GLU 341.A O no hydrogen 3.037 N/A ASN 358.A ND2 THR 338.A O no hydrogen 2.731 N/A ASN 358.A ND2 ASP 340.A O no hydrogen 2.827 N/A HIS 359.A N ASN 333.A O no hydrogen 2.970 N/A VAL 363.A N TYR 81.A O no hydrogen 3.084 N/A GLN 364.A N ASN 362.A OD1 no hydrogen 2.999 N/A GLN 364.A NE2 ASN 362.A OD1 no hydrogen 3.085 N/A ARG 365.A NH2 ASP 113.A OD2 no hydrogen 2.774 N/A HIS 367.A N GLN 364.A O no hydrogen 2.864 N/A HIS 367.A ND1 GLU 110.A OE2 no hydrogen 2.590 N/A HIS 367.A NE2 GLN 109.A OE1 no hydrogen 2.728 N/A GLU 369.A N ASN 366.A O no hydrogen 3.070 N/A ILE 371.A N HIS 367.A O no hydrogen 3.183 N/A ARG 372.A N SER 368.A O no hydrogen 2.792 N/A ARG 372.A NE ASP 563.A OD2 no hydrogen 2.712 N/A ARG 372.A NH2 ASP 563.A OD1 no hydrogen 2.832 N/A ARG 372.A NH2 ASP 563.A OD2 no hydrogen 3.521 N/A LYS 373.A N GLU 369.A O no hydrogen 2.929 N/A LYS 373.A NZ ASP 377.A OD2 no hydrogen 2.693 N/A LEU 374.A N VAL 370.A O no hydrogen 2.762 N/A GLY 375.A N ILE 371.A O no hydrogen 2.821 N/A ALA 376.A N ARG 372.A O no hydrogen 3.044 N/A ASP 377.A N LYS 373.A O no hydrogen 2.800 N/A SER 378.A N GLY 375.A O no hydrogen 3.275 N/A SER 378.A OG LEU 374.A O no hydrogen 2.681 N/A SER 378.A OG GLY 375.A O no hydrogen 2.929 N/A THR 379.A N ALA 376.A O no hydrogen 3.193 N/A THR 379.A OG1 GLY 375.A O no hydrogen 2.916 N/A VAL 380.A N TRP 549.A O no hydrogen 2.832 N/A LEU 382.A N ILE 547.A O no hydrogen 2.747 N/A LYS 383.A N ILE 547.A O no hydrogen 3.239 N/A LYS 383.A NZ TYR 539.A O no hydrogen 2.583 N/A LYS 383.A NZ VAL 544.A O no hydrogen 2.775 N/A ASN 384.A ND2 LEU 388.A O no hydrogen 2.958 N/A ASN 385.A N THR 545.A O no hydrogen 2.687 N/A ALA 387.A N ASN 384.A OD1 no hydrogen 2.873 N/A LEU 388.A N ASN 384.A OD1 no hydrogen 2.879 N/A LEU 390.A N LEU 565.A O no hydrogen 2.772 N/A THR 391.A N GLU 394.A OE2 no hydrogen 2.962 N/A THR 391.A OG1 GLU 394.A OE2 no hydrogen 3.461 N/A GLY 392.A N GLU 394.A OE1 no hydrogen 2.685 N/A LYS 393.A N THR 391.A OG1 no hydrogen 2.878 N/A ARG 395.A N SER 476.A OG no hydrogen 3.136 N/A LYS 396.A N SER 476.A OG no hydrogen 3.065 N/A LYS 396.A NZ SER 455.A OG no hydrogen 2.842 N/A VAL 397.A N SER 455.A O no hydrogen 2.813 N/A ALA 398.A N VAL 477.A O no hydrogen 3.021 N/A ILE 399.A N TYR 457.A O no hydrogen 2.751 N/A LEU 400.A N LEU 479.A O no hydrogen 2.813 N/A GLY 401.A N ILE 459.A O no hydrogen 2.666 N/A GLU 402.A N ASN 462.A OD1 no hydrogen 2.798 N/A ALA 404.A N GLY 401.A O no hydrogen 2.830 N/A GLY 405.A N GLU 402.A O no hydrogen 2.936 N/A TYR 409.A N ASN 407.A OD1 no hydrogen 2.938 N/A GLY 410.A N ASN 407.A O no hydrogen 2.721 N/A ASN 412.A ND2 PHE 435.A O no hydrogen 2.966 N/A GLY 413.A N GLY 410.A O no hydrogen 2.908 N/A ARG 417.A N CYS 414.A O no hydrogen 2.866 N/A ARG 417.A NH1 ASN 412.A O no hydrogen 3.250 N/A ARG 417.A NH1 CYS 414.A O no hydrogen 2.936 N/A ARG 417.A NH1 GLU 434.A OE2 no hydrogen 3.131 N/A ARG 417.A NH2 GLU 434.A OE2 no hydrogen 2.963 N/A GLY 418.A N SER 415.A O no hydrogen 2.933 N/A CYS 419.A N ARG 417.A O no hydrogen 2.832 N/A GLY 422.A N GLU 402.A OE2 no hydrogen 2.869 N/A THR 423.A N GLY 405.A O no hydrogen 2.851 N/A THR 423.A OG1 ASP 403.A O no hydrogen 2.699 N/A LEU 424.A N ASP 403.A OD1 no hydrogen 2.895 N/A TRP 428.A N ALA 486.A O no hydrogen 3.245 N/A TRP 428.A NE1 GLU 488.A O no hydrogen 3.026 N/A GLY 429.A N ASP 416.A O no hydrogen 2.926 N/A SER 430.A N GLU 488.A OE2 no hydrogen 2.800 N/A SER 430.A OG GLU 488.A OE2 no hydrogen 2.612 N/A THR 432.A OG1 GLY 429.A O no hydrogen 2.673 N/A PHE 435.A N ASN 412.A OD1 no hydrogen 2.814 N/A TYR 437.A OH GLU 556.A OE2 no hydrogen 2.587 N/A VAL 439.A N GLN 555.A O no hydrogen 2.993 N/A THR 440.A N GLN 443.A OE1 no hydrogen 2.961 N/A GLU 442.A N ALA 404.A O no hydrogen 2.764 N/A GLN 443.A N THR 440.A OG1 no hydrogen 3.028 N/A ALA 444.A N THR 440.A O no hydrogen 3.100 N/A ILE 445.A N PRO 441.A O no hydrogen 2.838 N/A GLN 446.A N GLU 442.A O no hydrogen 2.897 N/A ALA 447.A N GLN 443.A O no hydrogen 2.954 N/A GLU 448.A N ALA 444.A O no hydrogen 2.974 N/A VAL 449.A N ILE 445.A O no hydrogen 3.004 N/A LEU 450.A N GLN 446.A O no hydrogen 3.044 N/A LYS 451.A N ALA 447.A O no hydrogen 3.047 N/A LYS 451.A NZ GLU 448.A OE2 no hydrogen 3.323 N/A HIS 452.A N GLU 448.A O no hydrogen 3.351 N/A LYS 453.A N LEU 450.A O no hydrogen 2.961 N/A GLY 454.A N VAL 449.A O no hydrogen 2.958 N/A SER 455.A N ARG 395.A O no hydrogen 3.107 N/A TYR 457.A N VAL 397.A O no hydrogen 3.309 N/A TYR 457.A OH SER 455.A OG no hydrogen 3.057 N/A ILE 459.A N ILE 399.A O no hydrogen 2.780 N/A ASN 462.A ND2 LYS 507.A O no hydrogen 2.812 N/A TRP 463.A N ASP 461.A OD1 no hydrogen 2.940 N/A ALA 464.A N ASP 461.A O no hydrogen 2.862 N/A GLN 467.A N GLN 467.A OE1 no hydrogen 2.798 N/A VAL 468.A N ALA 464.A O no hydrogen 3.046 N/A GLU 469.A N LEU 465.A O no hydrogen 2.900 N/A THR 470.A N SER 466.A O no hydrogen 2.954 N/A THR 470.A OG1 SER 466.A O no hydrogen 3.066 N/A LEU 471.A N GLN 467.A O no hydrogen 2.936 N/A ALA 472.A N VAL 468.A O no hydrogen 2.805 N/A LYS 473.A N GLU 469.A O no hydrogen 3.132 N/A GLN 474.A N LEU 471.A O no hydrogen 2.790 N/A GLN 474.A NE2 THR 470.A O no hydrogen 3.410 N/A ALA 475.A N ALA 472.A O no hydrogen 3.212 N/A SER 476.A N LYS 396.A O no hydrogen 2.722 N/A SER 476.A OG LYS 396.A O no hydrogen 3.436 N/A SER 478.A N ASN 522.A O no hydrogen 3.015 N/A LEU 479.A N ALA 398.A O no hydrogen 2.777 N/A VAL 480.A N ILE 524.A O no hydrogen 2.772 N/A PHE 481.A N LEU 400.A O no hydrogen 2.740 N/A VAL 482.A N VAL 526.A O no hydrogen 3.025 N/A ASN 483.A ND2 ASP 403.A OD1 no hydrogen 2.908 N/A SER 484.A N HIS 528.A O no hydrogen 3.362 N/A ALA 486.A N ASP 485.A OD1 no hydrogen 2.983 N/A GLY 487.A N GLY 498.A O no hydrogen 3.036 N/A GLU 488.A N TRP 428.A O no hydrogen 3.020 N/A GLY 489.A N GLU 176.A OE1 no hydrogen 2.716 N/A TYR 490.A OH ASP 416.A OD2 no hydrogen 2.623 N/A ILE 491.A N GLU 488.A O no hydrogen 3.237 N/A VAL 493.A N ASN 496.A O no hydrogen 3.173 N/A ASN 496.A N VAL 493.A O no hydrogen 2.933 N/A ASN 496.A ND2 VAL 493.A O no hydrogen 2.999 N/A GLY 498.A N ASN 496.A O no hydrogen 2.824 N/A ARG 500.A N ASP 132.A O no hydrogen 2.937 N/A ARG 500.A NH1 SER 484.A OG no hydrogen 2.836 N/A ARG 500.A NH1 PRO 532.A O no hydrogen 2.848 N/A ARG 500.A NH2 PRO 131.A O no hydrogen 2.855 N/A ARG 500.A NH2 PRO 532.A O no hydrogen 2.829 N/A ASN 501.A N ASN 496.A OD1 no hydrogen 2.652 N/A ASN 501.A ND2 GLY 495.A O no hydrogen 3.002 N/A THR 504.A N ASN 502.A OD1 no hydrogen 2.925 N/A TRP 506.A N ASN 483.A O no hydrogen 2.779 N/A LYS 507.A NZ GLU 402.A OE1 no hydrogen 3.229 N/A LYS 507.A NZ GLU 402.A OE2 no hydrogen 2.867 N/A LYS 507.A NZ ASP 420.A O no hydrogen 2.999 N/A LYS 507.A NZ ASN 421.A OD1 no hydrogen 3.087 N/A ASN 508.A ND2 ASN 462.A O no hydrogen 2.940 N/A GLY 509.A N TRP 506.A O no hydrogen 3.057 N/A ASN 511.A ND2 ASN 508.A OD1 no hydrogen 2.984 N/A LEU 512.A N ASN 508.A O no hydrogen 3.010 N/A ILE 513.A N GLY 509.A O no hydrogen 3.065 N/A LYS 514.A N ASP 510.A O no hydrogen 3.080 N/A LYS 514.A NZ GLU 537.A OE1 no hydrogen 2.637 N/A ALA 515.A N ASN 511.A O no hydrogen 2.818 N/A ALA 516.A N LEU 512.A O no hydrogen 3.055 N/A ALA 517.A N ILE 513.A O no hydrogen 2.721 N/A ASN 518.A N LYS 514.A O no hydrogen 2.890 N/A ASN 519.A N ALA 516.A O no hydrogen 2.895 N/A ASN 519.A ND2 ALA 515.A O no hydrogen 2.857 N/A CYS 520.A SG ALA 475.A O no hydrogen 3.921 N/A CYS 520.A SG SER 478.A OG no hydrogen 3.355 N/A ASN 522.A ND2 SER 476.A O no hydrogen 3.429 N/A THR 523.A N ASN 543.A O no hydrogen 2.876 N/A THR 523.A OG1 CYS 520.A O no hydrogen 3.010 N/A ILE 524.A N SER 478.A O no hydrogen 2.712 N/A VAL 525.A N ALA 546.A O no hydrogen 2.931 N/A VAL 526.A N VAL 480.A O no hydrogen 2.708 N/A ILE 527.A N LEU 548.A O no hydrogen 2.876 N/A HIS 528.A N VAL 482.A O no hydrogen 2.910 N/A HIS 528.A ND1 ASP 403.A OD2 no hydrogen 2.513 N/A SER 529.A OG GLY 531.A O no hydrogen 2.777 N/A VAL 530.A N SER 484.A O no hydrogen 3.247 N/A LEU 534.A N LEU 503.A O no hydrogen 2.848 N/A TRP 538.A N VAL 535.A O no hydrogen 3.057 N/A TRP 538.A NE1 ASP 510.A OD1 no hydrogen 2.723 N/A TYR 539.A N VAL 535.A O no hydrogen 2.984 N/A HIS 541.A N TRP 538.A O no hydrogen 3.026 N/A HIS 541.A NE2 ASN 518.A OD1 no hydrogen 2.916 N/A ASN 543.A N HIS 541.A ND1 no hydrogen 2.967 N/A ASN 543.A ND2 ALA 517.A O no hydrogen 2.622 N/A VAL 544.A N HIS 541.A O no hydrogen 3.055 N/A THR 545.A N THR 523.A O no hydrogen 2.855 N/A THR 545.A OG1 ASN 522.A OD1 no hydrogen 2.760 N/A THR 545.A OG1 THR 523.A O no hydrogen 3.471 N/A ILE 547.A N LYS 383.A O no hydrogen 2.944 N/A LEU 548.A N VAL 525.A O no hydrogen 2.787 N/A TRP 549.A N VAL 380.A O no hydrogen 2.881 N/A TRP 549.A NE1 SER 529.A OG no hydrogen 2.763 N/A ALA 550.A N ILE 527.A O no hydrogen 2.747 N/A LEU 552.A N ASN 90.A OD1 no hydrogen 2.686 N/A GLY 554.A N ALA 425.A O no hydrogen 3.060 N/A GLN 555.A N ALA 84.A O no hydrogen 3.074 N/A GLN 555.A NE2 TYR 437.A OH no hydrogen 2.810 N/A SER 557.A N GLY 554.A O no hydrogen 3.204 N/A GLY 558.A N VAL 439.A O no hydrogen 2.850 N/A ASN 559.A ND2 GLU 556.A OE1 no hydrogen 2.810 N/A SER 560.A N GLU 556.A O no hydrogen 2.880 N/A SER 560.A OG ARG 372.A O no hydrogen 2.837 N/A SER 560.A OG GLU 556.A O no hydrogen 3.469 N/A LEU 561.A N SER 557.A O no hydrogen 3.008 N/A ALA 562.A N GLY 558.A O no hydrogen 2.880 N/A ASP 563.A N ASN 559.A O no hydrogen 2.922 N/A LEU 565.A N LEU 561.A O no hydrogen 2.895 N/A TYR 566.A N ALA 562.A O no hydrogen 2.885 N/A GLY 567.A N VAL 564.A O no hydrogen 3.029 N/A ARG 568.A NE ASP 563.A OD1 no hydrogen 2.902 N/A ARG 568.A NH1 GLU 448.A OE1 no hydrogen 3.471 N/A ARG 568.A NH1 GLU 448.A OE2 no hydrogen 2.858 N/A ARG 568.A NH2 GLU 448.A OE1 no hydrogen 3.103 N/A ARG 568.A NH2 ASP 563.A OD1 no hydrogen 3.350 N/A VAL 569.A N ASP 563.A O no hydrogen 2.845 N/A ASN 570.A ND2 ALA 749.A O no hydrogen 2.800 N/A LYS 574.A N ALA 93.A O no hydrogen 2.982 N/A LYS 574.A NZ GLY 630.A O no hydrogen 2.800 N/A SER 575.A N HIS 629.A O no hydrogen 2.781 N/A SER 575.A OG PHE 577.A O no hydrogen 2.639 N/A THR 578.A N ASP 612.A OD1 no hydrogen 2.828 N/A THR 578.A OG1 ASP 612.A OD2 no hydrogen 2.657 N/A TRP 579.A N TYR 625.A O no hydrogen 2.859 N/A TRP 579.A NE1 SER 575.A OG no hydrogen 2.796 N/A GLY 580.A N TYR 586.A OH no hydrogen 2.882 N/A LYS 581.A NZ THR 622.A O no hydrogen 3.158 N/A ARG 583.A NE ASP 132.A OD2 no hydrogen 2.951 N/A ARG 583.A NH1 ARG 583.A O no hydrogen 2.893 N/A ARG 583.A NH1 GLY 587.A O no hydrogen 2.597 N/A ARG 583.A NH2 ASP 132.A OD1 no hydrogen 2.974 N/A ARG 583.A NH2 ASP 132.A OD2 no hydrogen 3.420 N/A ARG 583.A NH2 GLY 587.A O no hydrogen 3.422 N/A ARG 583.A NH2 ASP 588.A O no hydrogen 2.928 N/A ALA 585.A N THR 582.A OG1 no hydrogen 3.031 N/A TYR 586.A N ARG 583.A O no hydrogen 3.140 N/A TYR 586.A OH THR 578.A O no hydrogen 2.594 N/A GLY 587.A N GLU 584.A O no hydrogen 3.079 N/A VAL 591.A N GLN 175.A OE1 no hydrogen 2.775 N/A ARG 592.A NH2 ASP 132.A OD2 no hydrogen 2.997 N/A ARG 592.A NH2 ARG 500.A O no hydrogen 2.839 N/A ASN 595.A ND2 GLN 602.A O no hydrogen 2.812 N/A ASN 596.A ND2 ALA 600.A O no hydrogen 2.979 N/A ASN 598.A ND2 ASN 190.A O no hydrogen 2.882 N/A GLY 599.A N ASN 596.A O no hydrogen 2.894 N/A GLN 602.A N ASN 595.A OD1 no hydrogen 2.916 N/A GLN 602.A NE2 ASN 232.A OD1 no hydrogen 3.014 N/A GLN 602.A NE2 ALA 600.A O no hydrogen 2.914 N/A ASP 603.A N SER 196.A O no hydrogen 2.776 N/A PHE 605.A N ASN 198.A O no hydrogen 2.924 N/A GLU 607.A N GLU 607.A OE1 no hydrogen 2.739 N/A GLY 608.A N PHE 605.A O no hydrogen 2.998 N/A PHE 610.A N GLU 607.A O no hydrogen 3.163 N/A ILE 611.A N VAL 609.A O no hydrogen 2.854 N/A TYR 613.A OH ASP 143.A OD1 no hydrogen 2.566 N/A ARG 614.A NH1 ASP 143.A OD1 no hydrogen 3.018 N/A GLY 615.A N ASP 612.A O no hydrogen 2.946 N/A PHE 616.A N ASP 612.A O no hydrogen 3.291 N/A ASP 617.A N TYR 613.A O no hydrogen 2.854 N/A LYS 618.A N ARG 614.A O no hydrogen 2.952 N/A ARG 619.A N GLY 615.A O no hydrogen 2.999 N/A ARG 619.A NH1 ALA 585.A O no hydrogen 2.920 N/A ASN 620.A N ASP 617.A O no hydrogen 3.109 N/A GLU 621.A N PHE 616.A O no hydrogen 2.859 N/A ILE 624.A N TRP 579.A O no hydrogen 2.929 N/A TYR 625.A N TRP 579.A O no hydrogen 3.389 N/A GLU 626.A N GLU 626.A OE1 no hydrogen 2.624 N/A GLY 628.A N SER 575.A O no hydrogen 2.786 N/A HIS 629.A N GLU 626.A O no hydrogen 2.963 N/A HIS 629.A NE2 LEU 382.A O no hydrogen 2.777 N/A LEU 631.A N LEU 381.A O no hydrogen 2.718 N/A SER 632.A OG ASN 570.A OD1 no hydrogen 3.092 N/A SER 632.A OG THR 634.A O no hydrogen 3.553 N/A TYR 633.A N ASN 570.A OD1 no hydrogen 2.646 N/A TYR 633.A OH VAL 564.A O no hydrogen 2.625 N/A THR 634.A N SER 632.A OG no hydrogen 2.991 N/A THR 634.A OG1 ASN 744.A OD1 no hydrogen 2.685 N/A THR 634.A OG1 VAL 748.A O no hydrogen 3.252 N/A THR 635.A OG1 THR 745.A OG1 no hydrogen 2.774 N/A ASN 637.A N LYS 743.A O no hydrogen 2.872 N/A SER 639.A N THR 741.A O no hydrogen 2.913 N/A HIS 642.A N SER 739.A O no hydrogen 2.908 N/A GLN 644.A N ARG 737.A O no hydrogen 2.711 N/A LEU 646.A N LEU 735.A O no hydrogen 2.821 N/A THR 652.A N GLN 716.A O no hydrogen 2.885 N/A THR 652.A OG1 GLY 653.A O no hydrogen 2.810 N/A ALA 655.A N GLY 713.A O no hydrogen 2.714 N/A PHE 658.A N ASP 310.A OD2 no hydrogen 2.674 N/A GLY 662.A N TYR 667.A OH no hydrogen 2.932 N/A ASP 666.A N ASN 663.A O no hydrogen 3.032 N/A TYR 667.A N ALA 664.A O no hydrogen 2.900 N/A VAL 668.A N SER 665.A O no hydrogen 3.531 N/A TYR 669.A N LEU 684.A O no hydrogen 2.974 N/A ARG 675.A NH1 ASN 685.A OD1 no hydrogen 3.506 N/A ARG 675.A NH2 ASN 685.A OD1 no hydrogen 2.810 N/A ILE 676.A N TYR 681.A OH no hydrogen 2.925 N/A SER 677.A N GLU 351.A OE1 no hydrogen 3.049 N/A SER 677.A OG GLU 351.A OE1 no hydrogen 3.353 N/A SER 677.A OG GLU 351.A OE2 no hydrogen 2.595 N/A PHE 679.A N ILE 676.A O no hydrogen 3.084 N/A ILE 680.A N THR 45.A O no hydrogen 2.928 N/A TRP 683.A NE1 ASP 36.A OD2 no hydrogen 2.748 N/A LEU 684.A N TYR 667.A O no hydrogen 2.704 N/A SER 686.A N SER 692.A OG no hydrogen 2.951 N/A ASP 688.A N SER 686.A OG no hydrogen 2.952 N/A ALA 691.A N ASP 688.A OD1 no hydrogen 3.185 N/A SER 692.A N ASP 688.A O no hydrogen 2.825 N/A SER 692.A OG SER 686.A O no hydrogen 2.805 N/A SER 692.A OG ASP 688.A O no hydrogen 3.015 N/A SER 693.A N LEU 689.A O no hydrogen 3.047 N/A SER 693.A N LYS 690.A O no hydrogen 3.190 N/A SER 693.A OG LYS 690.A O no hydrogen 2.724 N/A GLY 694.A N ALA 691.A O no hydrogen 3.089 N/A ASP 695.A N SER 693.A OG no hydrogen 3.054 N/A TYR 697.A N ASP 695.A OD1 no hydrogen 2.786 N/A TYR 698.A N ASP 695.A O no hydrogen 3.001 N/A VAL 700.A N TYR 697.A O no hydrogen 2.994 N/A GLU 704.A N GLU 704.A OE1 no hydrogen 2.998 N/A HIS 705.A N ASP 701.A O no hydrogen 3.311 N/A HIS 705.A N THR 702.A O no hydrogen 2.842 N/A VAL 706.A N ALA 703.A O no hydrogen 3.355 N/A ALA 710.A N PRO 707.A O no hydrogen 3.033 N/A ASP 712.A N GLY 709.A O no hydrogen 3.051 N/A SER 714.A N ASP 712.A OD1 no hydrogen 3.034 N/A SER 714.A OG ASP 712.A OD1 no hydrogen 2.616 N/A SER 714.A OG ASP 712.A OD2 no hydrogen 3.468 N/A GLN 716.A N THR 652.A OG1 no hydrogen 2.895 N/A GLN 716.A NE2 ASP 712.A OD2 no hydrogen 3.066 N/A GLN 716.A NE2 SER 714.A O no hydrogen 2.762 N/A VAL 718.A N THR 650.A O no hydrogen 2.898 N/A GLY 722.A N LEU 719.A O no hydrogen 2.973 N/A SER 725.A OG VAL 216.A O no hydrogen 3.319 N/A GLY 726.A N LEU 250.A O no hydrogen 2.805 N/A ASN 728.A N ALA 721.A O no hydrogen 2.655 N/A ASN 728.A ND2 PRO 720.A O no hydrogen 3.194 N/A ARG 730.A N ASN 728.A OD1 no hydrogen 2.992 N/A LEU 731.A N ASN 728.A O no hydrogen 2.823 N/A TYR 732.A N PRO 729.A O no hydrogen 2.836 N/A TYR 732.A OH GLY 726.A O no hydrogen 2.573 N/A ASP 733.A N ARG 730.A O no hydrogen 3.338 N/A LEU 735.A N LEU 790.A O no hydrogen 2.800 N/A ILE 736.A N LEU 790.A O no hydrogen 3.436 N/A ARG 737.A N GLN 644.A O no hydrogen 2.760 N/A ARG 737.A NH1 GLN 644.A OE1 no hydrogen 2.879 N/A VAL 738.A N THR 788.A O no hydrogen 2.748 N/A SER 739.A N HIS 642.A O no hydrogen 2.885 N/A VAL 740.A N TRP 786.A O no hydrogen 3.034 N/A THR 741.A N SER 639.A O no hydrogen 2.733 N/A VAL 742.A N THR 784.A O no hydrogen 2.839 N/A LYS 743.A N ASN 637.A O no hydrogen 2.849 N/A ASN 744.A N GLU 782.A O no hydrogen 2.774 N/A ASN 744.A ND2 VAL 748.A O no hydrogen 3.016 N/A ASN 744.A ND2 LEU 778.A O no hydrogen 2.969 N/A THR 745.A N THR 635.A O no hydrogen 2.846 N/A THR 745.A OG1 THR 635.A OG1 no hydrogen 2.774 N/A GLY 746.A N ASN 744.A OD1 no hydrogen 2.922 N/A GLY 750.A N LEU 778.A O no hydrogen 2.991 N/A ALA 752.A N LEU 776.A O no hydrogen 2.909 N/A GLN 755.A N GLY 817.A O no hydrogen 3.000 N/A GLN 755.A NE2 GLY 628.A O no hydrogen 3.098 N/A GLN 755.A NE2 VAL 753.A O no hydrogen 3.476 N/A LEU 756.A N LYS 772.A O no hydrogen 2.874 N/A TYR 757.A N HIS 815.A O no hydrogen 2.892 N/A TYR 757.A OH GLN 755.A OE1 no hydrogen 2.728 N/A VAL 758.A N VAL 769.A O no hydrogen 2.801 N/A SER 759.A N LYS 813.A O no hydrogen 2.871 N/A SER 759.A OG LYS 767.A O no hydrogen 2.669 N/A SER 759.A OG HIS 815.A NE2 no hydrogen 2.963 N/A LYS 767.A NZ ASP 617.A O no hydrogen 3.023 N/A VAL 769.A N VAL 758.A O no hydrogen 2.871 N/A LEU 770.A N TYR 613.A OH no hydrogen 2.991 N/A ARG 771.A N LEU 756.A O no hydrogen 2.742 N/A ARG 771.A NE ASP 794.A O no hydrogen 2.816 N/A ARG 771.A NH1 LEU 770.A O no hydrogen 2.899 N/A LYS 772.A N LEU 756.A O no hydrogen 3.155 N/A LYS 772.A NZ THR 789.A O no hydrogen 3.076 N/A LYS 772.A NZ ASP 794.A OD2 no hydrogen 2.690 N/A ARG 775.A NE ASP 751.A OD2 no hydrogen 2.781 N/A ARG 775.A NH1 THR 94.A O no hydrogen 2.987 N/A ARG 775.A NH1 ASP 377.A O no hydrogen 2.788 N/A ARG 775.A NH2 ASP 751.A OD2 no hydrogen 3.391 N/A LEU 776.A N ALA 752.A O no hydrogen 2.780 N/A THR 777.A OG1 ASP 751.A OD1 no hydrogen 2.703 N/A LEU 778.A N GLY 750.A O no hydrogen 2.800 N/A LYS 779.A N GLU 782.A OE2 no hydrogen 2.736 N/A SER 781.A N ASN 744.A O no hydrogen 2.820 N/A GLU 782.A N LYS 779.A O no hydrogen 2.863 N/A THR 784.A N VAL 742.A O no hydrogen 2.981 N/A TRP 786.A N VAL 740.A O no hydrogen 2.801 N/A TRP 786.A NE1 ASP 774.A OD2 no hydrogen 2.747 N/A THR 788.A N VAL 738.A O no hydrogen 2.932 N/A THR 789.A OG1 GLU 734.A OE2 no hydrogen 2.767 N/A LEU 790.A N ILE 736.A O no hydrogen 2.801 N/A THR 791.A N ASP 794.A OD2 no hydrogen 2.879 N/A ARG 792.A N ASP 733.A O no hydrogen 2.971 N/A ARG 792.A NE ARG 730.A O no hydrogen 3.065 N/A ARG 792.A NH2 GLN 833.A O no hydrogen 3.009 N/A ARG 793.A N LEU 731.A O no hydrogen 2.820 N/A ARG 793.A NH1 ASP 214.A OD1 no hydrogen 3.010 N/A ARG 793.A NH2 ASP 214.A OD1 no hydrogen 2.846 N/A ASP 794.A N THR 791.A OG1 no hydrogen 2.939 N/A LEU 795.A N ARG 792.A O no hydrogen 3.184 N/A SER 796.A N ARG 793.A O no hydrogen 3.165 N/A SER 796.A OG ARG 792.A O no hydrogen 2.613 N/A ASN 797.A N VAL 806.A O no hydrogen 2.805 N/A ASN 797.A ND2 GLU 206.A OE2 no hydrogen 2.943 N/A ASN 797.A ND2 GLU 765.A OE1 no hydrogen 2.933 N/A TRP 798.A N GLU 206.A OE2 no hydrogen 2.953 N/A TRP 798.A NE1 ASP 201.A OD2 no hydrogen 2.869 N/A ASP 799.A N ASP 804.A O no hydrogen 2.906 N/A ALA 802.A N ASP 799.A OD1 no hydrogen 2.871 N/A GLN 803.A NE2 ASP 201.A OD2 no hydrogen 2.960 N/A GLN 803.A NE2 VAL 800.A O no hydrogen 2.987 N/A ASP 804.A N ASP 799.A O no hydrogen 3.349 N/A TRP 805.A N ASP 804.A OD1 no hydrogen 2.807 N/A VAL 806.A N ASN 797.A O no hydrogen 2.852 N/A LYS 812.A NZ LEU 760.A O no hydrogen 2.724 N/A LYS 812.A NZ THR 808.A O no hydrogen 3.071 N/A LYS 812.A NZ THR 808.A OG1 no hydrogen 3.049 N/A LYS 812.A NZ TYR 810.A O no hydrogen 2.641 N/A LYS 813.A N SER 759.A O no hydrogen 3.170 N/A VAL 814.A N ALA 827.A O no hydrogen 2.820 N/A HIS 815.A N TYR 757.A O no hydrogen 2.876 N/A HIS 815.A ND1 HIS 826.A ND1 no hydrogen 2.625 N/A HIS 815.A NE2 SER 759.A OG no hydrogen 2.963 N/A VAL 816.A N LEU 825.A O no hydrogen 2.887 N/A GLY 817.A N GLN 755.A O no hydrogen 2.996 N/A SER 818.A N GLN 822.A O no hydrogen 2.888 N/A SER 819.A N GLN 822.A O no hydrogen 3.482 N/A SER 819.A OG GLU 626.A OE2 no hydrogen 2.656 N/A SER 820.A N PHE 627.A O no hydrogen 3.080 N/A SER 820.A OG PHE 627.A O no hydrogen 2.852 N/A ARG 821.A N SER 819.A OG no hydrogen 3.079 N/A ARG 821.A NE ASP 617.A OD1 no hydrogen 3.027 N/A ARG 821.A NH2 ASP 617.A OD1 no hydrogen 2.765 N/A ARG 821.A NH2 GLU 621.A O no hydrogen 2.876 N/A GLN 822.A N SER 819.A O no hydrogen 3.271 N/A LEU 825.A N VAL 816.A O no hydrogen 3.445 N/A HIS 826.A ND1 HIS 815.A ND1 no hydrogen 2.625 N/A ALA 827.A N VAL 814.A O no hydrogen 2.956 N/A LEU 829.A N LYS 812.A O no hydrogen 2.867 N/A GLN 833.A NE2 ILE 807.A O no hydrogen 3.115 N/A