Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1xsi_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): MET 1.A N SER 217.A OG no hydrogen 2.566 N/A MET 1.A N GLU 219.A OE2 no hydrogen 2.674 N/A LYS 2.A NZ GLU 219.A OE1 no hydrogen 3.146 N/A LYS 2.A NZ GLU 219.A OE2 no hydrogen 3.440 N/A ILE 3.A N GLU 223.A OE1 no hydrogen 3.041 N/A ILE 3.A N GLU 223.A OE2 no hydrogen 3.402 N/A SER 4.A N GLU 223.A OE2 no hydrogen 2.840 N/A SER 4.A OG GLY 6.A O no hydrogen 3.547 N/A SER 4.A OG GLU 223.A OE2 no hydrogen 2.785 N/A ASP 5.A N LEU 9.A O no hydrogen 2.903 N/A GLN 11.A N ILE 3.A O no hydrogen 2.885 N/A GLN 11.A NE2 SER 4.A O no hydrogen 2.915 N/A LEU 14.A N GLN 11.A O no hydrogen 3.186 N/A ASN 15.A N GLN 141.A O no hydrogen 2.910 N/A ASN 15.A ND2 GLN 141.A OE1 no hydrogen 2.776 N/A ILE 17.A N TYR 139.A O no hydrogen 3.109 N/A HIS 18.A ND1 ASN 137.A O no hydrogen 2.791 N/A LEU 20.A N ALA 37.A O no hydrogen 2.900 N/A GLN 21.A N ALA 37.A O no hydrogen 3.162 N/A GLN 21.A NE2 ASP 40.A OD1 no hydrogen 3.073 N/A PHE 23.A N TYR 35.A O no hydrogen 2.731 N/A GLU 24.A N TYR 35.A O no hydrogen 3.444 N/A GLU 26.A N VAL 33.A O no hydrogen 2.903 N/A GLN 28.A N GLU 31.A O no hydrogen 2.819 N/A GLN 28.A NE2 GLU 26.A OE2 no hydrogen 2.946 N/A ASN 30.A ND2 GLN 88.A O no hydrogen 2.871 N/A GLU 31.A N GLN 28.A O no hydrogen 3.102 N/A MET 32.A N PHE 57.A O no hydrogen 2.993 N/A VAL 33.A N GLU 26.A O no hydrogen 2.837 N/A VAL 34.A N LEU 55.A O no hydrogen 2.829 N/A TYR 35.A N GLU 24.A O no hydrogen 2.917 N/A ALA 36.A N PHE 53.A O no hydrogen 2.821 N/A ALA 37.A N GLN 21.A O no hydrogen 2.871 N/A ARG 39.A NH2 TRP 46.A O no hydrogen 2.881 N/A VAL 41.A N GLN 21.A OE1 no hydrogen 2.982 N/A ARG 42.A N ASP 40.A OD1 no hydrogen 3.162 N/A ARG 42.A NE ASP 40.A OD1 no hydrogen 2.970 N/A ARG 42.A NH2 ASP 40.A OD2 no hydrogen 2.892 N/A TRP 46.A N GLU 43.A O no hydrogen 3.032 N/A GLN 47.A N ARG 44.A O no hydrogen 2.828 N/A GLN 47.A NE2 VAL 41.A O no hydrogen 2.838 N/A THR 50.A OG1 PRO 51.A O no hydrogen 2.928 N/A PHE 53.A N ALA 36.A O no hydrogen 2.831 N/A THR 54.A N GLU 70.A O no hydrogen 3.091 N/A LEU 55.A N VAL 34.A O no hydrogen 2.789 N/A ARG 56.A N ARG 68.A O no hydrogen 2.811 N/A ARG 56.A NH1 GLN 28.A OE1 no hydrogen 2.984 N/A ARG 56.A NH1 GLU 31.A OE1 no hydrogen 2.752 N/A ARG 56.A NH2 GLN 28.A OE1 no hydrogen 2.962 N/A PHE 57.A N MET 32.A O no hydrogen 2.940 N/A PHE 58.A N GLY 66.A O no hydrogen 3.172 N/A SER 59.A OG GLN 61.A O no hydrogen 2.822 N/A SER 59.A OG ILE 64.A O no hydrogen 2.695 N/A SER 59.A OG SER 105.A OG no hydrogen 2.615 N/A GLN 61.A NE2 ASN 85.A O no hydrogen 2.649 N/A GLY 63.A N SER 105.A OG no hydrogen 3.254 N/A ILE 64.A N GLN 61.A O no hydrogen 2.975 N/A VAL 65.A N VAL 241.A O no hydrogen 2.835 N/A GLY 66.A N PHE 58.A O no hydrogen 2.742 N/A VAL 67.A N TYR 239.A O no hydrogen 2.801 N/A ARG 68.A N ARG 56.A O no hydrogen 2.915 N/A ARG 68.A NE GLU 70.A OE1 no hydrogen 3.113 N/A ARG 68.A NH1 GLU 238.A OE2 no hydrogen 3.185 N/A ILE 69.A N LEU 237.A O no hydrogen 2.753 N/A GLU 70.A N THR 54.A O no hydrogen 2.903 N/A HIS 71.A N GLU 235.A O no hydrogen 2.745 N/A HIS 71.A ND1 GLU 235.A OE1 no hydrogen 2.620 N/A PHE 72.A N GLU 235.A OE1 no hydrogen 3.057 N/A GLN 73.A NE2 GLU 70.A OE2 no hydrogen 2.822 N/A TYR 82.A OH HIS 212.A O no hydrogen 3.380 N/A LEU 84.A N TYR 82.A O no hydrogen 2.827 N/A ASN 85.A N PHE 257.A O no hydrogen 2.778 N/A ASN 85.A ND2 ARG 256.A O no hydrogen 2.830 N/A LEU 87.A N PRO 60.A O no hydrogen 2.800 N/A THR 93.A N LYS 104.A O no hydrogen 3.028 N/A GLU 95.A N GLU 102.A O no hydrogen 3.003 N/A ASN 96.A ND2 VAL 25.A O no hydrogen 3.511 N/A THR 97.A N TYR 100.A O no hydrogen 2.903 N/A THR 97.A OG1 TYR 100.A O no hydrogen 3.067 N/A TYR 100.A N THR 97.A OG1 no hydrogen 3.269 N/A ALA 101.A N VAL 112.A O no hydrogen 3.000 N/A GLU 102.A N GLU 95.A O no hydrogen 3.088 N/A PHE 103.A N ALA 110.A O no hydrogen 2.807 N/A LYS 104.A N THR 93.A O no hydrogen 2.874 N/A SER 105.A N LEU 108.A O no hydrogen 2.699 N/A SER 105.A OG SER 59.A OG no hydrogen 2.615 N/A LEU 108.A N SER 105.A O no hydrogen 3.079 N/A SER 109.A N LEU 123.A O no hydrogen 2.884 N/A SER 109.A OG GLU 102.A OE2 no hydrogen 2.859 N/A ALA 110.A N PHE 103.A O no hydrogen 2.791 N/A ARG 111.A N ASP 121.A O no hydrogen 2.753 N/A ARG 111.A NH2 ASP 121.A OD2 no hydrogen 3.406 N/A VAL 112.A N ALA 101.A O no hydrogen 2.786 N/A SER 113.A N SER 119.A O no hydrogen 2.880 N/A LYS 114.A N ARG 99.A O no hydrogen 2.879 N/A LYS 114.A NZ ASN 96.A OD1 no hydrogen 2.468 N/A LYS 114.A NZ THR 97.A O no hydrogen 2.876 N/A TRP 118.A N GLU 116.A O no hydrogen 3.214 N/A SER 119.A OG ASP 121.A OD1 no hydrogen 3.159 N/A LEU 120.A N SER 132.A O no hydrogen 3.098 N/A ASP 121.A N ARG 111.A O no hydrogen 2.863 N/A PHE 122.A N THR 130.A O no hydrogen 3.029 N/A LEU 123.A N SER 109.A O no hydrogen 2.772 N/A ARG 124.A N GLU 127.A O no hydrogen 2.735 N/A ARG 124.A NH1 ARG 204.A O no hydrogen 2.895 N/A ARG 124.A NH2 GLY 205.A O no hydrogen 2.883 N/A ARG 124.A NH2 ASP 243.A OD1 no hydrogen 2.681 N/A ASN 125.A N ASN 107.A O no hydrogen 3.123 N/A GLU 127.A N ARG 124.A O no hydrogen 2.824 N/A ARG 128.A NH1 ASP 155.A OD2 no hydrogen 2.259 N/A ARG 128.A NH2 ASP 121.A OD1 no hydrogen 2.916 N/A ILE 129.A N PHE 122.A O no hydrogen 2.804 N/A THR 130.A OG1 ASP 155.A O no hydrogen 2.957 N/A GLY 131.A N THR 130.A OG1 no hydrogen 2.668 N/A SER 132.A N LEU 120.A O no hydrogen 2.723 N/A SER 132.A OG GLU 152.A OE1 no hydrogen 2.421 N/A SER 132.A OG GLU 152.A OE2 no hydrogen 3.405 N/A ASN 136.A N GLN 133.A O no hydrogen 3.062 N/A ASN 136.A ND2 GLN 133.A O no hydrogen 3.342 N/A ASN 136.A ND2 VAL 134.A O no hydrogen 3.147 N/A ASN 137.A ND2 GLU 152.A OE2 no hydrogen 2.835 N/A GLY 138.A N PHE 151.A O no hydrogen 3.214 N/A TYR 139.A N ILE 17.A O no hydrogen 2.919 N/A TYR 139.A OH GLU 235.A OE2 no hydrogen 2.670 N/A VAL 140.A N TYR 149.A O no hydrogen 2.818 N/A GLN 141.A N ASN 15.A O no hydrogen 2.894 N/A ASP 142.A N ARG 147.A O no hydrogen 2.766 N/A THR 143.A N GLY 13.A O no hydrogen 2.906 N/A THR 143.A OG1 GLY 13.A O no hydrogen 2.918 N/A ASN 144.A N ASP 142.A OD1 no hydrogen 2.815 N/A ASN 144.A ND2 PRO 12.A O no hydrogen 2.913 N/A ASN 145.A N ASP 142.A OD1 no hydrogen 3.281 N/A GLN 146.A N ASP 142.A O no hydrogen 2.870 N/A ARG 147.A N ASP 142.A O no hydrogen 3.248 N/A ARG 147.A N ASN 145.A OD1 no hydrogen 2.987 N/A ARG 147.A NH2 GLU 233.A OE2 no hydrogen 3.156 N/A TYR 149.A N VAL 140.A O no hydrogen 2.868 N/A MET 150.A N VAL 232.A O no hydrogen 2.914 N/A PHE 151.A N GLY 138.A O no hydrogen 2.961 N/A GLU 152.A N PHE 230.A O no hydrogen 2.983 N/A ARG 153.A N GLU 152.A OE1 no hydrogen 2.849 N/A ARG 153.A NE GLN 229.A OE1 no hydrogen 2.756 N/A ARG 153.A NH1 ASN 136.A OD1 no hydrogen 2.996 N/A ARG 153.A NH2 GLN 229.A OE1 no hydrogen 3.341 N/A LEU 154.A N VAL 228.A O no hydrogen 2.992 N/A ASP 155.A N GLY 131.A O no hydrogen 2.887 N/A LEU 156.A N SER 226.A O no hydrogen 2.982 N/A GLY 157.A N GLU 160.A OE2 no hydrogen 2.679 N/A GLU 160.A N GLY 157.A O no hydrogen 3.167 N/A THR 161.A N ASN 203.A OD1 no hydrogen 2.907 N/A THR 161.A OG1 TYR 163.A OH no hydrogen 2.786 N/A VAL 162.A N ASN 175.A OD1 no hydrogen 2.945 N/A TYR 163.A N MET 201.A O no hydrogen 2.921 N/A TYR 163.A OH THR 161.A OG1 no hydrogen 2.786 N/A TYR 163.A OH ASP 602.A O no hydrogen 2.720 N/A LEU 165.A N PHE 199.A O no hydrogen 2.879 N/A GLY 166.A N SER 503.A OG no hydrogen 2.809 N/A GLU 167.A N LYS 195.A O no hydrogen 3.075 N/A ARG 168.A NH1 LEU 165.A O no hydrogen 2.882 N/A ARG 168.A NH1 ASN 196.A OD1 no hydrogen 2.724 N/A ARG 168.A NH2 GLU 191.A O no hydrogen 3.263 N/A ARG 168.A NH2 ASN 196.A OD1 no hydrogen 3.215 N/A THR 170.A OG1 GLN 177.A OE1 no hydrogen 2.639 N/A ARG 174.A N VAL 162.A O no hydrogen 2.749 N/A ARG 174.A NH1 GLY 164.A O no hydrogen 2.586 N/A ARG 174.A NH1 SER 499.A OG no hydrogen 3.105 N/A ARG 174.A NH2 ALA 171.A O no hydrogen 2.909 N/A ASN 175.A ND2 GLU 160.A O no hydrogen 2.921 N/A GLY 176.A N VAL 220.A O no hydrogen 2.719 N/A GLN 177.A N ARG 174.A O no hydrogen 2.887 N/A GLN 177.A NE2 ALA 171.A O no hydrogen 3.113 N/A GLN 177.A NE2 VAL 173.A O no hydrogen 3.518 N/A THR 178.A OG1 GLU 219.A OE1 no hydrogen 2.466 N/A VAL 179.A N PHE 218.A O no hydrogen 2.825 N/A THR 181.A N VAL 216.A O no hydrogen 3.039 N/A THR 181.A OG1 VAL 216.A O no hydrogen 3.478 N/A ASN 183.A N ASN 438.A OD1 no hydrogen 2.660 N/A ASN 183.A ND2 ALA 468.A O no hydrogen 2.741 N/A ARG 184.A N ALA 193.A O no hydrogen 2.726 N/A THR 188.A OG1 ASP 482.A O no hydrogen 3.543 N/A THR 188.A OG1 GLU 492.A OE1 no hydrogen 2.829 N/A SER 189.A OG GLU 492.A OE1 no hydrogen 3.019 N/A THR 190.A OG1 GLY 186.A O no hydrogen 3.565 N/A GLU 191.A N GLU 191.A OE1 no hydrogen 2.628 N/A GLN 192.A N THR 190.A OG1 no hydrogen 3.098 N/A LYS 195.A NZ GLU 167.A OE1 no hydrogen 3.050 N/A LYS 195.A NZ GLU 167.A OE2 no hydrogen 2.541 N/A LYS 195.A NZ ARG 466.A O no hydrogen 2.975 N/A LYS 195.A NZ TRP 479.A O no hydrogen 2.666 N/A ASN 196.A N ASN 183.A OD1 no hydrogen 2.902 N/A ASN 196.A ND2 ASN 183.A OD1 no hydrogen 2.921 N/A ASN 196.A ND2 ALA 193.A O no hydrogen 3.072 N/A PHE 199.A N ILE 197.A O no hydrogen 2.751 N/A TYR 200.A N VAL 208.A O no hydrogen 2.975 N/A MET 201.A N TYR 163.A O no hydrogen 3.132 N/A THR 202.A N TYR 206.A O no hydrogen 3.239 N/A THR 202.A OG1 GLU 160.A OE1 no hydrogen 2.606 N/A ASN 203.A N THR 161.A O no hydrogen 3.095 N/A ASN 203.A ND2 GLY 159.A O no hydrogen 3.086 N/A ASN 203.A ND2 ASP 602.A OD1 no hydrogen 3.314 N/A ARG 204.A N THR 202.A OG1 no hydrogen 3.033 N/A GLY 205.A N THR 202.A O no hydrogen 3.162 N/A TYR 206.A OH GLU 160.A OE1 no hydrogen 2.663 N/A GLY 207.A N ILE 242.A O no hydrogen 2.786 N/A VAL 208.A N TYR 200.A O no hydrogen 2.769 N/A LEU 209.A N PHE 240.A O no hydrogen 2.898 N/A VAL 210.A N PRO 198.A O no hydrogen 2.825 N/A ASN 211.A N GLU 238.A O no hydrogen 2.780 N/A ASN 211.A ND2 GLU 238.A OE1 no hydrogen 2.565 N/A HIS 212.A N VAL 210.A O no hydrogen 2.913 N/A GLN 214.A N GLN 214.A OE1 no hydrogen 2.867 N/A GLN 214.A NE2 GLU 233.A O no hydrogen 3.599 N/A CYS 215.A SG GLU 180.A OE1 no hydrogen 3.659 N/A CYS 215.A SG VAL 216.A O no hydrogen 4.001 N/A VAL 216.A N THR 181.A OG1 no hydrogen 3.041 N/A SER 217.A N SER 231.A O no hydrogen 2.977 N/A SER 217.A OG GLU 180.A OE2 no hydrogen 2.855 N/A PHE 218.A N VAL 179.A O no hydrogen 2.718 N/A GLU 219.A N GLN 229.A O no hydrogen 2.764 N/A VAL 220.A N GLN 177.A O no hydrogen 2.982 N/A GLY 221.A N LYS 227.A O no hydrogen 2.933 N/A SER 222.A OG GLN 177.A O no hydrogen 3.304 N/A SER 222.A OG GLU 219.A OE1 no hydrogen 2.700 N/A LYS 224.A NZ SER 4.A OG no hydrogen 2.907 N/A LYS 227.A N LYS 224.A O no hydrogen 3.144 N/A LYS 227.A NZ ASP 155.A OD1 no hydrogen 3.066 N/A VAL 228.A N LEU 154.A O no hydrogen 2.808 N/A GLN 229.A N GLU 219.A O no hydrogen 2.890 N/A GLN 229.A NE2 GLU 223.A OE1 no hydrogen 2.801 N/A PHE 230.A N GLU 152.A O no hydrogen 2.798 N/A SER 231.A N SER 217.A O no hydrogen 3.088 N/A VAL 232.A N MET 150.A O no hydrogen 3.077 N/A SER 234.A OG TYR 236.A O no hydrogen 2.720 N/A TYR 236.A N SER 234.A OG no hydrogen 3.262 N/A LEU 237.A N ILE 69.A O no hydrogen 2.797 N/A TYR 239.A N VAL 67.A O no hydrogen 2.946 N/A TYR 239.A OH GLU 152.A OE2 no hydrogen 2.747 N/A PHE 240.A N LEU 209.A O no hydrogen 2.855 N/A VAL 241.A N VAL 65.A O no hydrogen 2.932 N/A ILE 242.A N GLY 207.A O no hydrogen 2.846 N/A ASP 243.A N GLY 63.A O no hydrogen 3.013 N/A GLY 244.A N ASP 243.A OD1 no hydrogen 2.676 N/A LYS 248.A NZ GLU 594.A OE1 no hydrogen 3.131 N/A LYS 248.A NZ GLU 594.A OE2 no hydrogen 3.399 N/A ALA 249.A N THR 246.A OG1 no hydrogen 3.272 N/A VAL 250.A N THR 246.A O no hydrogen 2.897 N/A LEU 251.A N PRO 247.A O no hydrogen 2.960 N/A ASP 252.A N LYS 248.A O no hydrogen 2.929 N/A ARG 253.A N ALA 249.A O no hydrogen 3.073 N/A ARG 253.A NE GLU 62.A O no hydrogen 3.240 N/A ARG 253.A NE GLU 62.A OE2 no hydrogen 3.355 N/A ARG 253.A NH1 ASP 243.A O no hydrogen 2.784 N/A ARG 253.A NH1 GLY 244.A O no hydrogen 2.625 N/A ARG 253.A NH2 GLU 62.A OE2 no hydrogen 3.124 N/A TYR 254.A N VAL 250.A O no hydrogen 2.770 N/A THR 255.A N LEU 251.A O no hydrogen 2.759 N/A THR 255.A OG1 LEU 251.A O no hydrogen 2.874 N/A THR 255.A OG1 ASP 252.A O no hydrogen 3.297 N/A ARG 256.A N ASP 252.A O no hydrogen 2.866 N/A PHE 257.A N ARG 253.A O no hydrogen 2.868 N/A THR 258.A N TYR 254.A O no hydrogen 3.002 N/A THR 258.A OG1 TYR 254.A O no hydrogen 3.055 N/A GLY 259.A N THR 255.A O no hydrogen 2.755 N/A ARG 260.A NH1 ASP 252.A OD1 no hydrogen 2.918 N/A ARG 260.A NH2 ASP 252.A OD1 no hydrogen 2.557 N/A ARG 260.A NH2 THR 255.A OG1 no hydrogen 2.881 N/A TRP 267.A NE1 GLU 460.A OE1 no hydrogen 3.065 N/A SER 268.A N PRO 265.A O no hydrogen 3.044 N/A SER 268.A OG PRO 265.A O no hydrogen 2.863 N/A SER 268.A OG HIS 536.A NE2 no hydrogen 2.918 N/A PHE 269.A N ALA 266.A O no hydrogen 3.126 N/A GLY 270.A N TRP 267.A O no hydrogen 3.202 N/A LEU 271.A N HIS 301.A ND1 no hydrogen 2.746 N/A TRP 272.A N SER 537.A O no hydrogen 2.868 N/A TRP 272.A NE1 SER 268.A O no hydrogen 2.799 N/A LEU 273.A N VAL 302.A O no hydrogen 2.900 N/A THR 274.A N LEU 539.A O no hydrogen 3.084 N/A THR 274.A OG1 LEU 539.A O no hydrogen 3.294 N/A THR 274.A OG1 HIS 540.A ND1 no hydrogen 3.413 N/A THR 275.A N HIS 304.A O no hydrogen 3.181 N/A THR 275.A OG1 SER 276.A O no hydrogen 2.874 N/A SER 276.A OG GLY 541.A O no hydrogen 3.340 N/A SER 276.A OG SER 544.A O no hydrogen 2.804 N/A PHE 277.A N GLY 541.A O no hydrogen 2.895 N/A THR 278.A N SER 542.A O no hydrogen 2.848 N/A THR 278.A OG1 SER 542.A O no hydrogen 3.415 N/A THR 279.A OG1 THR 275.A O no hydrogen 2.699 N/A TYR 281.A OH PHE 277.A O no hydrogen 2.803 N/A THR 285.A N ASP 282.A OD2 no hydrogen 2.867 N/A THR 285.A OG1 ASP 282.A OD2 no hydrogen 2.907 N/A VAL 286.A N ASP 282.A O no hydrogen 2.949 N/A ASN 287.A N GLU 283.A O no hydrogen 2.852 N/A SER 288.A N ALA 284.A O no hydrogen 2.980 N/A PHE 289.A N THR 285.A O no hydrogen 3.128 N/A ILE 290.A N VAL 286.A O no hydrogen 2.959 N/A ASP 291.A N ASN 287.A O no hydrogen 2.647 N/A GLY 292.A N SER 288.A O no hydrogen 2.934 N/A MET 293.A N PHE 289.A O no hydrogen 2.901 N/A ALA 294.A N ILE 290.A O no hydrogen 3.108 N/A GLU 295.A N ASP 291.A O no hydrogen 2.818 N/A ARG 296.A N GLY 292.A O no hydrogen 3.334 N/A ARG 296.A N MET 293.A O no hydrogen 3.180 N/A ARG 296.A NH1 GLY 292.A O no hydrogen 3.021 N/A ASN 297.A N ALA 294.A O no hydrogen 3.095 N/A LEU 298.A N MET 293.A O no hydrogen 2.805 N/A HIS 301.A N LEU 271.A O no hydrogen 3.075 N/A HIS 301.A NE2 GLN 676.A O no hydrogen 2.866 N/A VAL 302.A N LEU 271.A O no hydrogen 3.117 N/A PHE 303.A N LYS 341.A O no hydrogen 2.894 N/A HIS 304.A N LEU 273.A O no hydrogen 2.776 N/A HIS 304.A NE2 ASP 306.A OD1 no hydrogen 3.006 N/A PHE 305.A N CYS 343.A O no hydrogen 2.891 N/A ASP 306.A N THR 275.A OG1 no hydrogen 3.255 N/A CYS 307.A SG ASP 306.A OD2 no hydrogen 3.491 N/A PHE 308.A N TYR 281.A OH no hydrogen 3.038 N/A TRP 309.A N ASP 306.A O no hydrogen 3.035 N/A TRP 309.A NE1 TRP 345.A O no hydrogen 2.794 N/A MET 310.A N CYS 307.A O no hydrogen 3.063 N/A GLN 314.A N LYS 311.A O no hydrogen 3.055 N/A GLN 314.A NE2 ASP 317.A OD2 no hydrogen 2.929 N/A TRP 315.A N GLN 381.A OE1 no hydrogen 2.870 N/A CYS 316.A N TYR 349.A O no hydrogen 2.936 N/A GLU 319.A N ASP 317.A OD1 no hydrogen 3.250 N/A ASP 321.A N TRP 309.A O no hydrogen 2.927 N/A LEU 323.A N ASP 321.A OD1 no hydrogen 2.986 N/A THR 324.A N ASP 321.A OD1 no hydrogen 3.304 N/A THR 324.A OG1 ASP 321.A OD2 no hydrogen 3.407 N/A PHE 325.A N ASP 321.A O no hydrogen 2.715 N/A GLY 330.A N ASP 327.A OD1 no hydrogen 3.108 N/A MET 331.A N ASP 327.A O no hydrogen 3.012 N/A ILE 332.A N PRO 328.A O no hydrogen 2.853 N/A ARG 333.A N GLU 329.A O no hydrogen 2.859 N/A ARG 334.A N GLY 330.A O no hydrogen 3.001 N/A ARG 334.A NH1 GLU 283.A OE2 no hydrogen 2.859 N/A LEU 335.A N MET 331.A O no hydrogen 3.288 N/A LYS 336.A N ILE 332.A O no hydrogen 2.860 N/A LYS 336.A NZ ASP 411.A OD1 no hydrogen 3.111 N/A LYS 336.A NZ ASP 411.A OD2 no hydrogen 2.750 N/A ALA 337.A N ARG 333.A O no hydrogen 2.760 N/A LYS 338.A N LEU 335.A O no hydrogen 3.040 N/A GLY 339.A N LYS 336.A O no hydrogen 2.733 N/A LYS 341.A N HIS 301.A O no hydrogen 2.823 N/A ILE 342.A N ASP 411.A OD2 no hydrogen 2.745 N/A CYS 343.A N PHE 303.A O no hydrogen 2.925 N/A CYS 343.A SG HIS 304.A ND1 no hydrogen 3.310 N/A CYS 343.A SG VAL 344.A O no hydrogen 4.017 N/A CYS 343.A SG CYS 412.A O no hydrogen 3.800 N/A TRP 345.A N PHE 305.A O no hydrogen 3.015 N/A TRP 345.A NE1 ASP 416.A OD2 no hydrogen 2.740 N/A ILE 346.A N LYS 414.A O no hydrogen 2.925 N/A TYR 349.A N ASN 347.A OD1 no hydrogen 3.073 N/A ILE 350.A N ALA 385.A O no hydrogen 2.851 N/A GLY 351.A N TRP 315.A O no hydrogen 2.878 N/A GLN 352.A N PRO 382.A O no hydrogen 3.086 N/A LYS 353.A NZ GLN 314.A OE1 no hydrogen 3.038 N/A SER 354.A N GLY 351.A O no hydrogen 3.283 N/A SER 354.A OG ASP 317.A OD2 no hydrogen 2.584 N/A VAL 356.A N SER 354.A OG no hydrogen 3.216 N/A PHE 357.A N SER 354.A O no hydrogen 3.144 N/A LEU 360.A N VAL 356.A O no hydrogen 2.984 N/A GLN 361.A N PHE 357.A O no hydrogen 2.886 N/A GLU 362.A N LYS 358.A O no hydrogen 2.889 N/A LYS 363.A N GLU 359.A O no hydrogen 3.071 N/A LYS 363.A NZ GLU 359.A OE2 no hydrogen 2.594 N/A GLY 364.A N GLN 361.A O no hydrogen 2.981 N/A TYR 365.A N LEU 360.A O no hydrogen 3.067 N/A LEU 367.A N ILE 386.A O no hydrogen 2.834 N/A ARG 369.A N SER 373.A O no hydrogen 2.899 N/A GLY 372.A N ARG 369.A O no hydrogen 2.887 N/A SER 373.A N ASP 371.A OD1 no hydrogen 2.982 N/A SER 373.A OG ASP 371.A OD1 no hydrogen 2.430 N/A SER 373.A OG ASP 371.A OD2 no hydrogen 3.481 N/A TRP 375.A N LEU 367.A O no hydrogen 3.080 N/A GLN 376.A NE2 GLN 352.A OE1 no hydrogen 2.894 N/A GLN 376.A NE2 GLY 383.A O no hydrogen 2.888 N/A TRP 377.A N LEU 384.A O no hydrogen 3.283 N/A GLN 381.A N LYS 379.A O no hydrogen 2.846 N/A GLN 381.A NE2 TRP 380.A O no hydrogen 2.954 N/A GLY 383.A N ASP 378.A OD1 no hydrogen 2.918 N/A LEU 384.A N TRP 377.A O no hydrogen 2.886 N/A ALA 385.A N ILE 350.A O no hydrogen 2.972 N/A TYR 387.A N PRO 348.A O no hydrogen 3.091 N/A TYR 387.A OH CYS 316.A O no hydrogen 2.984 N/A ASP 388.A N TYR 365.A O no hydrogen 3.020 N/A THR 390.A N ASP 388.A OD1 no hydrogen 3.032 N/A THR 390.A OG1 ASP 388.A OD1 no hydrogen 2.846 N/A ASN 391.A N ASP 388.A O no hydrogen 2.981 N/A ASN 391.A ND2 GLY 364.A O no hydrogen 2.917 N/A ASP 393.A N ASN 391.A OD1 no hydrogen 3.110 N/A CYS 395.A N ASN 391.A O no hydrogen 3.051 N/A CYS 395.A SG PHE 389.A O no hydrogen 3.087 N/A CYS 395.A SG ASN 391.A O no hydrogen 3.580 N/A LYS 396.A N PRO 392.A O no hydrogen 3.178 N/A LYS 396.A NZ ASP 400.A OD2 no hydrogen 2.966 N/A TRP 397.A N ASP 393.A O no hydrogen 3.015 N/A TRP 397.A NE1 GLU 359.A OE2 no hydrogen 3.005 N/A TYR 398.A N ALA 394.A O no hydrogen 3.028 N/A TYR 398.A OH ASN 347.A O no hydrogen 2.760 N/A ALA 399.A N CYS 395.A O no hydrogen 2.869 N/A ASP 400.A N LYS 396.A O no hydrogen 2.880 N/A LYS 401.A N TRP 397.A O no hydrogen 3.345 N/A LEU 402.A N TYR 398.A O no hydrogen 3.196 N/A LYS 403.A N ALA 399.A O no hydrogen 2.739 N/A GLY 404.A N ASP 400.A O no hydrogen 2.899 N/A LEU 405.A N LYS 401.A O no hydrogen 3.127 N/A LEU 405.A N LEU 402.A O no hydrogen 2.873 N/A VAL 406.A N LEU 402.A O no hydrogen 2.963 N/A ALA 407.A N LYS 403.A O no hydrogen 2.822 N/A MET 408.A N LEU 405.A O no hydrogen 3.080 N/A GLY 409.A N VAL 406.A O no hydrogen 2.682 N/A VAL 410.A N LEU 405.A O no hydrogen 3.038 N/A ASP 411.A N ILE 342.A O no hydrogen 2.835 N/A CYS 412.A N ILE 342.A O no hydrogen 3.234 N/A CYS 412.A SG ILE 342.A O no hydrogen 3.809 N/A LYS 414.A N VAL 344.A O no hydrogen 2.967 N/A LYS 414.A NZ ASP 306.A OD1 no hydrogen 2.818 N/A THR 415.A N PHE 464.A O no hydrogen 2.872 N/A THR 415.A OG1 ASN 445.A OD1 no hydrogen 2.725 N/A ASP 416.A N ILE 346.A O no hydrogen 2.970 N/A PHE 417.A N ASP 416.A OD1 no hydrogen 2.800 N/A GLY 418.A N TYR 349.A OH no hydrogen 2.952 N/A ARG 420.A NH2 ASP 185.A O no hydrogen 2.878 N/A ILE 421.A N GLU 419.A O no hydrogen 2.848 N/A VAL 425.A N THR 423.A O no hydrogen 2.829 N/A GLN 426.A N LYS 368.A O no hydrogen 2.965 N/A PHE 428.A N ASP 388.A OD2 no hydrogen 3.054 N/A ASP 429.A N THR 390.A OG1 no hydrogen 3.309 N/A GLY 430.A N TRP 427.A O no hydrogen 2.890 N/A SER 431.A N ASP 429.A OD1 no hydrogen 2.962 N/A SER 431.A OG ASP 429.A OD1 no hydrogen 2.239 N/A SER 431.A OG ASP 429.A OD2 no hydrogen 2.845 N/A ASP 432.A N GLY 79.A O no hydrogen 2.744 N/A GLN 434.A N ASP 432.A OD1 no hydrogen 2.896 N/A LYS 435.A N ASP 432.A O no hydrogen 2.905 N/A LYS 435.A NZ ASN 78.A O no hydrogen 3.178 N/A MET 436.A N ASP 432.A O no hydrogen 2.972 N/A HIS 437.A N PRO 433.A O no hydrogen 3.243 N/A HIS 437.A ND1 ILE 421.A O no hydrogen 2.485 N/A HIS 437.A NE2 ASN 183.A O no hydrogen 2.769 N/A ASN 438.A ND2 THR 181.A O no hydrogen 2.819 N/A ASN 438.A ND2 PRO 213.A O no hydrogen 2.953 N/A HIS 439.A N LYS 435.A O no hydrogen 3.316 N/A TYR 440.A N MET 436.A O no hydrogen 2.923 N/A TYR 440.A OH TYR 387.A O no hydrogen 2.656 N/A ALA 441.A N ASN 438.A O no hydrogen 3.165 N/A ILE 443.A N HIS 439.A O no hydrogen 3.120 N/A TYR 444.A N TYR 440.A O no hydrogen 2.955 N/A TYR 444.A OH ASP 416.A O no hydrogen 2.722 N/A ASN 445.A N ALA 441.A O no hydrogen 3.085 N/A ASN 445.A ND2 ALA 441.A O no hydrogen 2.729 N/A GLU 446.A N TYR 442.A O no hydrogen 2.775 N/A LEU 447.A N ILE 443.A O no hydrogen 2.988 N/A VAL 448.A N TYR 444.A O no hydrogen 3.132 N/A TRP 449.A N ASN 445.A O no hydrogen 2.916 N/A ASN 450.A N GLU 446.A O no hydrogen 2.982 N/A VAL 451.A N LEU 447.A O no hydrogen 3.122 N/A LEU 452.A N VAL 448.A O no hydrogen 3.240 N/A LYS 453.A N TRP 449.A O no hydrogen 2.891 N/A ASP 454.A N ASN 450.A O no hydrogen 3.050 N/A THR 455.A N LEU 452.A O no hydrogen 3.090 N/A THR 455.A OG1 VAL 451.A O no hydrogen 2.693 N/A THR 455.A OG1 LEU 452.A O no hydrogen 3.434 N/A GLY 457.A N LEU 452.A O no hydrogen 2.866 N/A GLU 460.A N GLY 457.A O no hydrogen 2.821 N/A ALA 461.A N GLU 458.A O no hydrogen 3.009 N/A LEU 463.A N PRO 476.A O no hydrogen 2.813 N/A PHE 464.A N PHE 413.A O no hydrogen 2.963 N/A ALA 465.A N VAL 477.A O no hydrogen 2.935 N/A ARG 466.A N THR 415.A O no hydrogen 3.129 N/A ARG 466.A NE GLU 419.A OE1 no hydrogen 2.995 N/A ARG 466.A NH2 ASP 185.A OD2 no hydrogen 2.949 N/A ARG 466.A NH2 GLU 419.A OE2 no hydrogen 2.832 N/A SER 467.A OG PHE 417.A O no hydrogen 3.197 N/A GLY 471.A N GLN 473.A OE1 no hydrogen 3.061 N/A ALA 472.A N SER 469.A O no hydrogen 2.959 N/A GLN 473.A N GLN 473.A OE1 no hydrogen 2.999 N/A GLN 473.A NE2 THR 258.A OG1 no hydrogen 2.886 N/A GLN 473.A NE2 GLY 259.A O no hydrogen 2.951 N/A LYS 474.A N GLY 471.A O no hydrogen 3.226 N/A LYS 474.A NZ TYR 442.A OH no hydrogen 2.798 N/A PHE 475.A N ALA 472.A O no hydrogen 2.951 N/A VAL 477.A N LEU 463.A O no hydrogen 2.777 N/A TRP 479.A N ALA 465.A O no hydrogen 2.997 N/A GLY 480.A N SER 509.A O no hydrogen 3.008 N/A ASP 482.A N TYR 194.A OH no hydrogen 3.148 N/A CYS 483.A N GLY 481.A O no hydrogen 3.113 N/A TYR 484.A N SER 489.A OG no hydrogen 2.766 N/A ALA 485.A N GLU 516.A O no hydrogen 3.040 N/A ASN 486.A N TYR 484.A O no hydrogen 2.876 N/A TYR 487.A OH HIS 522.A ND1 no hydrogen 2.648 N/A SER 489.A N ASN 486.A OD1 no hydrogen 2.739 N/A SER 489.A OG GLU 492.A OE1 no hydrogen 2.583 N/A MET 490.A N ASN 486.A O no hydrogen 2.880 N/A ALA 491.A N TYR 487.A O no hydrogen 2.887 N/A GLU 492.A N GLU 488.A O no hydrogen 2.925 N/A SER 493.A N SER 489.A O no hydrogen 2.976 N/A SER 493.A OG SER 489.A O no hydrogen 2.821 N/A LEU 494.A N MET 490.A O no hydrogen 3.190 N/A ARG 495.A N ALA 491.A O no hydrogen 3.033 N/A ARG 495.A NE PHE 169.A O no hydrogen 3.188 N/A ARG 495.A NE THR 170.A O no hydrogen 3.071 N/A ARG 495.A NH2 PHE 169.A O no hydrogen 2.675 N/A GLY 496.A N GLU 492.A O no hydrogen 3.201 N/A GLY 497.A N SER 493.A O no hydrogen 2.950 N/A LEU 498.A N LEU 494.A O no hydrogen 2.855 N/A SER 499.A N ARG 495.A O no hydrogen 3.024 N/A SER 499.A OG ARG 495.A O no hydrogen 2.778 N/A ILE 500.A N GLY 496.A O no hydrogen 2.851 N/A GLY 501.A N GLY 497.A O no hydrogen 3.295 N/A GLY 501.A N LEU 498.A O no hydrogen 3.153 N/A LEU 502.A N LEU 498.A O no hydrogen 3.116 N/A SER 503.A N ILE 500.A O no hydrogen 3.172 N/A SER 503.A OG SER 499.A O no hydrogen 3.040 N/A GLY 504.A N GLY 501.A O no hydrogen 3.353 N/A PHE 505.A N ILE 500.A O no hydrogen 3.118 N/A TRP 508.A N SER 535.A OG no hydrogen 3.039 N/A TRP 508.A NE1 GLU 167.A OE1 no hydrogen 2.878 N/A SER 509.A N HIS 478.A O no hydrogen 2.838 N/A SER 509.A OG HIS 510.A O no hydrogen 3.526 N/A SER 509.A OG HIS 536.A O no hydrogen 2.690 N/A HIS 510.A NE2 SER 534.A OG no hydrogen 2.853 N/A ILE 512.A N ARG 538.A O no hydrogen 2.810 N/A GLY 514.A N ASP 511.A O no hydrogen 3.022 N/A PHE 515.A N CYS 483.A O no hydrogen 3.028 N/A GLU 516.A N CYS 483.A O no hydrogen 2.917 N/A THR 518.A OG1 SER 544.A OG no hydrogen 2.715 N/A HIS 522.A ND1 TYR 487.A OH no hydrogen 2.648 N/A TYR 524.A N PRO 520.A O no hydrogen 3.109 N/A TYR 524.A OH ARG 546.A O no hydrogen 2.716 N/A LYS 525.A N ALA 521.A O no hydrogen 2.903 N/A LYS 525.A NZ ASP 552.A OD2 no hydrogen 2.935 N/A LYS 525.A NZ GLU 554.A OE1 no hydrogen 3.130 N/A ARG 526.A N HIS 522.A O no hydrogen 3.025 N/A ARG 526.A NH1 HIS 654.A O no hydrogen 3.415 N/A ARG 526.A NH1 GLY 655.A O no hydrogen 2.783 N/A ARG 526.A NH2 HIS 654.A O no hydrogen 2.661 N/A TRP 527.A N VAL 523.A O no hydrogen 3.009 N/A TRP 527.A NE1 HIS 510.A ND1 no hydrogen 3.169 N/A CYS 528.A N TYR 524.A O no hydrogen 2.842 N/A CYS 528.A SG TYR 524.A O no hydrogen 3.368 N/A ALA 529.A N LYS 525.A O no hydrogen 3.454 N/A PHE 530.A N ARG 526.A O no hydrogen 3.268 N/A GLY 531.A N TRP 527.A O no hydrogen 2.721 N/A LEU 532.A N CYS 528.A O no hydrogen 3.042 N/A LEU 533.A N PHE 530.A O no hydrogen 3.302 N/A SER 534.A N GLY 531.A O no hydrogen 3.318 N/A SER 534.A OG HIS 510.A NE2 no hydrogen 2.853 N/A SER 534.A OG PHE 530.A O no hydrogen 2.914 N/A SER 535.A OG TRP 508.A O no hydrogen 3.194 N/A SER 535.A OG HIS 536.A ND1 no hydrogen 2.931 N/A HIS 536.A ND1 SER 535.A OG no hydrogen 2.931 N/A HIS 536.A NE2 SER 268.A OG no hydrogen 2.918 N/A SER 537.A OG GLY 531.A O no hydrogen 2.716 N/A ARG 538.A NE ASP 511.A OD2 no hydrogen 3.387 N/A ARG 538.A NH2 ASP 511.A OD2 no hydrogen 2.666 N/A LEU 539.A N TRP 272.A O no hydrogen 2.850 N/A SER 542.A N PHE 515.A O no hydrogen 2.808 N/A SER 542.A OG GLU 516.A OE1 no hydrogen 2.763 N/A LYS 543.A NZ GLU 516.A OE2 no hydrogen 3.420 N/A SER 544.A OG THR 518.A OG1 no hydrogen 2.715 N/A TYR 545.A OH ASN 280.A O no hydrogen 2.520 N/A ARG 546.A NE GLY 514.A O no hydrogen 2.814 N/A ARG 546.A NH1 SER 544.A OG no hydrogen 2.799 N/A ARG 546.A NH1 TYR 545.A O no hydrogen 3.294 N/A ARG 546.A NH2 GLY 514.A O no hydrogen 2.670 N/A ALA 550.A N VAL 547.A O no hydrogen 2.869 N/A TYR 551.A N PRO 548.A O no hydrogen 3.226 N/A SER 555.A N ASP 552.A OD1 no hydrogen 2.857 N/A SER 555.A OG ASP 552.A OD1 no hydrogen 2.507 N/A CYS 556.A SG ASP 552.A O no hydrogen 3.932 N/A ASP 557.A N ASP 553.A O no hydrogen 3.410 N/A VAL 558.A N GLU 554.A O no hydrogen 2.909 N/A VAL 559.A N SER 555.A O no hydrogen 2.907 N/A ARG 560.A N CYS 556.A O no hydrogen 2.958 N/A ARG 560.A NE ARG 296.A O no hydrogen 2.887 N/A ARG 560.A NE ASN 297.A O no hydrogen 3.268 N/A ARG 560.A NH1 ASP 557.A OD1 no hydrogen 3.064 N/A ARG 560.A NH2 ARG 296.A O no hydrogen 2.724 N/A PHE 561.A N ASP 557.A O no hydrogen 2.898 N/A PHE 562.A N VAL 558.A O no hydrogen 3.067 N/A THR 563.A N VAL 559.A O no hydrogen 2.869 N/A THR 563.A OG1 VAL 559.A O no hydrogen 2.661 N/A GLN 564.A N ARG 560.A O no hydrogen 2.946 N/A LEU 565.A N PHE 561.A O no hydrogen 2.979 N/A LYS 566.A N PHE 562.A O no hydrogen 2.921 N/A LYS 566.A NZ PHE 269.A O no hydrogen 2.679 N/A LYS 566.A NZ SER 534.A O no hydrogen 3.236 N/A LYS 566.A NZ SER 535.A O no hydrogen 2.813 N/A LYS 566.A NZ SER 537.A OG no hydrogen 2.843 N/A CYS 567.A N THR 563.A O no hydrogen 3.020 N/A CYS 567.A SG THR 563.A O no hydrogen 3.608 N/A ARG 568.A N GLN 564.A O no hydrogen 2.930 N/A ARG 568.A NE GLY 672.A O no hydrogen 2.743 N/A ARG 568.A NH2 GLY 672.A O no hydrogen 2.911 N/A MET 569.A N LEU 565.A O no hydrogen 2.929 N/A MET 569.A N LYS 566.A O no hydrogen 3.100 N/A MET 570.A N CYS 567.A O no hydrogen 3.278 N/A TYR 572.A OH LEU 610.A O no hydrogen 2.679 N/A LEU 573.A N MET 569.A O no hydrogen 2.839 N/A TYR 574.A N MET 570.A O no hydrogen 2.738 N/A TYR 574.A OH PRO 264.A O no hydrogen 2.778 N/A TYR 574.A OH ALA 706.A O no hydrogen 3.320 N/A ARG 575.A NE GLU 702.A OE1 no hydrogen 3.003 N/A ARG 575.A NH1 ARG 575.A O no hydrogen 2.873 N/A ARG 575.A NH2 GLU 702.A OE1 no hydrogen 2.916 N/A GLU 576.A N TYR 572.A O no hydrogen 3.177 N/A ALA 577.A N LEU 573.A O no hydrogen 2.957 N/A ALA 578.A N TYR 574.A O no hydrogen 3.100 N/A ARG 579.A N ARG 575.A O no hydrogen 3.339 N/A ALA 580.A N GLU 576.A O no hydrogen 3.364 N/A ASN 581.A N ALA 577.A O no hydrogen 3.263 N/A ASN 581.A ND2 PRO 261.A O no hydrogen 3.018 N/A ALA 582.A N ALA 578.A O no hydrogen 2.907 N/A ARG 583.A N ARG 579.A O no hydrogen 2.952 N/A ARG 583.A NE ASP 252.A OD2 no hydrogen 3.344 N/A THR 585.A N ARG 579.A O no hydrogen 3.389 N/A MET 587.A N GLY 506.A O no hydrogen 3.163 N/A ARG 589.A N MET 609.A O no hydrogen 2.890 N/A ARG 589.A NE PRO 586.A O no hydrogen 2.833 N/A ARG 589.A NH1 GLU 594.A OE1 no hydrogen 2.864 N/A ARG 589.A NH1 ASP 612.A OD1 no hydrogen 2.870 N/A ARG 589.A NH2 ASP 612.A OD1 no hydrogen 3.186 N/A MET 593.A N ALA 590.A O no hydrogen 3.101 N/A GLU 594.A N ALA 590.A O no hydrogen 3.417 N/A PHE 595.A N MET 591.A O no hydrogen 2.730 N/A ASP 598.A N PHE 595.A O no hydrogen 2.949 N/A ALA 600.A N ASP 598.A OD1 no hydrogen 2.979 N/A CYS 601.A N ASP 598.A O no hydrogen 2.944 N/A LEU 604.A N CYS 601.A O no hydrogen 3.353 N/A GLN 607.A NE2 TYR 629.A O no hydrogen 2.698 N/A TYR 608.A N VAL 616.A O no hydrogen 3.005 N/A TYR 608.A OH LEU 533.A O no hydrogen 2.672 N/A MET 609.A N ARG 589.A O no hydrogen 2.957 N/A LEU 610.A N VAL 614.A O no hydrogen 2.836 N/A GLY 611.A N MET 587.A O no hydrogen 2.734 N/A ASP 612.A N GLU 576.A OE1 no hydrogen 2.870 N/A ASN 613.A N TYR 572.A OH no hydrogen 2.872 N/A MET 615.A N TYR 662.A O no hydrogen 2.713 N/A VAL 616.A N TYR 608.A O no hydrogen 2.973 N/A ALA 617.A N PRO 660.A O no hydrogen 2.960 N/A THR 621.A OG1 ASP 625.A O no hydrogen 2.742 N/A GLY 624.A N THR 621.A O no hydrogen 3.235 N/A GLY 624.A N THR 621.A OG1 no hydrogen 3.169 N/A VAL 626.A N GLN 652.A O no hydrogen 2.863 N/A PHE 628.A N HIS 650.A O no hydrogen 3.094 N/A TYR 629.A N GLN 607.A OE1 no hydrogen 2.772 N/A TYR 629.A OH ASP 598.A OD2 no hydrogen 2.480 N/A LEU 630.A N ARG 648.A O no hydrogen 2.903 N/A ARG 634.A N ASP 665.A OD1 no hydrogen 3.137 N/A TRP 635.A N LEU 644.A O no hydrogen 2.747 N/A TRP 635.A NE1 PRO 631.A O no hydrogen 2.926 N/A THR 636.A N VAL 663.A O no hydrogen 2.904 N/A HIS 637.A N ASP 642.A O no hydrogen 2.801 N/A HIS 637.A NE2 LEU 659.A O no hydrogen 2.985 N/A LEU 638.A N VAL 661.A O no hydrogen 2.839 N/A TRP 639.A N HIS 637.A ND1 no hydrogen 3.199 N/A HIS 640.A N HIS 637.A ND1 no hydrogen 3.001 N/A HIS 640.A NE2 SER 658.A OG no hydrogen 2.788 N/A ASN 641.A N HIS 637.A O no hydrogen 3.034 N/A ASN 641.A ND2 GLN 757.A O no hydrogen 3.174 N/A LEU 644.A N TRP 635.A O no hydrogen 2.920 N/A SER 647.A N LEU 630.A O no hydrogen 2.436 N/A ARG 648.A N LEU 630.A O no hydrogen 3.054 N/A HIS 650.A N PHE 628.A O no hydrogen 3.023 N/A HIS 650.A NE2 ASP 645.A O no hydrogen 2.759 N/A GLN 652.A N VAL 626.A O no hydrogen 2.974 N/A GLN 652.A NE2 TYR 662.A OH no hydrogen 2.811 N/A HIS 654.A N GLY 624.A O no hydrogen 2.968 N/A HIS 654.A ND1 SER 658.A OG no hydrogen 2.767 N/A HIS 654.A NE2 GLN 652.A OE1 no hydrogen 2.698 N/A SER 658.A N GLY 655.A O no hydrogen 3.169 N/A SER 658.A OG HIS 640.A NE2 no hydrogen 2.788 N/A SER 658.A OG HIS 654.A ND1 no hydrogen 2.767 N/A TYR 662.A N MET 615.A O no hydrogen 2.972 N/A TYR 662.A OH ASP 642.A OD2 no hydrogen 2.662 N/A VAL 663.A N THR 636.A O no hydrogen 2.783 N/A ARG 664.A N ASN 613.A O no hydrogen 3.024 N/A ARG 664.A NH1 GLU 594.A OE2 no hydrogen 2.834 N/A ARG 664.A NH1 ASP 612.A O no hydrogen 3.313 N/A ASN 666.A N ASN 692.A O no hydrogen 3.026 N/A ASN 666.A ND2 ASP 665.A OD2 no hydrogen 3.047 N/A ASN 666.A ND2 GLN 694.A OE1 no hydrogen 3.053 N/A THR 667.A N PHE 691.A O no hydrogen 3.374 N/A THR 667.A OG1 ASN 613.A OD1 no hydrogen 3.543 N/A THR 667.A OG1 ARG 664.A O no hydrogen 2.698 N/A THR 667.A OG1 ASP 665.A O no hydrogen 3.160 N/A LEU 669.A N HIS 689.A O no hydrogen 2.864 N/A LEU 671.A N ALA 687.A O no hydrogen 2.941 N/A GLY 672.A N ARG 568.A O no hydrogen 2.805 N/A GLN 676.A N ASN 674.A OD1 no hydrogen 2.926 N/A GLN 676.A NE2 ASP 675.A OD1 no hydrogen 3.153 N/A ARG 677.A NE ASP 679.A O no hydrogen 2.916 N/A ARG 677.A NE ASP 679.A OD1 no hydrogen 3.291 N/A ARG 677.A NH2 ASP 679.A OD2 no hydrogen 3.123 N/A ASP 679.A N ASP 679.A OD1 no hydrogen 2.473 N/A TYR 680.A OH CYS 567.A O no hydrogen 2.896 N/A TRP 682.A NE1 PRO 678.A O no hydrogen 3.152 N/A GLU 684.A N VAL 681.A O no hydrogen 3.208 N/A GLY 685.A N LYS 732.A O no hydrogen 2.950 N/A THR 686.A OG1 TRP 682.A O no hydrogen 2.511 N/A ALA 687.A N LEU 671.A O no hydrogen 2.848 N/A PHE 688.A N THR 735.A O no hydrogen 2.772 N/A HIS 689.A N LEU 669.A O no hydrogen 2.901 N/A LEU 690.A N CYS 737.A O no hydrogen 2.948 N/A PHE 691.A N THR 667.A O no hydrogen 2.998 N/A ASN 692.A ND2 GLU 643.A OE2 no hydrogen 3.466 N/A GLN 694.A N ASN 666.A OD1 no hydrogen 2.757 N/A GLY 696.A N ARG 718.A O no hydrogen 2.993 N/A HIS 697.A N GLN 694.A O no hydrogen 3.178 N/A ALA 699.A N ALA 716.A O no hydrogen 2.895 N/A CYS 701.A N LEU 714.A O no hydrogen 2.791 N/A VAL 703.A N PHE 712.A O no hydrogen 2.710 N/A ALA 705.A N SER 709.A O no hydrogen 2.652 N/A GLY 708.A N ALA 705.A O no hydrogen 2.769 N/A SER 709.A N ASP 707.A OD1 no hydrogen 3.123 N/A SER 709.A OG ASP 707.A OD1 no hydrogen 2.709 N/A ILE 711.A N VAL 703.A O no hydrogen 2.822 N/A PHE 712.A N VAL 703.A O no hydrogen 3.284 N/A THR 713.A N ALA 728.A O no hydrogen 2.877 N/A LEU 714.A N CYS 701.A O no hydrogen 2.734 N/A LYS 715.A N THR 726.A O no hydrogen 2.752 N/A ALA 716.A N ALA 699.A O no hydrogen 2.881 N/A ALA 717.A N THR 724.A O no hydrogen 2.854 N/A ARG 718.A N HIS 697.A O no hydrogen 2.993 N/A ARG 718.A NE GLY 720.A O no hydrogen 3.168 N/A ARG 718.A NH1 LEU 693.A O no hydrogen 2.788 N/A ARG 718.A NH2 GLY 720.A O no hydrogen 3.401 N/A THR 719.A N THR 722.A O no hydrogen 3.055 N/A ILE 723.A N ILE 770.A O no hydrogen 2.982 N/A THR 724.A N ALA 717.A O no hydrogen 2.734 N/A THR 726.A N LYS 715.A O no hydrogen 2.900 N/A ALA 728.A N THR 713.A O no hydrogen 2.888 N/A GLU 730.A N ILE 711.A O no hydrogen 2.961 N/A LYS 732.A N HIS 683.A O no hydrogen 3.170 N/A THR 735.A N THR 686.A O no hydrogen 3.100 N/A LEU 736.A N VAL 761.A O no hydrogen 2.824 N/A CYS 737.A N PHE 688.A O no hydrogen 2.788 N/A CYS 737.A SG GLY 758.A O no hydrogen 3.786 N/A LEU 738.A N LEU 759.A O no hydrogen 2.807 N/A ARG 739.A N LEU 690.A O no hydrogen 2.984 N/A ARG 739.A NE HIS 689.A ND1 no hydrogen 2.780 N/A ARG 739.A NH1 LEU 638.A O no hydrogen 2.876 N/A ARG 739.A NH1 ASN 641.A OD1 no hydrogen 2.796 N/A ARG 739.A NH2 HIS 689.A ND1 no hydrogen 2.903 N/A ASN 740.A N GLN 757.A O no hydrogen 2.686 N/A ASN 740.A ND2 ASN 641.A O no hydrogen 2.883 N/A VAL 741.A N LEU 738.A O no hydrogen 3.182 N/A LYS 743.A NZ VAL 744.A O no hydrogen 3.231 N/A ASN 745.A N THR 771.A O no hydrogen 2.933 N/A GLY 746.A N THR 771.A O no hydrogen 3.336 N/A GLN 748.A N THR 769.A O no hydrogen 3.079 N/A SER 751.A N LYS 762.A O no hydrogen 2.908 N/A SER 751.A OG LYS 762.A O no hydrogen 3.496 N/A ALA 753.A N VAL 760.A O no hydrogen 3.130 N/A SER 755.A OG GLY 758.A O no hydrogen 2.826 N/A GLY 758.A N SER 755.A O no hydrogen 3.198 N/A LEU 759.A N VAL 741.A O no hydrogen 2.817 N/A VAL 760.A N ALA 753.A O no hydrogen 2.846 N/A VAL 761.A N LEU 736.A O no hydrogen 2.702 N/A LYS 762.A N SER 751.A O no hydrogen 2.830 N/A LYS 762.A NZ PRO 763.A O no hydrogen 3.506 N/A GLN 764.A N ASP 749.A O no hydrogen 2.594 N/A ILE 770.A N ILE 723.A O no hydrogen 3.034 N/A THR 771.A N GLY 746.A O no hydrogen 2.774 N/A LEU 772.A N ASN 721.A O no hydrogen 2.420 N/A