Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1lsh_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLN 2.A N TYR 7.A OH no hydrogen 2.734 N/A GLY 4.A N GLY 39.A O no hydrogen 3.276 N/A LYS 5.A N GLN 2.A O no hydrogen 2.781 N/A LYS 5.A NZ SER 246.A OG no hydrogen 2.572 N/A VAL 6.A N GLN 245.A O no hydrogen 2.770 N/A TYR 7.A N ILE 37.A O no hydrogen 2.675 N/A ARG 8.A N GLY 243.A O no hydrogen 2.878 N/A ARG 8.A NE GLU 36.A OE2 no hydrogen 2.752 N/A ARG 8.A NH2 GLU 36.A OE2 no hydrogen 2.729 N/A TYR 9.A N ILE 35.A O no hydrogen 2.898 N/A TYR 9.A OH ILE 210.A O no hydrogen 2.701 N/A SER 10.A N ILE 240.A O no hydrogen 2.847 N/A TYR 11.A N MET 33.A O no hydrogen 2.791 N/A ASP 12.A N LYS 238.A O no hydrogen 2.765 N/A ALA 13.A N GLY 31.A O no hydrogen 2.950 N/A PHE 14.A N ARG 236.A O no hydrogen 2.685 N/A SER 15.A N LEU 29.A O no hydrogen 2.977 N/A SER 15.A OG.A SER 235.A OG no hydrogen 3.037 N/A ILE 16.A N GLU 234.A O no hydrogen 2.851 N/A SER 17.A N ALA 27.A O no hydrogen 2.911 N/A SER 17.A OG.A MET 798.A O no hydrogen 2.784 N/A GLY 18.A N VAL 232.A O no hydrogen 2.973 N/A GLU 21.A N LEU 19.A O no hydrogen 2.873 N/A ASN 25.A N VAL 869.A O no hydrogen 3.100 N/A ARG 26.A N GLY 59.A O no hydrogen 2.809 N/A ARG 26.A NH2.A GLU 21.A O no hydrogen 3.119 N/A ALA 27.A N SER 17.A O no hydrogen 3.175 N/A GLY 28.A N PHE 57.A O no hydrogen 2.755 N/A LEU 29.A N SER 15.A O no hydrogen 3.101 N/A SER 30.A N LYS 55.A O no hydrogen 2.843 N/A SER 30.A OG ALA 13.A O no hydrogen 3.298 N/A GLY 31.A N ALA 13.A O no hydrogen 3.011 N/A GLU 32.A N ASN 53.A O no hydrogen 2.890 N/A MET 33.A N TYR 11.A O no hydrogen 2.961 N/A LYS 34.A N GLN 51.A O no hydrogen 3.070 N/A LYS 34.A NZ GLU 242.A OE1 no hydrogen 3.237 N/A ILE 35.A N TYR 9.A O no hydrogen 2.939 N/A GLU 36.A N LYS 48.A O no hydrogen 2.857 N/A ILE 37.A N TYR 7.A O no hydrogen 2.788 N/A HIS 38.A N THR 46.A O no hydrogen 2.855 N/A HIS 38.A NE2.A GLU 36.A OE1 no hydrogen 2.934 N/A GLY 39.A N LYS 5.A O no hydrogen 2.771 N/A HIS 40.A N GLN 44.A O no hydrogen 2.944 N/A HIS 40.A NE2 THR 46.A OG1 no hydrogen 2.903 N/A GLN 44.A NE2 ASP 87.A OD1 no hydrogen 2.924 N/A ALA 45.A N PHE 86.A O no hydrogen 2.908 N/A THR 46.A N HIS 38.A O no hydrogen 3.077 N/A THR 46.A OG1 HIS 40.A NE2 no hydrogen 2.903 N/A LEU 47.A N VAL 84.A O no hydrogen 2.779 N/A LYS 48.A N GLU 36.A O no hydrogen 2.840 N/A THR 50.A N LYS 34.A O no hydrogen 2.876 N/A THR 50.A OG1 LYS 34.A O no hydrogen 3.104 N/A ASN 53.A N GLU 32.A O no hydrogen 2.767 N/A LYS 55.A N SER 30.A O no hydrogen 2.731 N/A LYS 55.A NZ.B GLU 32.A OE2 no hydrogen 2.685 N/A TYR 56.A N TYR 67.A O no hydrogen 2.804 N/A PHE 57.A N GLY 28.A O no hydrogen 2.617 N/A LEU 58.A N SER 65.A O no hydrogen 3.047 N/A GLY 59.A N ARG 26.A O no hydrogen 3.075 N/A SER 63.A OG PRO 60.A O no hydrogen 2.502 N/A SER 63.A OG SER 65.A OG no hydrogen 2.443 N/A SER 65.A OG SER 63.A OG no hydrogen 2.443 N/A TYR 67.A N TYR 56.A O no hydrogen 2.980 N/A LEU 69.A N LEU 54.A O no hydrogen 2.865 N/A TYR 73.A OH LEU 804.A O no hydrogen 2.992 N/A TYR 73.A OH ASP 860.A OD2 no hydrogen 2.838 N/A ILE 77.A N TYR 73.A O no hydrogen 2.769 N/A GLN 78.A N ASP 74.A O no hydrogen 2.965 N/A GLN 79.A N HIS 75.A O no hydrogen 3.070 N/A LEU 80.A N PHE 76.A O no hydrogen 2.942 N/A GLU 81.A N ILE 77.A O no hydrogen 3.224 N/A GLU 81.A N GLN 78.A O no hydrogen 3.282 N/A VAL 82.A N GLN 79.A O no hydrogen 3.222 N/A VAL 84.A N LEU 47.A O no hydrogen 2.877 N/A ARG 85.A N TYR 97.A O no hydrogen 3.021 N/A ARG 85.A NE SER 255.A O no hydrogen 2.790 N/A ARG 85.A NH1 GLN 44.A OE1 no hydrogen 2.893 N/A ARG 85.A NH1 GLN 252.A OE1 no hydrogen 2.973 N/A ARG 85.A NH2 ALA 254.A O no hydrogen 2.781 N/A PHE 86.A N ALA 45.A O no hydrogen 2.693 N/A ASP 87.A N ASP 95.A O no hydrogen 2.943 N/A TYR 88.A N ASN 43.A O no hydrogen 3.032 N/A TYR 88.A OH PHE 117.A O no hydrogen 2.604 N/A SER 89.A N.A ARG 92.A O no hydrogen 3.115 N/A SER 89.A N.B ARG 92.A O no hydrogen 3.140 N/A ARG 92.A N SER 89.A O.A no hydrogen 2.855 N/A ARG 92.A N SER 89.A O.B no hydrogen 2.902 N/A ARG 92.A NH1 THR 133.A OG1 no hydrogen 2.921 N/A ILE 93.A N GLN 118.A OE1 no hydrogen 2.712 N/A GLY 94.A N ASP 87.A O no hydrogen 2.866 N/A ASP 95.A N ASP 87.A OD2 no hydrogen 2.919 N/A ILE 96.A N GLY 260.A O no hydrogen 2.909 N/A TYR 97.A N ARG 85.A O no hydrogen 2.836 N/A TYR 97.A OH ASP 87.A OD1 no hydrogen 3.406 N/A TYR 97.A OH ASP 87.A OD2 no hydrogen 3.102 N/A ALA 98.A N GLN 257.A O no hydrogen 3.106 N/A VAL 102.A N PRO 99.A O no hydrogen 2.821 N/A THR 103.A N GLN 79.A OE1 no hydrogen 2.714 N/A THR 103.A OG1 GLN 79.A OE1 no hydrogen 2.774 N/A VAL 107.A N THR 103.A O no hydrogen 2.911 N/A ASN 108.A N ASP 104.A O no hydrogen 2.663 N/A ASN 108.A ND2 LYS 265.A O no hydrogen 2.755 N/A ILE 109.A N THR 105.A O no hydrogen 3.074 N/A VAL 110.A N ALA 106.A O no hydrogen 3.085 N/A ARG 111.A N VAL 107.A O no hydrogen 2.896 N/A ARG 111.A NE GLY 261.A O no hydrogen 2.756 N/A ARG 111.A NH1 ASN 108.A OD1 no hydrogen 2.926 N/A ARG 111.A NH2 ARG 259.A O no hydrogen 2.895 N/A ARG 111.A NH2 GLY 261.A O no hydrogen 2.814 N/A GLY 112.A N ASN 108.A O no hydrogen 3.066 N/A ILE 113.A N ILE 109.A O no hydrogen 3.357 N/A LEU 114.A N VAL 110.A O no hydrogen 2.767 N/A ASN 115.A N ARG 111.A O no hydrogen 2.737 N/A LEU 116.A N ILE 113.A O no hydrogen 3.081 N/A PHE 117.A N LEU 114.A O no hydrogen 2.952 N/A GLN 118.A N ASN 115.A O no hydrogen 3.115 N/A GLN 118.A NE2 THR 133.A O no hydrogen 2.979 N/A LEU 119.A N GLY 91.A O no hydrogen 2.940 N/A SER 120.A N TYR 143.A OH no hydrogen 2.977 N/A SER 120.A OG GLU 132.A OE2 no hydrogen 2.989 N/A GLN 125.A N LYS 122.A O no hydrogen 3.164 N/A THR 127.A OG1.A TYR 143.A O no hydrogen 3.078 N/A PHE 128.A N TYR 143.A O no hydrogen 3.091 N/A LEU 130.A N THR 141.A O no hydrogen 2.919 N/A GLN 131.A NE2 ASN 164.A O no hydrogen 3.018 N/A GLU 132.A N CYS 139.A O no hydrogen 2.918 N/A GLY 134.A N GLY 137.A O no hydrogen 2.778 N/A VAL 135.A N ASN 115.A OD1 no hydrogen 3.172 N/A GLY 137.A N GLY 134.A O no hydrogen 2.859 N/A ILE 138.A N HIS 167.A O no hydrogen 2.819 N/A CYS 139.A N GLU 132.A O no hydrogen 3.028 N/A CYS 139.A SG.A GLN 140.A O no hydrogen 3.789 N/A CYS 139.A SG.A ASP 161.A O no hydrogen 3.586 N/A GLN 140.A N ASN 164.A O no hydrogen 2.851 N/A THR 141.A N LEU 130.A O no hydrogen 2.654 N/A THR 141.A OG1 CYS 139.A O no hydrogen 2.839 N/A THR 142.A N THR 159.A O no hydrogen 2.919 N/A TYR 143.A N PHE 128.A O no hydrogen 2.794 N/A TYR 143.A OH GLU 132.A OE2 no hydrogen 2.371 N/A VAL 144.A N VAL 157.A O no hydrogen 2.991 N/A VAL 145.A N GLN 126.A O no hydrogen 2.719 N/A GLN 146.A N ALA 155.A O no hydrogen 2.923 N/A GLY 148.A N GLU 153.A O no hydrogen 3.400 N/A ARG 150.A N GLU 153.A OE2.A no hydrogen 3.142 N/A MET 154.A N ILE 201.A O no hydrogen 2.787 N/A ALA 155.A N GLN 146.A O no hydrogen 2.955 N/A VAL 156.A N TYR 199.A O no hydrogen 2.894 N/A VAL 157.A N VAL 144.A O no hydrogen 3.078 N/A LYS 158.A N TYR 197.A O no hydrogen 2.666 N/A LYS 158.A NZ GLN 118.A O no hydrogen 2.748 N/A LYS 158.A NZ GLU 132.A OE1 no hydrogen 2.795 N/A LYS 158.A NZ GLU 132.A OE2 no hydrogen 3.538 N/A THR 159.A N THR 142.A O no hydrogen 2.805 N/A THR 159.A OG1 ALA 195.A O no hydrogen 3.421 N/A LYS 160.A N ALA 195.A O no hydrogen 2.774 N/A LYS 160.A NZ GLU 132.A OE1 no hydrogen 3.149 N/A LYS 160.A NZ THR 141.A OG1 no hydrogen 3.191 N/A ASP 161.A N GLN 140.A O no hydrogen 2.849 N/A LEU 162.A N SER 193.A O no hydrogen 3.111 N/A ASN 163.A N ASP 161.A OD1 no hydrogen 2.985 N/A ASN 163.A ND2 LEU 191.A O no hydrogen 3.212 N/A ASN 164.A N ASP 161.A O no hydrogen 3.025 N/A CYS 165.A SG.A LEU 162.A O no hydrogen 2.779 N/A CYS 165.A SG.B ASP 161.A O no hydrogen 3.993 N/A CYS 165.A SG.B LEU 162.A O no hydrogen 3.098 N/A ASP 166.A N GLN 131.A OE1 no hydrogen 2.942 N/A HIS 167.A N ILE 138.A O no hydrogen 3.084 N/A LYS 168.A NZ LEU 162.A O no hydrogen 3.142 N/A LYS 168.A NZ GLN 735.A OE1 no hydrogen 3.460 N/A VAL 169.A N GLU 136.A O no hydrogen 3.078 N/A LYS 171.A N MET 734.A O no hydrogen 2.905 N/A THR 172.A OG1 THR 175.A OG1 no hydrogen 3.251 N/A MET 173.A N ARG 732.A O no hydrogen 2.964 N/A THR 175.A OG1 THR 172.A OG1 no hydrogen 3.251 N/A ALA 178.A N THR 175.A O no hydrogen 3.213 N/A GLU 179.A N ALA 653.A O no hydrogen 2.647 N/A CYS 181.A N GLY 651.A O no hydrogen 2.915 N/A GLN 185.A N CYS 181.A O no hydrogen 2.836 N/A LYS 186.A N PRO 182.A O no hydrogen 3.034 N/A LYS 186.A N THR 183.A O no hydrogen 2.839 N/A MET 187.A N THR 183.A O no hydrogen 3.182 N/A MET 187.A N CYS 184.A O no hydrogen 3.118 N/A ASN 188.A N CYS 184.A O no hydrogen 3.190 N/A LYS 189.A NZ GLN 185.A OE1 no hydrogen 3.534 N/A ASN 190.A ND2 SER 222.A O no hydrogen 2.703 N/A ARG 192.A N GLN 220.A O no hydrogen 2.749 N/A SER 193.A N ASN 163.A OD1 no hydrogen 2.885 N/A SER 193.A OG GLN 219.A OE1 no hydrogen 2.604 N/A THR 194.A N ILE 218.A O no hydrogen 3.092 N/A THR 194.A OG1 LYS 160.A O no hydrogen 2.974 N/A ALA 195.A N LYS 160.A O no hydrogen 3.292 N/A VAL 196.A N GLU 216.A O no hydrogen 2.844 N/A TYR 197.A N LYS 158.A O no hydrogen 2.686 N/A ASN 198.A N HIS 214.A O no hydrogen 2.875 N/A TYR 199.A N VAL 156.A O no hydrogen 2.743 N/A TYR 199.A OH LEU 116.A O no hydrogen 2.664 N/A ALA 200.A N SER 212.A O no hydrogen 3.055 N/A ILE 201.A N MET 154.A O no hydrogen 2.800 N/A PHE 202.A N ILE 209.A O no hydrogen 2.854 N/A ASP 203.A N ASN 152.A O no hydrogen 3.049 N/A GLY 207.A N GLU 204.A O no hydrogen 2.404 N/A ILE 209.A N PHE 202.A O no hydrogen 2.963 N/A LYS 211.A N ALA 200.A O no hydrogen 2.934 N/A LYS 211.A NZ.A LEU 241.A O no hydrogen 2.642 N/A SER 212.A N ALA 200.A O no hydrogen 3.210 N/A ALA 213.A N LEU 239.A O no hydrogen 2.750 N/A HIS 214.A N ASN 198.A O no hydrogen 2.674 N/A SER 215.A N GLN 237.A O no hydrogen 2.865 N/A SER 215.A OG GLN 237.A OE1 no hydrogen 2.878 N/A GLU 216.A N VAL 196.A O no hydrogen 2.991 N/A GLU 217.A N SER 235.A O no hydrogen 2.900 N/A ILE 218.A N THR 194.A O no hydrogen 2.822 N/A GLN 219.A N ILE 233.A O no hydrogen 2.785 N/A GLN 219.A NE2 GLU 136.A OE1 no hydrogen 3.162 N/A GLN 220.A N ARG 192.A O no hydrogen 2.804 N/A LEU 221.A N VAL 231.A O no hydrogen 3.028 N/A SER 222.A N ASN 190.A O no hydrogen 2.636 N/A ASP 225.A N ARG 618.A O no hydrogen 2.885 N/A LYS 227.A N ASP 225.A OD2 no hydrogen 2.891 N/A GLU 228.A N ASP 225.A O no hydrogen 2.915 N/A ASN 230.A ND2 LEU 221.A O no hydrogen 3.596 N/A ASN 230.A ND2 ILE 226.A O no hydrogen 3.673 N/A VAL 231.A N LEU 221.A O no hydrogen 3.023 N/A VAL 232.A N GLY 18.A O no hydrogen 2.752 N/A ILE 233.A N GLN 219.A O no hydrogen 2.837 N/A GLU 234.A N ILE 16.A O no hydrogen 2.998 N/A SER 235.A N GLU 217.A O no hydrogen 3.020 N/A SER 235.A OG SER 15.A OG.A no hydrogen 3.037 N/A ARG 236.A N PHE 14.A O no hydrogen 2.951 N/A ARG 236.A NE GLU 234.A OE2 no hydrogen 3.139 N/A ARG 236.A NH2 GLU 234.A OE2 no hydrogen 2.793 N/A GLN 237.A N SER 215.A O no hydrogen 3.356 N/A GLN 237.A N SER 215.A OG no hydrogen 3.145 N/A GLN 237.A NE2 TYR 11.A OH no hydrogen 2.865 N/A GLN 237.A NE2 GLY 112.A O no hydrogen 2.908 N/A LYS 238.A N ASP 12.A O no hydrogen 2.727 N/A LEU 239.A N ALA 213.A O no hydrogen 3.015 N/A ILE 240.A N SER 10.A O no hydrogen 3.103 N/A LEU 241.A N LYS 211.A O no hydrogen 2.833 N/A GLU 242.A N ARG 8.A O no hydrogen 2.759 N/A GLY 243.A N ARG 8.A O no hydrogen 3.353 N/A GLN 245.A N VAL 6.A O no hydrogen 2.809 N/A ALA 247.A N GLY 4.A O no hydrogen 2.692 N/A GLN 257.A N SER 255.A OG no hydrogen 2.525 N/A ASN 258.A ND2 ASP 95.A OD2 no hydrogen 3.018 N/A ARG 259.A N ILE 96.A O no hydrogen 2.770 N/A ARG 259.A NH1 ALA 98.A O no hydrogen 3.156 N/A ARG 259.A NH1 VAL 102.A O no hydrogen 2.818 N/A ARG 259.A NH2 VAL 102.A O no hydrogen 3.025 N/A ARG 259.A NH2 ASP 104.A OD1 no hydrogen 2.706 N/A GLY 260.A N ASN 258.A OD1 no hydrogen 2.794 N/A TYR 264.A N VAL 135.A O no hydrogen 2.777 N/A LYS 265.A N ASN 108.A OD1 no hydrogen 2.958 N/A LYS 265.A NZ GLY 261.A O no hydrogen 3.431 N/A LYS 265.A NZ MET 263.A O no hydrogen 2.732 N/A ALA 270.A N PRO 267.A O no hydrogen 3.094 N/A THR 272.A N SER 269.A O no hydrogen 3.194 N/A THR 272.A OG1 SER 269.A O no hydrogen 3.287 N/A LYS 273.A N SER 269.A O no hydrogen 3.097 N/A LYS 273.A NZ.B THR 272.A OG1 no hydrogen 2.532 N/A MET 274.A N ALA 270.A O no hydrogen 3.113 N/A SER 276.A OG.A ASN 746.A OD1 no hydrogen 2.480 N/A LEU 277.A N SER 275.A OG no hydrogen 2.951 N/A PHE 278.A N SER 275.A OG no hydrogen 3.110 N/A LYS 283.A N THR 280.A O no hydrogen 3.239 N/A ASN 284.A ND2 SER 287.A OG.A no hydrogen 2.847 N/A GLU 288.A N ASN 284.A O no hydrogen 3.005 N/A ILE 289.A N LEU 285.A O no hydrogen 2.895 N/A HIS 290.A N GLU 286.A O no hydrogen 2.981 N/A THR 291.A N SER 287.A O no hydrogen 3.001 N/A THR 291.A OG1 SER 287.A O no hydrogen 3.036 N/A VAL 292.A N GLU 288.A O no hydrogen 3.109 N/A LEU 293.A N ILE 289.A O no hydrogen 2.852 N/A LYS 294.A N HIS 290.A O no hydrogen 2.917 N/A HIS 295.A N THR 291.A O no hydrogen 2.921 N/A LEU 296.A N VAL 292.A O no hydrogen 3.002 N/A VAL 297.A N LEU 293.A O no hydrogen 3.010 N/A GLU 298.A N LYS 294.A O no hydrogen 2.849 N/A ASN 299.A N HIS 295.A O no hydrogen 2.857 N/A ASN 299.A ND2 HIS 295.A O no hydrogen 2.747 N/A GLN 301.A NE2 VAL 297.A O no hydrogen 2.969 N/A GLN 301.A NE2 ASP 339.A OD2 no hydrogen 3.073 N/A SER 303.A OG.A LEU 302.A O no hydrogen 2.730 N/A VAL 304.A N SER 789.A OG no hydrogen 2.900 N/A ASP 307.A N HIS 305.A ND1.B no hydrogen 2.881 N/A ALA 308.A N HIS 305.A O no hydrogen 2.959 N/A LYS 311.A N ASP 307.A O no hydrogen 2.977 N/A PHE 312.A N ALA 308.A O no hydrogen 2.767 N/A LEU 313.A N PRO 309.A O no hydrogen 2.933 N/A ARG 314.A N ALA 310.A O no hydrogen 2.891 N/A ARG 314.A NH2 GLU 288.A OE1 no hydrogen 2.950 N/A LEU 315.A N LYS 311.A O no hydrogen 2.797 N/A THR 316.A N PHE 312.A O no hydrogen 3.023 N/A THR 316.A OG1.A PHE 312.A O no hydrogen 2.847 N/A THR 316.A OG1.B PHE 312.A O no hydrogen 3.334 N/A THR 316.A OG1.B LEU 313.A O no hydrogen 2.772 N/A ALA 317.A N LEU 313.A O no hydrogen 2.962 N/A PHE 318.A N ARG 314.A O no hydrogen 3.075 N/A LEU 319.A N LEU 315.A O no hydrogen 2.947 N/A ARG 320.A N THR 316.A O no hydrogen 3.013 N/A ARG 320.A NE MET 351.A O no hydrogen 2.663 N/A ARG 320.A NH1 GLU 730.A OE1 no hydrogen 3.529 N/A ARG 320.A NH1 GLU 730.A OE2 no hydrogen 2.556 N/A ARG 320.A NH2 ALA 350.A O no hydrogen 2.776 N/A ARG 320.A NH2 GLU 730.A OE1 no hydrogen 2.664 N/A ARG 320.A NH2 GLU 730.A OE2 no hydrogen 3.306 N/A ASN 321.A N PHE 318.A O no hydrogen 2.891 N/A ASN 321.A ND2 LYS 273.A O no hydrogen 3.161 N/A ASN 321.A ND2 ALA 317.A O no hydrogen 2.818 N/A VAL 322.A N LEU 319.A O no hydrogen 3.057 N/A ALA 324.A N GLU 355.A OE1 no hydrogen 2.630 N/A VAL 326.A N ASP 323.A OD1 no hydrogen 3.211 N/A LEU 327.A N ASP 323.A O no hydrogen 3.153 N/A GLN 328.A N ALA 324.A O no hydrogen 2.839 N/A SER 329.A N GLY 325.A O no hydrogen 3.026 N/A SER 329.A OG GLY 325.A O no hydrogen 3.003 N/A ILE 330.A N VAL 326.A O no hydrogen 2.897 N/A TRP 331.A N LEU 327.A O no hydrogen 2.835 N/A TRP 331.A NE1 GLN 368.A OE1 no hydrogen 2.772 N/A HIS 332.A N GLN 328.A O no hydrogen 2.979 N/A LEU 334.A N ILE 330.A O no hydrogen 3.151 N/A LEU 334.A N TRP 331.A O no hydrogen 2.962 N/A HIS 335.A N TRP 331.A O no hydrogen 2.745 N/A GLN 337.A N LEU 334.A O no hydrogen 2.888 N/A LYS 338.A NZ LEU 721.A O no hydrogen 3.249 N/A TYR 340.A OH GLU 298.A OE2 no hydrogen 2.867 N/A ARG 341.A N GLN 337.A O no hydrogen 2.840 N/A ARG 341.A NE GLU 373.A OE2 no hydrogen 2.892 N/A ARG 341.A NH1 HIS 335.A O no hydrogen 3.094 N/A ARG 341.A NH2 GLN 368.A O no hydrogen 2.768 N/A ARG 341.A NH2 GLU 373.A OE1 no hydrogen 2.950 N/A ARG 342.A N LYS 338.A O no hydrogen 3.115 N/A ARG 342.A NE THR 723.A O no hydrogen 3.253 N/A ARG 342.A NE THR 723.A OG1 no hydrogen 2.781 N/A ARG 342.A NH1 ASP 339.A OD1 no hydrogen 2.760 N/A ARG 342.A NH2 ASP 339.A OD1 no hydrogen 2.765 N/A ARG 342.A NH2 THR 723.A OG1 no hydrogen 2.777 N/A TRP 343.A N ASP 339.A O no hydrogen 3.038 N/A ILE 344.A N TYR 340.A O no hydrogen 2.934 N/A LEU 345.A N ARG 341.A O no hydrogen 3.157 N/A ASP 346.A N ARG 342.A O no hydrogen 2.979 N/A ALA 347.A N TRP 343.A O no hydrogen 2.988 N/A VAL 348.A N ILE 344.A O no hydrogen 3.187 N/A MET 351.A N ALA 347.A O no hydrogen 3.069 N/A ALA 356.A N THR 353.A O no hydrogen 3.099 N/A LEU 358.A N SER 354.A O no hydrogen 2.854 N/A PHE 359.A N GLU 355.A O no hydrogen 2.962 N/A LEU 360.A N ALA 356.A O no hydrogen 2.913 N/A LYS 361.A N LEU 357.A O no hydrogen 2.841 N/A LYS 361.A NZ GLU 397.A OE1 no hydrogen 3.300 N/A ARG 362.A N LEU 358.A O no hydrogen 2.976 N/A ARG 362.A NH1 GLN 328.A OE1 no hydrogen 3.467 N/A THR 363.A N PHE 359.A O no hydrogen 2.836 N/A THR 363.A OG1 PHE 359.A O no hydrogen 2.736 N/A LEU 364.A N LEU 360.A O no hydrogen 2.992 N/A ALA 365.A N LYS 361.A O no hydrogen 2.988 N/A SER 366.A N ARG 362.A O no hydrogen 3.112 N/A SER 366.A OG ARG 362.A O no hydrogen 3.200 N/A SER 366.A OG THR 363.A O no hydrogen 3.089 N/A GLU 367.A N LEU 364.A O no hydrogen 2.808 N/A GLN 368.A N THR 363.A O no hydrogen 3.181 N/A GLN 368.A NE2 SER 366.A OG no hydrogen 2.768 N/A THR 370.A N GLU 373.A OE1 no hydrogen 3.140 N/A GLU 373.A N THR 370.A OG1 no hydrogen 3.044 N/A ALA 374.A N THR 370.A O no hydrogen 2.923 N/A THR 375.A N SER 371.A O no hydrogen 3.012 N/A THR 375.A OG1.B SER 371.A O no hydrogen 2.732 N/A GLN 376.A N ALA 372.A O no hydrogen 3.187 N/A GLN 376.A N GLU 373.A O no hydrogen 3.076 N/A ILE 377.A N GLU 373.A O no hydrogen 2.995 N/A VAL 378.A N ALA 374.A O no hydrogen 2.855 N/A SER 380.A N GLN 376.A O no hydrogen 3.296 N/A SER 380.A OG GLN 376.A O no hydrogen 3.215 N/A THR 381.A N ILE 377.A O no hydrogen 2.674 N/A THR 381.A OG1 ILE 377.A O no hydrogen 2.582 N/A LEU 382.A N VAL 378.A O no hydrogen 2.959 N/A SER 383.A OG ALA 379.A O no hydrogen 3.183 N/A SER 383.A OG SER 380.A O no hydrogen 3.039 N/A ASN 384.A N SER 380.A O no hydrogen 3.005 N/A ASN 384.A ND2 PRO 349.A O no hydrogen 2.616 N/A GLN 385.A NE2 THR 353.A O no hydrogen 2.928 N/A GLN 385.A NE2 THR 381.A O no hydrogen 3.628 N/A GLN 386.A N ALA 352.A O no hydrogen 2.950 N/A GLN 386.A NE2 THR 172.A O no hydrogen 3.213 N/A THR 388.A OG1 SER 391.A OG no hydrogen 3.304 N/A ARG 389.A NH1 GLU 435.A OE1 no hydrogen 3.478 N/A ARG 389.A NH2 GLU 435.A OE1 no hydrogen 2.913 N/A SER 391.A N THR 388.A OG1 no hydrogen 3.178 N/A SER 391.A OG GLN 385.A OE1 no hydrogen 2.829 N/A SER 391.A OG THR 388.A OG1 no hydrogen 3.304 N/A LEU 392.A N THR 388.A O no hydrogen 3.196 N/A SER 393.A N ARG 389.A O no hydrogen 3.041 N/A SER 393.A OG ARG 389.A O no hydrogen 3.374 N/A TYR 394.A N GLU 390.A O no hydrogen 2.848 N/A ALA 395.A N SER 391.A O no hydrogen 2.818 N/A ARG 396.A N LEU 392.A O no hydrogen 2.967 N/A ARG 396.A NH1.B TYR 418.A OH no hydrogen 3.086 N/A GLU 397.A N SER 393.A O no hydrogen 2.901 N/A LEU 398.A N TYR 394.A O no hydrogen 2.996 N/A LEU 399.A N ALA 395.A O no hydrogen 3.139 N/A ASN 400.A N GLU 397.A O no hydrogen 2.969 N/A THR 401.A N LEU 398.A O no hydrogen 3.006 N/A THR 401.A OG1 GLU 397.A O no hydrogen 3.305 N/A ARG 405.A N THR 401.A O no hydrogen 2.840 N/A ASN 406.A N SER 402.A O no hydrogen 2.833 N/A ARG 407.A N ILE 404.A O no hydrogen 3.109 N/A ARG 407.A NE SER 371.A OG no hydrogen 2.898 N/A ARG 407.A NH1 PHE 403.A O no hydrogen 2.943 N/A ARG 411.A N ARG 407.A O no hydrogen 2.731 N/A ARG 411.A NH1 GLU 455.A OE1 no hydrogen 3.036 N/A ARG 411.A NH1 GLU 455.A OE2 no hydrogen 2.771 N/A ARG 411.A NH2 GLU 455.A OE1 no hydrogen 2.582 N/A LYS 412.A N PRO 408.A O no hydrogen 2.967 N/A THR 413.A N ILE 409.A O no hydrogen 3.165 N/A THR 413.A OG1 ILE 409.A O no hydrogen 3.271 N/A ALA 414.A N LEU 410.A O no hydrogen 2.853 N/A VAL 415.A N ARG 411.A O no hydrogen 2.849 N/A LEU 416.A N LYS 412.A O no hydrogen 2.951 N/A GLY 417.A N THR 413.A O no hydrogen 2.883 N/A TYR 418.A N ALA 414.A O no hydrogen 2.990 N/A TYR 418.A OH LEU 436.A O no hydrogen 2.614 N/A GLY 419.A N VAL 415.A O no hydrogen 3.181 N/A SER 420.A N LEU 416.A O no hydrogen 2.877 N/A SER 420.A OG LEU 416.A O no hydrogen 3.216 N/A SER 420.A OG GLN 692.A OE1 no hydrogen 2.842 N/A LEU 421.A N GLY 417.A O no hydrogen 2.838 N/A VAL 422.A N TYR 418.A O no hydrogen 2.892 N/A PHE 423.A N GLY 419.A O no hydrogen 3.052 N/A ARG 424.A N SER 420.A O no hydrogen 3.003 N/A ARG 424.A NE GLN 385.A O no hydrogen 3.131 N/A ARG 424.A NH2 GLN 385.A O no hydrogen 2.660 N/A TYR 425.A N LEU 421.A O no hydrogen 2.967 N/A CYS 426.A N VAL 422.A O no hydrogen 2.912 N/A ALA 427.A N ARG 424.A O no hydrogen 3.422 N/A THR 429.A N CYS 426.A O no hydrogen 3.008 N/A LEU 436.A N PRO 433.A O no hydrogen 3.243 N/A LEU 437.A N ASP 434.A O no hydrogen 2.662 N/A GLN 438.A N ASP 434.A O no hydrogen 3.238 N/A GLN 438.A N GLU 435.A O no hydrogen 3.324 N/A HIS 441.A N LEU 437.A O no hydrogen 2.860 N/A HIS 441.A NE2 SER 471.A OG no hydrogen 2.825 N/A ASP 442.A N GLN 438.A O no hydrogen 2.831 N/A LEU 443.A N PRO 439.A O no hydrogen 2.971 N/A LEU 444.A N LEU 440.A O no hydrogen 3.014 N/A SER 445.A N HIS 441.A O no hydrogen 2.772 N/A GLN 446.A N ASP 442.A O no hydrogen 2.800 N/A GLN 446.A NE2 ASP 442.A O no hydrogen 3.429 N/A SER 447.A N LEU 443.A O no hydrogen 2.866 N/A SER 447.A OG.A LEU 443.A O no hydrogen 2.450 N/A SER 447.A OG.B LEU 443.A O no hydrogen 2.975 N/A SER 447.A OG.B LEU 444.A O no hydrogen 2.750 N/A SER 448.A N LEU 444.A O no hydrogen 2.991 N/A SER 448.A OG TYR 489.A OH no hydrogen 2.907 N/A ASP 449.A N SER 445.A O no hydrogen 3.114 N/A ARG 450.A N GLN 446.A O no hydrogen 3.002 N/A ALA 451.A N SER 448.A O no hydrogen 2.838 N/A LYS 452.A N SER 447.A O no hydrogen 3.253 N/A ILE 456.A N LYS 452.A O no hydrogen 3.040 N/A VAL 457.A N GLU 453.A O no hydrogen 3.028 N/A LEU 458.A N GLU 454.A O no hydrogen 3.035 N/A ALA 459.A N GLU 455.A O no hydrogen 2.976 N/A LEU 460.A N ILE 456.A O no hydrogen 2.917 N/A LYS 461.A N VAL 457.A O no hydrogen 2.950 N/A LYS 461.A NZ GLU 496.A OE1.A no hydrogen 3.247 N/A LYS 461.A NZ GLU 496.A OE2.A no hydrogen 2.794 N/A LYS 461.A NZ GLU 496.A OE2.B no hydrogen 3.383 N/A LYS 461.A NZ GLU 693.A OE1 no hydrogen 3.482 N/A LYS 461.A NZ GLU 693.A OE2 no hydrogen 2.812 N/A ALA 462.A N LEU 458.A O no hydrogen 3.129 N/A LEU 463.A N ALA 459.A O no hydrogen 2.917 N/A GLY 464.A N LEU 460.A O no hydrogen 2.809 N/A ASN 465.A N LYS 461.A O no hydrogen 2.977 N/A ASN 465.A ND2 LEU 416.A O no hydrogen 3.149 N/A ASN 465.A ND2 GLU 693.A O no hydrogen 2.784 N/A ALA 466.A N ALA 462.A O no hydrogen 2.847 N/A GLY 467.A N LEU 463.A O no hydrogen 2.915 N/A GLN 468.A NE2 ALA 466.A O no hydrogen 2.936 N/A ASN 470.A N ASN 470.A OD1 no hydrogen 2.578 N/A ASN 470.A ND2 CYS 432.A O no hydrogen 2.687 N/A ASN 470.A ND2 ASP 434.A OD1 no hydrogen 3.231 N/A SER 471.A N GLN 468.A O no hydrogen 2.890 N/A SER 471.A OG HIS 441.A NE2 no hydrogen 2.825 N/A ILE 472.A N PRO 469.A O no hydrogen 2.891 N/A ILE 475.A N SER 471.A O no hydrogen 2.872 N/A GLN 476.A N ILE 472.A O no hydrogen 2.911 N/A GLN 476.A NE2 GLN 482.A OE1 no hydrogen 3.075 N/A PHE 478.A N ILE 475.A O no hydrogen 2.919 N/A LEU 479.A N GLN 476.A O no hydrogen 3.127 N/A GLN 482.A NE2 PRO 480.A O no hydrogen 2.890 N/A TYR 489.A OH SER 448.A OG no hydrogen 2.907 N/A SER 490.A OG GLU 453.A OE2 no hydrogen 2.562 N/A ARG 492.A NH1.A GLU 453.A OE1 no hydrogen 2.852 N/A ARG 492.A NH1.A GLU 454.A OE1 no hydrogen 3.228 N/A ARG 492.A NH2.A GLU 454.A OE1 no hydrogen 3.241 N/A VAL 493.A N SER 490.A OG no hydrogen 3.256 N/A GLN 494.A N SER 490.A O no hydrogen 3.051 N/A ALA 495.A N THR 491.A O no hydrogen 2.680 N/A GLU 496.A N ARG 492.A O no hydrogen 3.059 N/A ALA 497.A N VAL 493.A O no hydrogen 2.917 N/A ILE 498.A N GLN 494.A O no hydrogen 2.953 N/A MET 499.A N ALA 495.A O no hydrogen 3.030 N/A ALA 500.A N GLU 496.A O no hydrogen 2.983 N/A LEU 501.A N ILE 498.A O no hydrogen 3.071 N/A ARG 502.A N MET 499.A O no hydrogen 3.127 N/A ARG 502.A NE GLU 539.A OE1 no hydrogen 2.757 N/A ARG 502.A NH1 GLU 658.A OE2 no hydrogen 2.734 N/A ARG 502.A NH2 GLU 539.A OE1 no hydrogen 3.537 N/A ARG 502.A NH2 GLU 539.A OE2 no hydrogen 2.739 N/A ARG 502.A NH2 GLU 658.A OE1 no hydrogen 2.626 N/A ASN 503.A ND2 GLY 464.A O no hydrogen 3.174 N/A ASN 503.A ND2 GLY 691.A O no hydrogen 2.892 N/A ALA 505.A N LEU 501.A O no hydrogen 3.054 N/A ALA 505.A N ARG 502.A O no hydrogen 3.177 N/A LYS 506.A N ASN 503.A O no hydrogen 3.102 N/A LYS 506.A NZ ASN 503.A OD1 no hydrogen 2.432 N/A ARG 507.A N ILE 504.A O no hydrogen 3.125 N/A ASP 508.A N ILE 504.A O no hydrogen 3.006 N/A ARG 510.A NH1 GLU 514.A OE2 no hydrogen 3.008 N/A LYS 511.A N ASP 508.A OD1 no hydrogen 3.236 N/A VAL 512.A N ASP 508.A O no hydrogen 3.169 N/A GLN 513.A N PRO 509.A O no hydrogen 2.694 N/A GLN 513.A NE2 SER 540.A O no hydrogen 3.412 N/A GLN 513.A NE2 SER 540.A OG no hydrogen 3.104 N/A GLU 514.A N ARG 510.A O no hydrogen 2.934 N/A ILE 515.A N VAL 512.A O no hydrogen 2.930 N/A VAL 516.A N VAL 512.A O no hydrogen 2.862 N/A LEU 517.A N GLN 513.A O no hydrogen 2.972 N/A PHE 520.A N VAL 516.A O no hydrogen 2.918 N/A LEU 521.A N LEU 517.A O no hydrogen 2.981 N/A ASN 522.A N ILE 519.A O no hydrogen 3.131 N/A ALA 524.A N ASN 522.A OD1 no hydrogen 2.960 N/A ILE 525.A N ASN 522.A O no hydrogen 3.094 N/A ARG 530.A N LYS 526.A O no hydrogen 3.074 N/A ARG 530.A NE PHE 520.A O no hydrogen 2.789 N/A ARG 530.A NH1 GLU 557.A OE2 no hydrogen 2.712 N/A ARG 530.A NH2 PHE 520.A O no hydrogen 2.898 N/A ARG 530.A NH2 GLU 557.A OE1 no hydrogen 2.599 N/A ILE 531.A N SER 527.A O no hydrogen 2.837 N/A ARG 532.A N GLU 528.A O no hydrogen 2.894 N/A ARG 532.A NE GLU 528.A OE2 no hydrogen 2.747 N/A ARG 532.A NH2 GLU 528.A OE2 no hydrogen 3.017 N/A SER 533.A N LEU 529.A O no hydrogen 2.978 N/A SER 533.A OG.A ARG 530.A O no hydrogen 2.637 N/A SER 533.A OG.B LEU 529.A O no hydrogen 2.947 N/A CYS 534.A N ARG 530.A O no hydrogen 2.821 N/A ILE 535.A N ILE 531.A O no hydrogen 2.961 N/A VAL 536.A N ARG 532.A O no hydrogen 3.003 N/A PHE 537.A N SER 533.A O no hydrogen 2.829 N/A PHE 538.A N CYS 534.A O no hydrogen 2.971 N/A GLU 539.A N ILE 535.A O no hydrogen 3.126 N/A SER 540.A N VAL 536.A O no hydrogen 3.144 N/A SER 540.A N PHE 537.A O no hydrogen 3.095 N/A SER 540.A OG PHE 537.A O no hydrogen 2.583 N/A LYS 541.A N PHE 538.A O no hydrogen 3.129 N/A LYS 541.A NZ GLU 580.A OE2 no hydrogen 3.012 N/A LEU 546.A N SER 543.A OG no hydrogen 3.330 N/A VAL 547.A N SER 543.A O no hydrogen 2.938 N/A SER 548.A N VAL 544.A O no hydrogen 2.805 N/A SER 548.A OG VAL 544.A O no hydrogen 2.722 N/A MET 549.A N ALA 545.A O no hydrogen 2.955 N/A VAL 550.A N LEU 546.A O no hydrogen 3.189 N/A ALA 551.A N VAL 547.A O no hydrogen 3.011 N/A VAL 552.A N SER 548.A O no hydrogen 2.842 N/A ARG 553.A N MET 549.A O no hydrogen 3.130 N/A LEU 554.A N VAL 550.A O no hydrogen 3.053 N/A LEU 554.A N ALA 551.A O no hydrogen 3.083 N/A ARG 555.A N VAL 552.A O no hydrogen 2.936 N/A ARG 555.A NH1.A MET 594.A O no hydrogen 3.061 N/A ARG 555.A NH2.B MET 594.A O no hydrogen 2.743 N/A GLU 557.A N LEU 554.A O no hydrogen 3.198 N/A ASN 559.A N GLU 557.A OE2 no hydrogen 2.821 N/A ASN 559.A ND2 SER 527.A OG no hydrogen 2.610 N/A GLN 561.A NE2 ARG 605.A O no hydrogen 2.995 N/A VAL 562.A N ASN 559.A OD1 no hydrogen 3.001 N/A ALA 563.A N ASN 559.A O no hydrogen 2.966 N/A SER 564.A N LEU 560.A O no hydrogen 2.810 N/A SER 564.A OG.A SER 607.A O no hydrogen 2.675 N/A SER 564.A OG.B LEU 560.A O no hydrogen 3.186 N/A SER 564.A OG.B GLN 561.A O no hydrogen 2.995 N/A SER 564.A OG.B SER 607.A O no hydrogen 2.806 N/A PHE 565.A N GLN 561.A O no hydrogen 3.198 N/A VAL 566.A N VAL 562.A O no hydrogen 2.987 N/A TYR 567.A N ALA 563.A O no hydrogen 3.000 N/A SER 568.A N SER 564.A O no hydrogen 3.066 N/A SER 568.A OG SER 564.A O no hydrogen 3.082 N/A SER 568.A OG PHE 565.A O no hydrogen 2.990 N/A SER 568.A OG ALA 609.A O no hydrogen 3.529 N/A GLN 569.A N PHE 565.A O no hydrogen 2.960 N/A GLN 569.A NE2.A CYS 534.A O no hydrogen 3.390 N/A MET 570.A N VAL 566.A O no hydrogen 3.086 N/A ARG 571.A N TYR 567.A O no hydrogen 2.938 N/A ARG 571.A NH1 TYR 567.A OH no hydrogen 2.868 N/A SER 572.A N SER 568.A O no hydrogen 2.846 N/A SER 572.A OG HIS 611.A O no hydrogen 3.149 N/A LEU 573.A N GLN 569.A O no hydrogen 2.840 N/A SER 574.A N MET 570.A O no hydrogen 2.913 N/A SER 574.A OG ARG 571.A O no hydrogen 2.692 N/A ARG 575.A N SER 572.A O no hydrogen 3.089 N/A SER 576.A N LEU 573.A O no hydrogen 2.904 N/A SER 576.A OG ASN 578.A O no hydrogen 3.503 N/A SER 576.A OG ASP 613.A OD1 no hydrogen 3.482 N/A SER 576.A OG ASP 613.A OD2 no hydrogen 2.445 N/A SER 577.A N ASP 613.A OD1 no hydrogen 3.047 N/A SER 577.A OG ASP 613.A OD1 no hydrogen 3.560 N/A ASN 578.A N SER 576.A OG no hydrogen 2.749 N/A ASN 578.A ND2 THR 614.A O no hydrogen 3.244 N/A ASN 578.A ND2 VAL 623.A O.B no hydrogen 3.474 N/A ASN 578.A ND2 GLN 648.A OE1 no hydrogen 2.921 N/A GLU 580.A N ASN 578.A OD1 no hydrogen 2.886 N/A PHE 581.A N ASN 578.A O no hydrogen 3.042 N/A ARG 582.A N PRO 579.A O no hydrogen 3.265 N/A ALA 585.A N PHE 581.A O no hydrogen 2.780 N/A ALA 586.A N ARG 582.A O no hydrogen 2.956 N/A ALA 587.A N ASP 583.A O no hydrogen 2.935 N/A CYS 588.A N VAL 584.A O no hydrogen 2.889 N/A CYS 588.A SG VAL 584.A O no hydrogen 3.436 N/A SER 589.A N ALA 585.A O no hydrogen 2.922 N/A SER 589.A OG.B ALA 585.A O no hydrogen 3.292 N/A VAL 590.A N ALA 586.A O no hydrogen 3.226 N/A ALA 591.A N ALA 587.A O no hydrogen 3.036 N/A ILE 592.A N CYS 588.A O no hydrogen 2.948 N/A LYS 593.A N VAL 590.A O no hydrogen 3.010 N/A LYS 593.A NZ SER 589.A O no hydrogen 2.858 N/A MET 594.A N ALA 591.A O no hydrogen 2.884 N/A LEU 595.A N ILE 592.A O no hydrogen 3.446 N/A ASP 600.A N SER 597.A O no hydrogen 2.983 N/A ARG 601.A N LYS 598.A O no hydrogen 3.124 N/A LEU 602.A N LEU 599.A O no hydrogen 3.159 N/A TYR 606.A N GLY 603.A O no hydrogen 2.776 N/A SER 607.A N GLN 561.A OE1 no hydrogen 2.999 N/A SER 607.A OG GLN 561.A OE1 no hydrogen 2.608 N/A LYS 608.A N ARG 629.A O no hydrogen 3.048 N/A LYS 608.A NZ SER 564.A OG.A no hydrogen 3.207 N/A LYS 608.A NZ LEU 602.A O no hydrogen 2.728 N/A LYS 608.A NZ GLY 603.A O no hydrogen 3.539 N/A ALA 609.A N SER 568.A OG no hydrogen 3.054 N/A VAL 610.A N TYR 627.A O no hydrogen 2.840 N/A HIS 611.A N SER 572.A OG no hydrogen 2.818 N/A HIS 611.A ND1 ASP 626.A OD2 no hydrogen 2.868 N/A HIS 611.A NE2 ASP 613.A OD2 no hydrogen 2.704 N/A VAL 612.A N ALA 625.A O no hydrogen 2.918 N/A THR 614.A N VAL 623.A O.A no hydrogen 3.137 N/A THR 614.A N VAL 623.A O.B no hydrogen 3.086 N/A ASN 616.A N ALA 621.A O no hydrogen 2.879 N/A ARG 618.A N ASN 616.A OD1 no hydrogen 2.822 N/A ARG 618.A NE GLU 228.A OE2 no hydrogen 2.585 N/A ARG 618.A NH2 GLU 228.A OE1 no hydrogen 2.606 N/A ARG 618.A NH2 GLU 228.A OE2 no hydrogen 3.257 N/A THR 619.A N ASN 616.A OD1 no hydrogen 3.235 N/A THR 619.A OG1 ASN 616.A O no hydrogen 3.384 N/A ALA 621.A N ASN 616.A O no hydrogen 3.381 N/A ALA 621.A N THR 619.A OG1 no hydrogen 3.272 N/A GLY 622.A N GLN 648.A O no hydrogen 2.957 N/A VAL 623.A N.A THR 614.A O no hydrogen 3.102 N/A VAL 623.A N.B THR 614.A O no hydrogen 3.044 N/A SER 624.A N ARG 646.A O no hydrogen 2.863 N/A ALA 625.A N VAL 612.A O no hydrogen 2.679 N/A ASP 626.A N LYS 644.A O no hydrogen 3.071 N/A TYR 627.A N VAL 610.A O no hydrogen 2.916 N/A PHE 628.A N ALA 642.A O no hydrogen 2.836 N/A ARG 629.A N LYS 608.A O no hydrogen 2.919 N/A ARG 629.A NE ASN 631.A OD1 no hydrogen 2.635 N/A ARG 629.A NH2 TYR 606.A O no hydrogen 2.493 N/A ILE 630.A N ALA 640.A O no hydrogen 2.832 N/A ASN 631.A N SER 607.A OG no hydrogen 2.708 N/A SER 632.A OG GLN 667.A OE1 no hydrogen 3.391 N/A GLY 635.A N SER 632.A O no hydrogen 3.343 N/A LEU 637.A N TYR 671.A OH no hydrogen 3.017 N/A ARG 639.A N ILE 630.A O no hydrogen 2.899 N/A ARG 639.A NE GLN 667.A OE1 no hydrogen 2.836 N/A ARG 639.A NH1 GLU 528.A OE1 no hydrogen 2.951 N/A ARG 639.A NH2 GLN 667.A OE1 no hydrogen 3.382 N/A ALA 640.A N ILE 630.A O no hydrogen 3.356 N/A VAL 641.A N LEU 661.A O no hydrogen 2.939 N/A ALA 642.A N PHE 628.A O no hydrogen 2.928 N/A ALA 643.A N PHE 659.A O no hydrogen 2.881 N/A LYS 644.A N ASP 626.A O no hydrogen 3.011 N/A LYS 644.A NZ.A GLU 539.A OE2 no hydrogen 3.445 N/A LYS 644.A NZ.A ASP 655.A OD1 no hydrogen 2.771 N/A LYS 644.A NZ.A ASP 655.A OD2 no hydrogen 3.482 N/A LYS 644.A NZ.B GLU 539.A OE2 no hydrogen 2.962 N/A ILE 645.A N VAL 657.A O no hydrogen 2.837 N/A ARG 646.A N SER 624.A O no hydrogen 2.903 N/A ARG 646.A NE GLU 580.A OE1 no hydrogen 2.692 N/A ARG 646.A NE GLU 580.A OE2 no hydrogen 2.912 N/A ARG 646.A NH1 GLU 179.A OE2 no hydrogen 2.808 N/A ARG 646.A NH1 ASP 655.A OD1 no hydrogen 3.028 N/A ARG 646.A NH2 GLU 179.A OE2 no hydrogen 3.019 N/A ARG 646.A NH2 GLU 580.A OE2 no hydrogen 2.603 N/A GLY 647.A N SER 654.A O no hydrogen 2.859 N/A GLN 648.A N GLY 622.A O no hydrogen 2.912 N/A GLN 648.A NE2 GLU 580.A OE1 no hydrogen 2.783 N/A GLN 648.A NE2 SER 624.A OG no hydrogen 3.189 N/A GLY 649.A N TYR 652.A O no hydrogen 2.850 N/A TYR 652.A N GLY 649.A O no hydrogen 2.862 N/A ALA 653.A N GLU 179.A O no hydrogen 2.655 N/A SER 654.A N GLY 647.A O no hydrogen 2.861 N/A SER 654.A OG TYR 177.A O no hydrogen 3.406 N/A SER 654.A OG ASP 655.A O no hydrogen 2.673 N/A ILE 656.A N ILE 645.A O no hydrogen 2.804 N/A VAL 657.A N ILE 645.A O no hydrogen 3.406 N/A GLU 658.A N LYS 688.A O no hydrogen 2.831 N/A PHE 659.A N ALA 643.A O no hydrogen 2.918 N/A GLY 660.A N TYR 686.A O no hydrogen 3.225 N/A LEU 661.A N VAL 641.A O no hydrogen 2.865 N/A ARG 662.A N SER 684.A O no hydrogen 2.775 N/A ARG 662.A NE GLU 528.A OE2 no hydrogen 2.881 N/A ARG 662.A NH1 GLU 664.A OE1 no hydrogen 3.172 N/A ARG 662.A NH2 GLU 528.A OE1 no hydrogen 2.853 N/A ARG 662.A NH2 GLU 664.A OE1 no hydrogen 3.122 N/A ALA 663.A N ARG 639.A O no hydrogen 2.812 N/A GLY 665.A N PRO 681.A O no hydrogen 3.280 N/A LEU 666.A N LEU 682.A O no hydrogen 2.806 N/A GLN 667.A N ALA 663.A O no hydrogen 3.079 N/A GLN 667.A NE2 SER 632.A OG no hydrogen 3.287 N/A GLN 667.A NE2 LEU 637.A O no hydrogen 2.631 N/A GLU 668.A N GLU 664.A O no hydrogen 2.974 N/A LEU 669.A N GLY 665.A O no hydrogen 2.869 N/A LEU 669.A N LEU 666.A O no hydrogen 3.177 N/A LEU 670.A N GLN 667.A O no hydrogen 2.872 N/A TYR 671.A N GLN 667.A O no hydrogen 3.069 N/A LYS 674.A NZ.A SER 675.A O no hydrogen 2.779 N/A VAL 676.A N GLU 488.A O no hydrogen 3.355 N/A ARG 680.A NH1 GLU 679.A O no hydrogen 3.350 N/A ALA 683.A N LEU 699.A O no hydrogen 3.231 N/A SER 684.A N ARG 662.A O no hydrogen 2.856 N/A GLY 685.A N ALA 697.A O no hydrogen 2.909 N/A TYR 686.A N GLY 660.A O no hydrogen 3.098 N/A TYR 686.A OH GLU 658.A OE2 no hydrogen 2.557 N/A VAL 687.A N VAL 695.A O no hydrogen 3.034 N/A LYS 688.A N GLU 658.A O no hydrogen 2.789 N/A LYS 688.A NZ GLY 691.A O no hydrogen 3.095 N/A VAL 689.A N GLN 692.A O no hydrogen 2.824 N/A HIS 690.A N ILE 656.A O no hydrogen 3.000 N/A HIS 690.A ND1.A ASP 655.A O no hydrogen 3.137 N/A GLN 692.A N VAL 689.A O no hydrogen 3.098 N/A GLN 692.A NE2 ASN 465.A O no hydrogen 3.117 N/A GLU 693.A N ASN 465.A OD1 no hydrogen 2.721 N/A VAL 694.A N VAL 687.A O no hydrogen 3.098 N/A ALA 697.A N GLY 685.A O no hydrogen 2.846 N/A LEU 699.A N ALA 683.A O no hydrogen 2.871 N/A LYS 701.A NZ ASP 700.A OD2 no hydrogen 2.875 N/A LYS 702.A NZ.A LYS 702.A O no hydrogen 3.285 N/A ILE 707.A N GLN 704.A O no hydrogen 2.799 N/A VAL 711.A N ILE 707.A O no hydrogen 3.312 N/A SER 712.A N GLY 708.A O no hydrogen 2.836 N/A LYS 713.A N ALA 709.A O no hydrogen 2.744 N/A LEU 714.A N VAL 710.A O no hydrogen 2.515 N/A GLU 715.A N VAL 711.A O no hydrogen 2.681 N/A GLN 716.A N SER 712.A O no hydrogen 2.860 N/A GLN 716.A N LYS 713.A O no hydrogen 3.045 N/A GLY 717.A N LEU 714.A O no hydrogen 3.200 N/A MET 718.A N LEU 759.A O no hydrogen 2.852 N/A VAL 720.A N ALA 757.A O no hydrogen 2.639 N/A LEU 722.A N ASN 755.A O no hydrogen 2.659 N/A LYS 724.A N THR 753.A O no hydrogen 2.746 N/A LYS 724.A NZ ASP 346.A OD1 no hydrogen 3.055 N/A GLY 725.A N ASP 346.A OD2 no hydrogen 2.905 N/A TYR 726.A N GLY 751.A O no hydrogen 2.916 N/A VAL 728.A N VAL 749.A O no hydrogen 2.774 N/A SER 729.A N VAL 749.A O no hydrogen 3.316 N/A VAL 731.A N LEU 747.A O no hydrogen 2.875 N/A ARG 732.A N MET 173.A O no hydrogen 2.951 N/A ARG 732.A NE ASP 744.A OD1 no hydrogen 2.730 N/A ARG 732.A NH1 ALA 270.A O no hydrogen 3.531 N/A ARG 732.A NH1 ILE 271.A O no hydrogen 2.833 N/A ARG 732.A NH1 MET 274.A O no hydrogen 2.749 N/A ARG 732.A NH2 MET 274.A O no hydrogen 2.856 N/A ARG 732.A NH2 ASP 744.A OD2 no hydrogen 2.890 N/A TYR 733.A N LEU 745.A O no hydrogen 2.868 N/A TYR 733.A OH GLN 735.A OE1 no hydrogen 2.629 N/A MET 734.A N LYS 171.A O no hydrogen 2.748 N/A GLN 735.A N MET 743.A O no hydrogen 3.023 N/A GLN 735.A NE2 GLN 219.A OE1 no hydrogen 2.957 N/A GLN 735.A NE2 PRO 736.A O no hydrogen 3.211 N/A VAL 737.A N ILE 741.A O no hydrogen 3.001 N/A CYS 738.A N GLU 217.A OE1 no hydrogen 3.018 N/A CYS 738.A SG GLN 237.A OE1 no hydrogen 3.588 N/A GLY 740.A N VAL 737.A O no hydrogen 2.947 N/A MET 743.A N GLN 735.A O no hydrogen 2.639 N/A ASP 744.A N GLY 799.A O no hydrogen 2.716 N/A LEU 745.A N TYR 733.A O no hydrogen 2.907 N/A ASN 746.A N ILE 797.A O no hydrogen 2.840 N/A ASN 746.A ND2 VAL 731.A O no hydrogen 3.016 N/A LEU 747.A N VAL 731.A O no hydrogen 2.892 N/A LEU 748.A N VAL 795.A O no hydrogen 2.881 N/A VAL 749.A N SER 729.A O no hydrogen 2.650 N/A SER 750.A N HIS 793.A O no hydrogen 2.892 N/A SER 750.A OG PRO 309.A O no hydrogen 3.037 N/A GLY 751.A N TYR 726.A O no hydrogen 2.895 N/A VAL 752.A N SER 791.A O no hydrogen 2.876 N/A THR 753.A N LYS 724.A O no hydrogen 2.659 N/A THR 753.A OG1 ASN 755.A OD1 no hydrogen 3.361 N/A THR 753.A OG1 SER 789.A O no hydrogen 3.509 N/A THR 754.A N SER 789.A O no hydrogen 3.005 N/A ASN 755.A N LEU 722.A O no hydrogen 2.596 N/A ARG 756.A N THR 787.A O no hydrogen 3.034 N/A ARG 756.A NE ASP 719.A OD1 no hydrogen 2.887 N/A ARG 756.A NH1 GLN 301.A O no hydrogen 2.799 N/A ARG 756.A NH1 GLN 301.A OE1 no hydrogen 2.904 N/A ARG 756.A NH2 ASP 719.A OD1 no hydrogen 3.042 N/A ARG 756.A NH2 ASP 719.A OD2 no hydrogen 3.017 N/A ALA 757.A N VAL 720.A O no hydrogen 2.822 N/A ASN 758.A N ALA 785.A O no hydrogen 2.670 N/A LEU 759.A N MET 718.A O no hydrogen 2.748 N/A SER 760.A N ARG 783.A O no hydrogen 2.851 N/A ALA 761.A N LEU 714.A O no hydrogen 2.873 N/A SER 762.A N GLU 781.A O no hydrogen 2.489 N/A LYS 771.A N ASP 774.A OD2 no hydrogen 2.819 N/A LEU 772.A N GLN 704.A OE1 no hydrogen 2.941 N/A LEU 775.A N LYS 771.A O no hydrogen 3.203 N/A LEU 776.A N LEU 772.A O no hydrogen 2.789 N/A ALA 777.A N ASP 774.A O no hydrogen 2.900 N/A THR 778.A N LEU 775.A O no hydrogen 2.937 N/A THR 778.A OG1 ASP 774.A O no hydrogen 2.754 N/A THR 778.A OG1 LEU 775.A O no hydrogen 3.045 N/A ILE 780.A N MET 827.A O no hydrogen 2.920 N/A GLU 781.A N SER 762.A O no hydrogen 2.791 N/A LEU 782.A N ILE 825.A O no hydrogen 2.620 N/A ARG 783.A N SER 760.A O no hydrogen 2.671 N/A ARG 783.A NH2.A SER 760.A O no hydrogen 3.051 N/A ARG 783.A NH2.A GLU 781.A O no hydrogen 2.447 N/A VAL 784.A N GLY 823.A O no hydrogen 2.892 N/A ALA 785.A N ASN 758.A O no hydrogen 2.935 N/A ALA 786.A N VAL 821.A O no hydrogen 2.787 N/A THR 787.A N ARG 756.A O no hydrogen 2.866 N/A THR 788.A N LEU 819.A O no hydrogen 3.174 N/A SER 789.A N THR 754.A O no hydrogen 3.092 N/A MET 790.A N ALA 817.A O no hydrogen 2.800 N/A SER 791.A N VAL 752.A O no hydrogen 2.958 N/A SER 791.A OG GLU 306.A O no hydrogen 3.436 N/A GLN 792.A N THR 815.A O no hydrogen 2.723 N/A GLN 792.A NE2 TYR 726.A OH no hydrogen 2.757 N/A HIS 793.A N SER 750.A O no hydrogen 2.911 N/A HIS 793.A NE2 GLU 306.A O no hydrogen 3.116 N/A ALA 794.A N TYR 813.A O no hydrogen 2.772 N/A VAL 795.A N LEU 748.A O no hydrogen 2.919 N/A ALA 796.A N THR 811.A O no hydrogen 2.787 N/A ILE 797.A N ASN 746.A O no hydrogen 2.764 N/A MET 798.A N MET 809.A O no hydrogen 3.033 N/A GLY 799.A N ASP 744.A O no hydrogen 3.036 N/A LEU 800.A N ALA 807.A O no hydrogen 2.727 N/A THR 801.A N PRO 742.A O no hydrogen 3.122 N/A THR 801.A OG1.A ASP 744.A OD2 no hydrogen 2.887 N/A THR 802.A N ALA 805.A O no hydrogen 3.075 N/A THR 802.A OG1 ALA 805.A O no hydrogen 2.751 N/A ALA 805.A N THR 802.A OG1 no hydrogen 3.013 N/A LYS 806.A N ARG 859.A O no hydrogen 2.724 N/A LYS 806.A NZ SER 275.A O no hydrogen 3.027 N/A LYS 806.A NZ THR 802.A O no hydrogen 2.679 N/A LYS 806.A NZ ASP 803.A O no hydrogen 3.433 N/A ALA 807.A N LEU 800.A O no hydrogen 2.894 N/A GLY 808.A N PHE 857.A O no hydrogen 3.121 N/A MET 809.A N MET 798.A O no hydrogen 2.854 N/A GLN 810.A N ILE 855.A O no hydrogen 2.824 N/A THR 811.A N ALA 796.A O no hydrogen 2.986 N/A THR 811.A OG1 SER 854.A OG no hydrogen 2.852 N/A HIS 812.A N GLU 853.A O no hydrogen 2.839 N/A TYR 813.A N ALA 794.A O no hydrogen 2.687 N/A LYS 814.A N THR 851.A O no hydrogen 2.809 N/A THR 815.A N GLN 792.A O no hydrogen 2.774 N/A THR 815.A OG1 SER 850.A OG no hydrogen 3.217 N/A SER 816.A N LEU 849.A O no hydrogen 2.773 N/A ALA 817.A N MET 790.A O no hydrogen 2.830 N/A GLY 818.A N VAL 847.A O no hydrogen 2.980 N/A LEU 819.A N THR 788.A O no hydrogen 2.968 N/A VAL 821.A N ALA 786.A O no hydrogen 2.952 N/A GLY 823.A N VAL 784.A O no hydrogen 2.909 N/A LYS 824.A N SER 837.A O no hydrogen 2.923 N/A LYS 824.A NZ GLU 826.A OE1 no hydrogen 2.855 N/A LYS 824.A NZ SER 837.A OG no hydrogen 3.010 N/A ILE 825.A N LEU 782.A O no hydrogen 2.887 N/A GLU 826.A N LYS 835.A O no hydrogen 2.721 N/A MET 827.A N ILE 780.A O no hydrogen 3.179 N/A ASN 828.A N ASN 833.A O no hydrogen 3.103 N/A ASN 828.A ND2 ASN 779.A OD1 no hydrogen 2.865 N/A ARG 830.A NH2 ALA 777.A O no hydrogen 2.913 N/A SER 832.A N ALA 829.A O no hydrogen 3.278 N/A ASN 833.A N ASN 828.A O no hydrogen 3.405 N/A ASN 833.A ND2 GLU 948.A OE2 no hydrogen 3.165 N/A ASN 833.A ND2 GLU 950.A OE1 no hydrogen 2.584 N/A PHE 834.A N LEU 949.A O no hydrogen 2.809 N/A LYS 835.A N GLU 826.A O no hydrogen 2.752 N/A LYS 835.A NZ GLU 948.A OE1 no hydrogen 3.318 N/A ALA 836.A N VAL 947.A O no hydrogen 2.882 N/A SER 837.A N LYS 824.A O no hydrogen 2.806 N/A LEU 838.A N THR 945.A O no hydrogen 2.933 N/A LYS 839.A N ASN 822.A O no hydrogen 3.135 N/A THR 845.A N VAL 935.A O no hydrogen 2.821 N/A THR 845.A OG1 GLN 843.A O no hydrogen 2.579 N/A VAL 847.A N VAL 933.A O no hydrogen 2.875 N/A VAL 848.A N VAL 933.A O no hydrogen 3.240 N/A LEU 849.A N SER 816.A O no hydrogen 2.670 N/A SER 850.A N SER 931.A O no hydrogen 2.877 N/A SER 850.A OG THR 815.A OG1 no hydrogen 3.217 N/A THR 851.A N LYS 814.A O no hydrogen 2.807 N/A MET 852.A N TYR 929.A O no hydrogen 2.933 N/A GLU 853.A N HIS 812.A O no hydrogen 2.968 N/A SER 854.A N GLY 927.A O no hydrogen 2.788 N/A SER 854.A OG THR 811.A OG1 no hydrogen 2.852 N/A SER 854.A OG GLY 927.A O no hydrogen 3.443 N/A ILE 855.A N GLN 810.A O no hydrogen 2.739 N/A VAL 856.A N LEU 867.A O no hydrogen 2.868 N/A PHE 857.A N GLY 808.A O no hydrogen 2.910 N/A VAL 858.A N ARG 865.A O no hydrogen 2.861 N/A ARG 859.A N LYS 806.A O no hydrogen 2.790 N/A ARG 859.A NH1 SER 276.A O no hydrogen 3.270 N/A ARG 859.A NH1 GLN 810.A OE1 no hydrogen 2.921 N/A ARG 859.A NH2 GLN 810.A OE1 no hydrogen 2.655 N/A ASP 860.A N GLY 863.A O no hydrogen 3.079 N/A GLY 863.A N ASP 860.A O no hydrogen 3.045 N/A ARG 865.A N VAL 858.A O no hydrogen 2.861 N/A ARG 865.A NH1 VAL 858.A O no hydrogen 3.372 N/A ARG 865.A NH1 ASP 860.A OD1 no hydrogen 2.787 N/A ARG 865.A NH2 ASP 860.A OD2 no hydrogen 3.006 N/A LEU 867.A N VAL 856.A O no hydrogen 2.959 N/A VAL 869.A N SER 854.A O no hydrogen 2.929 N/A THR 875.A OG1 MET 874.A O no hydrogen 2.347 N/A ASP 881.A N LYS 877.A O no hydrogen 3.317 N/A ILE 882.A N GLN 878.A O no hydrogen 2.956 N/A MET 883.A N ILE 879.A O no hydrogen 2.693 N/A THR 884.A N ILE 882.A O no hydrogen 2.772 N/A THR 884.A OG1 ARG 886.A O no hydrogen 3.042 N/A ARG 886.A N THR 884.A OG1 no hydrogen 2.934 N/A ARG 886.A NH1.A PRO 872.A O no hydrogen 2.646 N/A ARG 886.A NH2.A PRO 872.A O no hydrogen 2.367 N/A ARG 890.A N LEU 911.A O no hydrogen 2.695 N/A LYS 892.A N ALA 909.A O no hydrogen 2.999 N/A SER 894.A N PHE 907.A O no hydrogen 2.988 N/A CYS 895.A SG SER 894.A O no hydrogen 3.338 N/A SER 896.A OG CYS 895.A O no hydrogen 2.461 N/A SER 898.A N SER 903.A O no hydrogen 2.838 N/A LEU 901.A N SER 898.A OG no hydrogen 3.101 N/A SER 902.A N ALA 899.A O no hydrogen 3.137 N/A SER 903.A N SER 898.A O no hydrogen 3.346 N/A LYS 904.A N GLN 936.A O no hydrogen 2.694 N/A VAL 905.A N SER 896.A O no hydrogen 3.148 N/A CYS 906.A N TYR 934.A O no hydrogen 2.829 N/A PHE 907.A N SER 894.A O no hydrogen 3.153 N/A SER 908.A N.A LYS 932.A O no hydrogen 2.780 N/A SER 908.A N.B LYS 932.A O no hydrogen 2.854 N/A ALA 909.A N LYS 892.A O no hydrogen 3.221 N/A ARG 910.A N VAL 930.A O no hydrogen 2.703 N/A ARG 910.A NH1.B SER 908.A O.B no hydrogen 3.036 N/A LEU 911.A N ARG 890.A O no hydrogen 3.057 N/A ARG 912.A N ASP 928.A O no hydrogen 2.905 N/A ARG 912.A NH2 PRO 871.A O no hydrogen 3.461 N/A ASN 913.A ND2 LYS 924.A O no hydrogen 2.714 N/A ALA 914.A N TYR 923.A O no hydrogen 2.887 N/A ALA 915.A N ASN 913.A OD1 no hydrogen 3.109 N/A ILE 917.A N ALA 914.A O no hydrogen 2.798 N/A ARG 918.A NE.A GLU 21.A OE2 no hydrogen 3.100 N/A ARG 918.A NH1.B LYS 227.A O no hydrogen 3.351 N/A ARG 918.A NH2.A GLU 21.A OE2 no hydrogen 2.932 N/A ARG 918.A NH2.B LYS 227.A O no hydrogen 3.017 N/A ALA 920.A N ARG 918.A O no hydrogen 2.930 N/A LEU 921.A N GLU 228.A OE1 no hydrogen 2.858 N/A LEU 922.A N GLU 228.A O no hydrogen 2.935 N/A TYR 923.A OH GLU 21.A OE2 no hydrogen 2.655 N/A LYS 924.A N ALA 920.A O no hydrogen 3.386 N/A ILE 925.A N LEU 922.A O no hydrogen 3.255 N/A THR 926.A N TYR 923.A O no hydrogen 3.306 N/A THR 926.A OG1 LEU 922.A O no hydrogen 2.792 N/A GLY 927.A N SER 854.A OG no hydrogen 3.060 N/A ASP 928.A N ARG 912.A O no hydrogen 2.847 N/A TYR 929.A N MET 852.A O no hydrogen 2.987 N/A VAL 930.A N ARG 910.A O no hydrogen 2.953 N/A SER 931.A N SER 850.A O no hydrogen 2.761 N/A SER 931.A OG SER 850.A O no hydrogen 3.548 N/A LYS 932.A N SER 908.A O.A no hydrogen 2.737 N/A LYS 932.A N SER 908.A O.B no hydrogen 2.952 N/A VAL 933.A N VAL 848.A O no hydrogen 2.981 N/A TYR 934.A N CYS 906.A O no hydrogen 2.845 N/A VAL 935.A N THR 845.A O no hydrogen 2.987 N/A GLN 936.A N LYS 904.A O no hydrogen 2.726 N/A THR 938.A OG1 PRO 937.A O no hydrogen 2.690 N/A SER 939.A OG THR 938.A O no hydrogen 2.624 N/A GLN 943.A NE2 GLN 943.A O no hydrogen 3.102 N/A THR 945.A N LEU 838.A O no hydrogen 2.888 N/A VAL 947.A N ALA 836.A O no hydrogen 3.074 N/A LEU 949.A N PHE 834.A O no hydrogen 2.865 N/A LEU 951.A N SER 832.A O no hydrogen 2.918 N/A GLY 954.A N GLN 952.A OE1 no hydrogen 2.649 N/A