Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3ai7_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): THR 1.A N ASP 428.A OD1 no hydrogen 3.059 N/A THR 1.A N ASP 428.A OD2 no hydrogen 2.778 N/A THR 7.A N GLY 85.A O no hydrogen 2.961 N/A THR 7.A OG1 THR 7.A O no hydrogen 2.671 N/A THR 7.A OG1 HIS 84.A O no hydrogen 2.969 N/A TRP 9.A N GLN 86.A OE1 no hydrogen 2.843 N/A TRP 9.A NE1 PRO 171.A O no hydrogen 2.929 N/A LYS 10.A NZ PRO 8.A O no hydrogen 3.043 N/A LYS 11.A NZ ASP 275.A OD1 no hydrogen 2.564 N/A ALA 20.A N SER 17.A OG no hydrogen 2.889 N/A LEU 21.A N SER 17.A O no hydrogen 3.137 N/A GLU 22.A N GLU 18.A O no hydrogen 3.037 N/A GLY 23.A N GLU 19.A O no hydrogen 3.142 N/A VAL 24.A N ALA 20.A O no hydrogen 2.871 N/A ASP 25.A N LEU 21.A O no hydrogen 3.047 N/A LYS 26.A N GLU 22.A O no hydrogen 3.014 N/A LYS 26.A NZ ASP 358.A OD1 no hydrogen 3.086 N/A TYR 27.A N GLY 23.A O no hydrogen 2.889 N/A TRP 28.A N VAL 24.A O no hydrogen 2.821 N/A TRP 28.A NE1 PRO 68.A O no hydrogen 2.921 N/A ARG 29.A N ASP 25.A O no hydrogen 2.816 N/A ARG 29.A NE TYR 343.A O no hydrogen 3.120 N/A ARG 29.A NH2 TYR 343.A O no hydrogen 2.932 N/A ARG 29.A NH2 LYS 344.A O no hydrogen 3.353 N/A ARG 29.A NH2 GLU 347.A OE1 no hydrogen 2.908 N/A VAL 30.A N LYS 26.A O no hydrogen 2.838 N/A ALA 31.A N TYR 27.A O no hydrogen 2.787 N/A ASN 32.A N TRP 28.A O no hydrogen 3.005 N/A TYR 33.A N ARG 29.A O no hydrogen 2.903 N/A TYR 33.A OH PRO 45.A O no hydrogen 2.713 N/A LEU 34.A N VAL 30.A O no hydrogen 2.751 N/A SER 35.A N ALA 31.A O no hydrogen 2.893 N/A SER 35.A OG ALA 31.A O no hydrogen 2.829 N/A SER 35.A OG SER 103.A OG no hydrogen 3.388 N/A ILE 36.A N ASN 32.A O no hydrogen 2.929 N/A GLY 37.A N TYR 33.A O no hydrogen 2.917 N/A GLN 38.A N LEU 34.A O no hydrogen 3.124 N/A GLN 38.A NE2 LEU 34.A O no hydrogen 2.900 N/A GLN 38.A NE2 PRO 99.A O no hydrogen 3.592 N/A ILE 39.A N SER 35.A O no hydrogen 3.212 N/A TYR 40.A N ILE 36.A O no hydrogen 2.818 N/A TYR 40.A OH LEU 323.A O no hydrogen 2.684 N/A LEU 41.A N GLY 37.A O no hydrogen 2.779 N/A ARG 42.A N ASP 55.A O no hydrogen 2.855 N/A SER 43.A N ASP 55.A O no hydrogen 3.381 N/A SER 43.A OG ASP 55.A OD1 no hydrogen 2.956 N/A ASN 44.A ND2 LYS 48.A O no hydrogen 2.784 N/A ASN 44.A ND2 ASP 55.A OD2 no hydrogen 3.303 N/A MET 47.A N ASN 44.A O no hydrogen 2.996 N/A LYS 48.A N ASN 44.A OD1 no hydrogen 2.926 N/A THR 52.A N ASP 55.A OD2 no hydrogen 3.072 N/A ARG 53.A NH2 ARG 327.A O no hydrogen 3.307 N/A GLU 54.A N THR 52.A OG1 no hydrogen 3.163 N/A ASP 55.A N THR 52.A O no hydrogen 2.723 N/A VAL 56.A N ARG 53.A O no hydrogen 2.935 N/A LYS 57.A N TYR 40.A O no hydrogen 2.770 N/A LYS 57.A NZ GLN 38.A O no hydrogen 2.955 N/A LYS 57.A NZ PHE 129.A O no hydrogen 2.915 N/A LYS 57.A NZ ARG 130.A O no hydrogen 3.014 N/A TRP 64.A N GLN 320.A O no hydrogen 2.939 N/A TRP 64.A NE1 GLY 300.A O no hydrogen 2.950 N/A GLY 65.A N HIS 319.A O no hydrogen 3.191 N/A THR 67.A N TRP 64.A O no hydrogen 2.862 N/A THR 67.A OG1 HIS 63.A O no hydrogen 2.572 N/A LEU 70.A N THR 66.A O no hydrogen 3.125 N/A ASN 71.A N THR 67.A O no hydrogen 2.790 N/A ASN 71.A ND2 ASN 32.A OD1 no hydrogen 2.810 N/A ASN 71.A ND2 SER 35.A OG no hydrogen 3.310 N/A PHE 72.A N PRO 68.A O no hydrogen 3.137 N/A LEU 73.A N GLY 69.A O no hydrogen 3.136 N/A ILE 74.A N LEU 70.A O no hydrogen 2.718 N/A GLY 75.A N ASN 71.A O no hydrogen 2.912 N/A HIS 76.A N PHE 72.A O no hydrogen 3.311 N/A HIS 76.A NE2 HIS 259.A ND1 no hydrogen 2.867 N/A ILE 77.A N LEU 73.A O no hydrogen 2.902 N/A ASN 78.A N ILE 74.A O no hydrogen 2.789 N/A ASN 78.A ND2 GLN 104.A OE1 no hydrogen 3.031 N/A ARG 79.A N GLY 75.A O no hydrogen 2.906 N/A ARG 79.A NH1 ASP 83.A OD2 no hydrogen 2.912 N/A ARG 79.A NH1 GLU 267.A OE2 no hydrogen 2.741 N/A ARG 79.A NH2 GLU 267.A OE2 no hydrogen 2.808 N/A PHE 80.A N HIS 76.A O no hydrogen 2.979 N/A ILE 81.A N ILE 77.A O no hydrogen 2.805 N/A ALA 82.A N ASN 78.A O no hydrogen 3.084 N/A ASP 83.A N ARG 79.A O no hydrogen 2.902 N/A HIS 84.A N PHE 80.A O no hydrogen 3.084 N/A HIS 84.A ND1 LYS 10.A O no hydrogen 2.581 N/A HIS 84.A NE2 GLU 267.A OE1 no hydrogen 2.971 N/A HIS 84.A NE2 GLU 267.A OE2 no hydrogen 2.768 N/A GLN 86.A NE2 ASN 87.A O no hydrogen 2.890 N/A GLN 86.A NE2 SER 172.A O no hydrogen 2.995 N/A ASN 87.A ND2 SER 172.A OG no hydrogen 2.898 N/A THR 88.A OG1 GLN 86.A O no hydrogen 2.951 N/A VAL 89.A N PHE 174.A O no hydrogen 3.102 N/A ILE 91.A N PRO 176.A O no hydrogen 3.147 N/A GLY 93.A N ILE 178.A O no hydrogen 2.686 N/A GLY 95.A N GLY 93.A O no hydrogen 2.890 N/A GLY 97.A N PRO 94.A O no hydrogen 2.794 N/A ALA 100.A N GLY 97.A O no hydrogen 2.960 N/A GLY 101.A N GLY 98.A O no hydrogen 2.964 N/A THR 102.A N GLY 98.A O no hydrogen 3.070 N/A THR 102.A OG1 GLN 38.A OE1 no hydrogen 2.594 N/A THR 102.A OG1 PRO 99.A O no hydrogen 3.148 N/A SER 103.A N PRO 99.A O no hydrogen 2.794 N/A SER 103.A OG SER 35.A OG no hydrogen 3.388 N/A SER 103.A OG PRO 99.A O no hydrogen 2.833 N/A GLN 104.A N ALA 100.A O no hydrogen 3.018 N/A GLN 104.A NE2 ASP 108.A OD2 no hydrogen 2.986 N/A SER 105.A N GLY 101.A O no hydrogen 3.201 N/A SER 105.A OG THR 110.A OG1 no hydrogen 2.700 N/A TYR 106.A N THR 102.A O no hydrogen 2.940 N/A TYR 106.A OH THR 119.A O no hydrogen 2.729 N/A LEU 107.A N SER 103.A O no hydrogen 2.927 N/A ASP 108.A N GLN 104.A O no hydrogen 2.823 N/A THR 110.A N ASP 108.A OD1 no hydrogen 2.837 N/A THR 110.A OG1 SER 105.A O no hydrogen 3.513 N/A THR 110.A OG1 SER 105.A OG no hydrogen 2.700 N/A THR 110.A OG1 ASP 108.A OD1 no hydrogen 2.585 N/A TYR 111.A N SER 105.A O no hydrogen 2.980 N/A THR 112.A OG1 ILE 118.A O no hydrogen 2.578 N/A GLU 113.A N GLY 109.A O no hydrogen 3.216 N/A THR 114.A N THR 110.A O no hydrogen 3.012 N/A THR 114.A N TYR 111.A O no hydrogen 3.061 N/A THR 114.A OG1 THR 110.A O no hydrogen 2.945 N/A PHE 115.A N TYR 111.A O no hydrogen 2.617 N/A ILE 118.A N PHE 115.A O no hydrogen 2.793 N/A THR 119.A OG1 ASP 121.A OD1 no hydrogen 2.573 N/A THR 119.A OG1 ASP 121.A OD2 no hydrogen 3.408 N/A GLU 122.A N ASN 352.A O no hydrogen 2.918 N/A GLY 124.A N ASP 121.A OD1 no hydrogen 2.868 N/A LEU 125.A N ASP 121.A O no hydrogen 2.856 N/A GLN 126.A N GLU 122.A O no hydrogen 2.860 N/A LYS 127.A N ALA 123.A O no hydrogen 3.263 N/A PHE 128.A N GLY 124.A O no hydrogen 2.878 N/A PHE 129.A N LEU 125.A O no hydrogen 2.844 N/A ARG 130.A N GLN 126.A O no hydrogen 3.067 N/A ARG 130.A NE ARG 42.A O no hydrogen 2.620 N/A ARG 130.A NH2 ARG 42.A O no hydrogen 2.800 N/A GLN 131.A N LYS 127.A O no hydrogen 3.002 N/A GLN 131.A NE2 TYR 111.A OH no hydrogen 2.693 N/A SER 133.A N ILE 138.A O no hydrogen 2.915 N/A GLY 137.A N TYR 134.A O no hydrogen 2.792 N/A ILE 138.A N GLN 131.A O no hydrogen 2.879 N/A SER 140.A OG HIS 141.A ND1 no hydrogen 2.890 N/A HIS 141.A ND1 SER 140.A OG no hydrogen 2.890 N/A PHE 142.A N GLY 95.A O no hydrogen 3.130 N/A GLU 145.A N GLU 145.A OE1 no hydrogen 2.864 N/A THR 146.A N ALA 143.A O no hydrogen 2.867 N/A THR 146.A OG1 ALA 143.A O no hydrogen 2.928 N/A SER 149.A N THR 146.A O no hydrogen 3.277 N/A SER 149.A OG PHE 142.A O no hydrogen 2.786 N/A SER 149.A OG HIS 151.A O no hydrogen 3.110 N/A HIS 151.A N SER 149.A OG no hydrogen 3.087 N/A HIS 151.A ND1 HIS 162.A ND1 no hydrogen 2.788 N/A GLY 157.A N GLU 183.A OE2 no hydrogen 2.772 N/A TYR 158.A OH GLU 155.A OE2 no hydrogen 2.667 N/A SER 161.A OG TYR 158.A O no hydrogen 3.410 N/A HIS 162.A N TYR 158.A O no hydrogen 3.107 N/A HIS 162.A ND1 HIS 151.A ND1 no hydrogen 2.788 N/A HIS 162.A NE2 GLU 486.A OE2 no hydrogen 2.867 N/A ALA 163.A N ALA 159.A O no hydrogen 3.068 N/A TYR 164.A N LEU 160.A O no hydrogen 3.098 N/A TYR 164.A OH TYR 241.A OH no hydrogen 2.736 N/A GLY 165.A N SER 161.A O no hydrogen 3.028 N/A ALA 166.A N HIS 162.A O no hydrogen 2.953 N/A ILE 167.A N ALA 163.A O no hydrogen 3.347 N/A MET 168.A N GLY 165.A O no hydrogen 3.160 N/A ASP 169.A N ASP 204.A OD1 no hydrogen 2.759 N/A ASN 170.A N ILE 167.A O no hydrogen 2.977 N/A ASN 170.A ND2 ALA 166.A O no hydrogen 3.071 N/A ASN 170.A ND2 ASN 375.A OD1 no hydrogen 2.924 N/A SER 172.A OG PRO 3.A O no hydrogen 3.562 N/A LEU 173.A N ASN 170.A O no hydrogen 2.945 N/A PHE 174.A N ASN 87.A O no hydrogen 2.870 N/A VAL 175.A N ILE 206.A O no hydrogen 2.942 N/A ALA 177.A N LEU 208.A O no hydrogen 2.836 N/A ILE 178.A N ILE 91.A O no hydrogen 2.989 N/A VAL 179.A N ILE 210.A O no hydrogen 2.965 N/A GLY 180.A N GLU 183.A OE1 no hydrogen 3.294 N/A ALA 184.A N GLY 180.A O no hydrogen 2.962 N/A GLU 185.A N GLY 182.A O no hydrogen 2.680 N/A THR 186.A N GLU 183.A O no hydrogen 2.994 N/A THR 186.A OG1 GLU 183.A O no hydrogen 2.990 N/A LEU 189.A N THR 186.A OG1 no hydrogen 3.210 N/A ALA 190.A N THR 186.A O no hydrogen 3.042 N/A THR 191.A N GLY 187.A O no hydrogen 3.256 N/A GLY 192.A N PRO 188.A O no hydrogen 3.023 N/A GLN 194.A N THR 191.A O no hydrogen 3.059 N/A SER 195.A N GLY 192.A O no hydrogen 3.124 N/A SER 195.A OG GLY 192.A O no hydrogen 2.735 N/A ASN 196.A ND2 MET 239.A O no hydrogen 2.796 N/A LYS 197.A N GLN 194.A O no hydrogen 3.105 N/A LYS 197.A NZ MET 239.A O no hydrogen 3.260 N/A LEU 198.A N SER 195.A O no hydrogen 2.715 N/A ASN 200.A N ASP 204.A OD2 no hydrogen 2.781 N/A ASN 200.A ND2 ASN 284.A O no hydrogen 2.883 N/A ASN 200.A ND2 ASP 454.A OD1 no hydrogen 2.907 N/A ARG 202.A N ASN 200.A OD1 no hydrogen 3.077 N/A THR 203.A N ASN 200.A OD1 no hydrogen 3.331 N/A THR 203.A OG1 ASN 200.A OD1 no hydrogen 3.461 N/A THR 203.A OG1 SER 469.A OG no hydrogen 2.834 N/A ASP 204.A N ASN 200.A O no hydrogen 2.809 N/A GLY 205.A N ILE 167.A O no hydrogen 2.914 N/A ILE 206.A N LEU 173.A O no hydrogen 3.120 N/A LEU 208.A N VAL 175.A O no hydrogen 2.931 N/A ILE 210.A N ALA 177.A O no hydrogen 2.713 N/A LEU 211.A N LEU 293.A O no hydrogen 2.716 N/A HIS 212.A N VAL 179.A O no hydrogen 2.908 N/A LEU 213.A N PHE 295.A O no hydrogen 2.749 N/A ASN 214.A N HIS 212.A O no hydrogen 2.887 N/A GLY 215.A N ASP 181.A OD2 no hydrogen 2.818 N/A TYR 216.A N ASN 214.A OD1 no hydrogen 3.498 N/A LYS 217.A N ASN 220.A O no hydrogen 2.883 N/A LYS 217.A NZ GLU 185.A OE1 no hydrogen 2.728 N/A LYS 217.A NZ GLU 185.A OE2 no hydrogen 2.964 N/A LYS 217.A NZ PRO 221.A O no hydrogen 2.855 N/A THR 222.A N GLY 215.A O no hydrogen 3.149 N/A THR 222.A OG1 ASP 181.A OD2 no hydrogen 2.677 N/A THR 222.A OG1 SER 225.A OG no hydrogen 2.916 N/A ILE 223.A N GLU 185.A OE2 no hydrogen 2.942 N/A SER 225.A N THR 222.A O no hydrogen 3.227 N/A SER 225.A OG GLY 215.A O no hydrogen 3.409 N/A SER 225.A OG THR 222.A O no hydrogen 3.081 N/A SER 225.A OG THR 222.A OG1 no hydrogen 2.916 N/A ARG 226.A N ILE 223.A O no hydrogen 3.097 N/A ARG 226.A NH2 TYR 216.A OH no hydrogen 3.011 N/A ILE 227.A N ILE 223.A O no hydrogen 3.196 N/A SER 228.A N GLU 231.A OE1 no hydrogen 3.225 N/A SER 228.A OG GLU 231.A OE1 no hydrogen 2.849 N/A GLU 231.A N SER 228.A OG no hydrogen 3.101 N/A LEU 232.A N SER 228.A O no hydrogen 2.994 N/A HIS 233.A N ASP 229.A O no hydrogen 3.045 N/A HIS 233.A NE2 GLU 245.A OE2 no hydrogen 2.931 N/A GLU 234.A N GLU 230.A O no hydrogen 3.167 N/A PHE 235.A N GLU 231.A O no hydrogen 3.001 N/A PHE 236.A N LEU 232.A O no hydrogen 3.290 N/A HIS 237.A N HIS 233.A O no hydrogen 3.007 N/A GLY 238.A N GLU 234.A O no hydrogen 2.684 N/A MET 239.A N PHE 235.A O no hydrogen 3.147 N/A MET 239.A N PHE 236.A O no hydrogen 3.289 N/A GLY 240.A N HIS 237.A O no hydrogen 2.986 N/A TYR 241.A N PHE 236.A O no hydrogen 2.979 N/A TYR 241.A OH TYR 164.A OH no hydrogen 2.736 N/A TYR 241.A OH TRP 193.A O no hydrogen 2.644 N/A GLU 242.A N TYR 290.A O no hydrogen 2.818 N/A TYR 244.A N MET 292.A O no hydrogen 2.908 N/A PHE 246.A N ILE 294.A O no hydrogen 2.923 N/A ALA 248.A N ARG 296.A O no hydrogen 3.145 N/A GLU 253.A N ASP 251.A OD1 no hydrogen 3.077 N/A SER 257.A N ASP 254.A OD1 no hydrogen 3.389 N/A SER 257.A OG GLU 253.A OE1 no hydrogen 3.039 N/A ILE 258.A N ASP 254.A O no hydrogen 3.119 N/A HIS 259.A N HIS 255.A O no hydrogen 2.712 N/A HIS 259.A ND1 HIS 76.A NE2 no hydrogen 2.867 N/A HIS 259.A NE2 ASP 25.A OD1 no hydrogen 2.849 N/A ARG 260.A N MET 256.A O no hydrogen 2.813 N/A ARG 260.A NE GLU 18.A OE1 no hydrogen 2.900 N/A ARG 260.A NH1 GLU 18.A OE1 no hydrogen 3.544 N/A ARG 260.A NH1 GLU 18.A OE2 no hydrogen 3.108 N/A ARG 261.A N SER 257.A O no hydrogen 2.936 N/A ARG 261.A NE GLU 253.A OE1 no hydrogen 2.734 N/A ARG 261.A NH2 VAL 247.A O no hydrogen 2.890 N/A ARG 261.A NH2 GLU 253.A OE2 no hydrogen 2.959 N/A PHE 262.A N ILE 258.A O no hydrogen 2.821 N/A ALA 263.A N HIS 259.A O no hydrogen 2.792 N/A GLU 264.A N ARG 260.A O no hydrogen 3.120 N/A LEU 265.A N ARG 261.A O no hydrogen 2.985 N/A TRP 266.A N PHE 262.A O no hydrogen 2.769 N/A GLU 267.A N ALA 263.A O no hydrogen 2.811 N/A THR 268.A N GLU 264.A O no hydrogen 3.029 N/A THR 268.A OG1 GLU 264.A O no hydrogen 2.966 N/A ILE 269.A N LEU 265.A O no hydrogen 2.849 N/A TRP 270.A N TRP 266.A O no hydrogen 2.816 N/A TRP 270.A NE1 LYS 10.A O no hydrogen 2.879 N/A ASP 271.A N GLU 267.A O no hydrogen 2.726 N/A GLU 272.A N THR 268.A O no hydrogen 3.137 N/A ILE 273.A N ILE 269.A O no hydrogen 2.954 N/A CYS 274.A N TRP 270.A O no hydrogen 2.743 N/A CYS 274.A SG TRP 270.A O no hydrogen 3.331 N/A ASP 275.A N ASP 271.A O no hydrogen 2.828 N/A ILE 276.A N GLU 272.A O no hydrogen 2.949 N/A LYS 277.A N ILE 273.A O no hydrogen 2.816 N/A LYS 277.A NZ PRO 171.A O no hydrogen 2.766 N/A LYS 277.A NZ PRO 201.A O no hydrogen 2.840 N/A LYS 277.A NZ ASP 204.A O no hydrogen 2.622 N/A ALA 278.A N CYS 274.A O no hydrogen 2.912 N/A THR 279.A N ASP 275.A O no hydrogen 2.819 N/A THR 279.A OG1 ASP 275.A O no hydrogen 2.977 N/A ALA 280.A N ILE 276.A O no hydrogen 2.974 N/A GLN 281.A N ALA 278.A O no hydrogen 3.107 N/A THR 282.A N THR 279.A O no hydrogen 2.933 N/A ASP 283.A N THR 279.A O no hydrogen 2.775 N/A ASN 284.A ND2 ASN 200.A OD1 no hydrogen 2.734 N/A VAL 285.A N ASP 283.A OD1 no hydrogen 3.008 N/A HIS 286.A ND1 ASP 283.A OD1 no hydrogen 3.047 N/A HIS 286.A ND1 ASP 283.A OD2 no hydrogen 2.870 N/A TYR 290.A N GLY 240.A O no hydrogen 3.215 N/A MET 292.A N GLU 242.A O no hydrogen 3.058 N/A LEU 293.A N PRO 209.A O no hydrogen 3.016 N/A ILE 294.A N TYR 244.A O no hydrogen 2.736 N/A PHE 295.A N LEU 211.A O no hydrogen 2.862 N/A ARG 296.A N PHE 246.A O no hydrogen 2.926 N/A ARG 296.A NE GLU 245.A OE1 no hydrogen 2.729 N/A ARG 296.A NH1 SER 225.A O no hydrogen 3.334 N/A ARG 296.A NH2 ASP 229.A OD2 no hydrogen 3.277 N/A ARG 296.A NH2 GLU 245.A OE1 no hydrogen 3.274 N/A LYS 299.A NZ TYR 216.A O no hydrogen 3.217 N/A LYS 299.A NZ LYS 217.A O no hydrogen 2.833 N/A LYS 299.A NZ HIS 319.A ND1 no hydrogen 3.050 N/A GLY 300.A N GLY 65.A O no hydrogen 2.762 N/A TRP 301.A N PRO 298.A O no hydrogen 3.101 N/A THR 302.A N GLU 313.A OE1 no hydrogen 2.860 N/A THR 302.A OG1 TRP 301.A O no hydrogen 2.564 N/A THR 302.A OG1 TYR 343.A OH no hydrogen 2.747 N/A CYS 303.A N GLY 300.A O no hydrogen 2.961 N/A CYS 303.A SG GLY 300.A O no hydrogen 3.174 N/A CYS 303.A SG PRO 304.A O no hydrogen 3.374 N/A ILE 307.A N LYS 310.A O no hydrogen 2.856 N/A LYS 310.A N ILE 307.A O no hydrogen 2.891 N/A LYS 311.A NZ GLU 313.A O no hydrogen 3.539 N/A THR 312.A N LYS 305.A O no hydrogen 2.835 N/A THR 312.A OG1 LYS 310.A O no hydrogen 3.273 N/A GLU 313.A N LYS 305.A O no hydrogen 3.367 N/A GLY 314.A N LYS 299.A O no hydrogen 2.707 N/A SER 315.A OG LYS 311.A O no hydrogen 3.234 N/A ARG 317.A N SER 315.A OG no hydrogen 3.018 N/A SER 318.A N SER 315.A O no hydrogen 3.098 N/A SER 318.A OG THR 312.A O no hydrogen 3.566 N/A SER 318.A OG SER 315.A O no hydrogen 2.867 N/A HIS 319.A N TRP 316.A O no hydrogen 2.922 N/A LEU 323.A N TYR 40.A OH no hydrogen 3.412 N/A ARG 327.A N SER 325.A OG no hydrogen 3.113 N/A ARG 327.A NH1 GLU 54.A OE2 no hydrogen 2.798 N/A ARG 327.A NH2 VAL 56.A O no hydrogen 2.682 N/A ASP 328.A N SER 325.A OG no hydrogen 3.025 N/A THR 329.A N ASP 328.A OD1 no hydrogen 3.037 N/A HIS 332.A N THR 329.A OG1 no hydrogen 2.993 N/A HIS 332.A ND1 ASP 328.A OD1 no hydrogen 2.728 N/A HIS 332.A NE2 ASP 308.A OD2 no hydrogen 2.767 N/A PHE 333.A N THR 329.A O no hydrogen 3.145 N/A GLU 334.A N GLU 330.A O no hydrogen 2.855 N/A VAL 335.A N ALA 331.A O no hydrogen 3.100 N/A LEU 336.A N HIS 332.A O no hydrogen 3.102 N/A LYS 337.A N PHE 333.A O no hydrogen 2.852 N/A ASN 338.A N GLU 334.A O no hydrogen 2.983 N/A TRP 339.A N VAL 335.A O no hydrogen 2.878 N/A TRP 339.A NE1 TYR 343.A OH no hydrogen 2.763 N/A LEU 340.A N LEU 336.A O no hydrogen 2.815 N/A GLU 341.A N LYS 337.A O no hydrogen 2.862 N/A SER 342.A N TRP 339.A O no hydrogen 3.029 N/A SER 342.A OG TRP 339.A O no hydrogen 2.639 N/A TYR 343.A N LEU 340.A O no hydrogen 3.444 N/A TYR 343.A OH THR 302.A OG1 no hydrogen 2.747 N/A LYS 344.A N GLU 341.A O no hydrogen 2.807 N/A GLU 346.A N GLU 346.A OE2 no hydrogen 2.693 N/A GLU 347.A N LYS 344.A O no hydrogen 2.983 N/A LEU 348.A N PRO 345.A O no hydrogen 2.983 N/A PHE 349.A N PRO 345.A O no hydrogen 3.219 N/A ASP 350.A N ALA 354.A O no hydrogen 2.698 N/A GLY 353.A N ASP 350.A O no hydrogen 3.004 N/A ALA 354.A N ASP 350.A OD1 no hydrogen 3.035 N/A LYS 356.A N LEU 348.A O no hydrogen 2.899 N/A LYS 356.A NZ GLU 347.A O no hydrogen 3.428 N/A VAL 359.A N LYS 356.A O no hydrogen 3.116 N/A LEU 360.A N ASP 357.A O no hydrogen 3.110 N/A MET 363.A N LEU 360.A O no hydrogen 2.883 N/A ARG 369.A N GLY 366.A O no hydrogen 3.072 N/A ARG 369.A NE GLY 366.A O no hydrogen 2.955 N/A ARG 369.A NH1 ASP 108.A O no hydrogen 2.992 N/A ARG 369.A NH1 GLU 113.A OE1 no hydrogen 3.307 N/A ARG 369.A NH1 GLU 113.A OE2 no hydrogen 3.053 N/A ARG 369.A NH2 GLU 113.A OE1 no hydrogen 3.086 N/A GLY 371.A N ASP 108.A OD2 no hydrogen 2.944 N/A ALA 372.A N ARG 369.A O no hydrogen 3.138 N/A ASN 373.A N ARG 369.A O no hydrogen 3.027 N/A ASN 373.A ND2 ASN 87.A OD1 no hydrogen 2.967 N/A ASN 375.A N ASN 373.A OD1 no hydrogen 2.863 N/A ASN 375.A ND2 ASN 373.A OD1 no hydrogen 3.052 N/A ALA 376.A N ASN 373.A O no hydrogen 3.048 N/A ASN 377.A N PRO 374.A O no hydrogen 3.177 N/A ASN 377.A ND2 TRP 527.A O no hydrogen 3.108 N/A VAL 380.A N ASN 377.A O no hydrogen 2.900 N/A ILE 381.A N GLY 378.A O no hydrogen 2.838 N/A ARG 382.A N GLY 378.A O no hydrogen 2.996 N/A ARG 382.A NH1 ASP 384.A OD1 no hydrogen 3.309 N/A ARG 382.A NH2 ASP 384.A OD1 no hydrogen 3.289 N/A LYS 386.A N ASN 425.A OD1 no hydrogen 2.860 N/A ASP 392.A N ASN 389.A O no hydrogen 3.094 N/A TYR 393.A N LEU 390.A O no hydrogen 2.944 N/A TYR 393.A OH ASP 420.A OD2 no hydrogen 2.426 N/A GLU 394.A N GLU 391.A O no hydrogen 3.389 N/A VAL 395.A N ASN 581.A OD1 no hydrogen 2.819 N/A LYS 396.A NZ GLU 391.A O no hydrogen 3.537 N/A GLU 397.A N GLU 397.A OE1 no hydrogen 2.802 N/A GLU 400.A N LYS 396.A O no hydrogen 3.379 N/A TYR 401.A N GLU 397.A O no hydrogen 2.675 N/A GLY 402.A N VAL 398.A O no hydrogen 2.728 N/A HIS 403.A ND1 TRP 610.A O no hydrogen 2.764 N/A GLY 404.A N THR 609.A O no hydrogen 2.768 N/A THR 411.A OG1 ASN 440.A O no hydrogen 2.712 N/A ARG 412.A N GLU 409.A O no hydrogen 3.112 N/A ARG 412.A NE GLU 409.A OE1 no hydrogen 2.843 N/A ARG 412.A NH2 GLU 409.A OE1 no hydrogen 3.008 N/A THR 413.A N ALA 410.A O no hydrogen 3.171 N/A GLY 415.A N THR 411.A O no hydrogen 2.882 N/A ALA 416.A N ARG 412.A O no hydrogen 2.994 N/A TYR 417.A N THR 413.A O no hydrogen 2.950 N/A THR 418.A N LEU 414.A O no hydrogen 2.825 N/A THR 418.A OG1 LEU 414.A O no hydrogen 2.884 N/A THR 418.A OG1 TYR 591.A OH no hydrogen 2.949 N/A ARG 419.A N GLY 415.A O no hydrogen 2.964 N/A ARG 419.A NE ASP 420.A OD1 no hydrogen 2.924 N/A ARG 419.A NH1 GLU 447.A OE2 no hydrogen 2.915 N/A ARG 419.A NH2 ASP 420.A OD2 no hydrogen 2.923 N/A ASP 420.A N ALA 416.A O no hydrogen 3.321 N/A ILE 421.A N TYR 417.A O no hydrogen 2.929 N/A ILE 422.A N THR 418.A O no hydrogen 2.997 N/A LYS 423.A N ARG 419.A O no hydrogen 2.977 N/A ASN 424.A N ASP 420.A O no hydrogen 3.029 N/A ASN 424.A ND2 LYS 386.A O no hydrogen 3.139 N/A ASN 425.A N ILE 422.A O no hydrogen 2.993 N/A ASN 425.A ND2 LYS 386.A O no hydrogen 3.023 N/A ASN 425.A ND2 ILE 421.A O no hydrogen 2.730 N/A ARG 427.A NH1 THR 203.A O no hydrogen 3.092 N/A ARG 427.A NH2 THR 203.A O no hydrogen 2.995 N/A ASP 428.A N ASN 425.A O no hydrogen 3.241 N/A ARG 430.A N HIS 494.A O no hydrogen 2.948 N/A ARG 430.A NE ASP 169.A OD2 no hydrogen 2.735 N/A ARG 430.A NH1 GLY 470.A O no hydrogen 2.725 N/A ARG 430.A NH2 ASP 169.A OD1 no hydrogen 2.960 N/A ARG 430.A NH2 GLN 452.A OE1 no hydrogen 3.232 N/A ARG 430.A NH2 GLY 470.A O no hydrogen 2.745 N/A ILE 431.A N GLN 471.A O no hydrogen 2.967 N/A PHE 432.A N ILE 496.A O no hydrogen 3.066 N/A GLY 433.A N VAL 473.A O no hydrogen 3.194 N/A GLU 436.A N GLU 474.A OE2 no hydrogen 2.987 N/A THR 437.A N GLU 474.A OE2 no hydrogen 2.895 N/A THR 437.A OG1 GLU 474.A OE2 no hydrogen 2.782 N/A SER 439.A OG TYR 500.A OH no hydrogen 2.666 N/A ASN 440.A N GLU 436.A O no hydrogen 2.881 N/A ASN 440.A ND2 SER 498.A OG no hydrogen 2.763 N/A ARG 441.A N ALA 438.A O no hydrogen 2.957 N/A ARG 441.A NE LYS 604.A O no hydrogen 3.120 N/A ARG 441.A NH2 LYS 604.A O no hydrogen 3.474 N/A LEU 442.A N THR 437.A O no hydrogen 2.942 N/A GLN 443.A N GLN 443.A OE1 no hydrogen 2.871 N/A SER 445.A N LEU 442.A O no hydrogen 3.319 N/A TYR 446.A N GLN 443.A O no hydrogen 2.833 N/A GLU 447.A N ALA 444.A O no hydrogen 2.946 N/A VAL 448.A N SER 445.A O no hydrogen 2.976 N/A THR 449.A N SER 445.A O no hydrogen 3.058 N/A LYS 451.A N HIS 465.A O no hydrogen 2.841 N/A GLN 452.A N VAL 472.A O no hydrogen 2.714 N/A GLN 452.A NE2 LEU 198.A O no hydrogen 2.804 N/A GLN 452.A NE2 ASP 204.A OD2 no hydrogen 2.956 N/A TRP 453.A N HIS 467.A O no hydrogen 2.853 N/A TRP 453.A NE1 GLY 456.A O no hydrogen 3.061 N/A ASP 454.A N LYS 197.A O no hydrogen 2.803 N/A TYR 457.A OH TRP 453.A O no hydrogen 2.751 N/A ILE 458.A N ASP 463.A OD2 no hydrogen 2.838 N/A SER 459.A N ASP 463.A OD2 no hydrogen 2.923 N/A GLU 461.A N SER 459.A OG no hydrogen 3.066 N/A VAL 462.A N SER 459.A O no hydrogen 3.173 N/A ASP 463.A N SER 459.A O no hydrogen 3.085 N/A HIS 467.A N LYS 451.A O no hydrogen 2.923 N/A SER 469.A OG THR 203.A OG1 no hydrogen 2.834 N/A GLY 470.A N GLN 452.A OE1 no hydrogen 2.801 N/A GLN 471.A N THR 449.A OG1 no hydrogen 2.927 N/A GLN 471.A NE2 ASP 169.A OD2 no hydrogen 2.868 N/A GLN 471.A NE2 PHE 429.A O no hydrogen 3.285 N/A VAL 472.A N ASN 450.A O no hydrogen 3.318 N/A VAL 473.A N ILE 431.A O no hydrogen 2.987 N/A SER 477.A N GLN 475.A O no hydrogen 2.838 N/A GLU 478.A N GLU 478.A OE1 no hydrogen 2.783 N/A GLN 480.A N SER 477.A OG no hydrogen 3.053 N/A GLN 480.A NE2 SER 195.A OG no hydrogen 2.845 N/A GLN 480.A NE2 GLN 475.A OE1 no hydrogen 2.925 N/A MET 481.A N SER 477.A O no hydrogen 3.111 N/A GLU 482.A N GLU 478.A O no hydrogen 3.033 N/A GLY 483.A N HIS 479.A O no hydrogen 2.969 N/A PHE 484.A N GLN 480.A O no hydrogen 2.728 N/A LEU 485.A N MET 481.A O no hydrogen 3.156 N/A GLU 486.A N GLU 482.A O no hydrogen 2.924 N/A ALA 487.A N GLY 483.A O no hydrogen 3.342 N/A TYR 488.A N PHE 484.A O no hydrogen 2.940 N/A TYR 488.A OH ASP 169.A OD2 no hydrogen 2.702 N/A LEU 489.A N LEU 485.A O no hydrogen 2.888 N/A LEU 490.A N GLU 486.A O no hydrogen 2.927 N/A THR 491.A N ALA 487.A O no hydrogen 2.991 N/A THR 491.A OG1 ALA 487.A O no hydrogen 2.937 N/A THR 491.A OG1 TYR 488.A O no hydrogen 3.307 N/A GLY 492.A N LEU 489.A O no hydrogen 2.913 N/A ARG 493.A N TYR 488.A O no hydrogen 3.047 N/A ARG 493.A NE THR 491.A O no hydrogen 3.285 N/A ARG 493.A NE THR 491.A OG1 no hydrogen 3.105 N/A ARG 493.A NH1 MET 168.A O no hydrogen 2.779 N/A ARG 493.A NH2 MET 168.A O no hydrogen 3.146 N/A ARG 493.A NH2 THR 491.A OG1 no hydrogen 2.606 N/A HIS 494.A N ASP 428.A O no hydrogen 2.982 N/A ILE 496.A N ARG 430.A O no hydrogen 2.979 N/A TRP 497.A N ASN 535.A O no hydrogen 2.980 N/A SER 498.A N PHE 432.A O no hydrogen 3.287 N/A SER 499.A N LEU 537.A O no hydrogen 2.916 N/A SER 499.A OG TYR 500.A O no hydrogen 2.819 N/A TYR 500.A N GLU 436.A OE1 no hydrogen 2.772 N/A TYR 500.A OH SER 439.A OG no hydrogen 2.666 N/A GLU 501.A N SER 539.A O no hydrogen 2.966 N/A PHE 503.A N TYR 500.A O no hydrogen 3.133 N/A VAL 504.A N TYR 500.A O no hydrogen 3.253 N/A VAL 504.A N GLU 501.A O no hydrogen 3.208 N/A HIS 505.A ND1 ASP 508.A OD1 no hydrogen 2.800 N/A HIS 505.A NE2 ASP 554.A OD2 no hydrogen 2.718 N/A VAL 506.A N PHE 503.A O no hydrogen 2.924 N/A ILE 507.A N VAL 504.A O no hydrogen 2.915 N/A ASP 508.A N HIS 505.A O no hydrogen 3.150 N/A SER 509.A OG GLU 155.A OE2 no hydrogen 2.688 N/A MET 510.A N ILE 507.A O no hydrogen 2.926 N/A LEU 511.A N ILE 507.A O no hydrogen 3.064 N/A ASN 512.A N ASP 508.A O no hydrogen 2.965 N/A GLN 513.A N SER 509.A O no hydrogen 3.084 N/A HIS 514.A N MET 510.A O no hydrogen 2.995 N/A ALA 515.A N LEU 511.A O no hydrogen 2.867 N/A LYS 516.A N ASN 512.A O no hydrogen 2.905 N/A TRP 517.A N GLN 513.A O no hydrogen 2.908 N/A LEU 518.A N HIS 514.A O no hydrogen 2.914 N/A GLU 519.A N ALA 515.A O no hydrogen 2.756 N/A ALA 520.A N LYS 516.A O no hydrogen 2.969 N/A THR 521.A N TRP 517.A O no hydrogen 3.185 N/A THR 521.A OG1 TRP 517.A O no hydrogen 2.903 N/A VAL 522.A N LEU 518.A O no hydrogen 2.901 N/A ARG 523.A N GLU 519.A O no hydrogen 3.074 N/A ARG 523.A NE ASP 569.A OD1 no hydrogen 2.935 N/A ARG 523.A NE ASP 569.A OD2 no hydrogen 3.229 N/A ARG 523.A NH1 ASP 569.A OD2 no hydrogen 2.657 N/A GLU 524.A N ALA 520.A O no hydrogen 2.898 N/A ILE 525.A N THR 521.A O no hydrogen 2.959 N/A ARG 528.A N ILE 525.A O no hydrogen 3.050 N/A ARG 528.A NE PRO 144.A O no hydrogen 2.825 N/A ARG 528.A NH1 ALA 376.A O no hydrogen 2.912 N/A ARG 528.A NH2 PRO 144.A O no hydrogen 2.998 N/A ARG 528.A NH2 SER 149.A O no hydrogen 2.941 N/A LYS 529.A N ASN 377.A OD1 no hydrogen 3.037 N/A LYS 529.A NZ PRO 526.A O no hydrogen 3.148 N/A ILE 531.A N ASN 595.A OD1 no hydrogen 3.057 N/A SER 533.A OG SER 593.A OG no hydrogen 2.821 N/A MET 534.A N LYS 596.A O no hydrogen 2.801 N/A ASN 535.A ND2 GLY 495.A O no hydrogen 3.418 N/A LEU 536.A N ASN 598.A O no hydrogen 2.902 N/A LEU 537.A N TRP 497.A O no hydrogen 2.892 N/A VAL 538.A N ILE 600.A O no hydrogen 2.928 N/A SER 539.A N SER 499.A O no hydrogen 3.074 N/A SER 539.A OG ALA 602.A O no hydrogen 2.583 N/A SER 540.A N SER 539.A OG no hydrogen 2.743 N/A SER 540.A OG ASN 440.A OD1 no hydrogen 2.886 N/A HIS 541.A NE2 ASP 648.A OD2 no hydrogen 3.117 N/A VAL 542.A N GLU 501.A OE1 no hydrogen 2.830 N/A TRP 543.A NE1 HIS 709.A O no hydrogen 2.939 N/A ARG 544.A N HIS 541.A O no hydrogen 3.087 N/A ARG 544.A NE ASP 546.A OD1 no hydrogen 3.404 N/A ARG 544.A NE ASP 546.A OD2 no hydrogen 2.851 N/A ARG 544.A NH2 ASP 546.A OD1 no hydrogen 2.885 N/A GLN 545.A NE2 SER 540.A O no hydrogen 2.995 N/A ASN 548.A N GLN 545.A O no hydrogen 3.096 N/A ASN 548.A ND2 GLN 545.A OE1 no hydrogen 2.987 N/A GLY 549.A N GLN 545.A O no hydrogen 3.061 N/A SER 551.A OG HIS 552.A ND1 no hydrogen 2.839 N/A HIS 552.A N GLY 549.A O no hydrogen 2.876 N/A HIS 552.A ND1 SER 551.A OG no hydrogen 2.839 N/A GLN 553.A N PHE 550.A O no hydrogen 3.130 N/A GLN 553.A NE2 SER 738.A O no hydrogen 3.181 N/A GLY 556.A N ASP 554.A OD2 no hydrogen 2.974 N/A THR 558.A OG1 PRO 555.A O no hydrogen 3.399 N/A THR 558.A OG1 SER 710.A OG no hydrogen 2.885 N/A THR 558.A OG1 ASP 714.A OD2 no hydrogen 2.456 N/A SER 559.A N GLY 556.A O no hydrogen 2.965 N/A SER 559.A OG ASP 714.A OD1 no hydrogen 2.679 N/A SER 559.A OG ASP 714.A OD2 no hydrogen 3.541 N/A VAL 560.A N GLY 556.A O no hydrogen 3.234 N/A LEU 561.A N VAL 557.A O no hydrogen 2.720 N/A LEU 562.A N THR 558.A O no hydrogen 3.033 N/A ASN 563.A N VAL 560.A O no hydrogen 3.099 N/A LYS 564.A N LEU 561.A O no hydrogen 2.984 N/A LYS 564.A NZ ASN 563.A O no hydrogen 3.244 N/A CYS 565.A SG LEU 561.A O no hydrogen 3.449 N/A ASP 569.A N PHE 566.A O no hydrogen 2.924 N/A HIS 570.A NE2 ASP 686.A OD1 no hydrogen 2.888 N/A GLY 573.A N ILE 597.A O no hydrogen 2.797 N/A TYR 575.A N ALA 599.A O no hydrogen 2.942 N/A PHE 576.A N ALA 674.A O no hydrogen 2.860 N/A ALA 577.A N ILE 601.A O no hydrogen 2.849 N/A ASN 581.A ND2 VAL 395.A O no hydrogen 3.254 N/A ASN 581.A ND2 LEU 611.A O no hydrogen 2.699 N/A MET 582.A N ASP 579.A OD1 no hydrogen 3.033 N/A LEU 583.A N ASP 579.A O no hydrogen 2.870 N/A LEU 584.A N ALA 580.A O no hydrogen 2.874 N/A ALA 585.A N ASN 581.A O no hydrogen 2.925 N/A ILE 586.A N MET 582.A O no hydrogen 2.748 N/A ALA 587.A N LEU 583.A O no hydrogen 2.903 N/A GLU 588.A N LEU 584.A O no hydrogen 2.957 N/A LYS 589.A N ALA 585.A O no hydrogen 3.426 N/A CYS 590.A N ILE 586.A O no hydrogen 2.827 N/A CYS 590.A SG ILE 586.A O no hydrogen 3.250 N/A TYR 591.A N ALA 587.A O no hydrogen 2.739 N/A TYR 591.A OH THR 418.A OG1 no hydrogen 2.949 N/A LYS 592.A N GLU 588.A O no hydrogen 3.121 N/A SER 593.A N LYS 589.A O no hydrogen 3.034 N/A SER 593.A N CYS 590.A O no hydrogen 2.944 N/A SER 593.A OG SER 533.A OG no hydrogen 2.821 N/A SER 593.A OG CYS 590.A O no hydrogen 2.552 N/A ASN 595.A N ILE 531.A O no hydrogen 2.763 N/A LYS 596.A N SER 533.A OG no hydrogen 3.050 N/A LYS 596.A NZ TYR 575.A OH no hydrogen 3.296 N/A LYS 596.A NZ ASN 598.A OD1 no hydrogen 2.931 N/A ILE 597.A N VAL 571.A O no hydrogen 2.731 N/A ASN 598.A N MET 534.A O no hydrogen 2.908 N/A ASN 598.A ND2 ASN 535.A OD1 no hydrogen 3.031 N/A ASN 598.A ND2 SER 593.A OG no hydrogen 3.006 N/A ALA 599.A N GLY 573.A O no hydrogen 2.770 N/A ILE 600.A N LEU 536.A O no hydrogen 2.923 N/A ILE 601.A N TYR 575.A O no hydrogen 2.836 N/A ALA 602.A N VAL 538.A O no hydrogen 2.897 N/A LYS 604.A NZ SER 439.A O no hydrogen 2.767 N/A LYS 604.A NZ SER 540.A OG no hydrogen 2.834 N/A GLN 605.A N GLN 605.A OE1 no hydrogen 2.784 N/A GLN 605.A NE2 ASP 648.A OD2 no hydrogen 2.785 N/A ALA 607.A N LEU 408.A O no hydrogen 2.910 N/A THR 609.A N TRP 405.A O no hydrogen 2.830 N/A TRP 610.A N ASP 579.A OD2 no hydrogen 2.620 N/A LEU 611.A N ASP 579.A OD2 no hydrogen 3.002 N/A THR 612.A N GLU 615.A OE1 no hydrogen 2.900 N/A LEU 613.A N GLU 394.A OE2 no hydrogen 2.812 N/A GLU 615.A N THR 612.A OG1 no hydrogen 2.947 N/A ALA 616.A N THR 612.A O no hydrogen 2.882 N/A ARG 617.A N LEU 613.A O no hydrogen 2.811 N/A ARG 617.A NE GLU 588.A OE1 no hydrogen 3.264 N/A ALA 618.A N ASP 614.A O no hydrogen 3.102 N/A GLU 619.A N GLU 615.A O no hydrogen 2.895 N/A LEU 620.A N ALA 616.A O no hydrogen 2.939 N/A GLU 621.A N ARG 617.A O no hydrogen 3.109 N/A LYS 622.A NZ GLU 693.A OE2 no hydrogen 2.886 N/A GLY 623.A N GLU 619.A O no hydrogen 2.745 N/A ALA 625.A N ASN 672.A O no hydrogen 2.982 N/A TRP 627.A N VAL 670.A O no hydrogen 2.859 N/A TRP 627.A NE1 GLU 619.A OE2 no hydrogen 2.827 N/A ALA 630.A N TRP 627.A O no hydrogen 2.818 N/A SER 631.A N ASP 628.A O no hydrogen 3.110 N/A SER 631.A OG TRP 627.A O no hydrogen 3.009 N/A THR 632.A N PHE 668.A O no hydrogen 2.877 N/A THR 632.A OG1 VAL 666.A O no hydrogen 2.946 N/A THR 632.A OG1 PHE 668.A O no hydrogen 3.455 N/A ALA 633.A N PHE 668.A O no hydrogen 2.984 N/A LYS 634.A N GLU 638.A OE1 no hydrogen 2.989 N/A ASN 636.A ND2 ASP 696.A O no hydrogen 2.969 N/A ASP 637.A N ASN 635.A OD1 no hydrogen 2.842 N/A GLU 638.A N ASN 635.A OD1 no hydrogen 3.089 N/A ALA 639.A N ASN 636.A O no hydrogen 3.060 N/A GLU 640.A N LYS 667.A O no hydrogen 2.590 N/A VAL 642.A N PRO 703.A O no hydrogen 2.742 N/A LEU 643.A N LYS 669.A O no hydrogen 2.826 N/A ALA 644.A N LEU 705.A O no hydrogen 2.718 N/A ALA 645.A N VAL 671.A O no hydrogen 3.185 N/A ALA 646.A N ALA 707.A O no hydrogen 3.080 N/A THR 651.A N GLY 647.A O no hydrogen 2.860 N/A THR 651.A OG1 GLY 647.A O no hydrogen 2.820 N/A THR 651.A OG1 ASN 672.A OD1 no hydrogen 3.064 N/A GLN 652.A N ASP 648.A O no hydrogen 3.008 N/A GLU 653.A N VAL 649.A O no hydrogen 3.028 N/A ILE 654.A N PRO 650.A O no hydrogen 2.926 N/A MET 655.A N THR 651.A O no hydrogen 2.981 N/A ALA 656.A N GLN 652.A O no hydrogen 3.042 N/A ALA 657.A N GLU 653.A O no hydrogen 2.771 N/A SER 658.A N ILE 654.A O no hydrogen 2.838 N/A SER 658.A N MET 655.A O no hydrogen 3.103 N/A SER 658.A OG MET 655.A O no hydrogen 2.875 N/A ASP 659.A N MET 655.A O no hydrogen 3.081 N/A LYS 660.A N ALA 656.A O no hydrogen 3.262 N/A LYS 660.A NZ ASP 796.A OD2 no hydrogen 3.029 N/A LEU 661.A N ALA 657.A O no hydrogen 2.908 N/A LYS 662.A N SER 658.A O no hydrogen 2.844 N/A GLU 663.A N ASP 659.A O no hydrogen 3.220 N/A LEU 664.A N LYS 660.A O no hydrogen 3.266 N/A LEU 664.A N LEU 661.A O no hydrogen 3.073 N/A GLY 665.A N LYS 662.A O no hydrogen 2.708 N/A VAL 666.A N LEU 661.A O no hydrogen 3.049 N/A LYS 667.A N GLU 640.A OE2 no hydrogen 2.766 N/A PHE 668.A N THR 632.A OG1 no hydrogen 2.859 N/A LYS 669.A N VAL 641.A O no hydrogen 3.200 N/A LYS 669.A NZ ASN 636.A OD1 no hydrogen 2.756 N/A LYS 669.A NZ ILE 697.A O no hydrogen 2.772 N/A VAL 670.A N SER 631.A OG no hydrogen 2.950 N/A VAL 671.A N LEU 643.A O no hydrogen 2.813 N/A ASN 672.A N ALA 625.A O no hydrogen 2.977 N/A ASN 672.A ND2 THR 578.A OG1 no hydrogen 2.814 N/A ASN 672.A ND2 GLU 619.A OE1 no hydrogen 2.463 N/A ASN 672.A ND2 GLU 619.A OE2 no hydrogen 3.442 N/A VAL 673.A N ALA 645.A O no hydrogen 2.838 N/A ALA 674.A N GLY 623.A O no hydrogen 2.849 N/A ASP 675.A N GLY 623.A O no hydrogen 2.908 N/A LEU 676.A N ILE 574.A O no hydrogen 2.998 N/A LEU 677.A N ASP 675.A OD1 no hydrogen 2.959 N/A SER 678.A N ASP 675.A O no hydrogen 3.092 N/A SER 678.A OG ASP 675.A O no hydrogen 2.905 N/A LEU 679.A N LEU 676.A O no hydrogen 3.069 N/A GLN 680.A N LEU 677.A O no hydrogen 3.131 N/A GLN 680.A NE2 CYS 565.A O no hydrogen 2.862 N/A SER 681.A OG ASP 721.A OD1 no hydrogen 2.733 N/A LYS 683.A N SER 681.A OG no hydrogen 3.200 N/A LYS 683.A NZ ASP 721.A OD1 no hydrogen 3.300 N/A GLU 684.A N SER 681.A O no hydrogen 3.031 N/A ASN 685.A N SER 681.A O no hydrogen 3.122 N/A ASN 685.A ND2 GLN 680.A OE1 no hydrogen 2.831 N/A ASP 686.A N ASN 568.A OD1 no hydrogen 2.746 N/A GLU 687.A N ASN 685.A OD1 no hydrogen 2.759 N/A ALA 688.A N ASN 685.A O no hydrogen 3.067 N/A LEU 689.A N SER 678.A O no hydrogen 3.022 N/A THR 690.A N GLU 693.A OE1 no hydrogen 2.932 N/A THR 690.A OG1 GLU 693.A OE1 no hydrogen 3.359 N/A GLU 693.A N THR 690.A OG1 no hydrogen 3.095 N/A PHE 694.A N THR 690.A O no hydrogen 3.019 N/A ALA 695.A N ASP 691.A O no hydrogen 2.702 N/A ASP 696.A N GLU 692.A O no hydrogen 2.858 N/A ILE 697.A N GLU 693.A O no hydrogen 2.892 N/A PHE 698.A N PHE 694.A O no hydrogen 2.775 N/A THR 699.A OG1 PHE 698.A O no hydrogen 2.728 N/A LYS 702.A N THR 699.A OG1 no hydrogen 2.770 N/A LYS 702.A NZ ASP 637.A O no hydrogen 3.268 N/A VAL 704.A N ASN 727.A O no hydrogen 2.831 N/A LEU 705.A N VAL 642.A O no hydrogen 2.802 N/A PHE 706.A N ASN 729.A O no hydrogen 2.810 N/A ALA 707.A N ALA 644.A O no hydrogen 2.776 N/A TYR 708.A N HIS 731.A O no hydrogen 2.689 N/A TYR 708.A OH ASP 714.A OD2 no hydrogen 2.698 N/A HIS 709.A N ALA 646.A O no hydrogen 2.766 N/A HIS 709.A NE2 GLU 501.A OE2 no hydrogen 2.660 N/A SER 710.A OG PRO 555.A O no hydrogen 3.039 N/A SER 710.A OG THR 558.A OG1 no hydrogen 2.885 N/A TYR 711.A OH GLU 735.A OE2 no hydrogen 2.589 N/A ASP 714.A N TYR 711.A O no hydrogen 2.978 N/A ARG 716.A N ALA 712.A O no hydrogen 3.107 N/A ARG 716.A NH2 VAL 730.A O no hydrogen 2.892 N/A GLY 717.A N HIS 713.A O no hydrogen 2.991 N/A LEU 718.A N ASP 714.A O no hydrogen 3.100 N/A ILE 719.A N VAL 715.A O no hydrogen 3.070 N/A ARG 722.A N ILE 719.A O no hydrogen 2.818 N/A ARG 722.A NE LEU 679.A O no hydrogen 3.203 N/A ARG 722.A NH1 LEU 689.A O no hydrogen 2.731 N/A ARG 722.A NH1 ASP 691.A OD2 no hydrogen 2.759 N/A ARG 722.A NH2 LEU 689.A O no hydrogen 2.781 N/A ASN 724.A ND2 PHE 698.A O no hydrogen 3.687 N/A ASN 724.A ND2 THR 699.A O no hydrogen 3.533 N/A ASN 724.A ND2 LYS 702.A O no hydrogen 2.786 N/A HIS 725.A N ARG 722.A O no hydrogen 3.268 N/A HIS 725.A ND1 ARG 722.A O no hydrogen 2.623 N/A ASN 727.A N ASN 724.A O no hydrogen 3.107 N/A ASN 727.A ND2 ASN 724.A OD1 no hydrogen 2.924 N/A PHE 728.A N HIS 725.A O no hydrogen 3.026 N/A ASN 729.A N VAL 704.A O no hydrogen 2.622 N/A ASN 729.A ND2 GLU 759.A OE1 no hydrogen 2.735 N/A HIS 731.A N PHE 706.A O no hydrogen 2.822 N/A HIS 731.A ND1 ARG 750.A O no hydrogen 2.520 N/A HIS 731.A NE2 GLU 759.A OE1 no hydrogen 3.052 N/A TYR 733.A N SER 710.A O no hydrogen 2.843 N/A TYR 733.A OH GLN 553.A OE1 no hydrogen 3.340 N/A GLU 734.A N ASN 749.A OD1 no hydrogen 2.727 N/A THR 740.A OG1 ASP 744.A OD2 no hydrogen 2.819 N/A THR 741.A N THR 740.A OG1 no hydrogen 2.652 N/A THR 741.A OG1 ASP 793.A OD1 no hydrogen 2.486 N/A THR 741.A OG1 ASP 793.A OD2 no hydrogen 3.210 N/A TYR 743.A N ASP 793.A OD2 no hydrogen 2.622 N/A TYR 743.A OH ARG 780.A O no hydrogen 2.848 N/A ASP 744.A N THR 741.A OG1 no hydrogen 3.063 N/A MET 745.A N THR 741.A O no hydrogen 3.017 N/A VAL 746.A N PRO 742.A O no hydrogen 3.359 N/A ARG 747.A N TYR 743.A O no hydrogen 2.891 N/A ARG 747.A NE ASP 744.A OD1 no hydrogen 2.806 N/A ARG 747.A NH1 ASP 744.A OD1 no hydrogen 2.923 N/A VAL 748.A N ASP 744.A O no hydrogen 3.102 N/A ASN 749.A N VAL 746.A O no hydrogen 3.266 N/A ASN 749.A ND2 GLU 736.A O no hydrogen 2.810 N/A ASN 749.A ND2 MET 745.A O no hydrogen 3.002 N/A ARG 750.A N ARG 747.A O no hydrogen 2.957 N/A ARG 750.A NE GLU 734.A OE2 no hydrogen 3.174 N/A ARG 750.A NH2 GLU 734.A OE1 no hydrogen 2.783 N/A ARG 750.A NH2 GLU 734.A OE2 no hydrogen 3.462 N/A ILE 751.A N VAL 746.A O no hydrogen 3.092 N/A ARG 753.A N GLU 653.A OE1 no hydrogen 2.779 N/A ARG 753.A NE GLU 653.A OE1 no hydrogen 2.858 N/A ARG 753.A NH1 GLU 653.A OE1 no hydrogen 3.553 N/A ARG 753.A NH1 GLU 653.A OE2 no hydrogen 3.000 N/A TYR 754.A OH ASP 796.A OD2 no hydrogen 2.578 N/A GLU 755.A N ASP 752.A OD1 no hydrogen 2.992 N/A LEU 756.A N ASP 752.A O no hydrogen 2.929 N/A THR 757.A N ARG 753.A O no hydrogen 3.029 N/A THR 757.A OG1 ARG 753.A O no hydrogen 2.795 N/A ALA 758.A N TYR 754.A O no hydrogen 3.026 N/A GLU 759.A N GLU 755.A O no hydrogen 2.797 N/A ALA 760.A N LEU 756.A O no hydrogen 2.860 N/A LEU 761.A N THR 757.A O no hydrogen 3.026 N/A ARG 762.A N ALA 758.A O no hydrogen 2.849 N/A ARG 762.A NH1 GLU 755.A OE2 no hydrogen 3.048 N/A ARG 762.A NH1 GLU 759.A OE2 no hydrogen 2.711 N/A ARG 762.A NH2 GLU 777.A OE2 no hydrogen 2.762 N/A MET 763.A N GLU 759.A O no hydrogen 3.078 N/A MET 763.A N ALA 760.A O no hydrogen 3.000 N/A ILE 764.A N ALA 760.A O no hydrogen 3.117 N/A ILE 764.A N LEU 761.A O no hydrogen 3.265 N/A ASP 765.A N LEU 761.A O no hydrogen 2.892 N/A LYS 768.A N ASP 765.A OD2 no hydrogen 3.144 N/A LYS 768.A NZ TYR 769.A OH no hydrogen 3.540 N/A TYR 769.A N ASP 765.A O no hydrogen 3.026 N/A ALA 770.A N ASP 767.A O no hydrogen 3.277 N/A ILE 773.A N TYR 769.A O no hydrogen 2.822 N/A ASP 774.A N ALA 770.A O no hydrogen 3.009 N/A GLU 775.A N ASP 771.A O no hydrogen 2.855 N/A LEU 776.A N LYS 772.A O no hydrogen 2.872 N/A GLU 777.A N ILE 773.A O no hydrogen 3.060 N/A LYS 778.A N ASP 774.A O no hydrogen 3.143 N/A LYS 778.A NZ ASP 774.A OD1 no hydrogen 3.526 N/A LYS 778.A NZ ASP 774.A OD2 no hydrogen 3.486 N/A PHE 779.A N GLU 775.A O no hydrogen 2.996 N/A ARG 780.A N LEU 776.A O no hydrogen 3.088 N/A ARG 780.A NE ASP 752.A OD1 no hydrogen 3.406 N/A ARG 780.A NE ASP 752.A OD2 no hydrogen 3.006 N/A ARG 780.A NH1 GLU 777.A OE1 no hydrogen 2.920 N/A ARG 780.A NH2 ASP 752.A OD2 no hydrogen 3.147 N/A ASP 781.A N GLU 777.A O no hydrogen 3.384 N/A GLU 782.A N LYS 778.A O no hydrogen 3.038 N/A ALA 783.A N PHE 779.A O no hydrogen 2.787 N/A PHE 784.A N ARG 780.A O no hydrogen 3.139 N/A GLN 785.A N ASP 781.A O no hydrogen 3.137 N/A PHE 786.A N GLU 782.A O no hydrogen 2.991 N/A ALA 787.A N ALA 783.A O no hydrogen 3.258 N/A VAL 788.A N PHE 784.A O no hydrogen 2.977 N/A ASP 789.A N GLN 785.A O no hydrogen 2.822 N/A ASN 790.A N PHE 786.A O no hydrogen 2.984 N/A ASN 790.A ND2 PHE 786.A O no hydrogen 2.871 N/A GLY 791.A N ALA 787.A O no hydrogen 2.677 N/A ASP 796.A N HIS 794.A ND1 no hydrogen 2.866 N/A TYR 797.A N HIS 794.A O no hydrogen 2.732 N/A TYR 797.A OH GLU 653.A OE2 no hydrogen 2.760 N/A THR 798.A N HIS 794.A O no hydrogen 3.036 N/A THR 798.A OG1 ASP 793.A O no hydrogen 3.517 N/A ASP 799.A N PRO 795.A O no hydrogen 2.879 N/A TRP 800.A NE1 ASP 659.A OD1 no hydrogen 3.211 N/A SER 803.A N ASP 659.A OD1 no hydrogen 2.904 N/A SER 803.A OG ASP 659.A OD1 no hydrogen 3.561 N/A SER 803.A OG ASP 659.A OD2 no hydrogen 2.759 N/A VAL 805.A N TYR 802.A O no hydrogen 2.979 N/A ASN 806.A N TYR 401.A O no hydrogen 2.876 N/A LYS 809.A N ASN 806.A OD1 no hydrogen 3.048 N/A ALA 812.A N LYS 809.A O no hydrogen 3.434 N/A