Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4i3g_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): SER 1.A OG GLU 291.A OE2 no hydrogen 2.895 N/A ARG 2.A N GLU 291.A OE1 no hydrogen 2.963 N/A LEU 6.A N ARG 2.A O no hydrogen 2.963 N/A VAL 7.A N ALA 3.A O no hydrogen 3.009 N/A ALA 8.A N ALA 4.A O no hydrogen 2.959 N/A GLN 9.A N GLU 5.A O no hydrogen 3.197 N/A GLN 9.A N LEU 6.A O no hydrogen 3.029 N/A GLN 9.A NE2 GLU 5.A OE1.B no hydrogen 2.845 N/A MET 10.A N VAL 7.A O no hydrogen 3.043 N/A THR 11.A N GLU 14.A OE2 no hydrogen 2.933 N/A GLU 14.A N THR 11.A OG1 no hydrogen 3.059 N/A LYS 15.A N THR 11.A O no hydrogen 2.990 N/A LYS 15.A NZ GLU 276.A OE1 no hydrogen 2.904 N/A LYS 15.A NZ THR 280.A OG1 no hydrogen 2.934 N/A ILE 16.A N LEU 12.A O no hydrogen 2.937 N/A SER 17.A N ASP 13.A O no hydrogen 3.045 N/A SER 17.A N GLU 14.A O no hydrogen 3.228 N/A SER 17.A OG GLU 14.A O no hydrogen 2.684 N/A PHE 18.A N LYS 15.A O no hydrogen 3.070 N/A VAL 19.A N ILE 16.A O no hydrogen 3.073 N/A TRP 21.A N GLU 240.A O no hydrogen 2.940 N/A ALA 22.A N TYR 32.A O no hydrogen 2.797 N/A LEU 23.A N SER 255.A OG no hydrogen 2.985 N/A ASP 26.A N ASP 24.A OD1 no hydrogen 3.037 N/A ARG 27.A N ASP 24.A O no hydrogen 2.878 N/A ARG 27.A NE VAL 249.A O no hydrogen 2.798 N/A ARG 27.A NH1 ASP 24.A O no hydrogen 2.837 N/A ARG 27.A NH2 PRO 250.A O no hydrogen 2.948 N/A ARG 27.A NH2 GLU 253.A O no hydrogen 2.947 N/A GLN 28.A N ASP 24.A OD2 no hydrogen 2.886 N/A ASN 29.A N ASP 24.A OD2 no hydrogen 3.138 N/A ASN 29.A ND2 GLY 31.A O no hydrogen 3.140 N/A ASN 29.A ND2 GLN 94.A OE1 no hydrogen 2.900 N/A VAL 30.A N ALA 46.A O no hydrogen 2.962 N/A GLY 31.A N ALA 46.A O no hydrogen 3.133 N/A TYR 32.A N ALA 22.A O no hydrogen 2.933 N/A TYR 32.A OH GLU 43.A OE2 no hydrogen 2.539 N/A LEU 33.A N LEU 44.A O no hydrogen 2.796 N/A VAL 36.A N ILE 41.A O no hydrogen 2.956 N/A ARG 38.A NE GLU 14.A OE1 no hydrogen 2.905 N/A ARG 38.A NH2 GLN 9.A O no hydrogen 2.962 N/A ARG 38.A NH2 GLU 14.A OE2 no hydrogen 2.852 N/A LEU 39.A N VAL 36.A O no hydrogen 3.026 N/A GLY 40.A N PRO 37.A O no hydrogen 2.972 N/A ILE 41.A N VAL 36.A O no hydrogen 3.178 N/A LEU 44.A N LEU 33.A O no hydrogen 3.046 N/A ARG 45.A N ASP 95.A OD1 no hydrogen 2.799 N/A ARG 45.A NE ASP 24.A OD1 no hydrogen 3.052 N/A ALA 46.A N GLY 31.A O no hydrogen 2.921 N/A ALA 47.A N MET 96.A O no hydrogen 3.119 N/A GLY 49.A N GLY 52.A O no hydrogen 2.906 N/A ASN 51.A ND2 ALA 361.A O no hydrogen 2.960 N/A GLY 52.A N GLY 49.A O no hydrogen 3.191 N/A ARG 54.A N ASP 48.A O no hydrogen 2.794 N/A ARG 54.A NE SER 360.A O no hydrogen 2.789 N/A ARG 54.A NH2 ASP 48.A OD2 no hydrogen 2.808 N/A VAL 56.A N GLN 28.A O no hydrogen 2.918 N/A GLN 58.A N LEU 55.A O no hydrogen 3.198 N/A GLN 58.A NE2 THR 59.A O no hydrogen 2.871 N/A THR 59.A OG1 ASP 366.A OD1 no hydrogen 2.320 N/A THR 61.A N ASP 88.A OD2 no hydrogen 3.029 N/A THR 61.A OG1 ASP 88.A OD2 no hydrogen 2.570 N/A ALA 62.A N GLN 584.A OE1 no hydrogen 3.002 N/A LEU 63.A N ASN 51.A O no hydrogen 2.976 N/A ALA 65.A N TYR 581.A O no hydrogen 2.911 N/A VAL 67.A N TYR 114.A O no hydrogen 3.183 N/A LEU 69.A N ALA 65.A O no hydrogen 3.043 N/A ALA 70.A N PRO 66.A O no hydrogen 2.956 N/A SER 71.A N VAL 67.A O no hydrogen 2.948 N/A SER 71.A OG VAL 67.A O no hydrogen 2.784 N/A SER 71.A OG LYS 603.A O no hydrogen 3.434 N/A THR 72.A N LEU 69.A O no hydrogen 2.998 N/A THR 72.A OG1 LEU 69.A O no hydrogen 2.783 N/A THR 72.A OG1 ASP 74.A O no hydrogen 3.452 N/A PHE 73.A N ALA 70.A O no hydrogen 2.941 N/A ASP 74.A N THR 72.A OG1 no hydrogen 3.125 N/A THR 76.A N ASP 74.A OD1 no hydrogen 2.986 N/A THR 76.A OG1 ASP 74.A OD1 no hydrogen 2.692 N/A THR 76.A OG1 ASP 74.A OD2 no hydrogen 3.510 N/A MET 77.A N ASP 74.A O no hydrogen 2.969 N/A ASP 79.A N ASP 75.A O no hydrogen 2.987 N/A SER 80.A N THR 76.A O no hydrogen 3.105 N/A SER 80.A OG THR 76.A O no hydrogen 3.311 N/A TYR 81.A N MET 77.A O no hydrogen 2.903 N/A TYR 81.A OH PRO 50.A O no hydrogen 3.319 N/A TYR 81.A OH PRO 64.A O no hydrogen 2.670 N/A GLY 82.A N ALA 78.A O no hydrogen 2.898 N/A LYS 83.A N ASP 79.A O no hydrogen 2.916 N/A LYS 83.A NZ ASP 79.A OD1 no hydrogen 2.720 N/A VAL 84.A N SER 80.A O no hydrogen 3.150 N/A MET 85.A N TYR 81.A O no hydrogen 3.175 N/A GLY 86.A N GLY 82.A O no hydrogen 2.865 N/A ARG 87.A N LYS 83.A O no hydrogen 3.007 N/A ARG 87.A NE GLU 305.A O no hydrogen 2.926 N/A ARG 87.A NH2 GLU 305.A O no hydrogen 3.049 N/A ASP 88.A N VAL 84.A O no hydrogen 2.835 N/A GLY 89.A N MET 85.A O no hydrogen 2.916 N/A ARG 90.A N GLY 86.A O no hydrogen 2.961 N/A ARG 90.A NH1 ALA 301.A O no hydrogen 3.441 N/A ALA 91.A N ARG 87.A O no hydrogen 2.821 N/A LEU 92.A N ASP 88.A O no hydrogen 2.983 N/A LEU 92.A N GLY 89.A O no hydrogen 3.285 N/A ASN 93.A N ARG 90.A O no hydrogen 3.302 N/A GLN 94.A N GLY 89.A O no hydrogen 2.905 N/A GLN 94.A NE2 LEU 92.A O no hydrogen 3.027 N/A ASP 95.A N ARG 45.A O no hydrogen 2.828 N/A MET 96.A N ARG 45.A O no hydrogen 3.043 N/A VAL 97.A N MET 141.A O no hydrogen 2.907 N/A LEU 98.A N ALA 47.A O no hydrogen 2.818 N/A MET 102.A N LYS 145.A O no hydrogen 2.862 N/A ASN 103.A ND2 HIS 146.A O no hydrogen 2.774 N/A ASN 103.A ND2 GLU 172.A OE2 no hydrogen 2.870 N/A ASN 104.A N GLU 172.A OE1 no hydrogen 2.941 N/A ILE 105.A N SER 118.A O no hydrogen 2.865 N/A ARG 106.A NE GLU 635.A OE2 no hydrogen 2.810 N/A ARG 106.A NH1 SER 623.A O no hydrogen 3.105 N/A ARG 106.A NH2 SER 623.A O no hydrogen 3.285 N/A ARG 106.A NH2 GLU 635.A OE1 no hydrogen 2.908 N/A ARG 106.A NH2 GLU 635.A OE2 no hydrogen 3.552 N/A HIS 109.A NE2 GLU 612.A OE2 no hydrogen 2.747 N/A GLY 110.A N VAL 107.A O no hydrogen 2.890 N/A GLY 111.A N ASP 531.A OD1 no hydrogen 2.807 N/A ARG 112.A NE GLU 115.A OE1 no hydrogen 2.780 N/A ARG 112.A NH2 GLU 115.A OE1 no hydrogen 3.286 N/A ARG 112.A NH2 GLU 115.A OE2 no hydrogen 2.864 N/A ASN 113.A N GLY 110.A O no hydrogen 3.101 N/A ASN 113.A ND2 VAL 107.A O no hydrogen 2.879 N/A ASN 113.A ND2 SER 563.A OG no hydrogen 3.219 N/A TYR 114.A OH LEU 358.A O no hydrogen 2.770 N/A GLU 115.A N ARG 112.A O no hydrogen 2.859 N/A THR 116.A N ASN 113.A O no hydrogen 3.303 N/A THR 116.A OG1 ASN 103.A O no hydrogen 2.794 N/A SER 118.A OG ASP 120.A O no hydrogen 3.459 N/A SER 118.A OG THR 605.A O no hydrogen 2.781 N/A GLU 119.A N THR 605.A O no hydrogen 3.021 N/A ASP 120.A N SER 118.A OG no hydrogen 2.883 N/A LEU 122.A N ASP 120.A OD2 no hydrogen 2.895 N/A VAL 123.A N ASP 120.A OD2 no hydrogen 3.478 N/A SER 124.A N ASP 120.A O no hydrogen 3.092 N/A SER 124.A OG ASP 120.A O no hydrogen 3.236 N/A SER 125.A N PRO 121.A O no hydrogen 2.914 N/A SER 125.A OG PRO 121.A O no hydrogen 2.761 N/A ARG 126.A N LEU 122.A O no hydrogen 2.973 N/A ARG 126.A NE ASP 75.A OD1 no hydrogen 3.002 N/A ARG 126.A NH1 ASP 75.A OD1 no hydrogen 3.156 N/A ARG 126.A NH2 TYR 719.A O no hydrogen 2.977 N/A THR 127.A N VAL 123.A O no hydrogen 3.044 N/A THR 127.A OG1 VAL 123.A O no hydrogen 2.760 N/A ALA 128.A N SER 124.A O no hydrogen 2.918 N/A VAL 129.A N SER 125.A O no hydrogen 3.005 N/A ALA 130.A N ARG 126.A O no hydrogen 3.074 N/A GLN 131.A N THR 127.A O no hydrogen 3.019 N/A ILE 132.A N ALA 128.A O no hydrogen 2.893 N/A LYS 133.A N VAL 129.A O no hydrogen 2.940 N/A GLY 134.A N ALA 130.A O no hydrogen 3.123 N/A ILE 135.A N GLN 131.A O no hydrogen 2.851 N/A GLN 136.A N ILE 132.A O no hydrogen 2.901 N/A GLN 136.A NE2 GLY 183.A O no hydrogen 2.960 N/A GLY 137.A N LYS 133.A O no hydrogen 2.889 N/A ALA 138.A N GLY 134.A O no hydrogen 3.258 N/A ALA 138.A N ILE 135.A O no hydrogen 3.137 N/A GLY 139.A N GLN 136.A O no hydrogen 2.907 N/A LEU 140.A N ILE 135.A O no hydrogen 3.321 N/A MET 141.A N ASP 95.A O no hydrogen 2.930 N/A THR 142.A N GLN 136.A OE1 no hydrogen 3.166 N/A THR 142.A OG1 GLN 136.A OE1 no hydrogen 2.776 N/A THR 143.A N GLY 99.A O no hydrogen 2.959 N/A THR 143.A OG1 VAL 97.A O no hydrogen 3.245 N/A THR 143.A OG1 SER 186.A OG no hydrogen 2.920 N/A ALA 144.A N SER 186.A O no hydrogen 2.991 N/A LYS 145.A N PRO 100.A O no hydrogen 3.047 N/A LYS 145.A NZ LEU 98.A O no hydrogen 2.736 N/A HIS 146.A N ASN 103.A OD1 no hydrogen 2.928 N/A HIS 146.A ND1 ASN 103.A OD1 no hydrogen 3.194 N/A PHE 147.A N MET 188.A O no hydrogen 2.819 N/A ALA 149.A N GLU 172.A OE2 no hydrogen 2.823 N/A ASN 150.A ND2 ASN 192.A OD1 no hydrogen 3.529 N/A ASN 151.A ND2 ASN 104.A O no hydrogen 2.812 N/A ASN 151.A ND2 GLU 172.A OE1 no hydrogen 3.077 N/A GLN 152.A NE2 ASN 154.A O no hydrogen 2.950 N/A GLN 152.A NE2 PRO 625.A O no hydrogen 2.949 N/A GLU 153.A N ASP 531.A OD1 no hydrogen 2.762 N/A ASN 154.A N ASP 531.A OD2 no hydrogen 3.060 N/A ASN 155.A ND2 ASN 629.A OD1 no hydrogen 2.900 N/A ARG 156.A N GLU 153.A O no hydrogen 3.084 N/A ARG 156.A NH1 GLU 528.A OE2 no hydrogen 3.462 N/A ARG 156.A NH2 GLU 528.A OE2 no hydrogen 2.928 N/A SER 158.A N ASN 155.A O no hydrogen 3.023 N/A VAL 159.A N ASN 155.A O no hydrogen 2.845 N/A ASN 160.A N ASN 629.A O no hydrogen 2.889 N/A ASN 160.A ND2 ASN 162.A OD1 no hydrogen 2.976 N/A ASN 160.A ND2 GLN 630.A OE1.B no hydrogen 2.900 N/A ALA 161.A N GLY 193.A O no hydrogen 2.886 N/A ASN 162.A N GLN 631.A O no hydrogen 2.838 N/A VAL 163.A N ASN 195.A OD1 no hydrogen 2.923 N/A GLN 166.A NE2 GLU 170.A OE2 no hydrogen 2.880 N/A GLN 166.A NE2 PRO 710.A O no hydrogen 3.007 N/A THR 167.A N ASP 164.A OD1 no hydrogen 3.059 N/A THR 167.A OG1 ASP 164.A OD1 no hydrogen 3.291 N/A THR 167.A OG1 ASP 164.A OD2 no hydrogen 2.634 N/A LEU 168.A N ASP 164.A O no hydrogen 3.083 N/A ARG 169.A N GLU 165.A O no hydrogen 2.801 N/A ARG 169.A NE GLU 165.A OE2 no hydrogen 2.885 N/A ARG 169.A NH1 GLN 213.A OE1 no hydrogen 2.953 N/A ARG 169.A NH2 GLU 165.A OE2 no hydrogen 2.893 N/A ARG 169.A NH2 GLN 213.A OE1 no hydrogen 2.847 N/A GLU 170.A N GLN 166.A O no hydrogen 2.870 N/A ILE 171.A N THR 167.A O no hydrogen 2.860 N/A PHE 173.A N LEU 168.A O no hydrogen 2.759 N/A GLU 177.A N PHE 173.A O no hydrogen 2.859 N/A ALA 178.A N PRO 174.A O no hydrogen 2.862 N/A SER 179.A N ALA 175.A O no hydrogen 2.916 N/A SER 179.A OG ALA 175.A O no hydrogen 2.841 N/A SER 180.A N PHE 176.A O no hydrogen 2.851 N/A LYS 181.A N GLU 177.A O no hydrogen 3.004 N/A LYS 181.A NZ GLU 177.A OE2 no hydrogen 2.725 N/A ALA 182.A N ALA 178.A O no hydrogen 2.936 N/A GLY 183.A N SER 180.A O no hydrogen 2.965 N/A ALA 184.A N SER 179.A O no hydrogen 3.067 N/A ALA 185.A N GLN 136.A OE1 no hydrogen 3.008 N/A SER 186.A N THR 142.A O no hydrogen 3.167 N/A SER 186.A OG THR 142.A O no hydrogen 2.874 N/A PHE 187.A N TRP 219.A O no hydrogen 2.886 N/A MET 188.A N ALA 144.A O no hydrogen 2.858 N/A CYS 189.A N MET 221.A O no hydrogen 2.907 N/A CYS 189.A SG MET 221.A O no hydrogen 3.392 N/A ALA 190.A N PHE 147.A O no hydrogen 2.883 N/A TYR 191.A OH TRP 224.A O no hydrogen 2.596 N/A ASN 192.A ND2 ALA 148.A O no hydrogen 2.984 N/A ASN 192.A ND2 GLY 193.A O no hydrogen 3.041 N/A GLY 193.A N VAL 159.A O no hydrogen 2.844 N/A LEU 194.A N LYS 197.A O no hydrogen 2.872 N/A ASN 195.A N ALA 161.A O no hydrogen 2.850 N/A ASN 195.A ND2 VAL 163.A O no hydrogen 3.088 N/A GLY 196.A N ASN 160.A OD1 no hydrogen 2.800 N/A LYS 197.A N LEU 194.A O no hydrogen 3.330 N/A SER 199.A N ASN 192.A O no hydrogen 3.068 N/A SER 199.A OG ALA 148.A O no hydrogen 3.537 N/A SER 199.A OG ASN 192.A O no hydrogen 2.877 N/A CYS 200.A SG ALA 190.A O no hydrogen 3.673 N/A GLY 201.A N PRO 198.A O no hydrogen 2.862 N/A ASN 202.A ND2 LYS 197.A O no hydrogen 3.688 N/A LEU 205.A N ASN 202.A OD1 no hydrogen 3.013 N/A LEU 206.A N ASN 202.A O no hydrogen 2.880 N/A ASN 207.A N ASP 203.A O no hydrogen 2.870 N/A ASN 207.A ND2 ASP 203.A OD2 no hydrogen 2.769 N/A ASN 208.A N ASP 203.A O no hydrogen 3.076 N/A ASN 208.A ND2 GLU 204.A OE1 no hydrogen 3.419 N/A ASN 208.A ND2 GLU 204.A OE2 no hydrogen 2.804 N/A VAL 209.A N GLU 204.A O no hydrogen 2.879 N/A LEU 210.A N LEU 205.A O no hydrogen 3.131 N/A ARG 211.A N ASN 207.A O no hydrogen 3.056 N/A ARG 211.A NH1 GLY 218.A O no hydrogen 3.307 N/A ARG 211.A NH1 ASP 238.A OD2 no hydrogen 2.791 N/A ARG 211.A NH2 LEU 206.A O no hydrogen 3.052 N/A ARG 211.A NH2 GLY 236.A O no hydrogen 2.883 N/A THR 212.A N ASN 207.A O no hydrogen 2.942 N/A THR 212.A OG1 ASN 207.A O no hydrogen 3.551 N/A GLN 213.A N ASN 208.A O no hydrogen 2.853 N/A TRP 214.A N VAL 209.A O no hydrogen 2.933 N/A GLY 215.A N ARG 211.A O no hydrogen 2.839 N/A PHE 216.A N LEU 210.A O no hydrogen 2.979 N/A GLN 217.A NE2 GLY 215.A O no hydrogen 3.001 N/A TRP 219.A N ALA 185.A O no hydrogen 3.308 N/A TRP 219.A NE1 GLN 239.A OE1 no hydrogen 2.775 N/A VAL 220.A N ASP 238.A OD2 no hydrogen 2.801 N/A MET 221.A N PHE 187.A O no hydrogen 2.849 N/A SER 222.A N GLN 239.A O no hydrogen 2.913 N/A SER 222.A OG ASP 223.A O no hydrogen 2.770 N/A SER 222.A OG THR 227.A OG1 no hydrogen 2.999 N/A ASP 223.A N CYS 189.A O no hydrogen 3.199 N/A TRP 224.A N ASP 223.A OD2 no hydrogen 2.641 N/A LEU 225.A N MET 241.A O no hydrogen 2.816 N/A ALA 226.A N ASP 223.A O no hydrogen 2.980 N/A THR 227.A OG1 SER 222.A OG no hydrogen 2.999 N/A THR 230.A OG1 PHE 260.A O no hydrogen 2.756 N/A ALA 232.A N GLY 229.A O no hydrogen 3.039 N/A ILE 233.A N THR 230.A O no hydrogen 3.317 N/A THR 234.A N ASP 231.A O no hydrogen 2.967 N/A THR 234.A OG1 ASP 231.A O no hydrogen 2.765 N/A THR 234.A OG1 ASP 231.A OD1 no hydrogen 3.193 N/A LYS 235.A N ALA 232.A O no hydrogen 2.874 N/A LEU 237.A N ALA 232.A O no hydrogen 3.332 N/A ASP 238.A N VAL 220.A O no hydrogen 2.862 N/A GLN 239.A NE2 PHE 18.A O no hydrogen 3.051 N/A GLU 240.A N VAL 19.A O no hydrogen 2.873 N/A MET 241.A N SER 222.A OG no hydrogen 2.827 N/A GLU 253.A N PRO 250.A O no hydrogen 3.334 N/A SER 255.A OG PRO 256.A O no hydrogen 3.529 N/A PHE 260.A N GLU 240.A OE1 no hydrogen 2.837 N/A PHE 261.A N GLU 240.A OE2 no hydrogen 2.885 N/A LYS 266.A N GLY 262.A O no hydrogen 2.976 N/A LYS 266.A NZ ASP 13.A OD1 no hydrogen 2.804 N/A THR 267.A N GLU 263.A O no hydrogen 2.973 N/A THR 267.A OG1 GLU 263.A O no hydrogen 3.003 N/A ALA 268.A N ALA 264.A O no hydrogen 2.996 N/A VAL 269.A N LEU 265.A O no hydrogen 2.888 N/A LEU 270.A N LYS 266.A O no hydrogen 2.964 N/A ASN 271.A N THR 267.A O no hydrogen 2.969 N/A GLY 272.A N VAL 269.A O no hydrogen 3.169 N/A THR 273.A N ALA 268.A O no hydrogen 2.919 N/A THR 273.A N ASN 271.A OD1 no hydrogen 3.088 N/A THR 273.A OG1 ALA 268.A O no hydrogen 3.322 N/A THR 273.A OG1 ASN 271.A OD1 no hydrogen 2.783 N/A VAL 274.A N ALA 268.A O no hydrogen 3.070 N/A ALA 278.A N PRO 275.A O no hydrogen 3.079 N/A THR 280.A N GLU 276.A O no hydrogen 3.022 N/A THR 280.A OG1 GLU 276.A O no hydrogen 3.231 N/A ARG 281.A N ALA 277.A O no hydrogen 2.873 N/A SER 282.A N ALA 278.A O no hydrogen 3.109 N/A SER 282.A OG ASP 238.A OD1 no hydrogen 2.804 N/A SER 282.A OG ALA 278.A O no hydrogen 3.164 N/A ALA 283.A N VAL 279.A O no hydrogen 2.927 N/A GLU 284.A N THR 280.A O no hydrogen 2.865 N/A ARG 285.A N ARG 281.A O no hydrogen 3.017 N/A ARG 285.A NH1 ASP 238.A OD1 no hydrogen 2.835 N/A ILE 286.A N SER 282.A O no hydrogen 3.215 N/A VAL 287.A N ALA 283.A O no hydrogen 2.873 N/A GLY 288.A N GLU 284.A O no hydrogen 2.764 N/A GLN 289.A N ARG 285.A O no hydrogen 3.201 N/A MET 290.A N ILE 286.A O no hydrogen 3.010 N/A GLU 291.A N VAL 287.A O no hydrogen 2.854 N/A LYS 292.A N GLY 288.A O no hydrogen 3.011 N/A PHE 293.A N GLN 289.A O no hydrogen 3.034 N/A GLY 294.A N GLU 291.A O no hydrogen 2.969 N/A LEU 295.A N MET 290.A O no hydrogen 2.930 N/A ARG 303.A NH1 ARG 90.A O no hydrogen 2.933 N/A ARG 303.A NH1 GLN 94.A O no hydrogen 2.883 N/A ARG 303.A NH2 ASP 95.A OD2 no hydrogen 2.922 N/A ARG 306.A NH1 ASP 366.A OD1 no hydrogen 3.507 N/A ARG 306.A NH2 ASP 366.A OD1 no hydrogen 3.168 N/A LYS 308.A NZ ASP 366.A OD2 no hydrogen 3.483 N/A GLY 310.A N ASP 307.A OD1 no hydrogen 2.881 N/A ALA 311.A N ASP 307.A O no hydrogen 2.939 N/A GLN 312.A N LYS 308.A O no hydrogen 2.955 N/A ALA 313.A N ALA 309.A O no hydrogen 3.041 N/A VAL 314.A N GLY 310.A O no hydrogen 3.001 N/A SER 315.A N ALA 311.A O no hydrogen 2.876 N/A SER 315.A OG.A ALA 62.A O no hydrogen 3.354 N/A SER 315.A OG.B ALA 311.A O no hydrogen 2.883 N/A ARG 316.A N GLN 312.A O no hydrogen 2.872 N/A ARG 316.A NE GLU 320.A OE2 no hydrogen 2.922 N/A LYS 317.A N ALA 313.A O no hydrogen 2.897 N/A VAL 318.A N VAL 314.A O no hydrogen 2.887 N/A ALA 319.A N SER 315.A O no hydrogen 3.130 N/A GLU 320.A N ARG 316.A O no hydrogen 2.923 N/A ASN 321.A N LYS 317.A O no hydrogen 2.993 N/A ASN 321.A N VAL 318.A O no hydrogen 3.110 N/A ASN 321.A ND2 LYS 317.A O no hydrogen 2.863 N/A GLY 322.A N VAL 318.A O no hydrogen 2.856 N/A ALA 323.A N ALA 319.A O no hydrogen 3.164 N/A VAL 324.A N ASP 578.A O no hydrogen 2.880 N/A LEU 326.A N VAL 576.A O no hydrogen 2.864 N/A ARG 327.A N VAL 576.A O no hydrogen 3.321 N/A ARG 327.A NE THR 573.A O no hydrogen 2.995 N/A ARG 327.A NH2 THR 573.A O no hydrogen 3.050 N/A ASN 328.A ND2 LEU 333.A O no hydrogen 2.942 N/A GLU 329.A N ARG 574.A O no hydrogen 2.796 N/A ALA 332.A N GLU 329.A O no hydrogen 3.086 N/A LEU 333.A N ASN 328.A OD1 no hydrogen 2.903 N/A LEU 335.A N LEU 594.A O no hydrogen 2.791 N/A GLY 340.A N GLY 337.A O no hydrogen 3.070 N/A LYS 341.A N ASP 338.A O no hydrogen 3.031 N/A ILE 343.A N THR 384.A O no hydrogen 2.978 N/A ALA 344.A N THR 517.A O no hydrogen 2.840 N/A VAL 345.A N THR 386.A O no hydrogen 2.883 N/A ILE 346.A N VAL 519.A O no hydrogen 2.930 N/A GLY 347.A N GLU 388.A O no hydrogen 3.167 N/A ALA 350.A N GLY 347.A O no hydrogen 3.060 N/A VAL 351.A N PRO 348.A O no hydrogen 3.128 N/A ASP 352.A N PRO 348.A O no hydrogen 2.930 N/A LYS 354.A NZ THR 356.A O no hydrogen 3.226 N/A THR 356.A OG1 GLY 357.A O no hydrogen 3.084 N/A LEU 358.A N GLY 526.A O no hydrogen 3.418 N/A GLY 359.A N VAL 459.A O no hydrogen 2.858 N/A SER 360.A N GLU 528.A OE1 no hydrogen 2.937 N/A SER 360.A OG GLU 528.A OE1 no hydrogen 2.647 N/A HIS 362.A N GLY 359.A O no hydrogen 2.926 N/A HIS 362.A ND1 GLY 357.A O no hydrogen 2.935 N/A VAL 363.A N THR 356.A OG1 no hydrogen 3.420 N/A LEU 372.A N ALA 350.A O no hydrogen 2.895 N/A ASP 373.A N ALA 370.A O no hydrogen 2.915 N/A THR 374.A N ALA 370.A O no hydrogen 3.103 N/A THR 374.A OG1 PRO 371.A O no hydrogen 3.173 N/A THR 374.A OG1 ALA 587.A O no hydrogen 2.816 N/A ILE 375.A N PRO 371.A O no hydrogen 2.912 N/A LYS 376.A N LEU 372.A O no hydrogen 2.929 N/A ALA 377.A N ASP 373.A O no hydrogen 2.963 N/A ARG 378.A N THR 374.A O no hydrogen 3.008 N/A ARG 378.A NE ASP 597.A OD1 no hydrogen 3.344 N/A ARG 378.A NE ASP 597.A OD2 no hydrogen 2.793 N/A ARG 378.A NH1 ARG 378.A O no hydrogen 2.975 N/A ARG 378.A NH2 ASP 597.A OD1 no hydrogen 2.937 N/A ALA 379.A N ILE 375.A O no hydrogen 2.817 N/A GLY 380.A N LYS 376.A O no hydrogen 3.438 N/A GLY 380.A N ALA 377.A O no hydrogen 3.269 N/A ALA 383.A N GLY 380.A O no hydrogen 2.946 N/A THR 384.A N LYS 341.A O no hydrogen 2.880 N/A THR 386.A N ILE 343.A O no hydrogen 2.894 N/A TYR 387.A OH GLY 347.A O no hydrogen 2.896 N/A GLU 388.A N VAL 345.A O no hydrogen 3.020 N/A GLU 391.A N THR 389.A O no hydrogen 2.785 N/A THR 396.A N TRP 495.A O no hydrogen 3.161 N/A GLN 397.A NE2 GLU 492.A OE1 no hydrogen 3.027 N/A ILE 398.A N LEU 493.A O no hydrogen 3.116 N/A ASN 402.A N PRO 399.A O no hydrogen 2.901 N/A ASN 402.A ND2 THR 427.A O no hydrogen 2.865 N/A LEU 403.A N ALA 400.A O no hydrogen 3.140 N/A SER 404.A N THR 425.A O no hydrogen 3.020 N/A GLN 409.A NE2 LEU 493.A O no hydrogen 2.956 N/A GLY 410.A N LEU 491.A O no hydrogen 2.868 N/A GLN 412.A N LEU 489.A O no hydrogen 2.728 N/A GLN 412.A NE2 ASN 408.A O no hydrogen 2.873 N/A GLN 412.A NE2 GLY 410.A O no hydrogen 3.029 N/A LEU 413.A N LEU 489.A O no hydrogen 3.208 N/A GLY 416.A N MET 484.A O no hydrogen 2.987 N/A LYS 417.A N GLU 414.A O no hydrogen 3.050 N/A GLY 419.A N GLY 481.A O no hydrogen 3.285 N/A LEU 421.A N ILE 479.A O no hydrogen 2.853 N/A TYR 422.A N ILE 479.A O no hydrogen 3.329 N/A TYR 422.A OH PRO 405.A O no hydrogen 2.704 N/A GLY 424.A N LEU 477.A O no hydrogen 2.931 N/A THR 425.A N SER 404.A O no hydrogen 2.934 N/A LEU 426.A N HIS 475.A O no hydrogen 2.800 N/A THR 427.A N ASN 402.A O no hydrogen 2.791 N/A VAL 428.A N GLY 473.A O no hydrogen 2.853 N/A GLY 432.A N LEU 470.A O no hydrogen 2.882 N/A TYR 434.A N LEU 468.A O no hydrogen 2.927 N/A TYR 434.A OH ALA 430.A O no hydrogen 2.635 N/A ARG 435.A N VAL 496.A O no hydrogen 3.059 N/A ARG 435.A NE GLU 391.A OE2 no hydrogen 3.162 N/A ARG 435.A NH1 SER 465.A OG.B no hydrogen 3.037 N/A ARG 435.A NH2 GLU 391.A OE2 no hydrogen 2.691 N/A ARG 435.A NH2 TYR 523.A OH no hydrogen 2.908 N/A ILE 436.A N PRO 466.A O no hydrogen 3.140 N/A ALA 437.A N GLY 494.A O no hydrogen 2.844 N/A VAL 438.A N SER 464.A O no hydrogen 2.718 N/A ARG 439.A N GLU 492.A O no hydrogen 2.981 N/A ARG 439.A NH1 GLU 492.A OE1 no hydrogen 3.063 N/A THR 441.A N SER 490.A O no hydrogen 2.902 N/A TYR 444.A N PHE 482.A O no hydrogen 3.075 N/A ALA 445.A N ALA 456.A O no hydrogen 2.970 N/A THR 446.A N SER 480.A O no hydrogen 2.810 N/A THR 446.A OG1 GLU 455.A OE2 no hydrogen 2.707 N/A VAL 447.A N ILE 454.A O no hydrogen 2.858 N/A GLN 448.A N THR 478.A O no hydrogen 2.829 N/A GLN 448.A NE2 GLY 450.A O no hydrogen 2.884 N/A LEU 449.A N HIS 452.A O no hydrogen 2.944 N/A GLY 450.A N LYS 476.A O no hydrogen 2.859 N/A HIS 452.A N LEU 449.A O no hydrogen 2.882 N/A THR 453.A OG1 GLN 448.A OE1 no hydrogen 2.634 N/A ILE 454.A N VAL 447.A O no hydrogen 2.732 N/A ALA 456.A N ALA 445.A O no hydrogen 2.942 N/A VAL 459.A N TYR 444.A OH no hydrogen 3.104 N/A TYR 460.A N GLY 457.A O no hydrogen 2.877 N/A GLY 461.A N GLN 458.A O no hydrogen 3.057 N/A SER 464.A N VAL 438.A O no hydrogen 2.933 N/A SER 464.A OG GLU 455.A O no hydrogen 2.649 N/A SER 465.A OG.A THR 393.A O no hydrogen 2.803 N/A SER 465.A OG.B THR 393.A O no hydrogen 2.669 N/A LEU 468.A N TYR 434.A O no hydrogen 2.795 N/A LEU 470.A N GLY 432.A O no hydrogen 2.815 N/A LYS 472.A N ASP 431.A OD2 no hydrogen 2.757 N/A LYS 472.A NZ PRO 429.A O no hydrogen 3.247 N/A GLY 473.A N VAL 428.A O no hydrogen 2.922 N/A HIS 475.A NE2 THR 471.A O no hydrogen 2.749 N/A LEU 477.A N GLY 424.A O no hydrogen 2.976 N/A THR 478.A N GLN 448.A O no hydrogen 2.855 N/A ILE 479.A N TYR 422.A O no hydrogen 2.978 N/A SER 480.A N THR 446.A O no hydrogen 3.134 N/A GLY 481.A N GLY 419.A O no hydrogen 3.182 N/A PHE 482.A N TYR 444.A O no hydrogen 2.915 N/A ALA 483.A N LYS 417.A O no hydrogen 2.847 N/A MET 484.A N GLY 442.A O no hydrogen 2.880 N/A SER 485.A N ASP 248.A OD1 no hydrogen 2.826 N/A THR 487.A OG1 GLY 442.A O no hydrogen 3.020 N/A LEU 489.A N LEU 413.A O no hydrogen 2.852 N/A SER 490.A N THR 441.A O no hydrogen 2.966 N/A LEU 491.A N GLY 410.A O no hydrogen 2.712 N/A GLU 492.A N ARG 439.A O no hydrogen 2.976 N/A LEU 493.A N GLN 409.A OE1 no hydrogen 2.863 N/A GLY 494.A N ALA 437.A O no hydrogen 2.844 N/A TRP 495.A N THR 396.A O no hydrogen 2.914 N/A VAL 496.A N ARG 435.A O no hydrogen 2.959 N/A ALA 500.A N THR 497.A OG1 no hydrogen 3.074 N/A ALA 501.A N THR 497.A O no hydrogen 3.011 N/A ASP 502.A N PRO 498.A O no hydrogen 2.952 N/A ALA 503.A N ALA 499.A O no hydrogen 3.004 N/A THR 504.A N ALA 500.A O no hydrogen 3.081 N/A THR 504.A OG1 ALA 500.A O no hydrogen 3.101 N/A ILE 505.A N ALA 501.A O no hydrogen 2.893 N/A ALA 506.A N ASP 502.A O no hydrogen 2.882 N/A GLU 507.A N ALA 503.A O no hydrogen 3.182 N/A ALA 508.A N THR 504.A O no hydrogen 3.133 N/A VAL 509.A N ILE 505.A O no hydrogen 2.858 N/A LYS 510.A N ALA 506.A O no hydrogen 3.015 N/A LYS 510.A NZ LYS 510.A O no hydrogen 3.364 N/A SER 511.A N GLU 507.A O no hydrogen 3.233 N/A SER 511.A OG ALA 508.A O no hydrogen 2.776 N/A ALA 512.A N ALA 508.A O no hydrogen 3.005 N/A ARG 513.A N VAL 509.A O no hydrogen 3.055 N/A ARG 513.A N LYS 510.A O no hydrogen 3.208 N/A LYS 514.A N LYS 510.A O no hydrogen 3.378 N/A LYS 514.A N SER 511.A O no hydrogen 3.253 N/A ALA 515.A N ALA 512.A O no hydrogen 3.462 N/A ARG 516.A N SER 342.A OG no hydrogen 2.972 N/A THR 517.A N SER 342.A O no hydrogen 3.051 N/A THR 517.A OG1 ALA 339.A O no hydrogen 2.698 N/A ALA 518.A N ASN 554.A O no hydrogen 3.039 N/A VAL 519.A N ALA 344.A O no hydrogen 2.859 N/A VAL 520.A N ILE 556.A O no hydrogen 2.886 N/A PHE 521.A N ILE 346.A O no hydrogen 2.792 N/A ALA 522.A N VAL 558.A O no hydrogen 2.988 N/A TYR 523.A N GLN 541.A OE1 no hydrogen 2.976 N/A ASP 524.A N ASN 560.A O no hydrogen 3.269 N/A THR 527.A OG1 GLU 528.A O no hydrogen 2.960 N/A GLU 528.A N LEU 358.A O no hydrogen 3.141 N/A GLY 529.A N GLU 153.A OE1 no hydrogen 2.732 N/A ARG 532.A N HIS 109.A O no hydrogen 2.900 N/A ARG 532.A NH1 SER 564.A O no hydrogen 2.855 N/A ARG 532.A NH2 PRO 108.A O no hydrogen 2.808 N/A ARG 532.A NH2 SER 564.A O no hydrogen 2.799 N/A LEU 535.A N GLU 612.A OE1 no hydrogen 2.794 N/A SER 536.A N ASN 534.A OD1 no hydrogen 2.945 N/A THR 540.A N GLU 391.A OE2 no hydrogen 2.822 N/A THR 540.A OG1 GLU 391.A OE1 no hydrogen 2.570 N/A THR 540.A OG1 GLU 391.A OE2 no hydrogen 3.228 N/A GLN 541.A NE2 TYR 523.A O no hydrogen 2.910 N/A GLN 541.A NE2 PRO 538.A O no hydrogen 2.934 N/A LEU 544.A N THR 540.A O no hydrogen 3.056 N/A ILE 545.A N GLN 541.A O no hydrogen 2.952 N/A SER 546.A N ASP 542.A O no hydrogen 2.955 N/A ALA 547.A N LYS 543.A O no hydrogen 2.975 N/A VAL 548.A N LEU 544.A O no hydrogen 2.909 N/A ALA 549.A N ILE 545.A O no hydrogen 2.846 N/A ASP 550.A N SER 546.A O no hydrogen 2.989 N/A ALA 551.A N ALA 547.A O no hydrogen 3.153 N/A ALA 551.A N VAL 548.A O no hydrogen 3.117 N/A ASN 552.A N VAL 548.A O no hydrogen 2.917 N/A ASN 552.A ND2 ALA 512.A O no hydrogen 2.903 N/A ASN 552.A ND2 ARG 516.A O no hydrogen 3.311 N/A ASN 554.A N ASN 552.A OD1 no hydrogen 2.632 N/A ASN 554.A ND2 ARG 516.A O no hydrogen 2.987 N/A THR 555.A OG1 ASN 552.A O no hydrogen 2.864 N/A ILE 556.A N ALA 518.A O no hydrogen 2.751 N/A VAL 557.A N ALA 575.A O no hydrogen 2.904 N/A VAL 558.A N VAL 520.A O no hydrogen 2.849 N/A LEU 559.A N LEU 577.A O no hydrogen 2.810 N/A ASN 560.A N ALA 522.A O no hydrogen 2.740 N/A ASN 560.A ND2 THR 349.A OG1 no hydrogen 2.783 N/A GLY 562.A N ASP 524.A OD2 no hydrogen 2.932 N/A LEU 566.A N LEU 535.A O no hydrogen 2.917 N/A TRP 569.A NE1 ASP 542.A OD1 no hydrogen 2.890 N/A LEU 570.A N MET 567.A O no hydrogen 2.949 N/A LYS 572.A N TRP 569.A O no hydrogen 2.936 N/A LYS 572.A NZ ASP 550.A OD1 no hydrogen 2.992 N/A THR 573.A N LEU 570.A O no hydrogen 3.031 N/A THR 573.A OG1 LEU 570.A O no hydrogen 2.773 N/A ARG 574.A N THR 555.A O no hydrogen 2.911 N/A ARG 574.A NH1 GLU 329.A O no hydrogen 2.971 N/A ARG 574.A NH2 ASN 554.A OD1 no hydrogen 2.896 N/A VAL 576.A N ARG 327.A O no hydrogen 2.975 N/A LEU 577.A N VAL 557.A O no hydrogen 2.869 N/A ASP 578.A N VAL 324.A O no hydrogen 2.801 N/A MET 579.A N LEU 559.A O no hydrogen 2.857 N/A TRP 580.A N ASP 578.A OD1 no hydrogen 2.944 N/A TRP 580.A NE1 GLY 322.A O no hydrogen 2.947 N/A TYR 581.A OH ASP 524.A OD2 no hydrogen 2.593 N/A GLY 583.A N VAL 355.A O no hydrogen 2.983 N/A GLN 584.A N ALA 62.A O no hydrogen 2.824 N/A GLN 584.A NE2 GLN 312.A OE1 no hydrogen 2.891 N/A GLY 586.A N GLY 583.A O no hydrogen 3.003 N/A GLU 588.A N GLU 588.A OE1 no hydrogen 2.694 N/A ALA 589.A N ALA 585.A O no hydrogen 3.066 N/A THR 590.A N GLY 586.A O no hydrogen 2.864 N/A THR 590.A OG1 GLY 586.A O no hydrogen 2.737 N/A ALA 591.A N ALA 587.A O no hydrogen 3.047 N/A ALA 592.A N GLU 588.A O no hydrogen 3.074 N/A LEU 593.A N ALA 589.A O no hydrogen 2.893 N/A LEU 594.A N THR 590.A O no hydrogen 2.888 N/A TYR 595.A N ALA 591.A O no hydrogen 3.047 N/A TYR 595.A OH GLY 340.A O no hydrogen 2.757 N/A GLY 596.A N LEU 593.A O no hydrogen 3.089 N/A VAL 598.A N ALA 592.A O no hydrogen 3.225 N/A ASN 599.A ND2 ALA 692.A O no hydrogen 2.910 N/A GLY 602.A N ALA 323.A O no hydrogen 3.018 N/A LYS 603.A N SER 71.A O no hydrogen 2.994 N/A LYS 603.A NZ GLY 658.A O no hydrogen 2.855 N/A LYS 603.A NZ GLU 695.A OE2 no hydrogen 2.813 N/A LYS 603.A NZ SER 764.A O no hydrogen 3.094 N/A LEU 604.A N HIS 657.A O no hydrogen 2.804 N/A THR 605.A OG1 PHE 117.A O no hydrogen 2.664 N/A GLN 606.A NE2 SER 563.A OG no hydrogen 2.715 N/A SER 607.A N GLU 119.A OE1 no hydrogen 2.801 N/A SER 607.A OG GLU 119.A OE1 no hydrogen 3.570 N/A SER 607.A OG GLU 119.A OE2 no hydrogen 2.687 N/A PHE 608.A N PHE 653.A O no hydrogen 2.963 N/A GLN 614.A N ALA 611.A O no hydrogen 3.162 N/A VAL 617.A N HIS 615.A ND1 no hydrogen 3.365 N/A ALA 618.A N HIS 615.A O no hydrogen 3.254 N/A THR 622.A N ASP 620.A OD2 no hydrogen 2.898 N/A THR 622.A OG1 ASP 620.A OD1 no hydrogen 3.386 N/A THR 622.A OG1 ASP 620.A OD2 no hydrogen 2.644 N/A SER 623.A N ASP 620.A O no hydrogen 2.836 N/A TYR 624.A N ASP 620.A O no hydrogen 3.015 N/A TYR 624.A OH ASP 531.A OD2 no hydrogen 2.584 N/A GLY 626.A N PRO 621.A O no hydrogen 2.765 N/A VAL 627.A N GLN 630.A O no hydrogen 2.904 N/A GLN 630.A N VAL 627.A O no hydrogen 2.934 N/A GLN 630.A NE2.A ASP 628.A O no hydrogen 3.131 N/A GLN 631.A N ASN 160.A O no hydrogen 2.898 N/A GLN 631.A NE2 GLN 152.A OE1 no hydrogen 2.845 N/A GLN 631.A NE2 SER 623.A O no hydrogen 3.063 N/A THR 632.A N THR 622.A O no hydrogen 2.794 N/A TYR 633.A N ASN 162.A O no hydrogen 2.946 N/A TYR 633.A OH ASN 151.A OD1 no hydrogen 2.798 N/A ARG 634.A NE THR 622.A OG1 no hydrogen 2.955 N/A ARG 634.A NH2 THR 622.A OG1 no hydrogen 3.135 N/A GLU 635.A N GLU 635.A OE1 no hydrogen 2.764 N/A GLY 636.A N TYR 633.A O no hydrogen 3.024 N/A HIS 638.A N GLU 635.A O no hydrogen 2.986 N/A VAL 639.A N ILE 637.A O no hydrogen 2.923 N/A TYR 641.A N GLU 119.A OE2 no hydrogen 2.836 N/A TYR 641.A OH ASP 120.A OD1 no hydrogen 2.724 N/A ARG 642.A N VAL 639.A O no hydrogen 3.119 N/A ARG 642.A NH1 ASP 120.A OD1 no hydrogen 2.839 N/A ARG 642.A NH2 ASP 120.A OD1 no hydrogen 3.486 N/A TRP 643.A N GLY 640.A O no hydrogen 2.861 N/A PHE 644.A N GLY 640.A O no hydrogen 3.251 N/A ASP 645.A N TYR 641.A O no hydrogen 2.880 N/A LYS 646.A N ARG 642.A O no hydrogen 3.023 N/A GLU 647.A N TRP 643.A O no hydrogen 2.917 N/A ASN 648.A N ASP 645.A O no hydrogen 3.390 N/A VAL 649.A N PHE 644.A O no hydrogen 3.020 N/A PHE 653.A N PHE 608.A O no hydrogen 3.467 N/A GLY 656.A N LEU 604.A O no hydrogen 2.795 N/A HIS 657.A N PRO 654.A O no hydrogen 3.196 N/A HIS 657.A NE2 LEU 326.A O no hydrogen 2.881 N/A LEU 659.A N LEU 325.A O no hydrogen 2.887 N/A SER 660.A OG ASN 599.A OD1 no hydrogen 3.221 N/A SER 660.A OG THR 662.A O no hydrogen 3.449 N/A TYR 661.A N ASN 599.A OD1 no hydrogen 2.819 N/A TYR 661.A OH LEU 593.A O no hydrogen 2.689 N/A THR 662.A N SER 660.A OG no hydrogen 3.013 N/A THR 662.A OG1 ASN 687.A OD1 no hydrogen 2.709 N/A THR 662.A OG1 ARG 691.A O no hydrogen 3.206 N/A SER 663.A OG SER 688.A OG no hydrogen 2.764 N/A THR 665.A N ARG 686.A O no hydrogen 2.863 N/A SER 667.A N THR 684.A O no hydrogen 2.821 N/A SER 667.A OG ALA 668.A O no hydrogen 2.891 N/A THR 670.A N THR 682.A O no hydrogen 2.924 N/A VAL 672.A N LYS 680.A O no hydrogen 3.015 N/A ARG 673.A NH2 TRP 778.A OXT no hydrogen 3.026 N/A THR 674.A N GLY 678.A O no hydrogen 2.868 N/A THR 674.A OG1 THR 676.A OG1 no hydrogen 3.024 N/A THR 676.A N THR 674.A OG1 no hydrogen 3.366 N/A THR 676.A OG1 THR 674.A OG1 no hydrogen 3.024 N/A GLY 677.A N THR 674.A O no hydrogen 2.949 N/A GLY 678.A N THR 676.A OG1 no hydrogen 3.415 N/A LEU 679.A N VAL 736.A O no hydrogen 2.955 N/A LYS 680.A N VAL 672.A O no hydrogen 2.841 N/A VAL 681.A N VAL 734.A O no hydrogen 2.905 N/A THR 682.A N THR 670.A O no hydrogen 2.820 N/A VAL 683.A N VAL 732.A O no hydrogen 2.952 N/A THR 684.A N SER 667.A OG no hydrogen 2.872 N/A THR 684.A OG1 THR 731.A OG1 no hydrogen 2.834 N/A VAL 685.A N LYS 730.A O no hydrogen 2.891 N/A ARG 686.A N THR 665.A O no hydrogen 2.916 N/A ARG 686.A NH1 GLY 727.A O no hydrogen 2.913 N/A ASN 687.A N GLU 728.A O no hydrogen 2.831 N/A ASN 687.A ND2 ARG 691.A O no hydrogen 2.805 N/A ASN 687.A ND2 LEU 724.A O no hydrogen 3.081 N/A SER 688.A N SER 663.A O no hydrogen 2.845 N/A SER 688.A OG SER 663.A OG no hydrogen 2.764 N/A GLY 689.A N ASN 687.A OD1 no hydrogen 3.036 N/A GLY 693.A N LEU 724.A O no hydrogen 2.939 N/A GLN 694.A NE2 ASN 321.A OD1 no hydrogen 2.933 N/A GLU 695.A N VAL 722.A O no hydrogen 3.007 N/A VAL 696.A N GLU 695.A OE2 no hydrogen 2.866 N/A VAL 697.A N THR 720.A O no hydrogen 2.944 N/A GLN 698.A N GLY 763.A O no hydrogen 2.931 N/A GLN 698.A NE2 GLY 656.A O no hydrogen 3.117 N/A GLN 698.A NE2 VAL 696.A O no hydrogen 3.613 N/A ALA 699.A N GLY 718.A O no hydrogen 2.911 N/A TYR 700.A N GLN 761.A O no hydrogen 2.825 N/A TYR 700.A OH GLN 698.A OE1 no hydrogen 2.727 N/A LEU 701.A N LYS 715.A O no hydrogen 2.813 N/A GLY 702.A N LEU 759.A O no hydrogen 2.709 N/A SER 704.A N GLN 711.A OE1 no hydrogen 2.849 N/A SER 704.A OG THR 755.A O no hydrogen 2.564 N/A ASN 706.A N SER 704.A OG no hydrogen 3.000 N/A ASN 706.A ND2 THR 755.A OG1 no hydrogen 3.027 N/A GLN 711.A NE2 SER 704.A O no hydrogen 3.003 N/A LYS 714.A NZ ASP 645.A OD2 no hydrogen 2.744 N/A LYS 715.A N LEU 701.A O no hydrogen 2.911 N/A LYS 715.A NZ GLN 740.A O no hydrogen 2.948 N/A LEU 716.A N TYR 641.A OH no hydrogen 2.963 N/A VAL 717.A N ALA 699.A O no hydrogen 2.826 N/A THR 720.A N VAL 697.A O no hydrogen 2.970 N/A THR 720.A OG1 THR 733.A O no hydrogen 2.719 N/A LYS 721.A NZ THR 72.A O no hydrogen 2.938 N/A LYS 721.A NZ SER 601.A OG no hydrogen 2.918 N/A VAL 722.A N GLU 695.A O no hydrogen 2.848 N/A LEU 724.A N GLY 693.A O no hydrogen 2.935 N/A ALA 725.A N GLU 728.A OE1 no hydrogen 2.850 N/A GLY 727.A N ASN 687.A O no hydrogen 2.889 N/A GLU 728.A N ALA 725.A O no hydrogen 2.892 N/A LYS 730.A N VAL 685.A O no hydrogen 2.979 N/A LYS 730.A NZ SER 723.A O no hydrogen 2.810 N/A THR 731.A OG1 THR 684.A OG1 no hydrogen 2.834 N/A VAL 732.A N VAL 683.A O no hydrogen 2.745 N/A VAL 734.A N VAL 681.A O no hydrogen 2.719 N/A VAL 736.A N LEU 679.A O no hydrogen 2.828 N/A ARG 738.A NH1 GLY 677.A O no hydrogen 2.967 N/A ARG 738.A NH1 TRP 778.A OXT no hydrogen 2.859 N/A ARG 738.A NH2 TRP 778.A O no hydrogen 3.547 N/A ARG 738.A NH2 TRP 778.A OXT no hydrogen 3.021 N/A ARG 739.A NH1 GLU 177.A OE2 no hydrogen 3.019 N/A GLN 740.A N ASP 737.A O no hydrogen 2.915 N/A LEU 741.A N ARG 738.A O no hydrogen 2.914 N/A GLN 742.A N ARG 739.A O no hydrogen 3.037 N/A GLN 742.A NE2 THR 753.A OG1 no hydrogen 3.257 N/A PHE 743.A N LYS 752.A O no hydrogen 2.832 N/A TRP 744.A N GLU 170.A OE2 no hydrogen 2.805 N/A ASP 745.A N ASN 750.A O no hydrogen 2.875 N/A THR 748.A OG1 ASP 745.A OD1 no hydrogen 3.370 N/A ASN 750.A N ASP 745.A O no hydrogen 3.364 N/A TRP 751.A N ASN 750.A OD1 no hydrogen 2.817 N/A LYS 752.A N PHE 743.A O no hydrogen 2.854 N/A GLY 754.A N LEU 741.A O no hydrogen 2.879 N/A GLY 756.A N VAL 777.A O no hydrogen 2.921 N/A ARG 758.A N VAL 775.A O no hydrogen 2.876 N/A ARG 758.A NE GLY 702.A O no hydrogen 2.855 N/A ARG 758.A NH1 LEU 741.A O no hydrogen 3.346 N/A ARG 758.A NH1 GLY 754.A O no hydrogen 2.884 N/A ARG 758.A NH2 GLY 702.A O no hydrogen 2.923 N/A LEU 760.A N ALA 773.A O no hydrogen 2.882 N/A GLN 761.A N TYR 700.A O no hydrogen 2.834 N/A THR 762.A N GLY 771.A O no hydrogen 2.976 N/A GLY 763.A N GLN 698.A O no hydrogen 3.037 N/A SER 764.A N ASP 768.A O no hydrogen 3.113 N/A SER 766.A N PHE 655.A O no hydrogen 3.037 N/A SER 766.A OG PHE 655.A O no hydrogen 2.593 N/A ALA 767.A N SER 765.A OG no hydrogen 2.922 N/A ASP 768.A N SER 765.A O no hydrogen 3.268 N/A ARG 770.A NH2 ASP 768.A OD2 no hydrogen 3.196 N/A GLY 771.A N THR 762.A O no hydrogen 3.120 N/A ALA 773.A N LEU 760.A O no hydrogen 2.869 N/A VAL 775.A N ARG 758.A O no hydrogen 2.894 N/A VAL 777.A N GLY 756.A O no hydrogen 2.996 N/A