Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 8dme_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LYS 1.A N GLU 342.A O no hydrogen 3.046 N/A LYS 1.A NZ GLU 342.A OE2 no hydrogen 2.590 N/A MET 3.A N GLU 2.A OE1 no hydrogen 3.152 N/A PHE 9.A N LYS 13.A O no hydrogen 2.883 N/A LEU 12.A N PHE 9.A O no hydrogen 3.031 N/A LYS 13.A N GLY 10.A O no hydrogen 3.042 N/A ASN 14.A N GLU 41.A O no hydrogen 2.819 N/A ASN 14.A ND2 GLU 41.A O no hydrogen 3.612 N/A LEU 15.A N LEU 12.A O no hydrogen 2.922 N/A LEU 17.A N ASN 14.A O no hydrogen 2.886 N/A LEU 18.A N LEU 15.A O no hydrogen 2.950 N/A ASN 19.A N PRO 16.A O no hydrogen 3.039 N/A THR 20.A N LEU 18.A O no hydrogen 2.943 N/A LYS 22.A N THR 20.A OG1 no hydrogen 3.106 N/A LYS 22.A NZ ASP 430.A OD1 no hydrogen 2.783 N/A VAL 24.A N GLU 433.A OE1 no hydrogen 2.773 N/A GLN 25.A N GLU 433.A OE2 no hydrogen 3.040 N/A GLN 25.A NE2 ILE 431.A O no hydrogen 3.060 N/A GLN 25.A NE2 GLU 433.A OE2 no hydrogen 2.683 N/A ALA 26.A N LYS 22.A O no hydrogen 3.120 N/A LEU 27.A N PRO 23.A O no hydrogen 2.901 N/A MET 28.A N VAL 24.A O no hydrogen 2.891 N/A LYS 29.A N GLN 25.A O no hydrogen 3.124 N/A ILE 30.A N ALA 26.A O no hydrogen 3.016 N/A ALA 31.A N LEU 27.A O no hydrogen 2.830 N/A ASP 32.A N MET 28.A O no hydrogen 3.018 N/A GLU 33.A N LYS 29.A O no hydrogen 3.127 N/A LEU 34.A N ILE 30.A O no hydrogen 2.731 N/A GLY 35.A N ALA 31.A O no hydrogen 2.707 N/A PHE 38.A N TYR 49.A O no hydrogen 3.074 N/A LYS 39.A N PRO 4.A O no hydrogen 2.915 N/A PHE 40.A N THR 47.A O no hydrogen 2.824 N/A ALA 42.A N ARG 45.A O no hydrogen 2.790 N/A ARG 45.A N ALA 42.A O no hydrogen 2.994 N/A THR 47.A N PHE 40.A O no hydrogen 2.928 N/A ARG 48.A N GLU 350.A O no hydrogen 3.259 N/A ARG 48.A NH1 GLU 350.A O no hydrogen 2.962 N/A TYR 49.A N PHE 38.A O no hydrogen 2.778 N/A LEU 50.A N MET 352.A O no hydrogen 2.771 N/A SER 51.A N GLU 36.A O no hydrogen 2.923 N/A SER 52.A OG GLU 36.A OE1 no hydrogen 2.652 N/A GLN 53.A N ASP 361.A OD2 no hydrogen 2.855 N/A GLN 53.A NE2 GLN 385.A O no hydrogen 2.916 N/A ARG 54.A NE GLU 36.A OE1 no hydrogen 3.148 N/A ARG 54.A NH1 GLU 36.A OE2 no hydrogen 2.513 N/A ARG 54.A NH1 GLU 342.A OE1 no hydrogen 3.138 N/A ARG 54.A NH2 GLY 340.A O no hydrogen 3.199 N/A LEU 55.A N SER 52.A O no hydrogen 3.203 N/A ILE 56.A N SER 52.A O no hydrogen 2.998 N/A LYS 57.A N GLN 53.A O no hydrogen 2.893 N/A GLU 58.A N LEU 55.A O no hydrogen 2.928 N/A ALA 59.A N LEU 55.A O no hydrogen 2.937 N/A CYS 60.A N ILE 56.A O no hydrogen 2.889 N/A CYS 60.A SG ILE 56.A O no hydrogen 3.305 N/A ASP 61.A N GLU 58.A O no hydrogen 2.944 N/A SER 63.A N ASP 61.A OD1 no hydrogen 3.008 N/A SER 63.A OG ASP 61.A OD1 no hydrogen 2.771 N/A ARG 64.A N ASP 61.A O no hydrogen 2.929 N/A ARG 64.A NE THR 337.A OG1 no hydrogen 3.415 N/A ARG 64.A NH1 GLU 58.A OE1 no hydrogen 2.988 N/A ARG 64.A NH2 GLU 58.A OE1 no hydrogen 3.287 N/A ARG 64.A NH2 THR 337.A OG1 no hydrogen 3.046 N/A ARG 64.A NH2 VAL 338.A O no hydrogen 2.862 N/A PHE 65.A N ASP 61.A O no hydrogen 2.992 N/A ASP 66.A N TYR 332.A O no hydrogen 3.119 N/A LYS 67.A N ASP 66.A OD1 no hydrogen 2.794 N/A LYS 67.A NZ PHE 85.A O.A no hydrogen 2.749 N/A LYS 67.A NZ PHE 85.A O.B no hydrogen 2.756 N/A ASN 68.A N SER 330.A O no hydrogen 3.065 N/A ASN 68.A ND2 SER 330.A OG no hydrogen 2.936 N/A ASN 68.A ND2 GLU 350.A OE1 no hydrogen 2.839 N/A LEU 73.A N SER 70.A OG no hydrogen 3.174 N/A LYS 74.A N SER 70.A O no hydrogen 2.892 N/A PHE 75.A N GLN 71.A O no hydrogen 3.108 N/A VAL 76.A N ALA 72.A O no hydrogen 3.069 N/A ARG 77.A N LEU 73.A O no hydrogen 2.890 N/A ARG 77.A N LYS 74.A O no hydrogen 3.338 N/A ARG 77.A NH1 THR 86.A O no hydrogen 2.707 N/A ARG 77.A NH1 GLU 91.A OE1 no hydrogen 2.902 N/A ARG 77.A NH2 GLU 91.A OE2 no hydrogen 3.180 N/A ASP 78.A N PHE 75.A O no hydrogen 3.042 N/A PHE 79.A N VAL 76.A O no hydrogen 2.969 N/A PHE 80.A N VAL 76.A O no hydrogen 2.858 N/A GLY 81.A N ARG 77.A O no hydrogen 2.844 N/A GLY 83.A N PHE 80.A O no hydrogen 3.132 N/A THR 86.A OG1 GLY 81.A O no hydrogen 2.619 N/A SER 87.A OG GLY 83.A O no hydrogen 2.971 N/A SER 87.A OG LEU 84.A O no hydrogen 3.555 N/A TRP 88.A N GLU 91.A OE1 no hydrogen 2.770 N/A THR 89.A OG1 ASP 66.A OD1 no hydrogen 2.659 N/A THR 89.A OG1 ASP 66.A OD2 no hydrogen 3.554 N/A GLU 91.A N TRP 88.A O no hydrogen 3.033 N/A LYS 92.A NZ GLU 245.A OE1 no hydrogen 3.118 N/A LYS 92.A NZ GLU 245.A OE2 no hydrogen 2.714 N/A TRP 94.A N GLU 91.A O no hydrogen 2.969 N/A LYS 95.A NZ GLU 242.A OE2 no hydrogen 2.922 N/A LYS 96.A N LYS 92.A O no hydrogen 3.373 N/A LYS 96.A NZ GLU 245.A OE1 no hydrogen 2.686 N/A LYS 96.A NZ PRO 246.A O no hydrogen 3.072 N/A ALA 97.A N ASN 93.A O no hydrogen 3.221 N/A HIS 98.A N TRP 94.A O no hydrogen 2.835 N/A ASN 99.A N LYS 95.A O no hydrogen 2.999 N/A ASN 99.A ND2 ASP 240.A OD1 no hydrogen 2.765 N/A ASN 99.A ND2 GLU 242.A OE2 no hydrogen 3.013 N/A ILE 100.A N LYS 96.A O no hydrogen 2.896 N/A LEU 101.A N ALA 97.A O no hydrogen 2.844 N/A LEU 102.A N HIS 98.A O no hydrogen 2.950 N/A SER 104.A N LEU 101.A O no hydrogen 2.940 N/A PHE 105.A N LEU 102.A O no hydrogen 2.960 N/A SER 106.A N PRO 103.A O no hydrogen 3.443 N/A SER 106.A OG PRO 103.A O no hydrogen 3.199 N/A ALA 109.A N SER 106.A OG no hydrogen 3.173 N/A MET 110.A N SER 106.A O no hydrogen 2.972 N/A LYS 111.A N GLN 107.A O no hydrogen 2.953 N/A GLY 112.A N GLN 108.A O no hydrogen 3.012 N/A TYR 113.A N ALA 109.A O no hydrogen 2.976 N/A TYR 113.A N MET 110.A O no hydrogen 3.057 N/A TYR 113.A OH SER 104.A O no hydrogen 2.725 N/A HIS 114.A N LYS 111.A O no hydrogen 3.348 N/A HIS 114.A ND1 HIS 406.A NE2 no hydrogen 2.971 N/A HIS 114.A NE2 PRO 301.A O no hydrogen 2.862 N/A MET 117.A N TYR 113.A O no hydrogen 3.063 N/A VAL 118.A N HIS 114.A O no hydrogen 2.887 N/A ASP 119.A N ALA 115.A O no hydrogen 3.122 N/A ILE 120.A N MET 116.A O no hydrogen 3.347 N/A ALA 121.A N MET 117.A O no hydrogen 2.998 N/A VAL 122.A N VAL 118.A O no hydrogen 2.861 N/A GLN 123.A N ASP 119.A O no hydrogen 3.227 N/A LEU 124.A N ILE 120.A O no hydrogen 3.144 N/A VAL 125.A N ALA 121.A O no hydrogen 2.994 N/A GLN 126.A N VAL 122.A O no hydrogen 2.898 N/A LYS 127.A N GLN 123.A O no hydrogen 3.093 N/A LYS 127.A NZ ASP 142.A OD1 no hydrogen 2.900 N/A TRP 128.A N LEU 124.A O no hydrogen 3.152 N/A TRP 128.A NE1 ASP 142.A OD2 no hydrogen 2.925 N/A GLU 129.A N VAL 125.A O no hydrogen 2.821 N/A ARG 130.A N GLN 126.A O no hydrogen 2.984 N/A ARG 130.A N LYS 127.A O no hydrogen 3.093 N/A LEU 131.A N TRP 128.A O no hydrogen 3.400 N/A ASN 132.A N GLU 135.A OE1 no hydrogen 3.058 N/A GLU 135.A N ASN 132.A O no hydrogen 2.995 N/A ILE 137.A N VAL 444.A O no hydrogen 3.048 N/A VAL 139.A N PHE 442.A O no hydrogen 3.127 N/A GLU 141.A N GLU 141.A OE1 no hydrogen 2.903 N/A ASP 142.A N GLU 138.A O no hydrogen 3.079 N/A MET 143.A N VAL 139.A O no hydrogen 2.856 N/A THR 144.A N PRO 140.A O no hydrogen 2.923 N/A THR 144.A OG1 PRO 140.A O no hydrogen 3.217 N/A THR 144.A OG1 SER 268.A OG no hydrogen 2.932 N/A ARG 145.A N GLU 141.A O no hydrogen 3.100 N/A ARG 145.A NE SER 162.A O no hydrogen 3.169 N/A ARG 145.A NE ARG 165.A O no hydrogen 3.475 N/A ARG 145.A NH1 ASP 142.A OD1 no hydrogen 2.899 N/A ARG 145.A NH2 ARG 165.A O no hydrogen 3.121 N/A LEU 146.A N ASP 142.A O no hydrogen 3.037 N/A THR 147.A N MET 143.A O no hydrogen 2.896 N/A THR 147.A OG1 MET 143.A O no hydrogen 3.091 N/A THR 147.A OG1 HIS 264.A O no hydrogen 3.130 N/A LEU 148.A N THR 144.A O no hydrogen 3.084 N/A ASP 149.A N ARG 145.A O no hydrogen 3.242 N/A THR 150.A N LEU 146.A O no hydrogen 2.984 N/A THR 150.A OG1 LEU 146.A O no hydrogen 2.775 N/A THR 150.A OG1 GLU 407.A OE2 no hydrogen 3.202 N/A ILE 151.A N THR 147.A O no hydrogen 3.097 N/A GLY 152.A N LEU 148.A O no hydrogen 2.927 N/A LEU 153.A N ASP 149.A O no hydrogen 2.866 N/A CYS 154.A N THR 150.A O no hydrogen 2.826 N/A CYS 154.A SG TYR 113.A O no hydrogen 3.829 N/A CYS 154.A SG THR 150.A O no hydrogen 3.359 N/A GLY 155.A N ILE 151.A O no hydrogen 2.805 N/A PHE 156.A N GLY 152.A O no hydrogen 3.132 N/A ASN 157.A N LEU 153.A O no hydrogen 3.053 N/A TYR 158.A N GLY 152.A O no hydrogen 3.034 N/A ARG 159.A NH1 ASP 119.A OD1 no hydrogen 3.116 N/A ARG 159.A NH2 ASP 119.A OD2 no hydrogen 3.111 N/A SER 162.A N ASP 149.A OD2 no hydrogen 2.941 N/A SER 162.A OG ASP 149.A OD1 no hydrogen 2.603 N/A TYR 164.A N ASN 161.A O no hydrogen 3.141 N/A ARG 165.A N SER 162.A O no hydrogen 3.154 N/A ARG 165.A NE PHE 160.A O no hydrogen 3.059 N/A ARG 165.A NH2 PHE 160.A O no hydrogen 3.435 N/A PHE 171.A N HIS 169.A ND1 no hydrogen 2.971 N/A THR 173.A N HIS 169.A O no hydrogen 3.194 N/A SER 174.A N PRO 170.A O no hydrogen 3.120 N/A SER 174.A OG ASP 206.A OD1 no hydrogen 2.680 N/A MET 175.A N PHE 171.A O no hydrogen 2.900 N/A VAL 176.A N ILE 172.A O no hydrogen 2.886 N/A ARG 177.A N THR 173.A O no hydrogen 3.038 N/A ARG 177.A NH1 GLN 202.A OE1 no hydrogen 2.282 N/A ALA 178.A N SER 174.A O no hydrogen 2.908 N/A LEU 179.A N MET 175.A O no hydrogen 2.907 N/A ASP 180.A N.A VAL 176.A O no hydrogen 2.857 N/A ASP 180.A N.B VAL 176.A O no hydrogen 2.875 N/A GLU 181.A N ARG 177.A O no hydrogen 2.999 N/A ALA 182.A N ALA 178.A O no hydrogen 2.957 N/A MET 183.A N LEU 179.A O no hydrogen 2.901 N/A ASN 184.A N ASP 180.A O.A no hydrogen 2.760 N/A ASN 184.A N ASP 180.A O.B no hydrogen 2.798 N/A LYS 185.A N GLU 181.A O no hydrogen 2.801 N/A LEU 186.A N MET 183.A O no hydrogen 3.172 N/A GLN 187.A N ASN 184.A O no hydrogen 3.237 N/A ARG 188.A N LYS 185.A O no hydrogen 3.040 N/A ARG 188.A NE ASN 184.A OD1 no hydrogen 3.295 N/A ARG 188.A NH1 GLU 181.A OE2 no hydrogen 2.832 N/A ARG 188.A NH2 GLU 181.A OE1 no hydrogen 2.925 N/A ARG 188.A NH2 GLU 181.A OE2 no hydrogen 3.491 N/A ARG 188.A NH2 ASN 184.A OD1 no hydrogen 2.847 N/A ASP 193.A N ASN 190.A O no hydrogen 2.796 N/A ALA 195.A N ASP 193.A OD1 no hydrogen 2.763 N/A TYR 196.A N ASP 193.A O no hydrogen 3.112 N/A ASP 197.A N PRO 194.A O no hydrogen 3.079 N/A LYS 200.A N TYR 196.A O no hydrogen 3.054 N/A LYS 200.A NZ PRO 191.A O no hydrogen 2.866 N/A ARG 201.A N ASP 197.A O no hydrogen 3.169 N/A ARG 201.A NE GLU 198.A OE1 no hydrogen 2.822 N/A ARG 201.A NH1 GLU 205.A OE1 no hydrogen 2.750 N/A ARG 201.A NH2 GLU 198.A OE1 no hydrogen 3.495 N/A ARG 201.A NH2 GLU 198.A OE2 no hydrogen 2.774 N/A GLN 202.A N GLU 198.A O no hydrogen 2.878 N/A PHE 203.A N ASN 199.A O no hydrogen 2.905 N/A GLN 204.A N LYS 200.A O no hydrogen 2.960 N/A GLU 205.A N ARG 201.A O no hydrogen 3.091 N/A ASP 206.A N GLN 202.A O no hydrogen 2.809 N/A ILE 207.A N PHE 203.A O no hydrogen 2.842 N/A LYS 208.A N GLN 204.A O no hydrogen 2.844 N/A LYS 208.A NZ ASP 212.A OD1 no hydrogen 2.545 N/A LYS 208.A NZ ASP 212.A OD2 no hydrogen 3.028 N/A VAL 209.A N GLU 205.A O no hydrogen 2.974 N/A MET 210.A N ASP 206.A O no hydrogen 3.173 N/A ASN 211.A N ILE 207.A O no hydrogen 2.903 N/A ASN 211.A ND2 ILE 207.A O no hydrogen 3.226 N/A ASP 212.A N LYS 208.A O no hydrogen 2.795 N/A LEU 213.A N VAL 209.A O no hydrogen 3.282 N/A VAL 214.A N MET 210.A O no hydrogen 3.161 N/A ASP 215.A N ASN 211.A O no hydrogen 2.969 N/A LYS 216.A N ASP 212.A O no hydrogen 3.250 N/A ILE 217.A N LEU 213.A O no hydrogen 3.095 N/A ILE 218.A N VAL 214.A O no hydrogen 3.054 N/A ALA 219.A N ASP 215.A O no hydrogen 2.928 N/A ASP 220.A N LYS 216.A O no hydrogen 2.816 N/A ARG 221.A N ILE 217.A O no hydrogen 3.138 N/A ARG 221.A NH1 SER 228.A O no hydrogen 3.167 N/A ARG 221.A NH1 ASP 230.A OD1 no hydrogen 2.957 N/A ARG 221.A NH2 PHE 156.A O no hydrogen 3.127 N/A ARG 221.A NH2 ASP 230.A OD1 no hydrogen 3.536 N/A ARG 221.A NH2 ASP 230.A OD2 no hydrogen 2.885 N/A LYS 222.A N ILE 218.A O no hydrogen 3.096 N/A ALA 223.A N ASP 220.A O no hydrogen 2.994 N/A ASP 230.A N THR 233.A OG1 no hydrogen 2.923 N/A LEU 232.A N GLY 155.A O no hydrogen 3.111 N/A THR 233.A N ASP 230.A OD1 no hydrogen 3.026 N/A THR 233.A OG1 GLN 227.A O no hydrogen 2.772 N/A THR 233.A OG1 SER 228.A O no hydrogen 2.302 N/A THR 233.A OG1 ASP 230.A OD1 no hydrogen 3.080 N/A HIS 234.A N ASP 230.A O no hydrogen 3.165 N/A MET 235.A N LEU 231.A O no hydrogen 2.880 N/A LEU 236.A N LEU 232.A O no hydrogen 2.972 N/A ASN 237.A N THR 233.A O no hydrogen 2.917 N/A GLY 238.A N HIS 234.A O no hydrogen 2.835 N/A ASP 240.A N GLU 245.A O no hydrogen 2.954 N/A GLU 242.A N ASP 240.A OD1 no hydrogen 3.037 N/A THR 243.A N ASP 240.A OD2 no hydrogen 3.018 N/A THR 243.A OG1 ASP 240.A OD2 no hydrogen 2.779 N/A GLY 244.A N ASP 240.A O no hydrogen 2.787 N/A GLU 245.A N THR 243.A OG1 no hydrogen 3.190 N/A ASN 251.A N ASP 248.A OD1 no hydrogen 3.117 N/A ASN 251.A ND2 GLN 255.A OE1 no hydrogen 2.863 N/A ILE 252.A N ASP 248.A O no hydrogen 3.049 N/A ARG 253.A N ASP 249.A O no hydrogen 3.178 N/A ARG 253.A NH1 ASP 215.A OD1 no hydrogen 1.978 N/A TYR 254.A N GLU 250.A O no hydrogen 3.263 N/A GLN 255.A N ASN 251.A O no hydrogen 2.747 N/A ILE 256.A N ILE 252.A O no hydrogen 2.942 N/A ILE 257.A N ARG 253.A O no hydrogen 3.207 N/A THR 258.A N TYR 254.A O no hydrogen 2.970 N/A THR 258.A OG1 TYR 254.A O no hydrogen 2.823 N/A PHE 259.A N GLN 255.A O no hydrogen 2.854 N/A LEU 260.A N ILE 256.A O no hydrogen 2.872 N/A ILE 261.A N ILE 257.A O no hydrogen 3.132 N/A ALA 262.A N THR 258.A O no hydrogen 2.814 N/A GLY 263.A N PHE 259.A O no hydrogen 2.747 N/A HIS 264.A N ILE 261.A O no hydrogen 3.089 N/A HIS 264.A ND1 LEU 260.A O no hydrogen 2.758 N/A GLU 265.A N ILE 261.A O no hydrogen 2.986 N/A SER 268.A N HIS 264.A O no hydrogen 2.972 N/A SER 268.A OG PRO 140.A O no hydrogen 3.547 N/A SER 268.A OG THR 144.A OG1 no hydrogen 2.932 N/A GLY 269.A N GLU 265.A O no hydrogen 3.177 N/A LEU 270.A N THR 266.A O no hydrogen 2.988 N/A LEU 271.A N THR 267.A O no hydrogen 3.133 N/A SER 272.A N SER 268.A O no hydrogen 2.986 N/A SER 272.A OG SER 268.A O no hydrogen 2.754 N/A PHE 273.A N GLY 269.A O no hydrogen 2.931 N/A ALA 274.A N LEU 270.A O no hydrogen 2.765 N/A LEU 275.A N LEU 271.A O no hydrogen 2.927 N/A TYR 276.A N SER 272.A O no hydrogen 2.940 N/A PHE 277.A N PHE 273.A O no hydrogen 2.885 N/A LEU 278.A N ALA 274.A O no hydrogen 3.092 N/A VAL 279.A N LEU 275.A O no hydrogen 3.073 N/A LYS 280.A N TYR 276.A O no hydrogen 3.246 N/A LYS 280.A N PHE 277.A O no hydrogen 3.141 N/A LYS 280.A NZ ASP 423.A OD2 no hydrogen 2.692 N/A LYS 280.A NZ TYR 427.A O no hydrogen 2.746 N/A ASN 281.A N LEU 278.A O no hydrogen 2.976 N/A LEU 285.A N ASN 281.A O no hydrogen 2.945 N/A GLN 286.A N PRO 282.A O no hydrogen 2.944 N/A GLN 286.A NE2 GLU 290.A OE2 no hydrogen 2.819 N/A LYS 287.A N HIS 283.A O no hydrogen 3.028 N/A LYS 287.A NZ GLU 375.A OE2 no hydrogen 3.264 N/A ALA 288.A N VAL 284.A O no hydrogen 2.825 N/A ALA 289.A N LEU 285.A O no hydrogen 2.743 N/A GLU 290.A N GLN 286.A O no hydrogen 2.846 N/A GLU 291.A N LYS 287.A O no hydrogen 3.230 N/A ALA 292.A N ALA 288.A O no hydrogen 3.050 N/A ALA 293.A N ALA 289.A O no hydrogen 3.136 N/A ARG 294.A N GLU 290.A O no hydrogen 3.078 N/A VAL 295.A N GLU 291.A O no hydrogen 2.887 N/A LEU 296.A N ALA 292.A O no hydrogen 2.926 N/A SER 302.A N GLN 305.A OE1 no hydrogen 2.862 N/A GLN 305.A N SER 302.A OG no hydrogen 2.954 N/A GLN 305.A NE2 ASP 298.A OD2 no hydrogen 2.736 N/A VAL 306.A N SER 302.A O no hydrogen 2.974 N/A LYS 307.A N TYR 303.A O no hydrogen 3.201 N/A GLN 308.A N.A GLN 305.A O no hydrogen 2.863 N/A GLN 308.A N.B GLN 305.A O no hydrogen 2.938 N/A GLN 308.A NE2.A LYS 304.A O no hydrogen 3.420 N/A LEU 309.A N VAL 306.A O no hydrogen 3.075 N/A LYS 310.A N GLN 308.A O.A no hydrogen 2.968 N/A LYS 310.A N GLN 308.A O.B no hydrogen 3.009 N/A LYS 310.A NZ GLU 378.A O no hydrogen 3.279 N/A TYR 311.A N GLU 291.A OE2 no hydrogen 2.644 N/A TYR 311.A OH GLU 375.A OE2 no hydrogen 2.576 N/A VAL 312.A N GLU 291.A OE1 no hydrogen 2.969 N/A GLY 313.A N LEU 309.A O no hydrogen 3.040 N/A MET 314.A N LYS 310.A O no hydrogen 2.912 N/A VAL 315.A N TYR 311.A O no hydrogen 2.845 N/A LEU 316.A N VAL 312.A O no hydrogen 2.975 N/A ASN 317.A N GLY 313.A O no hydrogen 3.021 N/A GLU 318.A N MET 314.A O no hydrogen 2.933 N/A ALA 319.A N VAL 315.A O no hydrogen 3.016 N/A LEU 320.A N LEU 316.A O no hydrogen 2.939 N/A ARG 321.A N ASN 317.A O no hydrogen 2.812 N/A ARG 321.A NE GLU 318.A OE1 no hydrogen 2.740 N/A ARG 321.A NH1 HIS 359.A O no hydrogen 2.871 N/A ARG 321.A NH1 VAL 369.A O no hydrogen 2.987 N/A ARG 321.A NH2 GLU 318.A OE2 no hydrogen 3.059 N/A ARG 321.A NH2 VAL 369.A O no hydrogen 2.940 N/A LEU 322.A N GLU 318.A O no hydrogen 3.132 N/A TRP 323.A N ALA 319.A O no hydrogen 2.906 N/A THR 325.A OG1 THR 266.A O no hydrogen 2.937 N/A PHE 329.A N VAL 353.A O no hydrogen 3.411 N/A SER 330.A OG LEU 351.A O no hydrogen 3.087 N/A LEU 331.A N LEU 351.A O no hydrogen 2.891 N/A TYR 332.A N ASP 66.A O no hydrogen 2.867 N/A TYR 332.A OH ASP 66.A OD2 no hydrogen 2.764 N/A ALA 333.A N ASP 349.A O no hydrogen 2.947 N/A LYS 334.A N ARG 64.A O no hydrogen 2.822 N/A THR 337.A N LEU 345.A O no hydrogen 2.911 N/A LEU 339.A N TYR 343.A O no hydrogen 2.785 N/A GLY 340.A N GLU 58.A OE1 no hydrogen 3.204 N/A GLY 340.A N GLU 58.A OE2 no hydrogen 2.956 N/A GLU 342.A N LEU 339.A O no hydrogen 3.062 N/A TYR 343.A N LEU 339.A O no hydrogen 2.859 N/A LEU 345.A N THR 337.A O no hydrogen 2.686 N/A GLU 346.A N ASP 349.A OD2 no hydrogen 2.808 N/A LYS 347.A N ASP 336.A OD1 no hydrogen 2.829 N/A GLY 348.A N ALA 333.A O no hydrogen 2.860 N/A ASP 349.A N GLU 346.A O no hydrogen 2.954 N/A LEU 351.A N LEU 331.A O no hydrogen 2.759 N/A MET 352.A N ARG 48.A O no hydrogen 2.736 N/A VAL 353.A N PHE 329.A O no hydrogen 2.790 N/A LEU 354.A N LEU 50.A O no hydrogen 3.024 N/A ILE 355.A N PRO 327.A O no hydrogen 2.979 N/A GLN 357.A NE2 ASP 32.A OD1 no hydrogen 2.980 N/A LEU 358.A N LEU 354.A O no hydrogen 3.045 N/A HIS 359.A N ILE 355.A O no hydrogen 2.981 N/A HIS 359.A ND1 ARG 321.A O no hydrogen 2.921 N/A ARG 360.A N GLN 357.A O no hydrogen 3.014 N/A ARG 360.A NE GLU 370.A OE2 no hydrogen 2.955 N/A ARG 360.A NH1 LEU 322.A O no hydrogen 2.795 N/A ARG 360.A NH1 PRO 356.A O no hydrogen 2.888 N/A ARG 360.A NH2 LEU 322.A O no hydrogen 2.957 N/A ASP 361.A N LEU 358.A O no hydrogen 3.092 N/A LYS 362.A NZ ASP 367.A O no hydrogen 3.069 N/A THR 363.A N ASP 361.A OD1 no hydrogen 2.925 N/A THR 363.A OG1 ASP 361.A OD1 no hydrogen 2.628 N/A ILE 364.A N ASP 361.A O no hydrogen 2.997 N/A TRP 365.A N ASP 361.A O no hydrogen 3.010 N/A GLY 366.A N LYS 362.A O no hydrogen 2.909 N/A VAL 369.A N ASP 367.A O no hydrogen 2.954 N/A GLU 371.A N ASP 368.A O no hydrogen 3.087 N/A ARG 373.A N GLU 318.A OE2 no hydrogen 2.684 N/A ARG 373.A NE ASP 368.A OD2 no hydrogen 2.848 N/A ARG 373.A NH2 ASP 368.A OD2 no hydrogen 2.994 N/A GLU 375.A N GLU 375.A OE1 no hydrogen 2.781 N/A ARG 376.A N ARG 373.A O no hydrogen 2.965 N/A ARG 376.A NE GLU 318.A OE2 no hydrogen 3.023 N/A ARG 376.A NH1 ASP 368.A OD1 no hydrogen 3.019 N/A ARG 376.A NH2 ASP 368.A O no hydrogen 2.731 N/A ARG 376.A NH2 ASP 368.A OD1 no hydrogen 3.354 N/A ARG 376.A NH2 GLU 371.A O no hydrogen 3.214 N/A PHE 377.A N PRO 374.A O no hydrogen 2.861 N/A GLU 378.A N GLU 375.A O no hydrogen 3.109 N/A SER 381.A N ASN 379.A OD1 no hydrogen 3.352 N/A SER 381.A OG ASN 379.A OD1 no hydrogen 3.063 N/A ALA 382.A N ASN 379.A O no hydrogen 3.032 N/A ILE 383.A N PRO 380.A O no hydrogen 3.049 N/A LYS 389.A N HIS 359.A NE2 no hydrogen 3.024 N/A LYS 389.A NZ ASN 393.A OD1 no hydrogen 3.039 N/A GLY 392.A N LYS 389.A O no hydrogen 3.296 N/A ASN 393.A ND2 CYS 60.A O no hydrogen 3.109 N/A GLN 395.A N GLU 62.A OE2 no hydrogen 2.818 N/A ARG 396.A N ASN 393.A O no hydrogen 3.216 N/A ARG 396.A NH1 SER 87.A O no hydrogen 2.972 N/A ARG 396.A NH1 THR 89.A OG1 no hydrogen 2.923 N/A ARG 396.A NH2 LEU 84.A O no hydrogen 2.759 N/A ARG 396.A NH2 SER 87.A O no hydrogen 3.005 N/A ALA 397.A N GLY 394.A O no hydrogen 3.020 N/A CYS 398.A N PHE 391.A O no hydrogen 2.755 N/A ALA 404.A N GLY 400.A O no hydrogen 2.970 N/A LEU 405.A N GLN 401.A O no hydrogen 2.973 N/A HIS 406.A N GLN 402.A O no hydrogen 2.900 N/A HIS 406.A NE2 HIS 114.A ND1 no hydrogen 2.971 N/A GLU 407.A N PHE 403.A O no hydrogen 2.981 N/A ALA 408.A N ALA 404.A O no hydrogen 2.891 N/A THR 409.A N LEU 405.A O no hydrogen 2.917 N/A THR 409.A OG1 LEU 405.A O no hydrogen 2.499 N/A LEU 410.A N HIS 406.A O no hydrogen 2.938 N/A VAL 411.A N GLU 407.A O no hydrogen 2.887 N/A LEU 412.A N ALA 408.A O no hydrogen 2.785 N/A GLY 413.A N THR 409.A O no hydrogen 2.915 N/A MET 414.A N LEU 410.A O no hydrogen 3.053 N/A MET 415.A N VAL 411.A O no hydrogen 2.947 N/A LEU 416.A N LEU 412.A O no hydrogen 2.984 N/A LYS 417.A N GLY 413.A O no hydrogen 2.986 N/A LYS 417.A NZ LEU 296.A O no hydrogen 3.009 N/A HIS 418.A N MET 414.A O no hydrogen 3.036 N/A HIS 418.A N MET 415.A O no hydrogen 3.336 N/A PHE 419.A N MET 415.A O no hydrogen 2.986 N/A ASP 420.A N LYS 447.A O no hydrogen 2.858 N/A GLU 422.A N LYS 445.A O no hydrogen 2.887 N/A HIS 424.A N HIS 424.A ND1 no hydrogen 3.010 N/A ASN 426.A N ASP 423.A O no hydrogen 3.165 N/A TYR 427.A N ASP 423.A OD1 no hydrogen 2.904 N/A TYR 427.A OH GLU 440.A O no hydrogen 2.664 N/A ASP 430.A N TYR 427.A OH no hydrogen 3.164 N/A LYS 432.A N LYS 438.A O no hydrogen 2.769 N/A THR 434.A N THR 436.A O no hydrogen 2.802 N/A THR 434.A OG1 THR 436.A O no hydrogen 3.487 N/A THR 434.A OG1 THR 436.A OG1 no hydrogen 2.799 N/A THR 436.A OG1 GLU 265.A OE2 no hydrogen 2.649 N/A THR 436.A OG1 THR 434.A O no hydrogen 3.429 N/A THR 436.A OG1 THR 434.A OG1 no hydrogen 2.799 N/A LEU 437.A N THR 325.A O no hydrogen 2.909 N/A LYS 438.A N LYS 432.A O no hydrogen 3.126 N/A LYS 438.A NZ GLU 265.A OE1 no hydrogen 3.131 N/A LYS 438.A NZ GLU 265.A OE2 no hydrogen 3.145 N/A GLU 440.A N ASP 430.A O no hydrogen 2.706 N/A VAL 444.A N ILE 137.A O no hydrogen 3.228 N/A LYS 445.A N GLU 422.A O no hydrogen 3.025 N/A LYS 447.A N ASP 420.A O no hydrogen 2.792 N/A SER 448.A OG GLU 129.A OE1 no hydrogen 2.599 N/A SER 448.A OG GLU 129.A OE2 no hydrogen 3.453 N/A LYS 449.A N HIS 418.A O no hydrogen 2.843 N/A LYS 450.A N SER 448.A OG no hydrogen 2.727 N/A ASN 462.A ND2 ASN 465.A OD1 no hydrogen 2.411 N/A ALA 463.A N ASN 465.A OD1 no hydrogen 3.186 N/A HIS 464.A ND1 LEU 616.A O no hydrogen 2.996 N/A LEU 469.A N ALA 514.A O no hydrogen 3.178 N/A VAL 470.A N GLN 498.A O no hydrogen 2.569 N/A LEU 471.A N LEU 516.A O no hydrogen 2.975 N/A TYR 472.A N ALA 500.A O no hydrogen 2.821 N/A GLY 473.A N VAL 518.A O no hydrogen 2.979 N/A SER 474.A N ASN 529.A OD1 no hydrogen 2.690 N/A GLY 477.A N SER 474.A OG no hydrogen 2.818 N/A GLU 480.A N SER 474.A OG no hydrogen 3.409 N/A GLY 481.A N GLY 477.A O no hydrogen 2.772 N/A THR 482.A N THR 478.A O no hydrogen 3.071 N/A THR 482.A OG1 THR 478.A O no hydrogen 2.762 N/A ALA 483.A N ALA 479.A O no hydrogen 3.017 N/A ARG 484.A N GLU 480.A O no hydrogen 3.119 N/A ARG 484.A NE GLU 480.A OE2 no hydrogen 2.908 N/A ARG 484.A NH2 GLU 480.A OE2 no hydrogen 3.194 N/A ASP 485.A N GLY 481.A O no hydrogen 2.787 N/A LEU 486.A N THR 482.A O no hydrogen 2.909 N/A ALA 487.A N ALA 483.A O no hydrogen 2.928 N/A ASP 488.A N ARG 484.A O no hydrogen 2.983 N/A ASP 488.A N ASP 485.A O no hydrogen 2.838 N/A ILE 489.A N ASP 485.A O no hydrogen 2.926 N/A ALA 490.A N LEU 486.A O no hydrogen 2.805 N/A MET 491.A N ALA 487.A O no hydrogen 3.439 N/A SER 492.A OG ASP 488.A O no hydrogen 3.336 N/A SER 492.A OG ASP 623.A OD2 no hydrogen 2.924 N/A LYS 493.A N ALA 490.A O no hydrogen 2.593 N/A LYS 493.A NZ ILE 618.A O no hydrogen 3.556 N/A PHE 495.A N ALA 490.A O no hydrogen 3.083 N/A ALA 496.A N THR 466.A O no hydrogen 2.778 N/A GLN 498.A N LEU 468.A O no hydrogen 2.926 N/A ALA 500.A N VAL 470.A O no hydrogen 2.999 N/A LEU 502.A N TYR 472.A O no hydrogen 2.497 N/A ASP 503.A N ASN 529.A O no hydrogen 2.969 N/A SER 504.A OG THR 501.A O no hydrogen 3.028 N/A SER 504.A OG THR 501.A OG1 no hydrogen 3.201 N/A HIS 505.A N LEU 502.A O no hydrogen 3.209 N/A ASN 508.A N HIS 505.A O no hydrogen 2.890 N/A VAL 515.A N ARG 549.A O no hydrogen 2.964 N/A LEU 516.A N LEU 469.A O no hydrogen 2.918 N/A ILE 517.A N SER 551.A O no hydrogen 2.935 N/A VAL 518.A N LEU 471.A O no hydrogen 3.001 N/A THR 519.A N PHE 553.A O no hydrogen 3.228 N/A THR 519.A OG1 ALA 520.A O no hydrogen 2.796 N/A ALA 520.A N GLY 473.A O no hydrogen 3.183 N/A TYR 522.A N HIS 525.A O no hydrogen 2.629 N/A HIS 525.A N TYR 522.A O no hydrogen 2.769 N/A ASP 528.A N ASN 475.A OD1 no hydrogen 2.608 N/A ALA 530.A N PRO 527.A O no hydrogen 2.799 N/A GLN 532.A N ASP 503.A OD2 no hydrogen 3.151 N/A VAL 534.A N ALA 530.A O no hydrogen 3.201 N/A ASP 535.A N LYS 531.A O no hydrogen 2.969 N/A TRP 536.A N GLN 532.A O no hydrogen 3.064 N/A LEU 537.A N PHE 533.A O no hydrogen 2.735 N/A ASP 538.A N VAL 534.A O no hydrogen 2.500 N/A SER 541.A OG GLN 539.A O no hydrogen 3.543 N/A GLU 544.A N ALA 542.A O no hydrogen 2.665 N/A VAL 545.A N LYS 578.A O no hydrogen 3.245 N/A TYR 550.A OH ASP 572.A O no hydrogen 2.615 N/A TYR 550.A OH ASP 572.A OD1 no hydrogen 3.007 N/A SER 551.A N VAL 515.A O no hydrogen 3.289 N/A SER 551.A OG ALA 584.A O no hydrogen 2.725 N/A PHE 553.A N ILE 517.A O no hydrogen 2.667 N/A GLY 554.A N GLY 587.A O no hydrogen 2.494 N/A CYS 555.A N THR 519.A O no hydrogen 2.922 N/A GLY 556.A N ALA 589.A O no hydrogen 3.004 N/A LYS 558.A N ASP 590.A OD1 no hydrogen 2.588 N/A ASN 559.A N ASP 557.A OD1 no hydrogen 2.655 N/A ASN 559.A ND2 ASP 557.A OD1 no hydrogen 3.206 N/A TRP 560.A N ASP 557.A O no hydrogen 3.033 N/A THR 563.A N TRP 560.A O no hydrogen 3.161 N/A THR 563.A OG1 TRP 560.A O no hydrogen 3.377 N/A GLN 565.A NE2 GLY 554.A O no hydrogen 3.688 N/A GLN 565.A NE2 TYR 564.A OH no hydrogen 3.151 N/A GLN 565.A NE2 ALA 589.A O no hydrogen 3.070 N/A LYS 566.A N THR 563.A O no hydrogen 2.981 N/A VAL 567.A N SER 521.A OG no hydrogen 2.987 N/A ALA 569.A N GLN 565.A O no hydrogen 3.009 N/A PHE 570.A N LYS 566.A O no hydrogen 2.887 N/A ILE 571.A N VAL 567.A O no hydrogen 2.981 N/A ASP 572.A N PRO 568.A O no hydrogen 2.894 N/A GLU 573.A N ALA 569.A O no hydrogen 3.023 N/A THR 574.A N PHE 570.A O no hydrogen 2.711 N/A THR 574.A OG1 PHE 570.A O no hydrogen 2.750 N/A LEU 575.A N ILE 571.A O no hydrogen 2.851 N/A ALA 576.A N GLU 573.A O no hydrogen 3.222 N/A ALA 577.A N GLU 573.A O no hydrogen 3.042 N/A GLY 579.A N ALA 576.A O no hydrogen 3.316 N/A ASN 582.A ND2 TYR 550.A OH no hydrogen 3.350 N/A ILE 583.A N TYR 550.A O no hydrogen 3.111 N/A ARG 586.A NE GLU 588.A OE2 no hydrogen 3.460 N/A ARG 586.A NH1 ASP 572.A OD2 no hydrogen 2.946 N/A ARG 586.A NH2 GLU 588.A OE2 no hydrogen 2.929 N/A GLY 587.A N VAL 552.A O no hydrogen 2.836 N/A ALA 589.A N GLY 554.A O no hydrogen 2.594 N/A ALA 591.A N GLY 556.A O no hydrogen 3.029 N/A SER 592.A N ASP 590.A OD1 no hydrogen 3.366 N/A SER 592.A OG ASP 557.A OD1 no hydrogen 3.066 N/A ASP 593.A N ASP 590.A O no hydrogen 2.979 N/A THR 598.A N ASP 594.A O no hydrogen 3.330 N/A THR 598.A OG1 ASP 594.A O no hydrogen 3.170 N/A TYR 599.A N PHE 595.A O no hydrogen 3.025 N/A TYR 599.A OH ASP 485.A OD2 no hydrogen 2.678 N/A GLU 600.A N GLU 596.A O no hydrogen 2.846 N/A GLU 601.A N GLY 597.A O no hydrogen 2.736 N/A TRP 602.A N THR 598.A O no hydrogen 2.962 N/A TRP 602.A NE1 ASP 585.A O no hydrogen 2.889 N/A ARG 603.A N TYR 599.A O no hydrogen 3.125 N/A ARG 603.A NE TYR 599.A O no hydrogen 3.405 N/A GLU 604.A N GLU 600.A O no hydrogen 3.174 N/A HIS 605.A N GLU 601.A O no hydrogen 3.178 N/A MET 606.A N TRP 602.A O no hydrogen 2.784 N/A TRP 607.A N ARG 603.A O no hydrogen 2.887 N/A SER 608.A N GLU 604.A O no hydrogen 3.471 N/A SER 608.A OG GLU 604.A O no hydrogen 2.735 N/A ASP 609.A N HIS 605.A O no hydrogen 3.039 N/A VAL 610.A N MET 606.A O no hydrogen 3.166 N/A ALA 611.A N TRP 607.A O no hydrogen 2.694 N/A ALA 612.A N SER 608.A O no hydrogen 3.036 N/A TYR 613.A N ASP 609.A O no hydrogen 3.249 N/A PHE 614.A N VAL 610.A O no hydrogen 3.044 N/A SER 621.A OG GLU 619.A OE2 no hydrogen 2.496 N/A SER 621.A OG ASN 620.A O no hydrogen 2.167 N/A LYS 625.A NZ LYS 625.A O no hydrogen 2.524 N/A SER 626.A N ASN 624.A O no hydrogen 2.271 N/A SER 626.A OG ASN 624.A O no hydrogen 3.553 N/A SER 626.A OG SER 626.A O no hydrogen 2.411 N/A THR 627.A OG1 LYS 625.A O no hydrogen 2.645 N/A SER 635.A N VAL 633.A O no hydrogen 2.373 N/A SER 635.A OG VAL 633.A O no hydrogen 3.370 N/A LYS 643.A N MET 639.A O LYS 643.A H 3.056 2.071 MET 644.A N PRO 640.A O MET 644.A H 2.876 1.902 HIS 645.A N LEU 641.A O HIS 645.A H 3.216 2.279 GLY 646.A N LYS 643.A O GLY 646.A H 3.158 2.184 ALA 647.A N ALA 642.A O ALA 647.A H 2.783 1.826 THR 650.A N ILE 863.A O no hydrogen 2.981 N/A THR 650.A OG1 GLU 673.A O no hydrogen 2.767 N/A VAL 652.A N ASP 861.A O no hydrogen 2.893 N/A VAL 653.A N GLU 671.A O no hydrogen 2.868 N/A ALA 654.A N GLU 671.A O no hydrogen 3.360 N/A SER 655.A OG LEU 857.A O no hydrogen 2.891 N/A LYS 656.A N HIS 669.A O no hydrogen 3.059 N/A LEU 658.A N THR 667.A O no hydrogen 2.961 N/A GLN 659.A N GLU 657.A OE2 no hydrogen 2.874 N/A GLN 659.A NE2 THR 667.A OG1 no hydrogen 2.793 N/A GLN 660.A N GLU 927.A O no hydrogen 2.783 N/A SER 663.A N GLN 660.A O no hydrogen 2.911 N/A SER 663.A OG GLN 659.A OE1 no hydrogen 2.777 N/A SER 663.A OG ARG 665.A O no hydrogen 3.136 N/A ARG 665.A N SER 663.A OG no hydrogen 3.103 N/A SER 666.A OG GLU 657.A OE1 no hydrogen 2.326 N/A THR 667.A N GLU 657.A OE2 no hydrogen 3.072 N/A ARG 668.A N VAL 832.A O no hydrogen 2.835 N/A ARG 668.A NH2 GLU 657.A OE1 no hydrogen 3.535 N/A HIS 669.A N LYS 656.A O no hydrogen 3.099 N/A HIS 669.A ND1 TYR 931.A OH no hydrogen 2.700 N/A HIS 669.A NE2 GLU 671.A OE1 no hydrogen 3.042 N/A HIS 669.A NE2 GLU 671.A OE2 no hydrogen 3.201 N/A LEU 670.A N ILE 830.A O no hydrogen 3.253 N/A GLU 671.A N ALA 654.A O no hydrogen 3.024 N/A ILE 672.A N ALA 828.A O no hydrogen 2.810 N/A GLU 673.A N ASN 651.A O no hydrogen 3.126 N/A LEU 674.A N LYS 826.A O no hydrogen 3.029 N/A ALA 678.A N PRO 675.A O no hydrogen 3.033 N/A TYR 680.A OH SER 819.A OG no hydrogen 2.610 N/A TYR 680.A OH GLN 827.A O no hydrogen 2.801 N/A GLN 681.A N ASP 684.A OD2 no hydrogen 3.080 N/A ASP 684.A N GLN 681.A O no hydrogen 3.064 N/A HIS 685.A N SER 868.A O no hydrogen 2.746 N/A HIS 685.A NE2 ASP 1030.A OD1 no hydrogen 2.731 N/A LEU 686.A N TYR 815.A O no hydrogen 2.732 N/A GLY 687.A N PHE 866.A O no hydrogen 2.678 N/A VAL 688.A N ARG 813.A O no hydrogen 2.657 N/A ILE 689.A N THR 864.A O no hydrogen 3.093 N/A ASN 692.A N GLN 737.A OE1 no hydrogen 2.558 N/A ASN 692.A ND2 LEU 736.A O no hydrogen 2.869 N/A ASN 692.A ND2 VAL 739.A O no hydrogen 2.880 N/A ILE 696.A N TYR 693.A O no hydrogen 3.221 N/A VAL 697.A N TYR 693.A O no hydrogen 3.147 N/A ASN 698.A N GLU 694.A O no hydrogen 2.804 N/A ARG 699.A N GLY 695.A O no hydrogen 3.071 N/A ARG 699.A NE GLU 791.A OE1 no hydrogen 3.485 N/A ARG 699.A NE GLU 791.A OE2 no hydrogen 3.083 N/A ARG 699.A NH2 GLU 791.A OE1 no hydrogen 2.964 N/A VAL 700.A N ILE 696.A O no hydrogen 3.419 N/A VAL 700.A N VAL 697.A O no hydrogen 2.900 N/A THR 701.A N VAL 697.A O no hydrogen 3.059 N/A THR 701.A OG1 VAL 697.A O no hydrogen 3.533 N/A THR 701.A OG1 ASN 698.A O no hydrogen 3.208 N/A ALA 702.A N ASN 698.A O no hydrogen 3.017 N/A ARG 703.A N ARG 699.A O no hydrogen 3.150 N/A ARG 703.A NE LEU 790.A O no hydrogen 2.803 N/A ARG 703.A NH1 ARG 703.A O no hydrogen 2.914 N/A ARG 703.A NH2 TYR 793.A O no hydrogen 3.070 N/A ARG 703.A NH2 CYS 796.A O no hydrogen 3.080 N/A PHE 704.A N VAL 700.A O no hydrogen 3.114 N/A GLY 705.A N ALA 702.A O no hydrogen 3.322 N/A LEU 706.A N THR 701.A O no hydrogen 2.713 N/A SER 709.A OG ASP 707.A OD1 no hydrogen 3.160 N/A GLN 710.A N ASP 707.A O no hydrogen 3.201 N/A GLN 710.A NE2 GLN 711.A O no hydrogen 3.455 N/A ILE 712.A N VAL 730.A O no hydrogen 2.973 N/A ALA 727.A N LEU 714.A O no hydrogen 3.082 N/A VAL 730.A N ILE 712.A O no hydrogen 2.971 N/A SER 731.A N GLU 734.A OE2 no hydrogen 3.163 N/A SER 731.A OG GLU 733.A OE1 no hydrogen 3.321 N/A GLU 733.A N ALA 708.A O no hydrogen 3.059 N/A GLU 734.A N SER 731.A OG no hydrogen 3.321 N/A LEU 735.A N SER 731.A O no hydrogen 3.001 N/A LEU 736.A N VAL 732.A O no hydrogen 2.964 N/A GLN 737.A N GLU 734.A O no hydrogen 3.115 N/A GLN 737.A NE2 ASN 692.A O no hydrogen 2.923 N/A TYR 738.A N LEU 735.A O no hydrogen 3.107 N/A GLU 740.A N PRO 808.A O no hydrogen 2.874 N/A GLN 742.A NE2 LYS 847.A O no hydrogen 2.883 N/A VAL 745.A N LEU 784.A O no hydrogen 2.792 N/A THR 746.A N GLN 749.A OE1 no hydrogen 3.166 N/A ARG 747.A NE LEU 770.A O no hydrogen 2.998 N/A ARG 747.A NH2 LEU 770.A O no hydrogen 3.123 N/A GLN 749.A N THR 746.A OG1 no hydrogen 3.067 N/A GLN 749.A NE2 LEU 806.A O no hydrogen 2.854 N/A LEU 750.A N THR 746.A O no hydrogen 2.941 N/A ARG 751.A N ARG 747.A O no hydrogen 3.013 N/A ALA 752.A N THR 748.A O no hydrogen 2.989 N/A MET 753.A N GLN 749.A O no hydrogen 3.119 N/A ALA 754.A N LEU 750.A O no hydrogen 2.816 N/A ALA 755.A N ARG 751.A O no hydrogen 3.118 N/A LYS 756.A N MET 753.A O no hydrogen 3.154 N/A LYS 756.A NZ GLU 802.A OE1 no hydrogen 2.614 N/A LYS 756.A NZ GLU 802.A OE2 no hydrogen 3.325 N/A THR 757.A N ALA 754.A O no hydrogen 3.141 N/A THR 757.A OG1 MET 753.A O no hydrogen 2.735 N/A LYS 763.A N CYS 759.A O no hydrogen 2.784 N/A LYS 763.A N PRO 760.A O no hydrogen 2.945 N/A VAL 764.A N PRO 760.A O no hydrogen 3.065 N/A GLU 765.A N PRO 761.A O no hydrogen 3.162 N/A LEU 766.A N HIS 762.A O no hydrogen 3.200 N/A GLU 767.A N LYS 763.A O no hydrogen 3.083 N/A ALA 768.A N VAL 764.A O no hydrogen 2.872 N/A LEU 769.A N GLU 765.A O no hydrogen 3.322 N/A LEU 769.A N LEU 766.A O no hydrogen 3.288 N/A LEU 770.A N GLU 767.A O no hydrogen 2.903 N/A GLU 771.A N ALA 768.A O no hydrogen 3.190 N/A GLN 773.A NE2 GLU 777.A OE1 no hydrogen 2.383 N/A GLN 773.A NE2 GLU 777.A OE2 no hydrogen 2.715 N/A TYR 775.A N GLU 771.A O no hydrogen 2.782 N/A TYR 775.A OH VAL 745.A O no hydrogen 2.622 N/A LYS 776.A N LYS 772.A O no hydrogen 3.145 N/A GLU 777.A N GLN 773.A O no hydrogen 2.817 N/A GLN 778.A N ALA 774.A O no hydrogen 2.699 N/A VAL 779.A N TYR 775.A O no hydrogen 3.150 N/A LEU 780.A N TYR 775.A O no hydrogen 2.898 N/A ALA 781.A N LYS 776.A O no hydrogen 2.840 N/A ARG 783.A N LEU 780.A O no hydrogen 3.253 N/A ARG 783.A NH2 TYR 846.A OH no hydrogen 2.836 N/A LEU 784.A N VAL 779.A O no hydrogen 3.157 N/A THR 785.A N GLU 788.A OE1 no hydrogen 2.907 N/A GLU 788.A N THR 785.A OG1 no hydrogen 3.015 N/A LEU 789.A N THR 785.A O no hydrogen 3.152 N/A LEU 790.A N MET 786.A O no hydrogen 2.783 N/A GLU 791.A N LEU 787.A O no hydrogen 2.929 N/A LYS 792.A N GLU 788.A O no hydrogen 3.028 N/A LYS 792.A NZ TYR 793.A OH no hydrogen 3.479 N/A TYR 793.A N LEU 789.A O no hydrogen 2.836 N/A TYR 793.A N LEU 790.A O no hydrogen 3.089 N/A TYR 793.A OH GLU 765.A OE2 no hydrogen 3.243 N/A CYS 796.A N TYR 793.A O no hydrogen 3.038 N/A CYS 796.A SG MET 753.A O no hydrogen 3.682 N/A GLU 797.A N LYS 756.A O no hydrogen 2.787 N/A GLU 802.A N LYS 799.A O no hydrogen 2.968 N/A PHE 803.A N LYS 799.A O no hydrogen 2.998 N/A ILE 804.A N PHE 800.A O no hydrogen 2.961 N/A LEU 806.A N PHE 803.A O no hydrogen 2.980 N/A LEU 807.A N ILE 804.A O no hydrogen 3.351 N/A SER 809.A OG LEU 721.A O no hydrogen 3.369 N/A ILE 810.A N TYR 738.A O no hydrogen 3.035 N/A ARG 811.A N GLU 740.A OE2 no hydrogen 2.826 N/A ARG 811.A NH1 ASP 743.A OD2 no hydrogen 2.862 N/A ARG 811.A NH2 ASP 743.A OD1 no hydrogen 2.957 N/A ARG 813.A N VAL 688.A O no hydrogen 2.809 N/A ARG 813.A NH2 GLU 740.A OE1 no hydrogen 3.471 N/A ARG 813.A NH2 GLU 740.A OE2 no hydrogen 2.700 N/A ARG 813.A NH2 ARG 811.A O no hydrogen 2.822 N/A TYR 815.A N LEU 686.A O no hydrogen 2.913 N/A SER 816.A OG ASP 1030.A OD2 no hydrogen 2.640 N/A ILE 817.A N ASP 684.A O no hydrogen 3.066 N/A SER 818.A N SER 829.A O no hydrogen 2.890 N/A SER 818.A OG SER 829.A OG no hydrogen 2.700 N/A SER 818.A OG THR 831.A OG1 no hydrogen 2.708 N/A SER 819.A OG TYR 680.A OH no hydrogen 2.610 N/A SER 820.A N GLN 901.A OE1 no hydrogen 3.174 N/A ARG 822.A N SER 820.A OG no hydrogen 3.120 N/A VAL 823.A N SER 820.A O no hydrogen 3.169 N/A LYS 826.A N ASP 824.A OD1 no hydrogen 3.070 N/A GLN 827.A N ASP 824.A O no hydrogen 3.247 N/A ALA 828.A N ILE 672.A O no hydrogen 2.920 N/A SER 829.A N SER 819.A OG no hydrogen 3.167 N/A SER 829.A OG SER 818.A OG no hydrogen 2.700 N/A ILE 830.A N LEU 670.A O no hydrogen 2.987 N/A THR 831.A OG1 SER 818.A OG no hydrogen 2.708 N/A THR 831.A OG1 TYR 931.A OH no hydrogen 2.692 N/A VAL 832.A N ARG 668.A O no hydrogen 2.797 N/A VAL 834.A N SER 666.A O no hydrogen 2.972 N/A VAL 835.A N SER 851.A OG no hydrogen 3.153 N/A GLY 837.A N TYR 846.A O no hydrogen 3.186 N/A ALA 839.A N GLY 844.A O no hydrogen 2.971 N/A SER 841.A OG GLU 788.A OE1 no hydrogen 3.189 N/A SER 841.A OG GLU 788.A OE2 no hydrogen 2.628 N/A GLY 842.A N ALA 839.A O no hydrogen 2.930 N/A TYR 843.A N SER 841.A OG no hydrogen 3.302 N/A GLY 844.A N GLY 842.A O no hydrogen 3.146 N/A TYR 846.A N GLY 837.A O no hydrogen 2.910 N/A GLY 848.A N VAL 835.A O no hydrogen 3.083 N/A SER 851.A OG GLY 848.A O no hydrogen 3.472 N/A ASN 852.A N GLY 848.A O no hydrogen 3.163 N/A ASN 852.A ND2 VAL 835.A O no hydrogen 2.635 N/A ASN 852.A ND2 GLY 848.A O no hydrogen 3.107 N/A TYR 853.A N ILE 849.A O no hydrogen 3.076 N/A LEU 854.A N ALA 850.A O no hydrogen 2.791 N/A ALA 855.A N SER 851.A O no hydrogen 2.913 N/A GLU 856.A N ASN 852.A O no hydrogen 3.211 N/A GLU 856.A N TYR 853.A O no hydrogen 3.098 N/A LEU 857.A N LEU 854.A O no hydrogen 3.251 N/A GLN 858.A N ASP 861.A OD2 no hydrogen 2.645 N/A GLY 860.A N VAL 652.A O no hydrogen 2.908 N/A ASP 861.A N GLN 858.A O no hydrogen 2.994 N/A ILE 863.A N THR 650.A O no hydrogen 2.835 N/A CYS 865.A N PHE 648.A O no hydrogen 3.014 N/A PHE 866.A N GLY 687.A O no hydrogen 3.054 N/A SER 868.A N HIS 685.A O no hydrogen 2.710 N/A GLU 881.A N ASP 879.A OD1 no hydrogen 3.065 N/A THR 882.A N ASP 879.A O no hydrogen 3.001 N/A THR 882.A OG1 ASP 879.A O no hydrogen 3.166 N/A LEU 884.A N GLU 915.A O no hydrogen 3.191 N/A ILE 885.A N HIS 981.A O no hydrogen 2.913 N/A MET 886.A N HIS 917.A O no hydrogen 2.883 N/A VAL 887.A N TYR 983.A O no hydrogen 2.834 N/A GLY 888.A N TYR 919.A O no hydrogen 3.081 N/A GLY 890.A N GLY 921.A O no hydrogen 3.067 N/A GLY 892.A N PRO 889.A O no hydrogen 2.971 N/A VAL 893.A N GLY 890.A O no hydrogen 3.140 N/A ALA 894.A N THR 891.A O no hydrogen 2.984 N/A ARG 897.A N VAL 893.A O no hydrogen 3.055 N/A ARG 897.A N ALA 894.A O no hydrogen 2.924 N/A ARG 897.A NE GLU 934.A OE2 no hydrogen 2.657 N/A ARG 897.A NH1 SER 818.A O no hydrogen 3.006 N/A ARG 897.A NH2 GLU 934.A OE1 no hydrogen 2.789 N/A ARG 897.A NH2 GLU 934.A OE2 no hydrogen 3.494 N/A PHE 899.A N PRO 895.A O no hydrogen 3.095 N/A VAL 900.A N PHE 896.A O no hydrogen 2.975 N/A GLN 901.A N ARG 897.A O no hydrogen 3.055 N/A ALA 902.A N GLY 898.A O no hydrogen 2.940 N/A ARG 903.A N PHE 899.A O no hydrogen 3.004 N/A ARG 903.A NE ILE 943.A O no hydrogen 3.103 N/A ARG 903.A NH1 GLY 914.A O no hydrogen 2.863 N/A ARG 903.A NH1 ILE 943.A O no hydrogen 3.198 N/A LYS 904.A N VAL 900.A O no hydrogen 3.053 N/A GLN 905.A N GLN 901.A O no hydrogen 3.274 N/A LEU 906.A N ALA 902.A O no hydrogen 3.013 N/A LYS 907.A N ARG 903.A O no hydrogen 2.968 N/A LYS 907.A NZ GLU 941.A O no hydrogen 3.023 N/A GLU 908.A N LYS 904.A O no hydrogen 3.230 N/A GLN 909.A N GLN 905.A O no hydrogen 3.035 N/A GLN 909.A N LEU 906.A O no hydrogen 2.986 N/A GLY 910.A N LYS 907.A O no hydrogen 2.600 N/A GLN 911.A N LEU 906.A O no hydrogen 3.134 N/A GLY 914.A N PRO 880.A O no hydrogen 3.019 N/A HIS 917.A N LEU 884.A O no hydrogen 3.066 N/A HIS 917.A ND1 HIS 947.A NE2 no hydrogen 2.906 N/A HIS 917.A NE2 GLU 915.A OE1 no hydrogen 2.660 N/A LEU 918.A N THR 945.A O no hydrogen 2.899 N/A TYR 919.A N MET 886.A O no hydrogen 2.800 N/A TYR 919.A OH ASP 968.A OD2 no hydrogen 2.788 N/A PHE 920.A N HIS 947.A O no hydrogen 2.893 N/A CYS 922.A N ALA 949.A O no hydrogen 3.004 N/A CYS 922.A SG SER 924.A O no hydrogen 3.787 N/A ARG 923.A N ASP 928.A OD1 no hydrogen 2.897 N/A ARG 923.A N ASP 928.A OD2 no hydrogen 3.327 N/A ARG 923.A NH1 GLU 927.A OE2 no hydrogen 3.016 N/A SER 924.A N ASP 928.A OD1 no hydrogen 3.092 N/A HIS 926.A N SER 924.A OG no hydrogen 2.811 N/A GLU 927.A N SER 924.A O no hydrogen 3.122 N/A ASP 928.A N SER 924.A O no hydrogen 3.109 N/A LEU 930.A N ASP 928.A O no hydrogen 2.878 N/A TYR 931.A OH HIS 669.A ND1 no hydrogen 2.700 N/A TYR 931.A OH THR 831.A OG1 no hydrogen 2.692 N/A GLN 932.A N TYR 929.A O no hydrogen 3.358 N/A GLN 932.A NE2 GLU 936.A OE2 no hydrogen 3.135 N/A LEU 935.A N TYR 931.A O no hydrogen 3.000 N/A GLU 936.A N GLN 932.A O no hydrogen 2.812 N/A ASN 937.A N GLU 933.A O no hydrogen 2.844 N/A ALA 938.A N GLU 934.A O no hydrogen 2.873 N/A GLN 939.A N LEU 935.A O no hydrogen 3.044 N/A SER 940.A N GLU 936.A O no hydrogen 3.048 N/A GLU 941.A N ASN 937.A O no hydrogen 2.892 N/A GLY 942.A N GLN 939.A O no hydrogen 3.006 N/A ILE 943.A N ALA 938.A O no hydrogen 2.880 N/A THR 945.A N ALA 916.A O no hydrogen 2.833 N/A LEU 946.A N GLN 939.A OE1 no hydrogen 3.117 N/A HIS 947.A N LEU 918.A O no hydrogen 2.793 N/A HIS 947.A NE2 HIS 917.A ND1 no hydrogen 2.906 N/A ALA 949.A N PHE 920.A O no hydrogen 2.914 N/A SER 951.A N CYS 922.A O no hydrogen 3.011 N/A SER 951.A OG CYS 922.A O no hydrogen 3.058 N/A ARG 952.A N ARG 923.A O no hydrogen 3.021 N/A GLN 956.A N MET 953.A O no hydrogen 3.216 N/A THR 959.A N PHE 950.A O no hydrogen 3.006 N/A THR 959.A OG1 PRO 957.A O no hydrogen 3.240 N/A TYR 960.A N HIS 963.A ND1 no hydrogen 3.082 N/A HIS 963.A N TYR 960.A O no hydrogen 2.788 N/A VAL 964.A N TYR 960.A O no hydrogen 3.383 N/A MET 965.A N VAL 961.A O no hydrogen 2.844 N/A GLU 966.A N GLN 962.A O no hydrogen 3.070 N/A GLN 967.A N HIS 963.A O no hydrogen 3.199 N/A ASP 968.A N VAL 964.A O no hydrogen 3.068 N/A GLY 969.A N GLU 966.A O no hydrogen 3.235 N/A LEU 972.A N ASP 968.A O no hydrogen 2.937 N/A ILE 973.A N GLY 969.A O no hydrogen 2.804 N/A GLU 974.A N LYS 970.A O no hydrogen 2.951 N/A LEU 975.A N LYS 971.A O no hydrogen 3.080 N/A LEU 976.A N LEU 972.A O no hydrogen 3.017 N/A ASP 977.A N ILE 973.A O no hydrogen 2.947 N/A GLN 978.A N LEU 975.A O no hydrogen 2.988 N/A GLY 979.A N LEU 976.A O no hydrogen 3.147 N/A ALA 980.A N LEU 975.A O no hydrogen 2.977 N/A HIS 981.A N PRO 883.A O no hydrogen 2.988 N/A PHE 982.A N ARG 1026.A O no hydrogen 2.886 N/A TYR 983.A N ILE 885.A O no hydrogen 2.869 N/A TYR 983.A OH THR 875.A O no hydrogen 2.509 N/A ILE 984.A N ALA 1028.A O no hydrogen 2.991 N/A CYS 985.A N VAL 887.A O no hydrogen 2.824 N/A GLY 988.A N TRP 1032.A O no hydrogen 2.817 N/A SER 989.A N ASP 987.A OD1 no hydrogen 2.757 N/A SER 989.A OG ASP 987.A OD1 no hydrogen 2.829 N/A GLN 990.A N ASP 987.A OD2 no hydrogen 3.043 N/A MET 991.A N ASP 987.A OD2 no hydrogen 2.952 N/A ALA 992.A N ASP 987.A O no hydrogen 3.017 N/A ALA 994.A N GLN 990.A O no hydrogen 3.437 N/A VAL 995.A N MET 991.A O no hydrogen 2.961 N/A GLU 996.A N ALA 992.A O no hydrogen 2.911 N/A ALA 997.A N PRO 993.A O no hydrogen 3.059 N/A THR 998.A N ALA 994.A O no hydrogen 2.948 N/A THR 998.A OG1 ALA 994.A O no hydrogen 3.050 N/A LEU 999.A N VAL 995.A O no hydrogen 2.898 N/A MET 1000.A N GLU 996.A O no hydrogen 3.030 N/A LYS 1001.A N ALA 997.A O no hydrogen 2.997 N/A LYS 1001.A NZ ASP 1005.A OD2 no hydrogen 2.828 N/A SER 1002.A N THR 998.A O no hydrogen 2.845 N/A SER 1002.A OG THR 998.A O no hydrogen 3.211 N/A TYR 1003.A N LEU 999.A O no hydrogen 3.055 N/A ALA 1004.A N MET 1000.A O no hydrogen 3.026 N/A ASP 1005.A N LYS 1001.A O no hydrogen 3.040 N/A VAL 1006.A N SER 1002.A O no hydrogen 2.954 N/A HIS 1007.A N TYR 1003.A O no hydrogen 2.920 N/A HIS 1007.A NE2 ASP 977.A OD2 no hydrogen 2.562 N/A VAL 1009.A N ALA 1004.A O no hydrogen 3.208 N/A ASP 1013.A N SER 1010.A OG no hydrogen 2.962 N/A ALA 1014.A N SER 1010.A O no hydrogen 2.972 N/A ARG 1015.A N GLU 1011.A O no hydrogen 3.013 N/A ARG 1015.A NH1 ARG 1015.A O no hydrogen 2.820 N/A LEU 1016.A N ALA 1012.A O no hydrogen 2.882 N/A TRP 1017.A N ASP 1013.A O no hydrogen 2.866 N/A LEU 1018.A N ALA 1014.A O no hydrogen 3.159 N/A GLN 1019.A N ARG 1015.A O no hydrogen 2.935 N/A GLN 1019.A NE2 GLU 1023.A OE2 no hydrogen 3.124 N/A GLN 1020.A N LEU 1016.A O no hydrogen 2.813 N/A GLN 1020.A N TRP 1017.A O no hydrogen 3.052 N/A GLN 1020.A NE2 LEU 1016.A O no hydrogen 3.329 N/A LEU 1021.A N TRP 1017.A O no hydrogen 2.887 N/A GLU 1022.A N LEU 1018.A O no hydrogen 3.011 N/A LYS 1024.A N GLN 1020.A O no hydrogen 2.852 N/A GLY 1025.A N GLU 1022.A O no hydrogen 2.903 N/A ARG 1026.A N LEU 1021.A O no hydrogen 2.936 N/A TYR 1027.A OH GLU 996.A OE2 no hydrogen 2.726 N/A ALA 1028.A N PHE 982.A O no hydrogen 3.021 N/A LYS 1029.A NZ GLU 996.A OE2 no hydrogen 2.526 N/A ASP 1030.A N ILE 984.A O no hydrogen 2.845 N/A TRP 1032.A N GLY 986.A O no hydrogen 2.989 N/A