Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3vil_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): THR 4.A N THR 1.A O no hydrogen 3.073 N/A PHE 5.A N ARG 464.A O no hydrogen 2.961 N/A PHE 9.A N PRO 6.A O no hydrogen 3.054 N/A LYS 10.A N ILE 413.A O no hydrogen 3.191 N/A LYS 10.A NZ GLU 115.A OE1 no hydrogen 2.788 N/A LEU 11.A N GLN 74.A OE1 no hydrogen 2.885 N/A GLY 12.A N TYR 415.A O no hydrogen 2.919 N/A ALA 13.A N VAL 75.A O no hydrogen 3.370 N/A ALA 14.A N ALA 417.A O no hydrogen 2.887 N/A THR 15.A N ARG 77.A O no hydrogen 2.887 N/A THR 15.A OG1 TYR 76.A OH no hydrogen 2.743 N/A SER 17.A N SER 79.A OG no hydrogen 2.800 N/A SER 17.A OG SER 79.A OG no hydrogen 2.918 N/A SER 17.A OG ASP 124.A OD2 no hydrogen 2.733 N/A GLN 19.A NE2 PHE 424.A O no hydrogen 2.887 N/A GLN 19.A NE2 GLU 425.A OE1 no hydrogen 3.567 N/A ILE 20.A N ALA 16.A O no hydrogen 3.215 N/A ILE 20.A N SER 17.A O no hydrogen 3.240 N/A GLU 21.A N SER 17.A O no hydrogen 2.868 N/A GLU 26.A N ALA 23.A O no hydrogen 3.258 N/A ASN 27.A ND2 TYR 58.A OH no hydrogen 2.907 N/A LYS 29.A N GLU 26.A O no hydrogen 3.199 N/A LYS 29.A NZ TRP 24.A O no hydrogen 2.791 N/A LYS 29.A NZ GLY 30.A O no hydrogen 2.848 N/A LYS 29.A NZ ASP 35.A OD2 no hydrogen 2.940 N/A GLY 30.A N ALA 83.A O no hydrogen 2.938 N/A ASN 32.A N ASP 35.A OD2 no hydrogen 2.794 N/A ILE 33.A N LEU 125.A O no hydrogen 2.858 N/A TRP 34.A N ASN 32.A OD1 no hydrogen 2.940 N/A ASP 35.A N ASN 32.A OD1 no hydrogen 2.935 N/A THR 36.A N ASN 32.A O no hydrogen 3.048 N/A THR 36.A OG1 ASN 32.A O no hydrogen 3.225 N/A THR 36.A OG1 GLN 127.A OE1 no hydrogen 2.687 N/A LEU 37.A N ILE 33.A O no hydrogen 2.928 N/A THR 38.A N TRP 34.A O no hydrogen 2.968 N/A THR 38.A OG1 TYR 18.A OH no hydrogen 3.153 N/A THR 38.A OG1 TRP 34.A O no hydrogen 3.047 N/A HIS 39.A N ASP 35.A O no hydrogen 2.971 N/A HIS 39.A NE2 ASP 52.A OD1 no hydrogen 2.637 N/A GLU 40.A N THR 36.A O no hydrogen 2.852 N/A HIS 41.A N LEU 37.A O no hydrogen 2.778 N/A TYR 44.A N HIS 41.A O no hydrogen 2.884 N/A VAL 45.A N PRO 42.A O no hydrogen 3.104 N/A VAL 46.A N LEU 427.A O no hydrogen 2.895 N/A GLY 48.A N VAL 45.A O no hydrogen 2.907 N/A ALA 49.A N VAL 46.A O no hydrogen 3.197 N/A GLY 51.A N TYR 18.A OH no hydrogen 2.911 N/A ASP 52.A N THR 50.A OG1 no hydrogen 2.982 N/A ASP 56.A N ILE 53.A O no hydrogen 2.806 N/A SER 57.A N ILE 20.A O no hydrogen 3.005 N/A SER 57.A OG ILE 20.A O no hydrogen 3.562 N/A SER 57.A OG ASP 64.A OD2 no hydrogen 2.714 N/A TYR 58.A N GLU 21.A O no hydrogen 2.959 N/A TYR 58.A OH ASP 97.A OD1 no hydrogen 3.024 N/A TYR 58.A OH ASP 97.A OD2 no hydrogen 2.617 N/A HIS 59.A N ASP 56.A O no hydrogen 2.980 N/A HIS 59.A ND1 ASP 56.A OD1 no hydrogen 2.622 N/A HIS 59.A NE2 GLU 26.A OE2 no hydrogen 2.751 N/A LEU 60.A N ASP 56.A O no hydrogen 2.840 N/A GLU 63.A N LEU 60.A O no hydrogen 2.849 N/A ASP 64.A N LEU 60.A O no hydrogen 3.255 N/A VAL 65.A N TYR 61.A O no hydrogen 3.032 N/A LYS 66.A N LYS 62.A O no hydrogen 2.959 N/A ILE 67.A N GLU 63.A O no hydrogen 3.040 N/A LEU 68.A N ASP 64.A O no hydrogen 2.963 N/A LYS 69.A N VAL 65.A O no hydrogen 2.854 N/A LYS 69.A NZ ASN 112.A OD1 no hydrogen 2.844 N/A GLU 70.A N LYS 66.A O no hydrogen 2.959 N/A LEU 71.A N ILE 67.A O no hydrogen 2.837 N/A GLY 72.A N LEU 68.A O no hydrogen 2.988 N/A GLY 72.A N LYS 69.A O no hydrogen 3.120 N/A ALA 73.A N LEU 68.A O no hydrogen 3.052 N/A GLN 74.A N LEU 11.A O no hydrogen 2.773 N/A TYR 76.A N GLU 115.A O no hydrogen 2.948 N/A TYR 76.A OH THR 15.A OG1 no hydrogen 2.743 N/A ARG 77.A N ALA 13.A O no hydrogen 3.027 N/A ARG 77.A NE.B THR 375.A O no hydrogen 3.109 N/A ARG 77.A NH1.A THR 375.A O no hydrogen 3.139 N/A ARG 77.A NH1.A GLU 376.A OE2 no hydrogen 3.018 N/A ARG 77.A NH1.B THR 119.A OG1 no hydrogen 2.696 N/A ARG 77.A NH2.A ASN 166.A OD1 no hydrogen 2.277 N/A ARG 77.A NH2.B THR 375.A O no hydrogen 3.221 N/A PHE 78.A N MET 117.A O no hydrogen 3.020 N/A SER 79.A OG SER 17.A OG no hydrogen 2.918 N/A ILE 80.A N THR 119.A O no hydrogen 3.000 N/A SER 81.A N TYR 102.A OH no hydrogen 2.929 N/A SER 81.A OG ASP 124.A OD2 no hydrogen 3.486 N/A TRP 82.A NE1 GLY 89.A O no hydrogen 2.958 N/A ARG 84.A N SER 81.A O no hydrogen 2.969 N/A ARG 84.A NE GLU 21.A OE1 no hydrogen 2.892 N/A ARG 84.A NH1 ALA 23.A O no hydrogen 3.080 N/A ARG 84.A NH2 GLU 21.A OE1 no hydrogen 2.883 N/A ARG 84.A NH2 GLY 22.A O no hydrogen 2.888 N/A ARG 84.A NH2 ALA 23.A O no hydrogen 3.343 N/A VAL 85.A N SER 81.A O no hydrogen 3.303 N/A VAL 85.A N TRP 82.A O no hydrogen 3.125 N/A LEU 86.A N TRP 82.A O no hydrogen 2.794 N/A GLY 89.A N LEU 86.A O no hydrogen 2.871 N/A ASN 92.A ND2 GLU 88.A OE1.B no hydrogen 2.983 N/A ASN 95.A N VAL 85.A O no hydrogen 2.796 N/A ASN 95.A ND2 ASN 27.A O no hydrogen 3.017 N/A ASN 95.A ND2 ARG 84.A O no hydrogen 2.956 N/A GLN 96.A NE2.A ASP 100.A OD1 no hydrogen 2.817 N/A ILE 99.A N ASN 95.A O no hydrogen 3.199 N/A ASP 100.A N GLN 96.A O no hydrogen 2.833 N/A TYR 101.A N ASP 97.A O no hydrogen 2.937 N/A TYR 101.A OH SER 57.A O no hydrogen 2.818 N/A TYR 102.A N GLY 98.A O no hydrogen 3.100 N/A TYR 102.A OH GLU 21.A OE2 no hydrogen 2.587 N/A ASN 103.A N ILE 99.A O no hydrogen 2.905 N/A ASN 104.A N ASP 100.A O no hydrogen 2.805 N/A LEU 105.A N TYR 101.A O no hydrogen 2.974 N/A ILE 106.A N TYR 102.A O no hydrogen 2.864 N/A ASN 107.A N ASN 103.A O no hydrogen 2.817 N/A GLU 108.A N ASN 104.A O no hydrogen 2.963 N/A LEU 109.A N LEU 105.A O no hydrogen 2.947 N/A LEU 110.A N ILE 106.A O no hydrogen 2.981 N/A ALA 111.A N ASN 107.A O no hydrogen 2.964 N/A ASN 112.A N GLU 108.A O no hydrogen 3.240 N/A ASN 112.A N LEU 109.A O no hydrogen 2.948 N/A ASN 112.A ND2 GLU 108.A O no hydrogen 2.784 N/A GLY 113.A N LEU 110.A O no hydrogen 3.102 N/A ILE 114.A N LEU 109.A O no hydrogen 2.944 N/A GLU 115.A N GLN 74.A O no hydrogen 2.937 N/A MET 117.A N TYR 76.A O no hydrogen 2.898 N/A VAL 118.A N LEU 161.A O no hydrogen 2.981 N/A THR 119.A N PHE 78.A O no hydrogen 2.893 N/A MET 120.A N LEU 163.A O no hydrogen 2.827 N/A TYR 121.A N THR 164.A O no hydrogen 3.037 N/A TRP 123.A NE1 ASN 166.A O no hydrogen 2.855 N/A GLN 127.A N PRO 31.A O no hydrogen 2.870 N/A GLN 127.A NE2 ASP 131.A OD1 no hydrogen 2.858 N/A LEU 129.A N PRO 126.A O no hydrogen 2.984 N/A GLN 130.A N PRO 126.A O no hydrogen 3.173 N/A ASP 131.A N GLN 127.A O no hydrogen 2.901 N/A LEU 132.A N LEU 129.A O no hydrogen 3.113 N/A GLY 133.A N GLN 130.A O no hydrogen 2.774 N/A GLY 134.A N LEU 129.A O no hydrogen 3.112 N/A TRP 135.A N TYR 175.A OH no hydrogen 3.104 N/A TRP 135.A NE1 TYR 121.A OH no hydrogen 3.014 N/A ASN 137.A N GLY 134.A O no hydrogen 2.870 N/A ASN 137.A ND2 LEU 132.A O no hydrogen 2.856 N/A VAL 139.A N ASN 137.A OD1 no hydrogen 3.238 N/A LEU 140.A N ASN 137.A O no hydrogen 3.034 N/A ALA 141.A N LEU 138.A O no hydrogen 2.958 N/A LYS 142.A NZ GLU 145.A OE2 no hydrogen 3.289 N/A LYS 142.A NZ ASN 146.A OD1 no hydrogen 2.894 N/A TYR 143.A N VAL 139.A O no hydrogen 3.436 N/A SER 144.A N LEU 140.A O no hydrogen 2.850 N/A SER 144.A OG LEU 140.A O no hydrogen 2.802 N/A GLU 145.A N ALA 141.A O no hydrogen 3.034 N/A ASN 146.A N LYS 142.A O no hydrogen 3.003 N/A TYR 147.A N TYR 143.A O no hydrogen 2.979 N/A TYR 147.A OH MET 120.A O no hydrogen 2.822 N/A ALA 148.A N SER 144.A O no hydrogen 2.924 N/A ARG 149.A N GLU 145.A O no hydrogen 2.915 N/A ARG 149.A NE GLU 213.A OE1 no hydrogen 2.915 N/A ARG 149.A NE GLU 213.A OE2 no hydrogen 3.541 N/A ARG 149.A NH1 ASN 146.A OD1 no hydrogen 2.965 N/A ARG 149.A NH2 GLU 145.A OE2 no hydrogen 2.984 N/A ARG 149.A NH2 GLU 213.A OE2 no hydrogen 3.305 N/A VAL 150.A N ASN 146.A O no hydrogen 3.307 N/A LEU 151.A N TYR 147.A O no hydrogen 3.117 N/A PHE 152.A N ALA 148.A O no hydrogen 2.788 N/A LYS 153.A N ARG 149.A O no hydrogen 2.884 N/A ASN 154.A N VAL 150.A O no hydrogen 3.053 N/A ASN 154.A ND2 VAL 150.A O no hydrogen 2.830 N/A PHE 155.A N LEU 151.A O no hydrogen 2.910 N/A GLY 156.A N PHE 152.A O no hydrogen 2.922 N/A ARG 158.A N PHE 155.A O no hydrogen 3.027 N/A ARG 158.A NE ASP 157.A OD1 no hydrogen 3.374 N/A ARG 158.A NE ASP 157.A OD2 no hydrogen 2.856 N/A ARG 158.A NH1 ASN 107.A OD1 no hydrogen 2.955 N/A ARG 158.A NH2 ASP 157.A OD1 no hydrogen 2.995 N/A VAL 159.A N PHE 155.A O no hydrogen 2.879 N/A LYS 160.A NZ GLY 156.A O no hydrogen 2.876 N/A LYS 160.A NZ ASP 157.A O no hydrogen 3.200 N/A LYS 160.A NZ GLN 218.A O no hydrogen 2.781 N/A TRP 162.A N LYS 221.A O no hydrogen 2.966 N/A LEU 163.A N VAL 118.A O no hydrogen 2.831 N/A THR 164.A N GLY 223.A O no hydrogen 2.949 N/A THR 164.A OG1 HIS 203.A ND1 no hydrogen 2.748 N/A THR 164.A OG1 GLY 223.A O no hydrogen 3.490 N/A ASN 166.A N TYR 121.A O no hydrogen 2.989 N/A ASN 166.A ND2 GLU 376.A OE2 no hydrogen 3.188 N/A SER 167.A N SER 225.A O no hydrogen 2.840 N/A THR 170.A N SER 167.A O no hydrogen 2.946 N/A PHE 171.A N SER 167.A O no hydrogen 3.069 N/A MET 172.A N PRO 168.A O no hydrogen 2.864 N/A ASP 173.A N THR 170.A O no hydrogen 2.903 N/A GLY 174.A N PHE 171.A O no hydrogen 2.925 N/A TYR 175.A N MET 172.A O no hydrogen 2.994 N/A TYR 175.A OH GLN 130.A OE1 no hydrogen 2.726 N/A ALA 176.A N ASP 173.A O no hydrogen 2.940 N/A SER 177.A N ILE 185.A O no hydrogen 2.980 N/A ILE 179.A N SER 177.A OG no hydrogen 3.136 N/A SER 184.A N MET 181.A O no hydrogen 2.818 N/A SER 184.A OG GLY 180.A O no hydrogen 2.848 N/A ILE 185.A N GLY 174.A O no hydrogen 2.927 N/A THR 187.A N TYR 175.A O no hydrogen 2.927 N/A THR 187.A OG1 TYR 175.A O no hydrogen 2.735 N/A GLY 189.A N ASP 192.A OD2 no hydrogen 3.414 N/A ILE 190.A N THR 187.A O no hydrogen 3.158 N/A GLY 191.A N THR 187.A O no hydrogen 2.827 N/A TYR 193.A N ASP 192.A OD1 no hydrogen 2.948 N/A TYR 193.A OH ASP 330.A OD2 no hydrogen 2.701 N/A LEU 194.A N ILE 190.A O no hydrogen 3.185 N/A ALA 195.A N GLY 191.A O no hydrogen 2.856 N/A ALA 196.A N ASP 192.A O no hydrogen 3.003 N/A HIS 197.A N TYR 193.A O no hydrogen 3.000 N/A HIS 197.A ND1 TYR 266.A OH no hydrogen 2.705 N/A HIS 197.A NE2 GLN 290.A O no hydrogen 3.165 N/A THR 198.A N LEU 194.A O no hydrogen 3.031 N/A THR 198.A OG1 TRP 135.A O no hydrogen 2.712 N/A THR 198.A OG1 LEU 194.A O no hydrogen 3.291 N/A VAL 199.A N ALA 195.A O no hydrogen 2.958 N/A ILE 200.A N ALA 196.A O no hydrogen 2.921 N/A HIS 201.A N HIS 197.A O no hydrogen 3.068 N/A ALA 202.A N THR 198.A O no hydrogen 2.796 N/A HIS 203.A N VAL 199.A O no hydrogen 2.819 N/A HIS 203.A ND1 THR 164.A OG1 no hydrogen 2.748 N/A HIS 203.A NE2 THR 302.A O no hydrogen 2.704 N/A ALA 204.A N ILE 200.A O no hydrogen 3.015 N/A ARG 205.A N HIS 201.A O no hydrogen 2.954 N/A ARG 205.A NE GLU 145.A OE1 no hydrogen 2.679 N/A ARG 205.A NH1 GLU 145.A OE1 no hydrogen 2.829 N/A ILE 206.A N ALA 202.A O no hydrogen 2.926 N/A TYR 207.A N HIS 203.A O no hydrogen 2.947 N/A TYR 207.A OH ASP 304.A OD1 no hydrogen 2.660 N/A HIS 208.A N ALA 204.A O no hydrogen 2.964 N/A HIS 208.A NE2 TYR 298.A O no hydrogen 2.775 N/A LEU 209.A N ARG 205.A O no hydrogen 2.877 N/A TYR 210.A N ILE 206.A O no hydrogen 2.990 N/A ASP 211.A N TYR 207.A O no hydrogen 3.002 N/A GLN 212.A N HIS 208.A O no hydrogen 2.860 N/A GLU 213.A N LEU 209.A O no hydrogen 2.808 N/A PHE 214.A N TYR 210.A O no hydrogen 2.984 N/A ARG 215.A N TYR 210.A O no hydrogen 2.794 N/A ARG 215.A NE ASP 211.A OD1 no hydrogen 2.809 N/A ARG 215.A NH1 ASP 304.A OD2 no hydrogen 2.942 N/A ARG 215.A NH2 ASP 211.A OD1 no hydrogen 2.902 N/A ARG 215.A NH2 ASP 304.A OD2 no hydrogen 3.024 N/A GLN 218.A N PHE 214.A O no hydrogen 2.842 N/A GLN 218.A NE2 PHE 152.A O no hydrogen 2.989 N/A GLY 219.A N ARG 215.A O no hydrogen 2.786 N/A GLY 220.A N TYR 210.A OH no hydrogen 2.778 N/A LYS 221.A N LYS 160.A O no hydrogen 2.856 N/A VAL 222.A N ASP 304.A OD2 no hydrogen 2.852 N/A GLY 223.A N TRP 162.A O no hydrogen 2.881 N/A SER 225.A N PHE 165.A O no hydrogen 2.931 N/A SER 225.A OG THR 375.A OG1 no hydrogen 2.763 N/A LEU 226.A N GLY 307.A O no hydrogen 2.880 N/A ILE 228.A N ASN 309.A O no hydrogen 3.182 N/A TRP 230.A N THR 312.A O no hydrogen 3.133 N/A TRP 230.A NE1 GLU 232.A OE1 no hydrogen 2.864 N/A GLU 232.A N LEU 314.A O no hydrogen 2.812 N/A ALA 234.A N GLY 316.A O no hydrogen 2.829 N/A THR 235.A N ASP 240.A OD2 no hydrogen 3.173 N/A THR 235.A OG1 ASP 240.A OD2 no hydrogen 2.714 N/A SER 237.A N THR 235.A OG1 no hydrogen 3.302 N/A SER 237.A OG THR 235.A OG1 no hydrogen 3.320 N/A GLU 239.A N GLU 239.A OE1 no hydrogen 2.773 N/A ASP 240.A N SER 237.A OG no hydrogen 2.997 N/A ARG 241.A N SER 237.A O no hydrogen 2.943 N/A ALA 242.A N ALA 238.A O no hydrogen 2.866 N/A SER 243.A N GLU 239.A O no hydrogen 3.122 N/A SER 243.A OG ASP 240.A O no hydrogen 2.729 N/A CYS 244.A N ASP 240.A O no hydrogen 3.132 N/A CYS 244.A SG CYS 231.A O no hydrogen 3.305 N/A CYS 244.A SG ASP 240.A O no hydrogen 3.521 N/A CYS 244.A SG GLY 316.A O no hydrogen 3.814 N/A GLU 245.A N ARG 241.A O no hydrogen 3.016 N/A ASN 246.A N ALA 242.A O no hydrogen 2.893 N/A ASN 246.A ND2 SER 331.A O no hydrogen 3.375 N/A ASN 246.A ND2 GLY 332.A O no hydrogen 3.098 N/A TYR 247.A N SER 243.A O no hydrogen 2.979 N/A GLN 248.A N CYS 244.A O no hydrogen 2.966 N/A GLN 248.A NE2 ASN 229.A O no hydrogen 3.213 N/A GLN 248.A NE2 GLU 359.A OE1 no hydrogen 3.042 N/A GLN 249.A N GLU 245.A O no hydrogen 2.945 N/A GLN 249.A NE2 GLU 245.A OE2 no hydrogen 3.156 N/A GLN 249.A NE2 GLU 366.A OE2 no hydrogen 3.054 N/A PHE 250.A N ASN 246.A O no hydrogen 2.854 N/A ASN 251.A N TYR 247.A O no hydrogen 3.008 N/A ASN 251.A ND2 TYR 247.A O no hydrogen 2.838 N/A LEU 252.A N GLN 248.A O no hydrogen 2.876 N/A GLY 253.A N GLN 248.A O no hydrogen 2.893 N/A TYR 255.A N LEU 252.A O no hydrogen 3.130 N/A ALA 256.A N LEU 252.A O no hydrogen 2.870 N/A HIS 257.A N GLY 253.A O no hydrogen 2.835 N/A HIS 257.A ND1 ASP 265.A O no hydrogen 2.744 N/A ILE 259.A N ALA 256.A O no hydrogen 3.245 N/A PHE 260.A N ALA 256.A O no hydrogen 2.745 N/A THR 261.A OG1 HIS 257.A O no hydrogen 2.726 N/A GLU 263.A N GLU 263.A OE1 no hydrogen 2.787 N/A GLY 264.A N THR 261.A OG1 no hydrogen 2.929 N/A TYR 266.A N ASP 265.A OD1 no hydrogen 2.812 N/A TYR 266.A OH HIS 197.A ND1 no hydrogen 2.705 N/A LYS 271.A N PRO 267.A O no hydrogen 3.144 N/A LYS 271.A NZ ASP 265.A OD2 no hydrogen 2.758 N/A ASP 272.A N ALA 268.A O no hydrogen 2.821 N/A ARG 273.A N VAL 269.A O no hydrogen 2.965 N/A ARG 273.A NE ASP 330.A O no hydrogen 2.808 N/A VAL 274.A N LEU 270.A O no hydrogen 3.122 N/A SER 275.A N LYS 271.A O no hydrogen 2.997 N/A SER 275.A OG.B LYS 271.A O no hydrogen 2.879 N/A SER 275.A OG.B ASP 272.A O no hydrogen 2.942 N/A ARG 276.A N ASP 272.A O no hydrogen 2.984 N/A ASN 277.A N ARG 273.A O no hydrogen 2.918 N/A ASN 277.A ND2 ASP 330.A OD1 no hydrogen 2.963 N/A SER 278.A N VAL 274.A O no hydrogen 2.877 N/A SER 278.A OG VAL 274.A O no hydrogen 2.764 N/A ALA 279.A N SER 275.A O no hydrogen 2.995 N/A ASP 280.A N ARG 276.A O no hydrogen 2.949 N/A GLU 281.A N ASN 277.A O no hydrogen 3.047 N/A GLY 282.A N ALA 279.A O no hydrogen 3.049 N/A TYR 283.A N SER 278.A O no hydrogen 3.033 N/A ARG 287.A N SER 278.A OG no hydrogen 2.944 N/A ARG 287.A NH1 GLY 189.A O no hydrogen 2.977 N/A ARG 287.A NH1 ASP 330.A OD2 no hydrogen 2.867 N/A ARG 287.A NH2 ASP 330.A OD1 no hydrogen 2.882 N/A ARG 287.A NH2 ASP 330.A OD2 no hydrogen 3.477 N/A LEU 288.A N SER 286.A OG no hydrogen 3.086 N/A THR 292.A N GLU 295.A OE1 no hydrogen 2.923 N/A GLU 295.A N THR 292.A OG1 no hydrogen 3.082 N/A VAL 296.A N THR 292.A O no hydrogen 2.908 N/A GLU 297.A N ALA 293.A O no hydrogen 3.091 N/A TYR 298.A N GLU 294.A O no hydrogen 2.969 N/A ILE 299.A N GLU 295.A O no hydrogen 2.900 N/A ARG 300.A N VAL 296.A O no hydrogen 3.005 N/A ARG 300.A NH1 GLU 263.A O no hydrogen 3.072 N/A ARG 300.A NH2 GLU 297.A OE1 no hydrogen 2.897 N/A GLY 301.A N ILE 259.A O no hydrogen 2.870 N/A THR 302.A N ILE 299.A O no hydrogen 3.376 N/A THR 302.A OG1 HIS 203.A NE2 no hydrogen 3.332 N/A THR 302.A OG1 ILE 299.A O no hydrogen 2.732 N/A HIS 303.A N GLY 301.A O no hydrogen 2.894 N/A ASP 304.A N VAL 222.A O no hydrogen 2.878 N/A LEU 306.A N PRO 371.A O no hydrogen 2.864 N/A GLY 307.A N ILE 224.A O no hydrogen 2.814 N/A ILE 308.A N PHE 373.A O no hydrogen 2.894 N/A ASN 309.A N LEU 226.A O no hydrogen 2.912 N/A ASN 309.A ND2 ASN 166.A OD1 no hydrogen 2.884 N/A ASN 309.A ND2 SER 167.A OG no hydrogen 2.917 N/A PHE 310.A N GLU 376.A O no hydrogen 3.016 N/A TYR 311.A OH GLU 376.A OE1 no hydrogen 2.698 N/A THR 312.A OG1 LYS 350.A O no hydrogen 2.611 N/A ALA 313.A N THR 312.A OG1 no hydrogen 2.800 N/A LEU 314.A N TRP 230.A O no hydrogen 2.828 N/A LEU 315.A N THR 336.A O no hydrogen 2.781 N/A GLY 316.A N GLU 232.A O no hydrogen 2.882 N/A LYS 317.A N ILE 334.A O no hydrogen 2.983 N/A SER 318.A N ASP 240.A OD1 no hydrogen 2.884 N/A SER 326.A OG TYR 323.A O no hydrogen 2.676 N/A ARG 327.A NH1.A ASP 173.A OD1.A no hydrogen 2.707 N/A ARG 327.A NH1.A ASP 192.A OD2 no hydrogen 2.729 N/A ARG 327.A NH2.A ASP 173.A OD1.A no hydrogen 2.948 N/A TYR 328.A OH GLU 321.A OE2 no hydrogen 2.616 N/A ARG 329.A N SER 326.A OG no hydrogen 3.118 N/A ARG 329.A NH1 GLY 322.A O no hydrogen 2.944 N/A ASP 330.A N SER 326.A O no hydrogen 2.937 N/A SER 331.A N ARG 327.A O no hydrogen 2.952 N/A SER 331.A N TYR 328.A O no hydrogen 3.170 N/A SER 331.A OG TYR 328.A O no hydrogen 2.756 N/A GLY 332.A N ARG 329.A O no hydrogen 3.441 N/A ILE 334.A N LYS 317.A O no hydrogen 2.889 N/A LEU 335.A N TYR 328.A OH no hydrogen 2.985 N/A THR 336.A N LEU 315.A O no hydrogen 2.962 N/A GLN 337.A NE2.A SER 347.A O no hydrogen 3.185 N/A GLN 337.A NE2.B ALA 313.A O no hydrogen 2.883 N/A GLN 337.A NE2.B TRP 348.A O no hydrogen 2.961 N/A ALA 340.A N ASP 338.A OD1 no hydrogen 2.803 N/A TRP 341.A N ASP 338.A O no hydrogen 3.101 N/A SER 344.A OG SER 346.A O no hydrogen 3.051 N/A SER 344.A OG LEU 349.A O no hydrogen 2.775 N/A SER 344.A OG SER 380.A OG no hydrogen 3.317 N/A ALA 345.A N SER 380.A O no hydrogen 3.118 N/A SER 346.A N SER 344.A OG no hydrogen 2.926 N/A SER 346.A OG SER 380.A OG no hydrogen 2.733 N/A SER 346.A OG GLU 432.A OE1 no hydrogen 2.681 N/A LEU 349.A N SER 346.A O no hydrogen 2.990 N/A LYS 350.A N THR 312.A OG1 no hydrogen 2.944 N/A VAL 351.A N PRO 342.A O no hydrogen 2.852 N/A GLY 355.A N VAL 352.A O no hydrogen 2.905 N/A PHE 356.A N PRO 353.A O no hydrogen 2.937 N/A ARG 357.A NE ASP 408.A OD2 no hydrogen 2.781 N/A ARG 357.A NH2 GLU 407.A OE1 no hydrogen 3.011 N/A ARG 357.A NH2 ASP 408.A OD1 no hydrogen 2.909 N/A ARG 357.A NH2 ASP 408.A OD2 no hydrogen 3.444 N/A LYS 358.A N TRP 354.A O no hydrogen 3.098 N/A GLU 359.A N GLY 355.A O no hydrogen 2.878 N/A LEU 360.A N PHE 356.A O no hydrogen 2.965 N/A ASN 361.A N ARG 357.A O no hydrogen 3.028 N/A ASN 361.A ND2 ARG 357.A O no hydrogen 2.925 N/A ASN 361.A ND2 ASP 408.A OD2 no hydrogen 2.841 N/A TRP 362.A N LYS 358.A O no hydrogen 2.937 N/A TRP 362.A NE1 GLU 245.A OE1 no hydrogen 2.875 N/A ILE 363.A N GLU 359.A O no hydrogen 2.948 N/A LYS 364.A N LEU 360.A O no hydrogen 2.964 N/A LYS 364.A NZ ASP 408.A O no hydrogen 2.704 N/A ASN 365.A N ASN 361.A O no hydrogen 2.993 N/A GLU 366.A N TRP 362.A O no hydrogen 2.913 N/A TYR 367.A N ILE 363.A O no hydrogen 2.925 N/A ASN 369.A N LYS 364.A O no hydrogen 2.895 N/A ASN 369.A ND2 GLY 409.A O no hydrogen 3.099 N/A VAL 372.A N ASN 411.A O no hydrogen 2.894 N/A PHE 373.A N LEU 306.A O no hydrogen 2.870 N/A ILE 374.A N GLY 414.A O no hydrogen 2.870 N/A THR 375.A N ILE 308.A O no hydrogen 2.839 N/A THR 375.A OG1 SER 225.A OG no hydrogen 2.763 N/A THR 375.A OG1 ILE 308.A O no hydrogen 3.449 N/A THR 375.A OG1 ASN 309.A OD1 no hydrogen 2.638 N/A ASN 377.A ND2 TYR 415.A OH no hydrogen 2.646 N/A SER 380.A OG SER 344.A OG no hydrogen 3.317 N/A SER 380.A OG SER 346.A OG no hydrogen 2.733 N/A ASP 381.A N LYS 433.A O no hydrogen 3.017 N/A GLY 383.A N ASP 381.A OD1 no hydrogen 3.205 N/A THR 388.A N ASN 386.A O no hydrogen 2.958 N/A THR 388.A OG1.A ASN 386.A O no hydrogen 3.497 N/A ARG 390.A NE PHE 379.A O no hydrogen 3.050 N/A ARG 390.A NH1 ASP 381.A OD2 no hydrogen 3.002 N/A ARG 390.A NH1 ASP 387.A OD2 no hydrogen 2.798 N/A ARG 390.A NH2 PHE 379.A O no hydrogen 2.946 N/A VAL 391.A N ASP 387.A O no hydrogen 2.967 N/A HIS 392.A N THR 388.A O no hydrogen 2.950 N/A TYR 393.A N GLY 389.A O no hydrogen 2.863 N/A TYR 393.A OH TYR 311.A O no hydrogen 2.760 N/A TYR 393.A OH ASN 377.A OD1 no hydrogen 3.035 N/A TYR 394.A N ARG 390.A O no hydrogen 2.927 N/A TYR 394.A OH ASN 377.A O no hydrogen 3.088 N/A THR 395.A N VAL 391.A O no hydrogen 2.918 N/A THR 395.A OG1 VAL 391.A O no hydrogen 3.117 N/A THR 395.A OG1 HIS 392.A O no hydrogen 3.360 N/A GLU 396.A N HIS 392.A O no hydrogen 2.984 N/A HIS 397.A N TYR 393.A O no hydrogen 2.944 N/A HIS 397.A ND1 TYR 393.A O no hydrogen 2.846 N/A LEU 398.A N TYR 394.A O no hydrogen 2.884 N/A LYS 399.A N THR 395.A O no hydrogen 2.980 N/A LYS 399.A NZ GLU 396.A OE2 no hydrogen 2.827 N/A LYS 399.A NZ PHE 470.A O no hydrogen 2.794 N/A LYS 399.A NZ ASP 472.A OD1 no hydrogen 2.744 N/A GLU 400.A N GLU 396.A O no hydrogen 2.983 N/A MET 401.A N HIS 397.A O no hydrogen 2.912 N/A LEU 402.A N LEU 398.A O no hydrogen 2.894 N/A LYS 403.A N LYS 399.A O no hydrogen 2.980 N/A LYS 403.A NZ GLU 400.A OE2 no hydrogen 2.806 N/A ALA 404.A N GLU 400.A O no hydrogen 2.947 N/A ILE 405.A N MET 401.A O no hydrogen 2.931 N/A HIS 406.A N LEU 402.A O no hydrogen 2.828 N/A HIS 406.A NE2 THR 4.A O no hydrogen 2.757 N/A GLU 407.A N LYS 403.A O no hydrogen 2.797 N/A ASP 408.A N LYS 403.A O no hydrogen 3.199 N/A GLY 409.A N ILE 405.A O no hydrogen 3.170 N/A VAL 410.A N ALA 404.A O no hydrogen 2.946 N/A ASN 411.A N ASN 369.A OD1 no hydrogen 2.922 N/A VAL 412.A N VAL 410.A O no hydrogen 2.911 N/A ILE 413.A N VAL 372.A O no hydrogen 2.759 N/A TYR 415.A N LYS 10.A O no hydrogen 2.833 N/A THR 416.A N ILE 374.A O no hydrogen 2.789 N/A THR 416.A OG1 ILE 374.A O no hydrogen 3.467 N/A THR 416.A OG1 THR 375.A O no hydrogen 2.910 N/A ALA 417.A N GLY 12.A O no hydrogen 3.026 N/A TRP 418.A N ASN 377.A O no hydrogen 2.887 N/A SER 419.A N PHE 434.A O no hydrogen 3.016 N/A SER 419.A OG ALA 14.A O no hydrogen 2.812 N/A SER 419.A OG MET 421.A O no hydrogen 3.313 N/A LEU 420.A N ALA 14.A O no hydrogen 3.085 N/A ASP 422.A N TYR 437.A O no hydrogen 3.019 N/A PHE 424.A N GLN 19.A O no hydrogen 2.949 N/A GLU 425.A N GLY 429.A O no hydrogen 2.787 N/A ARG 428.A N GLU 425.A O no hydrogen 2.834 N/A ARG 428.A NE GLU 432.A OE2 no hydrogen 2.869 N/A GLY 429.A N TRP 426.A O no hydrogen 2.963 N/A TYR 430.A OH THR 50.A O no hydrogen 2.725 N/A SER 431.A N ARG 428.A O no hydrogen 3.103 N/A SER 431.A OG ARG 428.A O no hydrogen 2.698 N/A LYS 433.A N ASP 381.A O no hydrogen 2.852 N/A LYS 433.A NZ TYR 430.A O no hydrogen 2.763 N/A GLY 435.A N ASP 422.A OD1 no hydrogen 2.927 N/A ILE 436.A N SER 419.A O no hydrogen 2.946 N/A TYR 437.A N LEU 420.A O no hydrogen 3.063 N/A TYR 437.A OH GLU 70.A OE2 no hydrogen 2.727 N/A ALA 438.A N ILE 449.A O no hydrogen 2.756 N/A GLU 442.A N ASP 440.A OD1 no hydrogen 2.939 N/A ASP 443.A N ASP 440.A O no hydrogen 3.160 N/A ALA 445.A N ASP 443.A OD1 no hydrogen 2.917 N/A ARG 446.A N ASP 443.A O no hydrogen 2.766 N/A ARG 446.A NE ALA 54.A O no hydrogen 2.851 N/A ARG 446.A NH1 ASP 443.A O no hydrogen 2.900 N/A ARG 448.A NE ASP 64.A OD1 no hydrogen 2.958 N/A ARG 448.A NH1 ASP 55.A O no hydrogen 2.906 N/A ARG 448.A NH1 ARG 446.A O no hydrogen 2.754 N/A ARG 448.A NH2 ASP 55.A O no hydrogen 3.039 N/A ARG 448.A NH2 ASP 64.A OD1 no hydrogen 2.763 N/A ILE 449.A N ALA 438.A O no hydrogen 2.906 N/A LYS 451.A N ILE 436.A O no hydrogen 2.963 N/A LYS 451.A NZ ASP 422.A OD1 no hydrogen 2.741 N/A LYS 451.A NZ GLY 435.A O no hydrogen 2.787 N/A GLU 452.A N LEU 385.A O no hydrogen 2.899 N/A SER 453.A N ASP 387.A OD1 no hydrogen 2.875 N/A SER 453.A OG ASP 387.A OD2 no hydrogen 2.614 N/A LYS 455.A N LYS 451.A O no hydrogen 3.309 N/A VAL 456.A N GLU 452.A O no hydrogen 2.931 N/A LEU 457.A N SER 453.A O no hydrogen 2.840 N/A ALA 458.A N ALA 454.A O no hydrogen 2.867 N/A GLU 459.A N LYS 455.A O no hydrogen 3.034 N/A ILE 460.A N VAL 456.A O no hydrogen 2.946 N/A MET 461.A N LEU 457.A O no hydrogen 2.798 N/A ASN 462.A N ALA 458.A O no hydrogen 2.837 N/A THR 463.A N GLU 459.A O no hydrogen 2.923 N/A THR 463.A OG1 GLU 459.A O no hydrogen 2.799 N/A THR 463.A OG1 LYS 465.A O no hydrogen 3.320 N/A ARG 464.A N ILE 460.A O no hydrogen 2.774 N/A ARG 464.A NH1 PHE 9.A O no hydrogen 3.242 N/A ARG 464.A NH1 GLN 74.A OE1 no hydrogen 2.873 N/A ARG 464.A NH2 PRO 6.A O no hydrogen 2.859 N/A ARG 464.A NH2 PHE 9.A O no hydrogen 2.783 N/A ILE 466.A N TYR 3.A O no hydrogen 2.918 N/A ARG 469.A NH1 GLU 459.A OE1 no hydrogen 3.459 N/A ARG 469.A NH1 GLU 459.A OE2 no hydrogen 2.872 N/A ARG 469.A NH2 GLU 459.A OE1 no hydrogen 2.835 N/A PHE 470.A N PRO 467.A O no hydrogen 2.926 N/A ARG 471.A N GLU 468.A O no hydrogen 3.015 N/A ARG 471.A NE ILE 466.A O no hydrogen 2.834 N/A ARG 471.A NH2 ILE 466.A O no hydrogen 2.945 N/A