Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3syt_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ASN 2.A N GLN 8.A OE1 no hydrogen 3.256 N/A SER 5.A N ASN 2.A O no hydrogen 3.302 N/A TYR 7.A OH GLY 44.A O no hydrogen 2.691 N/A GLN 8.A N SER 5.A OG no hydrogen 3.068 N/A GLN 8.A NE2 ALA 314.A O no hydrogen 3.363 N/A HIS 9.A N ALA 6.A O no hydrogen 3.288 N/A HIS 9.A NE2 PHE 3.A O no hydrogen 2.754 N/A GLY 10.A N TYR 7.A O no hydrogen 3.082 N/A PHE 11.A N ALA 6.A O no hydrogen 3.014 N/A VAL 12.A N VAL 274.A O no hydrogen 2.926 N/A ARG 13.A N TYR 7.A OH no hydrogen 3.300 N/A ARG 13.A NE ASP 273.A OD1 no hydrogen 2.596 N/A ARG 13.A NE ASP 273.A OD2 no hydrogen 3.300 N/A ARG 13.A NH1 ASP 43.A O no hydrogen 3.082 N/A ARG 13.A NH1 ILE 317.A O no hydrogen 2.989 N/A ARG 13.A NH2 ASP 273.A OD2 no hydrogen 2.616 N/A ARG 13.A NH2 ILE 317.A O no hydrogen 2.829 N/A ARG 13.A NH2 GLY 318.A O no hydrogen 3.216 N/A VAL 14.A N ALA 272.A O no hydrogen 3.074 N/A ALA 15.A N LEU 47.A O no hydrogen 2.786 N/A ALA 16.A N SER 270.A O no hydrogen 2.865 N/A CYS 17.A N VAL 49.A O no hydrogen 2.753 N/A THR 18.A N ARG 268.A O no hydrogen 2.932 N/A THR 18.A OG1 ALA 232.A O no hydrogen 2.839 N/A HIS 19.A N HIS 19.A ND1 no hydrogen 2.917 N/A HIS 20.A N SER 32.A OG no hydrogen 3.129 N/A THR 21.A N GLU 235.A O no hydrogen 3.074 N/A THR 21.A OG1 GLU 237.A OE2 no hydrogen 3.325 N/A THR 22.A N ASN 29.A OD1 no hydrogen 2.777 N/A GLY 24.A N SER 56.A O no hydrogen 3.054 N/A ASP 25.A N THR 22.A O no hydrogen 3.044 N/A ALA 28.A N ASP 25.A O no hydrogen 2.915 N/A ALA 28.A N ASP 25.A OD1 no hydrogen 3.437 N/A ASN 29.A N ASP 25.A O no hydrogen 3.119 N/A ASN 29.A ND2 THR 22.A O no hydrogen 3.234 N/A ASN 29.A ND2 LEU 55.A O no hydrogen 3.192 N/A ALA 30.A N PRO 26.A O no hydrogen 2.741 N/A ALA 31.A N ALA 27.A O no hydrogen 2.968 N/A SER 32.A N ALA 28.A O no hydrogen 3.068 N/A VAL 33.A N ASN 29.A O no hydrogen 2.826 N/A LEU 34.A N ALA 30.A O no hydrogen 2.665 N/A ASP 35.A N ALA 31.A O no hydrogen 3.184 N/A MET 36.A N SER 32.A O no hydrogen 2.962 N/A ALA 37.A N VAL 33.A O no hydrogen 2.801 N/A ARG 38.A N LEU 34.A O no hydrogen 2.986 N/A ARG 38.A NH2 GLU 83.A OE1 no hydrogen 3.443 N/A ALA 39.A N ASP 35.A O no hydrogen 3.213 N/A CYS 40.A N MET 36.A O no hydrogen 3.011 N/A CYS 40.A SG MET 36.A O no hydrogen 3.513 N/A HIS 41.A N ALA 37.A O no hydrogen 2.817 N/A ASP 42.A N ARG 38.A O no hydrogen 2.993 N/A ASP 43.A N ALA 39.A O no hydrogen 2.965 N/A GLY 44.A N HIS 41.A O no hydrogen 2.842 N/A ALA 45.A N CYS 40.A O no hydrogen 3.007 N/A ALA 46.A N ARG 13.A O no hydrogen 2.619 N/A ALA 48.A N VAL 90.A O no hydrogen 2.937 N/A VAL 49.A N ALA 15.A O no hydrogen 2.823 N/A PHE 50.A N VAL 92.A O no hydrogen 3.058 N/A GLU 52.A N SER 201.A O no hydrogen 3.009 N/A THR 54.A OG1 PRO 51.A O no hydrogen 2.460 N/A LEU 55.A N GLY 94.A O no hydrogen 2.973 N/A SER 56.A N LEU 53.A O no hydrogen 3.161 N/A SER 56.A OG LEU 53.A O no hydrogen 3.412 N/A SER 56.A OG GLY 57.A O no hydrogen 2.926 N/A GLY 57.A N LEU 53.A O no hydrogen 2.774 N/A TYR 58.A N GLU 237.A OE2 no hydrogen 2.969 N/A TYR 58.A OH GLU 132.A OE2 no hydrogen 2.769 N/A SER 59.A N GLU 237.A OE1 no hydrogen 3.044 N/A SER 59.A OG GLU 237.A OE1 no hydrogen 2.669 N/A VAL 63.A N ILE 60.A O no hydrogen 2.953 N/A LEU 64.A N GLU 61.A O no hydrogen 2.899 N/A LEU 65.A N ASP 62.A O no hydrogen 3.118 N/A GLN 66.A N VAL 63.A O no hydrogen 3.226 N/A GLN 66.A NE2 ASP 62.A O no hydrogen 3.363 N/A LEU 69.A N GLN 66.A O no hydrogen 2.816 N/A LEU 70.A N GLN 66.A O no hydrogen 2.983 N/A ASP 71.A N ASP 67.A O no hydrogen 2.761 N/A ALA 72.A N SER 68.A O no hydrogen 3.052 N/A VAL 73.A N LEU 69.A O no hydrogen 2.934 N/A GLU 74.A N LEU 70.A O no hydrogen 3.091 N/A ASP 75.A N ASP 71.A O no hydrogen 3.056 N/A ALA 76.A N ALA 72.A O no hydrogen 2.922 N/A LEU 77.A N VAL 73.A O no hydrogen 2.951 N/A LEU 78.A N GLU 74.A O no hydrogen 3.045 N/A ASP 79.A N ASP 75.A O no hydrogen 3.224 N/A LEU 80.A N ALA 76.A O no hydrogen 2.954 N/A VAL 81.A N LEU 77.A O no hydrogen 2.885 N/A THR 82.A N LEU 78.A O no hydrogen 3.022 N/A THR 82.A OG1 LEU 78.A O no hydrogen 2.890 N/A GLU 83.A N ASP 79.A O no hydrogen 2.870 N/A SER 84.A N LEU 80.A O no hydrogen 2.828 N/A SER 84.A N VAL 81.A O no hydrogen 3.213 N/A SER 84.A OG VAL 81.A O no hydrogen 2.792 N/A ALA 85.A N THR 82.A O no hydrogen 3.256 N/A ASP 86.A N GLU 83.A O no hydrogen 3.200 N/A LEU 87.A N SER 84.A O no hydrogen 3.097 N/A LEU 88.A N HIS 41.A ND1 no hydrogen 2.799 N/A VAL 90.A N ALA 46.A O no hydrogen 2.734 N/A LEU 91.A N ILE 110.A O no hydrogen 2.794 N/A VAL 92.A N ALA 48.A O no hydrogen 2.904 N/A VAL 93.A N VAL 108.A O no hydrogen 3.064 N/A GLY 94.A N THR 54.A OG1 no hydrogen 2.901 N/A ALA 95.A N THR 106.A O no hydrogen 3.082 N/A LEU 97.A N TYR 104.A O no hydrogen 2.989 N/A ARG 98.A NH2 ASP 67.A OD1 no hydrogen 2.979 N/A HIS 99.A N ARG 102.A O no hydrogen 2.856 N/A ARG 102.A N HIS 99.A O no hydrogen 3.103 N/A ARG 102.A NH2 ARG 133.A O no hydrogen 3.074 N/A TYR 104.A N LEU 97.A O no hydrogen 2.769 N/A ASN 105.A ND2 GLU 52.A OE2 no hydrogen 2.708 N/A ASN 105.A ND2 GLU 132.A OE1 no hydrogen 3.469 N/A THR 106.A N ALA 95.A O no hydrogen 3.015 N/A THR 106.A OG1 ALA 95.A O no hydrogen 2.776 N/A ALA 107.A N VAL 119.A O no hydrogen 2.737 N/A VAL 108.A N VAL 93.A O no hydrogen 2.668 N/A VAL 109.A N GLY 117.A O no hydrogen 2.966 N/A ILE 110.A N LEU 91.A O no hydrogen 2.740 N/A HIS 111.A N ALA 114.A O no hydrogen 2.794 N/A ARG 112.A NH1 ALA 85.A O no hydrogen 3.273 N/A GLY 113.A N SER 84.A OG no hydrogen 2.828 N/A ALA 114.A N HIS 111.A O no hydrogen 2.965 N/A LEU 116.A N VAL 109.A O no hydrogen 2.771 N/A VAL 118.A N ALA 154.A O no hydrogen 2.858 N/A VAL 119.A N ALA 107.A O no hydrogen 2.890 N/A LYS 121.A N ASN 105.A O no hydrogen 2.685 N/A LYS 121.A NZ GLU 52.A OE2 no hydrogen 2.850 N/A LYS 121.A NZ GLU 132.A OE1 no hydrogen 2.990 N/A LYS 121.A NZ GLU 132.A OE2 no hydrogen 3.223 N/A SER 122.A N ASP 178.A OD1 no hydrogen 3.013 N/A SER 122.A N ASP 178.A OD2 no hydrogen 3.443 N/A TYR 123.A N ASP 178.A OD1 no hydrogen 3.097 N/A THR 126.A OG1 LEU 124.A O no hydrogen 3.330 N/A TYR 127.A N PHE 130.A O no hydrogen 2.904 N/A TYR 127.A OH GLU 177.A OE1 no hydrogen 3.342 N/A TYR 127.A OH GLU 177.A OE2 no hydrogen 2.744 N/A GLU 129.A N GLU 129.A OE1 no hydrogen 2.939 N/A PHE 130.A N TYR 127.A O no hydrogen 2.724 N/A GLU 132.A N PRO 125.A O no hydrogen 3.030 N/A ARG 133.A N THR 126.A OG1 no hydrogen 3.188 N/A ARG 134.A N TYR 131.A O no hydrogen 3.077 N/A ARG 134.A NE ASP 62.A OD1 no hydrogen 2.677 N/A ARG 134.A NE ASP 62.A OD2 no hydrogen 3.244 N/A ARG 134.A NH2 ASP 62.A OD2 no hydrogen 2.763 N/A GLN 135.A N GLU 132.A O no hydrogen 3.133 N/A GLN 135.A NE2 GLU 61.A OE1 no hydrogen 2.929 N/A GLN 135.A NE2 ASP 62.A OD1 no hydrogen 2.811 N/A MET 136.A N GLU 132.A O no hydrogen 2.958 N/A ALA 137.A N ILE 103.A O no hydrogen 2.961 N/A GLU 142.A N GLY 139.A O no hydrogen 2.774 N/A ARG 143.A NH1 GLU 142.A O no hydrogen 2.887 N/A ARG 143.A NH1 THR 157.A OG1 no hydrogen 3.156 N/A ILE 146.A N VAL 153.A O no hydrogen 2.762 N/A ARG 147.A NH1 ASP 152.A OD1 no hydrogen 2.906 N/A ILE 148.A N ALA 151.A O no hydrogen 2.901 N/A ALA 151.A N ILE 148.A O no hydrogen 3.110 N/A VAL 153.A N ILE 146.A O no hydrogen 2.874 N/A PHE 155.A N GLY 144.A O no hydrogen 2.845 N/A GLY 156.A N VAL 118.A O no hydrogen 3.064 N/A LEU 160.A N ARG 304.A O no hydrogen 2.939 N/A PHE 161.A N LEU 171.A O no hydrogen 2.823 N/A ALA 162.A N ILE 306.A O no hydrogen 2.868 N/A ALA 163.A N PHE 169.A O no hydrogen 3.129 N/A SER 164.A N PHE 308.A O no hydrogen 2.767 N/A LEU 166.A N ALA 163.A O no hydrogen 3.358 N/A PHE 169.A N LEU 166.A O no hydrogen 2.931 N/A VAL 170.A N THR 195.A OG1 no hydrogen 3.119 N/A LEU 171.A N PHE 161.A O no hydrogen 2.680 N/A HIS 172.A N VAL 196.A O no hydrogen 3.061 N/A GLU 174.A N ALA 198.A O no hydrogen 2.975 N/A ILE 175.A N ASP 178.A OD2 no hydrogen 2.796 N/A CYS 176.A N ASN 199.A OD1 no hydrogen 3.000 N/A CYS 176.A N LEU 200.A O no hydrogen 2.768 N/A CYS 176.A SG SER 201.A OG no hydrogen 3.132 N/A ASP 178.A N ILE 175.A O no hydrogen 2.829 N/A MET 179.A N CYS 176.A O no hydrogen 3.069 N/A PHE 180.A N GLU 177.A O no hydrogen 2.931 N/A SER 186.A N GLU 174.A OE1 no hydrogen 3.125 N/A SER 186.A OG GLU 174.A OE1 no hydrogen 3.481 N/A SER 186.A OG GLU 174.A OE2 no hydrogen 2.899 N/A ALA 187.A N PRO 184.A O no hydrogen 3.029 N/A ALA 189.A N PRO 185.A O no hydrogen 2.964 N/A ALA 190.A N SER 186.A O no hydrogen 2.889 N/A LEU 191.A N ALA 187.A O no hydrogen 3.206 N/A ALA 192.A N GLU 188.A O no hydrogen 2.969 N/A GLY 193.A N ALA 190.A O no hydrogen 3.025 N/A ALA 194.A N ALA 189.A O no hydrogen 2.849 N/A THR 195.A N VAL 170.A O no hydrogen 2.796 N/A THR 195.A OG1 GLY 168.A O no hydrogen 2.545 N/A THR 195.A OG1 VAL 170.A O no hydrogen 3.509 N/A VAL 196.A N VAL 170.A O no hydrogen 3.101 N/A LEU 197.A N ALA 227.A O no hydrogen 2.838 N/A ALA 198.A N HIS 172.A O no hydrogen 2.896 N/A ASN 199.A N VAL 229.A O no hydrogen 2.792 N/A ASN 199.A ND2 CYS 176.A O no hydrogen 3.443 N/A ASN 199.A ND2 TYR 228.A OH no hydrogen 3.062 N/A LEU 200.A N GLU 174.A O no hydrogen 3.311 N/A SER 201.A N ALA 231.A O no hydrogen 2.797 N/A SER 201.A OG ASN 199.A OD1 no hydrogen 3.452 N/A SER 201.A OG TYR 230.A OH no hydrogen 3.249 N/A ILE 205.A N ALA 243.A O no hydrogen 2.784 N/A THR 206.A OG1 ILE 207.A O no hydrogen 3.492 N/A ARG 209.A N THR 206.A O no hydrogen 3.010 N/A ARG 209.A NH1 GLU 129.A OE2 no hydrogen 2.928 N/A ARG 209.A NH1 PRO 204.A O no hydrogen 2.537 N/A ARG 209.A NH2 GLU 129.A OE2 no hydrogen 2.811 N/A ASP 212.A N GLY 208.A O no hydrogen 3.230 N/A ARG 213.A N ARG 209.A O no hydrogen 2.829 N/A ARG 213.A NE SER 203.A OG no hydrogen 2.811 N/A ARG 213.A NH1 ASP 245.A OD1 no hydrogen 2.892 N/A ARG 213.A NH1 ASP 245.A OD2 no hydrogen 3.176 N/A ARG 213.A NH1 GLN 247.A OE1 no hydrogen 2.952 N/A ARG 213.A NH2 SER 203.A O no hydrogen 3.007 N/A ARG 213.A NH2 SER 203.A OG no hydrogen 3.096 N/A ARG 213.A NH2 ASP 245.A OD1 no hydrogen 3.074 N/A ARG 214.A N ALA 210.A O no hydrogen 2.998 N/A LEU 215.A N GLU 211.A O no hydrogen 2.765 N/A LEU 216.A N ASP 212.A O no hydrogen 3.074 N/A ALA 217.A N ARG 213.A O no hydrogen 2.862 N/A ARG 218.A N ARG 214.A O no hydrogen 2.748 N/A ARG 218.A NE GLY 254.A O no hydrogen 2.826 N/A SER 219.A N LEU 215.A O no hydrogen 2.943 N/A SER 219.A OG LEU 215.A O no hydrogen 2.968 N/A SER 219.A OG LEU 216.A O no hydrogen 3.505 N/A ALA 220.A N LEU 216.A O no hydrogen 3.081 N/A SER 221.A N ALA 217.A O no hydrogen 3.016 N/A SER 221.A OG ALA 217.A O no hydrogen 3.444 N/A SER 221.A OG ARG 218.A O no hydrogen 2.741 N/A ALA 222.A N ARG 218.A O no hydrogen 3.047 N/A ARG 223.A N SER 219.A O no hydrogen 2.787 N/A CYS 224.A N ALA 220.A O no hydrogen 2.913 N/A LEU 225.A N ALA 222.A O no hydrogen 3.276 N/A ALA 226.A N SER 221.A O no hydrogen 2.959 N/A ALA 227.A N THR 195.A O no hydrogen 2.881 N/A TYR 228.A N TRP 251.A O no hydrogen 2.834 N/A TYR 228.A OH GLU 174.A OE2 no hydrogen 2.612 N/A VAL 229.A N LEU 197.A O no hydrogen 2.796 N/A TYR 230.A N MET 249.A O no hydrogen 2.891 N/A TYR 230.A OH SER 201.A OG no hydrogen 3.249 N/A ALA 231.A N ASN 199.A O no hydrogen 3.276 N/A ALA 232.A N GLN 247.A O no hydrogen 2.969 N/A ALA 233.A N GLY 202.A O no hydrogen 3.268 N/A GLU 237.A N GLY 234.A O no hydrogen 3.409 N/A SER 238.A N SER 59.A OG no hydrogen 2.943 N/A THR 240.A N SER 238.A OG no hydrogen 3.077 N/A THR 240.A OG1 SER 238.A OG no hydrogen 2.560 N/A TRP 244.A NE1 SER 238.A O no hydrogen 2.784 N/A GLY 246.A N ALA 233.A O no hydrogen 3.014 N/A GLN 247.A N ASP 245.A OD1 no hydrogen 3.061 N/A THR 248.A N SER 260.A OG no hydrogen 3.137 N/A THR 248.A OG1 ALA 16.A O no hydrogen 3.491 N/A THR 248.A OG1 SER 260.A OG no hydrogen 2.618 N/A THR 248.A OG1 SER 270.A OG no hydrogen 2.843 N/A MET 249.A N TYR 230.A O no hydrogen 2.904 N/A ILE 250.A N ALA 258.A O no hydrogen 2.947 N/A TRP 251.A N TYR 228.A O no hydrogen 2.806 N/A GLU 252.A N ALA 255.A O no hydrogen 2.777 N/A ASN 253.A N ALA 226.A O no hydrogen 2.951 N/A GLY 254.A N SER 221.A OG no hydrogen 2.995 N/A ALA 255.A N GLU 252.A O no hydrogen 2.830 N/A LEU 257.A N ILE 250.A O no hydrogen 2.830 N/A SER 260.A N THR 248.A O no hydrogen 3.067 N/A SER 260.A OG THR 248.A OG1 no hydrogen 2.618 N/A ARG 262.A NE ASP 245.A OD2 no hydrogen 2.763 N/A ARG 262.A NH2 ASP 245.A OD2 no hydrogen 3.074 N/A PHE 263.A N ASP 245.A O no hydrogen 2.759 N/A LYS 265.A NZ GLU 235.A OE2 no hydrogen 2.932 N/A GLY 266.A N GLU 235.A OE1 no hydrogen 3.153 N/A ARG 268.A N THR 18.A O no hydrogen 3.383 N/A ARG 268.A NE GLU 261.A OE1 no hydrogen 2.998 N/A ARG 268.A NH1 LYS 265.A O no hydrogen 3.288 N/A ARG 268.A NH1 VAL 267.A O no hydrogen 2.742 N/A ARG 268.A NH2 GLU 261.A OE1 no hydrogen 2.936 N/A ARG 268.A NH2 LYS 265.A O no hydrogen 3.090 N/A ARG 269.A NH2 ASP 43.A OD2 no hydrogen 2.267 N/A SER 270.A N ALA 16.A O no hydrogen 2.899 N/A SER 270.A OG THR 248.A O no hydrogen 3.373 N/A SER 270.A OG THR 248.A OG1 no hydrogen 2.843 N/A ALA 272.A N VAL 14.A O no hydrogen 3.119 N/A ASP 273.A N LEU 320.A O no hydrogen 2.848 N/A VAL 274.A N VAL 12.A O no hydrogen 2.932 N/A ASP 275.A N GLU 252.A OE1 no hydrogen 2.748 N/A THR 276.A N GLY 10.A O no hydrogen 2.908 N/A THR 276.A OG1 GLY 10.A O no hydrogen 2.662 N/A LEU 278.A N ASP 275.A OD1 no hydrogen 3.147 N/A LEU 279.A N ASP 275.A O no hydrogen 3.319 N/A ARG 280.A N THR 276.A O no hydrogen 2.835 N/A SER 281.A N GLU 277.A O no hydrogen 2.750 N/A SER 281.A OG GLU 277.A O no hydrogen 2.993 N/A SER 281.A OG TYR 558.A O no hydrogen 2.793 N/A GLU 282.A N LEU 278.A O no hydrogen 2.947 N/A ARG 283.A N LEU 279.A O no hydrogen 3.035 N/A ARG 283.A NE LEU 225.A O no hydrogen 3.120 N/A ARG 283.A NH1 ALA 194.A O no hydrogen 3.097 N/A ARG 283.A NH2 ALA 194.A O no hydrogen 2.773 N/A ARG 283.A NH2 CYS 224.A O no hydrogen 2.819 N/A ARG 283.A NH2 LEU 225.A O no hydrogen 3.217 N/A LEU 284.A N ARG 280.A O no hydrogen 2.911 N/A ARG 285.A N GLU 282.A O no hydrogen 3.316 N/A ARG 285.A NH1 SER 281.A O no hydrogen 3.190 N/A MET 286.A N GLU 282.A O no hydrogen 3.053 N/A GLY 287.A N ARG 285.A O no hydrogen 3.144 N/A PHE 289.A N MET 286.A O no hydrogen 2.951 N/A ASP 291.A N GLY 287.A O no hydrogen 2.921 N/A ASN 292.A N THR 288.A O no hydrogen 3.045 N/A ARG 293.A N PHE 289.A O no hydrogen 3.120 N/A ARG 293.A NE ASP 290.A OD1 no hydrogen 2.845 N/A ARG 293.A NH2 ASP 290.A OD1 no hydrogen 3.203 N/A ARG 294.A N ASP 290.A O no hydrogen 2.869 N/A HIS 295.A N ASP 291.A O no hydrogen 3.015 N/A HIS 296.A N ASN 292.A O no hydrogen 3.041 N/A ARG 297.A N ARG 294.A O no hydrogen 3.325 N/A THR 300.A N HIS 296.A O no hydrogen 2.912 N/A THR 300.A N ARG 297.A O no hydrogen 3.050 N/A THR 300.A OG1 HIS 296.A O no hydrogen 2.897 N/A THR 300.A OG1 ARG 297.A O no hydrogen 3.328 N/A GLU 301.A N ARG 297.A O no hydrogen 2.889 N/A SER 302.A OG LEU 299.A O no hydrogen 3.167 N/A ARG 304.A N ASP 158.A O no hydrogen 3.031 N/A ARG 304.A NE ASP 158.A OD1 no hydrogen 3.363 N/A ARG 304.A NE ASP 158.A OD2 no hydrogen 2.973 N/A ARG 304.A NH1 GLY 144.A O no hydrogen 2.924 N/A ARG 304.A NH2 PHE 155.A O no hydrogen 2.763 N/A ARG 304.A NH2 ASP 158.A OD1 no hydrogen 2.758 N/A ILE 306.A N LEU 160.A O no hydrogen 2.731 N/A PHE 308.A N ALA 162.A O no hydrogen 3.107 N/A LEU 310.A N ASP 165.A OD1 no hydrogen 2.979 N/A ASP 311.A N ASP 165.A OD2 no hydrogen 2.702 N/A GLY 318.A N ASP 316.A OD1 no hydrogen 2.746 N/A LEU 320.A N ASP 273.A OD2 no hydrogen 2.774 N/A ARG 321.A N LEU 319.A O no hydrogen 2.845 N/A ARG 321.A NH1 GLU 252.A OE1 no hydrogen 2.895 N/A ARG 321.A NH1 ASP 273.A O no hydrogen 2.842 N/A ARG 321.A NH2 GLU 252.A OE1 no hydrogen 3.498 N/A ARG 321.A NH2 GLU 252.A OE2 no hydrogen 2.711 N/A ARG 325.A NH1 ARG 578.A O no hydrogen 3.058 N/A ARG 325.A NH1 ASN 580.A O no hydrogen 3.347 N/A ARG 325.A NH2 ARG 578.A O no hydrogen 2.775 N/A VAL 329.A N PHE 326.A O no hydrogen 2.716 N/A ALA 331.A N GLU 324.A OE1 no hydrogen 3.063 N/A ALA 331.A N GLU 324.A OE2 no hydrogen 3.330 N/A ARG 335.A N ASP 332.A OD2 no hydrogen 3.125 N/A LEU 336.A N ASP 332.A O no hydrogen 2.763 N/A GLN 337.A N PRO 333.A O no hydrogen 2.935 N/A GLN 338.A N GLN 334.A O no hydrogen 3.094 N/A GLN 338.A NE2 GLU 342.A OE2 no hydrogen 3.177 N/A ASP 339.A N ARG 335.A O no hydrogen 3.043 N/A CYS 340.A N LEU 336.A O no hydrogen 2.964 N/A CYS 340.A SG LEU 336.A O no hydrogen 3.256 N/A TYR 341.A N GLN 337.A O no hydrogen 3.039 N/A GLU 342.A N GLN 338.A O no hydrogen 2.984 N/A ALA 343.A N ASP 339.A O no hydrogen 2.749 N/A TYR 344.A N CYS 340.A O no hydrogen 2.831 N/A ASN 345.A N TYR 341.A O no hydrogen 3.110 N/A ASN 345.A ND2 TYR 341.A O no hydrogen 2.681 N/A ILE 346.A N GLU 342.A O no hydrogen 2.928 N/A ILE 346.A N ALA 343.A O no hydrogen 3.078 N/A GLN 347.A N ALA 343.A O no hydrogen 3.014 N/A GLN 347.A NE2 VAL 498.A O no hydrogen 2.952 N/A GLN 347.A NE2 ASN 499.A OD1 no hydrogen 2.949 N/A VAL 348.A N TYR 344.A O no hydrogen 2.992 N/A SER 349.A N ASN 345.A O no hydrogen 2.968 N/A SER 349.A OG ASN 345.A O no hydrogen 2.936 N/A SER 349.A OG ILE 346.A O no hydrogen 3.304 N/A GLY 350.A N ILE 346.A O no hydrogen 2.814 N/A LEU 351.A N GLN 347.A O no hydrogen 3.140 N/A GLU 352.A N VAL 348.A O no hydrogen 2.731 N/A GLN 353.A N SER 349.A O no hydrogen 3.210 N/A ARG 354.A N GLY 350.A O no hydrogen 3.408 N/A ARG 354.A NH1 ASN 622.A OD1 no hydrogen 3.378 N/A ARG 354.A NH2 ASN 622.A OD1 no hydrogen 2.777 N/A LEU 355.A N LEU 351.A O no hydrogen 2.990 N/A ARG 356.A N GLU 352.A O no hydrogen 2.831 N/A ARG 356.A NH1 GLU 387.A OE2 no hydrogen 2.712 N/A ARG 356.A NH2 GLN 353.A OE1 no hydrogen 2.806 N/A ALA 357.A N GLN 353.A O no hydrogen 2.854 N/A LEU 358.A N ARG 354.A O no hydrogen 2.953 N/A ASP 359.A N ARG 356.A O no hydrogen 2.926 N/A TYR 360.A N LEU 355.A O no hydrogen 2.803 N/A TYR 360.A OH GLU 387.A OE1 no hydrogen 2.759 N/A LYS 362.A N GLY 468.A O no hydrogen 3.060 N/A LYS 362.A NZ ARG 467.A O no hydrogen 2.912 N/A VAL 363.A N ASP 393.A O no hydrogen 2.843 N/A VAL 364.A N ILE 470.A O no hydrogen 2.834 N/A ILE 365.A N LEU 395.A O no hydrogen 3.124 N/A VAL 367.A N PHE 397.A O no hydrogen 2.863 N/A SER 368.A OG SER 373.A OG no hydrogen 3.286 N/A GLY 370.A N SER 368.A OG no hydrogen 3.326 N/A SER 373.A OG SER 368.A OG no hydrogen 3.286 N/A THR 374.A N GLY 370.A O no hydrogen 3.163 N/A THR 374.A OG1 GLY 370.A O no hydrogen 2.630 N/A HIS 375.A N LEU 371.A O no hydrogen 2.906 N/A HIS 375.A NE2 GLN 347.A OE1 no hydrogen 2.681 N/A ALA 376.A N ASP 372.A O no hydrogen 2.934 N/A LEU 377.A N SER 373.A O no hydrogen 2.810 N/A ILE 378.A N THR 374.A O no hydrogen 3.154 N/A VAL 379.A N HIS 375.A O no hydrogen 2.909 N/A ALA 380.A N ALA 376.A O no hydrogen 2.749 N/A THR 381.A N LEU 377.A O no hydrogen 2.997 N/A THR 381.A OG1 LEU 377.A O no hydrogen 2.767 N/A HIS 382.A N ILE 378.A O no hydrogen 2.990 N/A ALA 383.A N VAL 379.A O no hydrogen 2.959 N/A MET 384.A N ALA 380.A O no hydrogen 2.925 N/A ASP 385.A N THR 381.A O no hydrogen 2.814 N/A ARG 386.A N HIS 382.A O no hydrogen 2.848 N/A GLU 387.A N ALA 383.A O no hydrogen 3.021 N/A GLY 388.A N ASP 385.A O no hydrogen 2.823 N/A ARG 389.A N MET 384.A O no hydrogen 2.764 N/A ARG 391.A NE ASP 385.A OD1 no hydrogen 3.250 N/A ARG 391.A NE ASP 385.A OD2 no hydrogen 3.443 N/A ARG 391.A NH1 LEU 413.A O no hydrogen 2.738 N/A ARG 391.A NH2 ASP 385.A OD2 no hydrogen 2.810 N/A ASP 393.A N PRO 390.A O no hydrogen 3.101 N/A ILE 394.A N ARG 391.A O no hydrogen 3.062 N/A LEU 395.A N VAL 363.A O no hydrogen 2.616 N/A ALA 396.A N THR 416.A O no hydrogen 2.783 N/A PHE 397.A N ILE 365.A O no hydrogen 2.912 N/A ALA 398.A N SER 418.A O no hydrogen 2.971 N/A PHE 402.A N GLN 452.A OE1 no hydrogen 3.022 N/A LYS 408.A N ASN 404.A O no hydrogen 3.022 N/A LEU 409.A N ASN 405.A O no hydrogen 2.803 N/A ALA 410.A N ALA 406.A O no hydrogen 2.957 N/A ARG 411.A N ILE 407.A O no hydrogen 2.822 N/A ALA 412.A N LYS 408.A O no hydrogen 2.989 N/A LEU 413.A N LEU 409.A O no hydrogen 2.840 N/A GLY 414.A N ALA 410.A O no hydrogen 2.891 N/A VAL 415.A N ALA 410.A O no hydrogen 3.295 N/A THR 416.A N ILE 394.A O no hydrogen 2.964 N/A THR 416.A OG1 SER 392.A O no hydrogen 2.763 N/A SER 418.A N ALA 396.A O no hydrogen 3.137 N/A ILE 420.A N ALA 398.A O no hydrogen 2.886 N/A ILE 422.A N PRO 400.A O no hydrogen 3.088 N/A GLY 423.A N ASP 421.A OD1 no hydrogen 2.866 N/A THR 425.A OG1 TYR 459.A OH no hydrogen 2.724 N/A ALA 426.A N ILE 422.A O no hydrogen 2.902 N/A ARG 427.A N GLY 423.A O no hydrogen 2.757 N/A ARG 427.A NH1 ASP 424.A OD1 no hydrogen 2.936 N/A LEU 428.A N ASP 424.A O no hydrogen 2.939 N/A MET 429.A N THR 425.A O no hydrogen 2.864 N/A LEU 430.A N ALA 426.A O no hydrogen 2.788 N/A HIS 431.A N ARG 427.A O no hydrogen 2.937 N/A THR 432.A N LEU 428.A O no hydrogen 2.877 N/A THR 432.A OG1 LEU 428.A O no hydrogen 2.768 N/A ILE 433.A N MET 429.A O no hydrogen 3.083 N/A GLY 434.A N HIS 431.A O no hydrogen 2.871 N/A HIS 435.A N LEU 430.A O no hydrogen 2.790 N/A HIS 435.A NE2 ASP 445.A OD2 no hydrogen 2.839 N/A SER 438.A N HIS 435.A O no hydrogen 3.169 N/A SER 438.A OG HIS 435.A O no hydrogen 2.742 N/A VAL 439.A N PRO 436.A O no hydrogen 3.112 N/A GLY 440.A N TYR 437.A O no hydrogen 2.838 N/A VAL 443.A N GLU 441.A O no hydrogen 2.929 N/A GLU 449.A N ASP 445.A O no hydrogen 3.084 N/A ASN 450.A N VAL 446.A O no hydrogen 2.824 N/A VAL 451.A N THR 447.A O no hydrogen 2.838 N/A GLN 452.A NE2 PHE 448.A O no hydrogen 3.567 N/A ALA 453.A N GLU 449.A O no hydrogen 3.093 N/A GLY 454.A N ASN 450.A O no hydrogen 2.726 N/A LEU 455.A N VAL 451.A O no hydrogen 2.905 N/A ARG 456.A N GLN 452.A O no hydrogen 2.979 N/A ARG 456.A NE LEU 399.A O no hydrogen 2.756 N/A ARG 456.A NH2 LEU 399.A O no hydrogen 2.957 N/A THR 457.A N ALA 453.A O no hydrogen 3.358 N/A ASP 458.A N GLY 454.A O no hydrogen 2.793 N/A TYR 459.A N LEU 455.A O no hydrogen 2.798 N/A TYR 459.A OH THR 425.A OG1 no hydrogen 2.724 N/A LEU 460.A N ARG 456.A O no hydrogen 2.989 N/A PHE 461.A N THR 457.A O no hydrogen 2.835 N/A ARG 462.A N ASP 458.A O no hydrogen 2.981 N/A ARG 462.A NH1 ASN 465.A OD1 no hydrogen 2.459 N/A ILE 463.A N TYR 459.A O no hydrogen 2.801 N/A ALA 464.A N LEU 460.A O no hydrogen 2.776 N/A ASN 465.A N PHE 461.A O no hydrogen 2.921 N/A GLN 466.A N ARG 462.A O no hydrogen 2.870 N/A ARG 467.A N ILE 463.A O no hydrogen 2.725 N/A ARG 467.A NH1 GLN 466.A OE1 no hydrogen 2.547 N/A GLY 469.A N ALA 464.A O no hydrogen 2.915 N/A ILE 470.A N LYS 362.A O no hydrogen 2.957 N/A VAL 471.A N HIS 495.A ND1 no hydrogen 2.860 N/A LEU 472.A N VAL 364.A O no hydrogen 2.896 N/A GLY 473.A N TYR 496.A O no hydrogen 2.700 N/A ASP 476.A N GLU 479.A OE1 no hydrogen 3.269 N/A LEU 477.A N VAL 502.A O no hydrogen 2.886 N/A SER 478.A OG ASP 549.A OD1 no hydrogen 2.437 N/A SER 478.A OG ASP 549.A OD2 no hydrogen 2.984 N/A GLU 479.A N ASP 476.A OD1 no hydrogen 2.806 N/A LEU 480.A N ASP 476.A O no hydrogen 3.064 N/A ALA 481.A N LEU 477.A O no hydrogen 2.784 N/A LEU 482.A N SER 478.A O no hydrogen 3.152 N/A TRP 484.A N GLU 479.A O no hydrogen 3.006 N/A THR 486.A N ASP 491.A OD1 no hydrogen 2.976 N/A THR 486.A OG1 ASN 450.A OD1 no hydrogen 3.052 N/A GLY 488.A N GLN 492.A OE1 no hydrogen 2.875 N/A GLN 492.A N THR 486.A O no hydrogen 3.221 N/A GLN 492.A NE2 LYS 616.A O no hydrogen 3.109 N/A GLN 492.A NE2 ALA 619.A O no hydrogen 2.913 N/A MET 493.A N GLY 490.A O no hydrogen 3.055 N/A HIS 495.A N VAL 471.A O no hydrogen 2.775 N/A ASN 497.A N ASN 622.A O no hydrogen 2.851 N/A ASN 497.A ND2 GLY 475.A O no hydrogen 2.959 N/A ASN 499.A N ASN 497.A OD1 no hydrogen 2.965 N/A ASN 499.A ND2 ASP 372.A O no hydrogen 2.971 N/A ASN 499.A ND2 THR 474.A O no hydrogen 3.013 N/A ALA 500.A N ASN 497.A O no hydrogen 3.450 N/A VAL 502.A N ASN 499.A O no hydrogen 2.964 N/A LYS 504.A N SER 478.A OG no hydrogen 2.726 N/A LYS 504.A NZ ASP 372.A OD2 no hydrogen 3.482 N/A LYS 504.A NZ ASP 476.A OD2 no hydrogen 2.476 N/A LYS 504.A NZ GLU 479.A OE2 no hydrogen 3.064 N/A THR 505.A N ASP 549.A OD2 no hydrogen 3.069 N/A THR 505.A OG1 ASP 549.A OD2 no hydrogen 2.628 N/A LEU 506.A N PRO 503.A O no hydrogen 3.040 N/A ILE 507.A N PRO 503.A O no hydrogen 3.292 N/A ILE 507.A N LYS 504.A O no hydrogen 3.156 N/A HIS 509.A N LEU 506.A O no hydrogen 2.862 N/A LEU 510.A N LEU 506.A O no hydrogen 2.996 N/A ILE 511.A N ILE 507.A O no hydrogen 3.023 N/A ARG 512.A N GLN 508.A O no hydrogen 3.124 N/A TRP 513.A N HIS 509.A O no hydrogen 2.833 N/A TRP 513.A NE1 GLN 337.A OE1 no hydrogen 2.914 N/A VAL 514.A N LEU 510.A O no hydrogen 2.873 N/A ILE 515.A N ILE 511.A O no hydrogen 3.021 N/A SER 516.A N ARG 512.A O no hydrogen 2.738 N/A ALA 517.A N TRP 513.A O no hydrogen 2.927 N/A GLY 518.A N VAL 514.A O no hydrogen 3.278 N/A GLY 521.A N GLY 518.A O no hydrogen 3.025 N/A GLY 525.A N GLY 521.A O no hydrogen 3.067 N/A GLU 526.A N GLU 522.A O no hydrogen 2.972 N/A VAL 527.A N LYS 523.A O no hydrogen 3.232 N/A LEU 528.A N VAL 524.A O no hydrogen 2.898 N/A GLN 529.A N GLY 525.A O no hydrogen 2.784 N/A GLN 529.A NE2 ASP 533.A OD1 no hydrogen 3.040 N/A SER 530.A N GLU 526.A O no hydrogen 2.936 N/A SER 530.A OG ASN 405.A OD1 no hydrogen 2.957 N/A VAL 531.A N VAL 527.A O no hydrogen 2.789 N/A LEU 532.A N LEU 528.A O no hydrogen 3.037 N/A ASP 533.A N GLN 529.A O no hydrogen 2.872 N/A THR 534.A N SER 530.A O no hydrogen 2.797 N/A THR 534.A OG1 SER 530.A O no hydrogen 3.007 N/A GLU 535.A N VAL 531.A O no hydrogen 2.911 N/A ILE 536.A N LEU 532.A O no hydrogen 3.159 N/A LYS 541.A N SER 538.A O no hydrogen 3.400 N/A VAL 542.A N SER 538.A O no hydrogen 3.205 N/A PHE 545.A N GLU 539.A OE1 no hydrogen 3.176 N/A LEU 547.A N PRO 544.A O no hydrogen 3.010 N/A GLN 548.A N PRO 544.A O no hydrogen 3.178 N/A GLN 548.A NE2 VAL 542.A O no hydrogen 2.948 N/A GLN 548.A NE2 TRP 601.A O no hydrogen 2.916 N/A ASP 549.A N PHE 545.A O no hydrogen 2.707 N/A PHE 550.A N ALA 546.A O no hydrogen 3.144 N/A SER 551.A N LEU 547.A O no hydrogen 2.973 N/A SER 551.A OG LEU 547.A O no hydrogen 3.442 N/A LEU 552.A N GLN 548.A O no hydrogen 2.953 N/A PHE 553.A N ASP 549.A O no hydrogen 3.219 N/A GLN 554.A N PHE 550.A O no hydrogen 3.318 N/A GLN 554.A NE2 PHE 550.A O no hydrogen 3.601 N/A VAL 555.A N SER 551.A O no hydrogen 2.917 N/A LEU 556.A N LEU 552.A O no hydrogen 2.735 N/A ARG 557.A N PHE 553.A O no hydrogen 2.854 N/A ARG 557.A NE GLU 282.A OE2 no hydrogen 3.011 N/A ARG 557.A NH1 HIS 628.A O no hydrogen 2.826 N/A ARG 557.A NH2 GLU 282.A OE1 no hydrogen 3.034 N/A ARG 557.A NH2 GLU 282.A OE2 no hydrogen 3.259 N/A TYR 558.A N GLN 554.A O no hydrogen 3.124 N/A GLY 559.A N VAL 555.A O no hydrogen 2.997 N/A ARG 561.A NH1 GLU 277.A OE1 no hydrogen 3.292 N/A ARG 561.A NH1 GLU 277.A OE2 no hydrogen 2.641 N/A ARG 561.A NH2 GLU 277.A OE2 no hydrogen 3.259 N/A SER 563.A N GLN 652.A OE1 no hydrogen 2.804 N/A LYS 564.A NZ HIS 9.A O no hydrogen 2.863 N/A LYS 564.A NZ ASP 275.A OD1 no hydrogen 2.772 N/A LYS 564.A NZ ASP 275.A OD2 no hydrogen 3.269 N/A LYS 564.A NZ GLU 277.A OE1 no hydrogen 2.905 N/A ILE 565.A N ARG 561.A O no hydrogen 3.076 N/A ALA 566.A N PRO 562.A O no hydrogen 2.824 N/A PHE 567.A N SER 563.A O no hydrogen 2.963 N/A LEU 568.A N LYS 564.A O no hydrogen 3.074 N/A ALA 569.A N ILE 565.A O no hydrogen 2.929 N/A TRP 570.A N ALA 566.A O no hydrogen 2.958 N/A HIS 571.A N PHE 567.A O no hydrogen 3.021 N/A ALA 572.A N LEU 568.A O no hydrogen 2.959 N/A TRP 573.A N ALA 569.A O no hydrogen 2.789 N/A TRP 573.A NE1 ARG 325.A O no hydrogen 3.126 N/A ASN 574.A N TRP 570.A O no hydrogen 3.046 N/A ASN 574.A ND2 TRP 570.A O no hydrogen 2.966 N/A GLU 577.A N ASP 575.A OD1 no hydrogen 2.816 N/A ARG 578.A N ASP 575.A O no hydrogen 3.286 N/A ARG 578.A N ASP 575.A OD1 no hydrogen 3.349 N/A TRP 581.A NE1 ALA 576.A O no hydrogen 2.915 N/A GLU 589.A N PRO 586.A O no hydrogen 2.748 N/A ARG 590.A NH1 PHE 585.A O no hydrogen 2.902 N/A TYR 593.A N TRP 573.A O no hydrogen 3.106 N/A SER 594.A N GLU 597.A OE1 no hydrogen 3.007 N/A SER 594.A OG GLU 597.A OE1 no hydrogen 3.448 N/A GLU 597.A N SER 594.A OG no hydrogen 3.085 N/A ILE 598.A N SER 594.A O no hydrogen 3.021 N/A ARG 599.A N LEU 595.A O no hydrogen 2.732 N/A ARG 599.A NE VAL 657.A O no hydrogen 2.985 N/A ARG 599.A NH2 VAL 657.A O no hydrogen 3.376 N/A HIS 600.A N ALA 596.A O no hydrogen 3.055 N/A TRP 601.A N GLU 597.A O no hydrogen 2.956 N/A LEU 602.A N ILE 598.A O no hydrogen 3.035 N/A GLN 603.A N ARG 599.A O no hydrogen 3.028 N/A ILE 604.A N HIS 600.A O no hydrogen 3.268 N/A PHE 605.A N TRP 601.A O no hydrogen 2.821 N/A VAL 606.A N LEU 602.A O no hydrogen 2.805 N/A GLN 607.A N GLN 603.A O no hydrogen 3.139 N/A ARG 608.A N ILE 604.A O no hydrogen 2.948 N/A ARG 608.A NE LEU 482.A O no hydrogen 2.565 N/A ARG 608.A NH2 LEU 482.A O no hydrogen 2.857 N/A ARG 608.A NH2 GLY 483.A O no hydrogen 3.228 N/A PHE 609.A N PHE 605.A O no hydrogen 2.712 N/A TYR 610.A N VAL 606.A O no hydrogen 2.954 N/A SER 611.A OG MET 644.A O no hydrogen 2.892 N/A PHE 612.A N GLN 607.A O no hydrogen 3.143 N/A SER 613.A N ARG 608.A O no hydrogen 2.882 N/A SER 613.A OG ALA 481.A O no hydrogen 3.262 N/A SER 613.A OG ARG 608.A O no hydrogen 2.394 N/A SER 613.A OG PHE 609.A O no hydrogen 3.420 N/A LYS 616.A N SER 613.A O no hydrogen 3.109 N/A LYS 616.A NZ GLY 483.A O no hydrogen 2.989 N/A LYS 616.A NZ SER 485.A O no hydrogen 2.897 N/A ARG 617.A NE GLN 614.A OE1 no hydrogen 2.790 N/A ARG 617.A NH1 LEU 480.A O no hydrogen 2.900 N/A ARG 617.A NH1 ALA 481.A O no hydrogen 3.044 N/A ARG 617.A NH1 SER 613.A OG no hydrogen 2.885 N/A ARG 617.A NH2 PHE 609.A O no hydrogen 2.831 N/A ARG 617.A NH2 GLN 614.A OE1 no hydrogen 2.736 N/A SER 618.A N GLN 614.A O no hydrogen 2.853 N/A SER 618.A N PHE 615.A O no hydrogen 3.291 N/A LYS 625.A NZ ASP 637.A OD1 no hydrogen 3.208 N/A GLY 629.A N SER 627.A OG no hydrogen 2.757 N/A GLY 630.A N SER 627.A O no hydrogen 3.137 N/A ALA 631.A N ASP 637.A OD2 no hydrogen 3.059 N/A ARG 635.A N SER 633.A OG no hydrogen 2.960 N/A ARG 635.A NH1 LEU 620.A O no hydrogen 2.772 N/A ARG 635.A NH2 LEU 620.A O no hydrogen 3.422 N/A ARG 635.A NH2 PRO 621.A O no hydrogen 3.280 N/A GLY 636.A N SER 633.A O no hydrogen 2.833 N/A TRP 638.A N SER 633.A O no hydrogen 3.287 N/A ARG 647.A N SER 645.A OG no hydrogen 2.867 N/A LEU 650.A N ALA 646.A O no hydrogen 3.179 N/A ASP 651.A N ARG 647.A O no hydrogen 2.858 N/A GLN 652.A N ILE 648.A O no hydrogen 2.931 N/A GLN 652.A NE2 SER 563.A OG no hydrogen 2.956 N/A ILE 653.A N TRP 649.A O no hydrogen 3.035 N/A ASP 654.A N LEU 650.A O no hydrogen 3.079 N/A ARG 655.A N ASP 651.A O no hydrogen 2.974 N/A ARG 655.A NE ASP 651.A OD2 no hydrogen 3.069 N/A GLU 656.A N GLN 652.A O no hydrogen 2.837 N/A VAL 657.A N ILE 653.A O no hydrogen 3.072 N/A