Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 2x6w_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): PHE 2.A N GLN 1.A O no hydrogen 2.271 N/A ARG 3.A NH1 GLU 7.A OE1 no hydrogen 2.808 N/A ILE 5.A N GLN 1.A O no hydrogen 3.254 N/A ILE 6.A N PHE 2.A O no hydrogen 2.939 N/A GLU 7.A N ARG 3.A O no hydrogen 2.963 N/A SER 8.A N ALA 4.A O no hydrogen 3.130 N/A SER 8.A N ILE 5.A O no hydrogen 3.179 N/A SER 8.A OG ILE 5.A O no hydrogen 2.601 N/A GLU 10.A N SER 8.A OG no hydrogen 3.268 N/A GLY 11.A N SER 8.A O no hydrogen 2.916 N/A GLY 13.A N GLU 10.A O no hydrogen 2.959 N/A HIS 14.A N GLY 11.A O no hydrogen 2.857 N/A HIS 14.A ND1 GLU 10.A O no hydrogen 2.883 N/A VAL 15.A N ALA 12.A O no hydrogen 3.464 N/A TYR 17.A N ARG 28.A O no hydrogen 2.801 N/A GLN 18.A NE2 SER 25.A O no hydrogen 2.899 N/A ARG 21.A N GLN 18.A O no hydrogen 3.130 N/A ASN 22.A N TYR 19.A O no hydrogen 2.786 N/A ASN 22.A ND2 SER 25.A OG no hydrogen 2.881 N/A GLY 24.A N ASN 22.A OD1 no hydrogen 3.262 N/A SER 25.A N ASN 22.A O no hydrogen 2.962 N/A ARG 28.A N TYR 17.A O no hydrogen 2.780 N/A ARG 28.A NH1 GLU 36.A OE2 no hydrogen 2.864 N/A ARG 28.A NH2 GLU 36.A OE2 no hydrogen 2.867 N/A MET 29.A N ASP 32.A OD2 no hydrogen 2.896 N/A VAL 30.A N VAL 15.A O no hydrogen 2.857 N/A SER 31.A N ALA 12.A O no hydrogen 3.067 N/A ASP 32.A N MET 29.A O no hydrogen 2.939 N/A LEU 34.A N VAL 30.A O no hydrogen 3.017 N/A ASP 35.A N SER 31.A O no hydrogen 2.871 N/A GLU 36.A N VAL 33.A O no hydrogen 3.044 N/A ARG 37.A N LEU 34.A O no hydrogen 3.237 N/A ARG 37.A NE LEU 34.A O no hydrogen 2.797 N/A ARG 37.A NH1 ASP 42.A OD2 no hydrogen 2.771 N/A ARG 37.A NH2 LEU 34.A O no hydrogen 3.310 N/A ARG 37.A NH2 ASP 42.A OD2 no hydrogen 3.038 N/A SER 39.A N ASP 42.A OD2 no hydrogen 3.067 N/A LEU 40.A N THR 80.A O no hydrogen 2.990 N/A TRP 41.A N SER 39.A OG no hydrogen 3.071 N/A ASP 42.A N SER 39.A O no hydrogen 2.988 N/A PHE 43.A N LEU 40.A O no hydrogen 3.033 N/A HIS 44.A ND1 ILE 52.A O no hydrogen 2.713 N/A HIS 44.A NE2 SER 60.A OG no hydrogen 2.727 N/A CYS 45.A SG PHE 43.A O no hydrogen 3.969 N/A CYS 45.A SG ASP 46.A O no hydrogen 3.785 N/A ASP 46.A N ASN 50.A O no hydrogen 2.921 N/A SER 48.A N ASP 46.A OD1 no hydrogen 2.899 N/A GLY 49.A N ASP 46.A O no hydrogen 2.915 N/A ASN 50.A N ASP 46.A OD1 no hydrogen 2.967 N/A ASN 50.A ND2 ASP 46.A OD2 no hydrogen 3.257 N/A ILE 52.A N HIS 44.A O no hydrogen 2.933 N/A VAL 58.A N GLY 55.A O no hydrogen 2.925 N/A SER 60.A N TYR 88.A O no hydrogen 2.780 N/A SER 60.A OG HIS 44.A NE2 no hydrogen 2.727 N/A ARG 61.A N ASP 59.A OD1 no hydrogen 3.087 N/A ARG 61.A NE SER 91.A OG no hydrogen 2.771 N/A TYR 63.A N SER 60.A O no hydrogen 3.178 N/A LEU 64.A N SER 60.A O no hydrogen 3.159 N/A GLN 65.A N ARG 61.A O no hydrogen 2.952 N/A GLN 65.A NE2 GLN 65.A O no hydrogen 3.581 N/A GLN 65.A NE2 ASP 69.A OD1 no hydrogen 2.910 N/A GLN 65.A NE2 GLN 105.A O no hydrogen 3.054 N/A ALA 66.A N GLN 62.A O no hydrogen 2.883 N/A ALA 67.A N TYR 63.A O no hydrogen 2.997 N/A ILE 68.A N LEU 64.A O no hydrogen 2.984 N/A ASP 69.A N GLN 65.A O no hydrogen 2.841 N/A TYR 70.A N ALA 66.A O no hydrogen 2.965 N/A VAL 71.A N ALA 67.A O no hydrogen 3.005 N/A SER 72.A N ILE 68.A O no hydrogen 2.965 N/A SER 73.A N ASP 69.A O no hydrogen 3.193 N/A SER 73.A OG TYR 70.A O no hydrogen 2.537 N/A ASN 74.A N VAL 71.A O no hydrogen 3.125 N/A GLY 75.A N SER 72.A O no hydrogen 3.028 N/A GLY 76.A N VAL 71.A O no hydrogen 3.035 N/A GLY 77.A N ASN 109.A O no hydrogen 2.982 N/A ILE 79.A N ASN 111.A O no hydrogen 2.943 N/A THR 80.A N VAL 38.A O no hydrogen 3.166 N/A ILE 81.A N ASN 113.A O no hydrogen 2.846 N/A TRP 87.A N ARG 117.A O no hydrogen 2.768 N/A TRP 87.A NE1 PRO 82.A O no hydrogen 3.191 N/A LEU 89.A N HIS 119.A O no hydrogen 2.923 N/A GLY 90.A N ASP 59.A OD1 no hydrogen 2.835 N/A SER 91.A OG ASP 59.A OD2 no hydrogen 2.546 N/A TYR 92.A OH PRO 128.A O no hydrogen 2.639 N/A GLY 93.A N GLY 102.A O no hydrogen 2.856 N/A ALA 98.A N GLY 95.A O no hydrogen 2.964 N/A HIS 100.A N ILE 97.A O no hydrogen 2.975 N/A HIS 100.A NE2 ASN 137.A O no hydrogen 2.819 N/A SER 101.A N ALA 98.A O no hydrogen 3.117 N/A GLY 102.A N ILE 97.A O no hydrogen 2.944 N/A ILE 103.A N GLN 130.A O no hydrogen 2.933 N/A ILE 104.A N VAL 131.A O no hydrogen 2.801 N/A GLN 105.A N GLN 65.A OE1 no hydrogen 2.837 N/A LEU 106.A N VAL 133.A O no hydrogen 2.889 N/A ARG 107.A NE ASP 69.A OD1 no hydrogen 2.702 N/A ARG 107.A NH2 ASP 69.A OD1 no hydrogen 3.044 N/A ASN 109.A N GLU 147.A O no hydrogen 2.922 N/A VAL 110.A N ARG 107.A O no hydrogen 3.202 N/A ASN 111.A N GLY 77.A O no hydrogen 2.839 N/A LEU 112.A N HIS 150.A O no hydrogen 2.963 N/A ASN 113.A N ILE 79.A O no hydrogen 2.895 N/A ASN 113.A ND2 GLU 115.A OE2 no hydrogen 2.869 N/A ASN 113.A ND2 TYR 152.A O no hydrogen 3.217 N/A ILE 114.A N TYR 152.A O no hydrogen 2.831 N/A GLU 115.A N ILE 81.A O no hydrogen 3.039 N/A GLY 116.A N ILE 81.A O no hydrogen 2.974 N/A ARG 117.A N TYR 85.A O no hydrogen 3.135 N/A ARG 117.A NE HIS 119.A NE2.A no hydrogen 2.838 N/A ARG 117.A NH2 HIS 119.A NE2.A no hydrogen 3.040 N/A ILE 118.A N VAL 156.A O no hydrogen 2.815 N/A HIS 119.A N TRP 87.A O no hydrogen 3.054 N/A LEU 120.A N ASP 158.A O no hydrogen 3.155 N/A SER 121.A N LEU 89.A O no hydrogen 2.977 N/A SER 121.A OG LEU 89.A O no hydrogen 3.432 N/A PHE 124.A N SER 121.A O no hydrogen 3.031 N/A ASP 125.A N PRO 122.A O no hydrogen 2.952 N/A LYS 127.A N PHE 124.A O no hydrogen 3.040 N/A LYS 127.A NZ PHE 123.A O no hydrogen 3.018 N/A PHE 129.A N LEU 170.A O no hydrogen 3.212 N/A GLN 130.A N SER 101.A O no hydrogen 2.936 N/A GLN 130.A NE2 HIS 100.A O no hydrogen 3.123 N/A VAL 131.A N ASN 172.A O no hydrogen 3.009 N/A PHE 132.A N GLY 173.A O no hydrogen 2.870 N/A VAL 133.A N ILE 104.A O no hydrogen 2.863 N/A GLY 134.A N ALA 175.A O no hydrogen 2.720 N/A ASP 136.A N SER 143.A OG no hydrogen 2.956 N/A ASP 139.A N ASN 137.A OD1 no hydrogen 2.970 N/A SER 142.A N ASP 139.A O no hydrogen 2.960 N/A SER 142.A OG ASP 139.A OD2 no hydrogen 2.883 N/A SER 143.A N PRO 140.A O no hydrogen 3.064 N/A SER 143.A OG ASP 136.A OD1 no hydrogen 3.256 N/A SER 143.A OG GLY 144.A O no hydrogen 2.817 N/A GLY 144.A N ASP 136.A OD1 no hydrogen 2.825 N/A LEU 146.A N ARG 178.A O no hydrogen 2.909 N/A GLU 147.A N SER 108.A OG no hydrogen 2.945 N/A ASN 148.A N TYR 180.A O no hydrogen 2.979 N/A ASN 148.A ND2 ASN 109.A OD1 no hydrogen 2.987 N/A CYS 149.A SG VAL 110.A O no hydrogen 3.463 N/A HIS 150.A N ASN 111.A OD1 no hydrogen 2.832 N/A HIS 150.A ND1 SER 183.A OG no hydrogen 2.656 N/A ILE 151.A N SER 183.A O no hydrogen 2.874 N/A TYR 152.A N LEU 112.A O no hydrogen 2.986 N/A GLY 153.A N THR 185.A O no hydrogen 3.202 N/A HIS 154.A N GLU 115.A OE2 no hydrogen 3.197 N/A HIS 154.A ND1 GLU 115.A OE1 no hydrogen 3.130 N/A GLY 155.A N ILE 114.A O no hydrogen 2.854 N/A VAL 156.A N GLY 116.A O no hydrogen 3.188 N/A VAL 157.A N THR 188.A O no hydrogen 2.818 N/A ASP 158.A N ILE 118.A O no hydrogen 2.835 N/A PHE 159.A N GLN 190.A O no hydrogen 3.042 N/A GLY 160.A N ASP 158.A OD1 no hydrogen 2.883 N/A GLY 161.A N ASN 191.A O no hydrogen 2.823 N/A TYR 162.A OH LEU 120.A O no hydrogen 2.992 N/A PHE 164.A N ASP 193.A OD2 no hydrogen 2.998 N/A GLY 165.A N GLN 169.A OE1 no hydrogen 2.826 N/A SER 167.A OG.A VAL 224.A O no hydrogen 2.633 N/A GLN 169.A N ALA 166.A O no hydrogen 3.092 N/A GLN 169.A NE2 LEU 126.A O no hydrogen 2.889 N/A ARG 171.A N THR 195.A OG1 no hydrogen 3.085 N/A ARG 171.A NE LYS 127.A O no hydrogen 2.800 N/A ARG 171.A NH1 TYR 162.A O no hydrogen 2.786 N/A ARG 171.A NH1 ASP 193.A O no hydrogen 2.905 N/A ARG 171.A NH2 LYS 127.A O no hydrogen 2.975 N/A ARG 171.A NH2 GLU 163.A O no hydrogen 2.885 N/A ASN 172.A N PHE 129.A O no hydrogen 2.930 N/A ASN 172.A ND2 GLN 130.A OE1 no hydrogen 3.128 N/A ASN 172.A ND2 THR 199.A OG1 no hydrogen 3.287 N/A GLY 173.A N ASN 172.A OD1 no hydrogen 2.922 N/A VAL 174.A N ALA 197.A O no hydrogen 2.858 N/A ALA 175.A N PHE 132.A O no hydrogen 2.808 N/A PHE 176.A N THR 199.A O no hydrogen 3.141 N/A ARG 178.A NH1 PRO 140.A O no hydrogen 3.122 N/A ARG 178.A NH1 ALA 141.A O no hydrogen 3.190 N/A SER 179.A OG GLY 177.A O no hydrogen 3.248 N/A TYR 180.A N LEU 146.A O no hydrogen 2.871 N/A ASN 181.A N SER 207.A O no hydrogen 2.886 N/A ASN 181.A ND2 ASN 148.A OD1 no hydrogen 2.931 N/A CYS 182.A SG LEU 146.A O no hydrogen 3.783 N/A CYS 182.A SG TYR 180.A O no hydrogen 3.786 N/A SER 183.A N CYS 149.A O no hydrogen 3.136 N/A SER 183.A OG HIS 150.A ND1 no hydrogen 2.656 N/A VAL 184.A N TYR 210.A O no hydrogen 2.974 N/A THR 185.A N ILE 151.A O no hydrogen 2.947 N/A GLY 186.A N ARG 212.A O no hydrogen 3.109 N/A THR 188.A N GLY 155.A O no hydrogen 3.217 N/A PHE 189.A N ARG 215.A O no hydrogen 2.805 N/A GLN 190.A N VAL 157.A O no hydrogen 2.970 N/A GLN 190.A NE2 ASP 158.A OD2 no hydrogen 2.884 N/A ASN 191.A N ILE 217.A O no hydrogen 3.053 N/A ASN 191.A ND2.A ASP 158.A OD2 no hydrogen 3.157 N/A ASN 191.A ND2.B ASP 158.A OD1 no hydrogen 2.911 N/A GLY 192.A N ASN 218.A O no hydrogen 2.939 N/A VAL 194.A N LEU 219.A O no hydrogen 2.947 N/A THR 195.A N ARG 171.A O no hydrogen 2.903 N/A TRP 196.A N ARG 171.A O no hydrogen 3.059 N/A ALA 197.A N THR 230.A O no hydrogen 2.846 N/A ILE 198.A N THR 230.A O no hydrogen 3.044 N/A THR 199.A N VAL 174.A O no hydrogen 2.809 N/A LEU 200.A N TYR 232.A O no hydrogen 2.869 N/A GLY 201.A N SER 179.A OG no hydrogen 2.933 N/A TRP 202.A N TYR 205.A O no hydrogen 3.064 N/A GLY 204.A N ASN 234.A O no hydrogen 2.997 N/A TYR 205.A N TRP 202.A O no hydrogen 2.876 N/A SER 207.A N SER 179.A O no hydrogen 2.896 N/A ASN 208.A ND2 TYR 237.A O no hydrogen 3.248 N/A CYS 209.A N SER 238.A OG no hydrogen 2.948 N/A CYS 209.A SG SER 179.A O no hydrogen 3.129 N/A CYS 209.A SG SER 179.A OG no hydrogen 3.262 N/A CYS 209.A SG SER 207.A O no hydrogen 3.562 N/A TYR 210.A N CYS 182.A O no hydrogen 3.120 N/A VAL 211.A N GLY 239.A O no hydrogen 3.012 N/A ARG 212.A N VAL 184.A O no hydrogen 2.986 N/A ARG 212.A NE GLU 241.A OE1 no hydrogen 3.250 N/A LYS 213.A N GLU 241.A O no hydrogen 3.225 N/A CYS 214.A SG VAL 184.A O no hydrogen 3.593 N/A CYS 214.A SG ARG 212.A O no hydrogen 3.629 N/A ARG 215.A N ILE 187.A O no hydrogen 3.010 N/A ARG 215.A NE THR 188.A OG1 no hydrogen 2.963 N/A ARG 215.A NH2 THR 188.A OG1 no hydrogen 3.160 N/A PHE 216.A N TYR 244.A O no hydrogen 2.828 N/A ILE 217.A N PHE 189.A O no hydrogen 2.897 N/A ASN 218.A N SER 246.A O no hydrogen 2.839 N/A ASN 221.A N ASP 193.A OD1 no hydrogen 2.858 N/A ASN 221.A ND2 GLY 161.A O no hydrogen 2.982 N/A SER 222.A N ASP 193.A OD1 no hydrogen 3.279 N/A SER 222.A OG ASP 193.A OD2 no hydrogen 2.584 N/A VAL 224.A N SER 222.A OG no hydrogen 3.085 N/A ASN 225.A N SER 222.A OG no hydrogen 3.284 N/A ASN 225.A ND2 ASP 193.A OD1 no hydrogen 2.998 N/A ASN 225.A ND2 VAL 194.A O no hydrogen 3.085 N/A ASP 227.A N ASN 225.A OD1 no hydrogen 3.198 N/A HIS 228.A ND1 VAL 194.A O no hydrogen 2.821 N/A HIS 228.A NE2 THR 230.A OG1 no hydrogen 2.765 N/A SER 229.A N THR 195.A O no hydrogen 2.850 N/A SER 229.A OG.A GLN 260.A OE1 no hydrogen 2.540 N/A SER 229.A OG.B GLN 260.A OE1 no hydrogen 2.839 N/A THR 230.A N CYS 257.A O no hydrogen 2.932 N/A THR 230.A OG1 HIS 228.A NE2 no hydrogen 2.765 N/A THR 230.A OG1 CYS 257.A O no hydrogen 3.567 N/A THR 230.A OG1 TYR 276.A OH no hydrogen 2.675 N/A VAL 231.A N SER 258.A O no hydrogen 2.984 N/A TYR 232.A N ILE 198.A O no hydrogen 2.996 N/A TYR 232.A OH GLU 288.A OE2 no hydrogen 2.586 N/A VAL 233.A N GLN 260.A O no hydrogen 2.773 N/A ASN 234.A N LEU 200.A O no hydrogen 2.757 N/A ASN 234.A ND2 ASN 203.A OD1 no hydrogen 3.247 N/A CYS 235.A SG SER 238.A OG no hydrogen 3.444 N/A TYR 237.A N HIS 264.A O no hydrogen 3.253 N/A SER 238.A N ASP 265.A O no hydrogen 3.327 N/A SER 238.A OG CYS 235.A O no hydrogen 3.528 N/A SER 238.A OG PRO 236.A O no hydrogen 2.835 N/A GLY 239.A N CYS 209.A O no hydrogen 3.031 N/A VAL 240.A N PHE 267.A O no hydrogen 2.923 N/A GLU 241.A N VAL 211.A O no hydrogen 2.954 N/A SER 242.A N ARG 269.A O no hydrogen 2.992 N/A CYS 243.A N SER 271.A OG no hydrogen 3.030 N/A CYS 243.A SG VAL 211.A O no hydrogen 3.714 N/A CYS 243.A SG GLU 241.A O no hydrogen 3.585 N/A TYR 244.A N CYS 214.A O no hydrogen 2.980 N/A PHE 245.A N THR 272.A O no hydrogen 2.838 N/A SER 246.A N PHE 216.A O no hydrogen 2.788 N/A MET 247.A N ASN 274.A O no hydrogen 2.961 N/A SER 248.A OG ASN 218.A OD1 no hydrogen 3.145 N/A SER 249.A OG.A VAL 220.A O no hydrogen 2.949 N/A PHE 251.A N SER 249.A OG.B no hydrogen 3.125 N/A ALA 252.A N SER 249.A O no hydrogen 3.158 N/A ALA 252.A N SER 249.A OG.A no hydrogen 3.113 N/A ARG 253.A N SER 250.A O no hydrogen 3.121 N/A ASN 254.A N PHE 251.A O no hydrogen 3.029 N/A ILE 255.A N PHE 251.A O no hydrogen 3.092 N/A ALA 256.A N ALA 252.A O no hydrogen 2.977 N/A CYS 257.A N HIS 228.A O no hydrogen 2.837 N/A CYS 257.A SG.A VAL 259.A O no hydrogen 3.454 N/A CYS 257.A SG.A GLY 279.A O no hydrogen 3.432 N/A CYS 257.A SG.B HIS 228.A O no hydrogen 3.985 N/A CYS 257.A SG.B SER 229.A OG.A no hydrogen 2.713 N/A CYS 257.A SG.B SER 229.A OG.B no hydrogen 2.445 N/A CYS 257.A SG.B VAL 259.A O no hydrogen 3.878 N/A CYS 257.A SG.B GLN 260.A OE1 no hydrogen 2.780 N/A SER 258.A N ARG 278.A O no hydrogen 3.225 N/A SER 258.A N GLY 279.A O no hydrogen 3.189 N/A SER 258.A OG TYR 268.A OH no hydrogen 2.732 N/A SER 258.A OG GLY 279.A O no hydrogen 2.639 N/A VAL 259.A N GLY 279.A O no hydrogen 3.103 N/A GLN 260.A N VAL 231.A O no hydrogen 2.867 N/A GLN 260.A NE2 HIS 262.A NE2 no hydrogen 2.809 N/A LEU 261.A N TYR 281.A O no hydrogen 2.788 N/A HIS 262.A N VAL 233.A O no hydrogen 3.033 N/A HIS 262.A ND1 GLU 288.A OE1 no hydrogen 2.770 N/A GLN 263.A NE2 ASN 234.A OD1 no hydrogen 2.833 N/A GLN 263.A NE2 GLU 288.A O no hydrogen 2.999 N/A HIS 264.A ND1 ASP 265.A OD2 no hydrogen 2.678 N/A ASP 265.A N TYR 297.A O no hydrogen 2.815 N/A THR 266.A N ASN 298.A O no hydrogen 3.221 N/A THR 266.A OG1 GLN 263.A O no hydrogen 2.796 N/A PHE 267.A N SER 238.A O no hydrogen 3.225 N/A TYR 268.A N GLN 300.A O no hydrogen 2.861 N/A TYR 268.A OH SER 258.A OG no hydrogen 2.732 N/A ARG 269.A N VAL 240.A O no hydrogen 2.947 N/A ARG 269.A NE.B GLU 302.A OE2.B no hydrogen 2.937 N/A ARG 269.A NH1.A GLN 300.A OE1 no hydrogen 2.722 N/A ARG 269.A NH1.B GLU 241.A OE2 no hydrogen 2.489 N/A ARG 269.A NH2.A GLU 241.A OE2 no hydrogen 2.574 N/A ARG 269.A NH2.B GLN 300.A OE1 no hydrogen 2.816 N/A GLY 270.A N GLU 302.A O no hydrogen 3.075 N/A SER 271.A N ASN 304.A OD1 no hydrogen 2.850 N/A SER 271.A OG ARG 269.A O no hydrogen 3.043 N/A THR 272.A N CYS 243.A O no hydrogen 2.995 N/A VAL 273.A N ILE 305.A O no hydrogen 2.863 N/A ASN 274.A N PHE 245.A O no hydrogen 2.866 N/A GLY 275.A N VAL 307.A O no hydrogen 3.152 N/A TYR 276.A OH THR 230.A OG1 no hydrogen 2.675 N/A ARG 278.A N ALA 256.A O no hydrogen 2.951 N/A ARG 278.A NE GLN 311.A OE1 no hydrogen 2.733 N/A GLY 279.A N GLN 311.A O no hydrogen 3.163 N/A ALA 280.A N PHE 312.A O no hydrogen 2.755 N/A TYR 281.A N VAL 259.A O no hydrogen 3.070 N/A VAL 282.A N ILE 314.A O no hydrogen 2.791 N/A VAL 283.A N LEU 261.A O no hydrogen 3.087 N/A MET 284.A N GLY 316.A O no hydrogen 3.137 N/A HIS 285.A ND1 ASP 318.A OD2 no hydrogen 2.752 N/A ALA 286.A N ASP 318.A OD1 no hydrogen 3.064 N/A GLU 288.A N HIS 285.A O no hydrogen 2.891 N/A ALA 289.A N ALA 286.A O no hydrogen 3.311 N/A GLY 291.A N ASN 203.A O no hydrogen 2.768 N/A GLY 293.A N ALA 289.A O no hydrogen 3.258 N/A SER 294.A OG.A SER 324.A O no hydrogen 3.403 N/A ALA 296.A N HIS 326.A O no hydrogen 2.858 N/A ASN 298.A ND2 ASP 265.A OD1 no hydrogen 2.984 N/A MET 299.A N ASP 329.A O no hydrogen 3.141 N/A GLN 300.A N THR 266.A O no hydrogen 3.041 N/A VAL 301.A N ILE 331.A O no hydrogen 2.940 N/A GLU 302.A N TYR 268.A O no hydrogen 2.987 N/A ASN 303.A N SER 333.A O no hydrogen 2.980 N/A ASN 303.A ND2.B GLU 302.A OE1.B no hydrogen 2.093 N/A ASN 304.A N ASN 335.A OD1 no hydrogen 2.953 N/A ASN 304.A ND2 TYR 268.A O no hydrogen 3.156 N/A ASN 304.A ND2 ASN 335.A OD1 no hydrogen 3.080 N/A ILE 305.A N SER 271.A O no hydrogen 2.849 N/A ALA 306.A N ILE 336.A O no hydrogen 2.976 N/A VAL 307.A N VAL 273.A O no hydrogen 2.870 N/A ILE 308.A N SER 338.A O no hydrogen 2.983 N/A TYR 309.A N TYR 276.A O no hydrogen 2.941 N/A GLY 310.A N CYS 277.A O no hydrogen 2.741 N/A GLN 311.A NE2 PHE 349.A O no hydrogen 2.802 N/A PHE 312.A N ALA 351.A O no hydrogen 2.900 N/A VAL 313.A N PHE 352.A O no hydrogen 2.939 N/A ILE 314.A N ALA 280.A O no hydrogen 2.946 N/A LEU 315.A N ASP 354.A O no hydrogen 2.815 N/A GLY 316.A N VAL 282.A O no hydrogen 3.279 N/A SER 317.A OG GLY 325.A O no hydrogen 2.937 N/A ASP 318.A N MET 284.A O no hydrogen 3.296 N/A THR 320.A N VAL 323.A O no hydrogen 2.833 N/A THR 320.A OG1 VAL 323.A O no hydrogen 3.457 N/A VAL 323.A N THR 320.A OG1 no hydrogen 3.074 N/A GLY 325.A N ASP 318.A O no hydrogen 2.818 N/A HIS 326.A N SER 294.A O no hydrogen 2.935 N/A HIS 326.A ND1 ASP 367.A OD2 no hydrogen 2.670 N/A LEU 327.A N ASP 367.A O no hydrogen 2.936 N/A ASN 328.A N ALA 296.A O no hydrogen 2.979 N/A ASN 328.A ND2 ASP 329.A OD2 no hydrogen 2.895 N/A VAL 330.A N ARG 370.A O no hydrogen 3.047 N/A ILE 331.A N MET 299.A O no hydrogen 2.880 N/A VAL 332.A N LEU 372.A O no hydrogen 2.878 N/A SER 333.A N VAL 301.A O no hydrogen 3.019 N/A SER 333.A OG.A GLU 302.A OE2.A no hydrogen 2.754 N/A SER 333.A OG.B THR 374.A O no hydrogen 2.876 N/A GLY 334.A N GLY 375.A O no hydrogen 3.137 N/A ASN 335.A N ASN 376.A OD1 no hydrogen 2.954 N/A ASN 335.A ND2 VAL 301.A O no hydrogen 3.104 N/A ASN 335.A ND2 ASN 376.A OD1 no hydrogen 2.941 N/A ILE 336.A N ASN 304.A O no hydrogen 2.959 N/A VAL 337.A N SER 377.A O no hydrogen 2.949 N/A SER 338.A N ALA 306.A O no hydrogen 2.984 N/A ILE 339.A N TYR 379.A O no hydrogen 2.908 N/A GLY 340.A N ILE 308.A O no hydrogen 2.870 N/A ARG 342.A NE TYR 309.A O no hydrogen 2.886 N/A ARG 342.A NH1 ALA 343.A O no hydrogen 3.112 N/A ARG 342.A NH1 ASP 386.A OD1 no hydrogen 3.315 N/A ARG 342.A NH1 ASP 386.A OD2 no hydrogen 2.970 N/A ARG 342.A NH2 TYR 309.A O no hydrogen 2.975 N/A ARG 342.A NH2 ASP 386.A OD2 no hydrogen 2.961 N/A PHE 345.A N ASP 386.A OD1 no hydrogen 2.827 N/A SER 346.A N ALA 343.A O no hydrogen 3.243 N/A SER 346.A OG ALA 343.A O no hydrogen 2.696 N/A GLY 350.A N ASP 386.A O no hydrogen 2.808 N/A ALA 351.A N GLY 310.A O no hydrogen 3.012 N/A PHE 352.A N ALA 388.A O no hydrogen 3.048 N/A ILE 353.A N ALA 389.A O no hydrogen 2.933 N/A ASP 354.A N VAL 313.A O no hydrogen 2.869 N/A ILE 355.A N THR 391.A O no hydrogen 2.918 N/A GLY 356.A N LEU 315.A O no hydrogen 3.042 N/A ASP 358.A N ALA 362.A O no hydrogen 2.961 N/A SER 360.A N ASP 358.A OD1 no hydrogen 2.813 N/A SER 360.A OG.A ASP 358.A OD1 no hydrogen 2.756 N/A GLY 361.A N ASP 358.A O no hydrogen 2.826 N/A ALA 362.A N ASP 358.A OD1 no hydrogen 2.861 N/A SER 363.A OG THR 419.A O.B no hydrogen 3.052 N/A SER 363.A OG THR 419.A OG1.B no hydrogen 3.326 N/A VAL 365.A N GLN 366.A OE1 no hydrogen 3.055 N/A GLN 366.A NE2 ALA 362.A O no hydrogen 2.967 N/A ASP 367.A N SER 317.A OG no hydrogen 2.899 N/A GLN 369.A N LEU 327.A O no hydrogen 3.008 N/A ARG 370.A NE ASP 329.A OD1 no hydrogen 2.837 N/A ARG 370.A NH2 ASP 329.A OD2 no hydrogen 2.938 N/A LEU 372.A N VAL 330.A O no hydrogen 2.883 N/A VAL 373.A N THR 400.A O no hydrogen 2.795 N/A THR 374.A N VAL 332.A O no hydrogen 2.966 N/A THR 374.A OG1 ILE 402.A O no hydrogen 2.818 N/A GLY 375.A N ALA 403.A O no hydrogen 3.067 N/A ASN 376.A N ASN 404.A OD1 no hydrogen 3.043 N/A ASN 376.A ND2 VAL 332.A O no hydrogen 2.957 N/A ASN 376.A ND2 ASN 404.A OD1 no hydrogen 2.972 N/A SER 377.A N ASN 335.A O no hydrogen 2.931 N/A PHE 378.A N ASN 405.A O no hydrogen 2.919 N/A TYR 379.A N VAL 337.A O no hydrogen 3.008 N/A ALA 380.A N ASP 407.A O no hydrogen 2.958 N/A ASN 383.A ND2 ARG 342.A O no hydrogen 2.874 N/A ILE 384.A N PRO 381.A O no hydrogen 2.984 N/A SER 387.A OG ILE 384.A O no hydrogen 2.797 N/A ALA 388.A N GLY 350.A O no hydrogen 2.946 N/A ALA 389.A N TYR 410.A O no hydrogen 3.015 N/A ILE 390.A N MET 411.A O no hydrogen 2.949 N/A THR 391.A N ILE 353.A O no hydrogen 2.964 N/A THR 391.A OG1 ASP 354.A OD1 no hydrogen 2.669 N/A LEU 392.A N TYR 413.A O no hydrogen 2.903 N/A ARG 393.A N ILE 355.A O no hydrogen 3.202 N/A ARG 393.A NE ASP 354.A OD1 no hydrogen 2.802 N/A ARG 393.A NH2 ASP 354.A OD2 no hydrogen 2.796 N/A ASN 395.A N SER 363.A O no hydrogen 2.977 N/A LEU 396.A N VAL 422.A O.A no hydrogen 3.085 N/A LEU 396.A N VAL 422.A O.B no hydrogen 3.079 N/A ASN 397.A N ILE 368.A O no hydrogen 2.832 N/A ASN 397.A ND2 ASP 367.A OD1 no hydrogen 2.836 N/A CYS 399.A N ASN 425.A O no hydrogen 3.074 N/A THR 400.A N VAL 371.A O no hydrogen 2.804 N/A PHE 401.A N VAL 427.A O no hydrogen 2.767 N/A ILE 402.A N VAL 373.A O no hydrogen 3.014 N/A ALA 403.A N SER 431.A OG no hydrogen 2.901 N/A ASN 404.A N ASN 432.A OD1 no hydrogen 3.110 N/A ASN 404.A ND2 VAL 373.A O no hydrogen 2.941 N/A ASN 404.A ND2 ASN 432.A OD1 no hydrogen 2.937 N/A ASN 405.A N ASN 376.A O no hydrogen 2.913 N/A PHE 406.A N VAL 433.A O no hydrogen 2.913 N/A ASP 407.A N PHE 378.A O no hydrogen 2.872 N/A CYS 408.A SG TYR 410.A O no hydrogen 3.267 N/A ARG 409.A N SER 387.A OG no hydrogen 3.033 N/A ARG 409.A NE HIS 438.A ND1 no hydrogen 2.848 N/A ARG 409.A NH1 GLN 445.A OE1 no hydrogen 2.947 N/A ARG 409.A NH2 ALA 382.A O no hydrogen 2.907 N/A TYR 410.A N SER 387.A O no hydrogen 2.929 N/A MET 411.A N LEU 447.A O no hydrogen 2.831 N/A TYR 413.A N ILE 390.A O no hydrogen 3.002 N/A ASN 414.A ND2 THR 419.A O.A no hydrogen 3.136 N/A ASN 414.A ND2 THR 419.A OG1.A no hydrogen 3.377 N/A ASN 414.A ND2 GLN 451.A O no hydrogen 2.965 N/A THR 418.A OG1.A ALA 415.A O.A no hydrogen 2.805 N/A THR 418.A OG1.A ALA 415.A O.B no hydrogen 2.668 N/A THR 418.A OG1.A PRO 416.A O.B no hydrogen 2.898 N/A THR 419.A N.B THR 418.A O.A no hydrogen 3.072 N/A THR 419.A OG1.A ARG 393.A O no hydrogen 2.924 N/A THR 419.A OG1.B SER 363.A OG no hydrogen 3.326 N/A SER 420.A OG.A GLY 417.A O.B no hydrogen 3.014 N/A SER 420.A OG.B GLY 417.A O.B no hydrogen 3.245 N/A SER 420.A OG.B THR 419.A O.A no hydrogen 2.657 N/A VAL 422.A N.A ASN 395.A OD1 no hydrogen 2.857 N/A VAL 422.A N.B ASN 395.A OD1 no hydrogen 2.846 N/A VAL 423.A N SER 454.A O no hydrogen 2.941 N/A GLN 424.A N LEU 396.A O no hydrogen 2.871 N/A ASN 425.A N VAL 456.A O no hydrogen 3.087 N/A ASN 425.A ND2 ASN 397.A O no hydrogen 3.001 N/A LEU 426.A N SER 458.A OG no hydrogen 3.114 N/A VAL 427.A N CYS 399.A O no hydrogen 2.933 N/A TRP 428.A N THR 459.A O no hydrogen 2.771 N/A ASP 429.A N PHE 401.A O no hydrogen 3.098 N/A LYS 430.A N GLU 461.A OE1 no hydrogen 2.939 N/A LYS 430.A NZ ASP 491.A OD1 no hydrogen 2.920 N/A SER 431.A N ASP 429.A OD2 no hydrogen 3.051 N/A SER 431.A OG ASP 429.A OD2 no hydrogen 2.643 N/A ASN 432.A N ASP 429.A O no hydrogen 3.155 N/A ASN 432.A ND2 PHE 401.A O no hydrogen 2.960 N/A ASN 432.A ND2 ASP 429.A O no hydrogen 2.862 N/A VAL 433.A N ASN 404.A O no hydrogen 2.871 N/A GLY 435.A N PHE 406.A O no hydrogen 2.883 N/A THR 437.A N ASP 407.A OD1 no hydrogen 2.908 N/A THR 437.A OG1 ASP 407.A OD1 no hydrogen 3.251 N/A THR 437.A OG1 ASP 407.A OD2 no hydrogen 2.604 N/A HIS 438.A NE2 ALA 380.A O no hydrogen 2.803 N/A ALA 439.A N GLY 436.A O no hydrogen 3.069 N/A ASN 440.A N ASP 468.A OD1 no hydrogen 2.857 N/A GLN 441.A N HIS 438.A O no hydrogen 2.991 N/A ARG 442.A N SER 470.A OG no hydrogen 2.828 N/A ARG 442.A NE ARG 409.A O no hydrogen 2.756 N/A ARG 442.A NH1 ASP 468.A OD2 no hydrogen 2.804 N/A ARG 442.A NH2 CYS 408.A O no hydrogen 2.992 N/A ARG 442.A NH2 ARG 409.A O no hydrogen 3.251 N/A GLN 445.A N ARG 442.A O no hydrogen 2.904 N/A ASN 446.A ND2 ASP 449.A OD1 no hydrogen 3.107 N/A LEU 447.A N SER 473.A O no hydrogen 3.091 N/A PHE 448.A N CYS 474.A O no hydrogen 2.905 N/A ASP 449.A N VAL 412.A O no hydrogen 2.862 N/A MET 450.A N LEU 476.A O no hydrogen 2.984 N/A GLN 451.A N ASP 449.A O no hydrogen 2.965 N/A GLN 451.A NE2 ASP 449.A OD1 no hydrogen 2.941 N/A PHE 452.A N MET 450.A O no hydrogen 2.902 N/A ALA 453.A N PRO 421.A O.A no hydrogen 2.863 N/A ALA 453.A N PRO 421.A O.B no hydrogen 2.824 N/A VAL 455.A N GLN 482.A O no hydrogen 2.824 N/A VAL 456.A N VAL 423.A O no hydrogen 3.047 N/A SER 458.A N SER 486.A OG no hydrogen 3.169 N/A SER 458.A OG VAL 456.A O no hydrogen 2.964 N/A THR 459.A N LEU 426.A O no hydrogen 2.816 N/A ILE 460.A N LYS 487.A O no hydrogen 2.832 N/A GLU 461.A N TRP 428.A O no hydrogen 3.062 N/A VAL 462.A N THR 489.A O no hydrogen 2.847 N/A GLN 463.A NE2 LEU 464.A O no hydrogen 2.992 N/A GLN 463.A NE2 ASP 491.A OD2 no hydrogen 2.950 N/A SER 465.A OG ILE 434.A O no hydrogen 2.675 N/A SER 470.A N ASP 468.A OD1 no hydrogen 2.985 N/A SER 470.A OG ASP 468.A OD1 no hydrogen 2.596 N/A SER 470.A OG ASP 468.A OD2 no hydrogen 3.459 N/A PHE 472.A N GLN 445.A O no hydrogen 2.837 N/A SER 473.A OG ASN 446.A OD1 no hydrogen 2.838 N/A CYS 474.A N THR 501.A O no hydrogen 2.823 N/A ILE 475.A N THR 501.A O no hydrogen 3.255 N/A LEU 476.A N PHE 448.A O no hydrogen 3.075 N/A PHE 477.A N VAL 503.A O no hydrogen 2.886 N/A CYS 481.A N PRO 478.A O no hydrogen 2.936 N/A CYS 481.A SG MET 450.A O no hydrogen 3.880 N/A CYS 481.A SG GLN 482.A O no hydrogen 3.449 N/A GLN 482.A N ALA 453.A O no hydrogen 3.154 N/A GLN 482.A NE2 SER 480.A O no hydrogen 3.582 N/A SER 484.A N VAL 455.A O no hydrogen 3.078 N/A SER 486.A N ASN 513.A O no hydrogen 3.250 N/A SER 486.A OG SER 484.A O no hydrogen 2.874 N/A LYS 487.A N SER 458.A O no hydrogen 2.899 N/A LYS 487.A NZ GLU 461.A OE2 no hydrogen 3.154 N/A ILE 488.A N TYR 515.A O no hydrogen 2.903 N/A THR 489.A N ILE 460.A O no hydrogen 2.947 N/A VAL 490.A N SER 517.A O no hydrogen 2.919 N/A ASP 491.A N VAL 462.A O no hydrogen 2.988 N/A ALA 493.A N ASP 491.A OD2 no hydrogen 3.025 N/A THR 495.A N SER 492.A O no hydrogen 2.987 N/A THR 495.A OG1 SER 492.A O no hydrogen 2.658 N/A MET 498.A N THR 495.A O no hydrogen 3.027 N/A ASN 500.A ND2 PHE 472.A O no hydrogen 3.029 N/A THR 501.A OG1 PRO 519.A O no hydrogen 2.818 N/A ALA 502.A N THR 501.A OG1 no hydrogen 2.810 N/A VAL 503.A N ILE 475.A O no hydrogen 2.815 N/A GLU 505.A N PHE 477.A O no hydrogen 2.921 N/A GLY 506.A N GLN 508.A OE1 no hydrogen 2.842 N/A ASN 507.A N PHE 504.A O no hydrogen 2.960 N/A GLN 508.A N GLN 508.A OE1 no hydrogen 2.853 N/A GLN 508.A NE2 PRO 478.A O no hydrogen 2.793 N/A GLN 508.A NE2 CYS 481.A O no hydrogen 2.831 N/A GLN 509.A N GLN 509.A OE1 no hydrogen 2.750 N/A GLN 509.A NE2 TYR 518.A OH no hydrogen 3.109 N/A ALA 510.A N ASN 507.A O no hydrogen 3.229 N/A GLY 511.A N GLN 508.A O no hydrogen 3.137 N/A VAL 514.A N GLY 511.A O no hydrogen 3.144 N/A TYR 515.A N SER 486.A O no hydrogen 2.913 N/A VAL 516.A N ARG 595.A O no hydrogen 3.033 N/A SER 517.A N ILE 488.A O no hydrogen 3.120 N/A TYR 518.A N LEU 593.A O no hydrogen 2.973 N/A ALA 520.A N LEU 591.A O no hydrogen 2.855 N/A VAL 522.A N VAL 589.A O no hydrogen 2.826 N/A LEU 524.A N VAL 587.A O no hydrogen 2.838 N/A THR 525.A N PHE 536.A O no hydrogen 2.920 N/A THR 525.A OG1.A SER 586.A OG.B no hydrogen 3.248 N/A SER 526.A N ARG 585.A O no hydrogen 2.898 N/A SER 526.A OG TYR 527.A O no hydrogen 2.765 N/A TYR 527.A N PRO 534.A O no hydrogen 3.232 N/A GLN 530.A NE2 GLU 580.A O no hydrogen 3.011 N/A GLY 531.A N ASN 579.A O no hydrogen 2.825 N/A VAL 533.A N GLY 577.A O no hydrogen 2.992 N/A PHE 535.A N GLY 575.A O no hydrogen 2.863 N/A PHE 536.A N THR 525.A O no hydrogen 2.927 N/A SER 537.A N LEU 573.A O no hydrogen 2.971 N/A SER 537.A OG ASP 539.A O no hydrogen 2.742 N/A THR 538.A N ASN 523.A O no hydrogen 2.979 N/A THR 538.A OG1.A ASN 523.A O no hydrogen 3.546 N/A THR 538.A OG1.B ASN 523.A O no hydrogen 3.465 N/A TYR 542.A N GLY 571.A O no hydrogen 2.841 N/A TRP 544.A NE1 ASN 541.A O no hydrogen 2.994 N/A VAL 545.A N TYR 542.A O no hydrogen 3.171 N/A THR 546.A N GLN 594.A O no hydrogen 2.833 N/A THR 546.A OG1 GLN 594.A O no hydrogen 3.163 N/A SER 547.A N GLN 594.A O no hydrogen 3.262 N/A ALA 548.A N TYR 565.A O no hydrogen 2.995 N/A TYR 549.A N MET 592.A O no hydrogen 3.154 N/A SER 550.A N ALA 563.A O no hydrogen 2.913 N/A SER 550.A OG SER 552.A O no hydrogen 2.897 N/A LEU 551.A N ARG 590.A O no hydrogen 2.736 N/A SER 552.A N SER 550.A OG no hydrogen 3.216 N/A ASN 554.A ND2 PHE 559.A O no hydrogen 2.925 N/A ASN 556.A N ASN 554.A OD1 no hydrogen 3.284 N/A ASN 556.A ND2 ASN 554.A OD1 no hydrogen 2.940 N/A SER 560.A N TYR 578.A O no hydrogen 2.903 N/A TYR 565.A N ALA 548.A O no hydrogen 2.831 N/A THR 566.A N VAL 574.A O no hydrogen 2.908 N/A THR 566.A OG1.B THR 546.A O no hydrogen 3.314 N/A ASN 567.A ND2 TYR 542.A O no hydrogen 3.038 N/A ASN 567.A ND2 ALA 543.A O no hydrogen 2.778 N/A LYS 568.A N GLN 572.A O no hydrogen 2.919 N/A LYS 568.A NZ GLN 572.A OE1 no hydrogen 2.903 N/A ASN 570.A ND2 GLN 572.A OE1 no hydrogen 2.900 N/A GLY 571.A N LYS 568.A O no hydrogen 2.947 N/A GLN 572.A N ASN 570.A OD1 no hydrogen 3.024 N/A GLN 572.A NE2 SER 537.A O no hydrogen 2.862 N/A LEU 573.A N SER 537.A OG no hydrogen 2.901 N/A VAL 574.A N THR 566.A O no hydrogen 2.876 N/A GLY 575.A N PHE 535.A O no hydrogen 3.004 N/A GLY 577.A N VAL 533.A O no hydrogen 2.767 N/A TYR 578.A N SER 560.A O no hydrogen 2.981 N/A ASN 579.A N GLY 531.A O no hydrogen 2.831 N/A ASN 579.A ND2 ASN 528.A O no hydrogen 3.582 N/A ASN 579.A ND2 THR 529.A O no hydrogen 2.961 N/A ASN 579.A ND2 GLY 583.A O no hydrogen 3.015 N/A GLU 580.A N ASP 558.A O no hydrogen 2.865 N/A ILE 581.A N ASP 558.A O no hydrogen 3.423 N/A GLY 583.A N ASN 528.A O no hydrogen 2.881 N/A ARG 585.A N SER 526.A OG no hydrogen 2.897 N/A ARG 585.A NE ASN 579.A OD1 no hydrogen 2.795 N/A ARG 585.A NH2 ASN 579.A OD1 no hydrogen 3.444 N/A ARG 585.A NH2 ILE 581.A O no hydrogen 2.879 N/A SER 586.A OG.B THR 525.A OG1.A no hydrogen 3.248 N/A VAL 587.A N LEU 524.A O no hydrogen 3.019 N/A SER 588.A OG ASN 523.A OD1 no hydrogen 3.431 N/A VAL 589.A N VAL 522.A O no hydrogen 2.899 N/A ARG 590.A N SER 552.A OG no hydrogen 2.843 N/A ARG 590.A NH1 MET 498.A O no hydrogen 3.391 N/A ARG 590.A NH1 THR 521.A OG1 no hydrogen 2.913 N/A ARG 590.A NH2 MET 498.A O no hydrogen 3.006 N/A LEU 591.A N ALA 520.A O no hydrogen 2.758 N/A MET 592.A N TYR 549.A O no hydrogen 2.872 N/A LEU 593.A N TYR 518.A O no hydrogen 2.903 N/A GLN 594.A N SER 547.A O no hydrogen 2.835 N/A GLN 594.A NE2 SER 547.A OG no hydrogen 2.918 N/A ARG 595.A N VAL 516.A O no hydrogen 2.739 N/A ARG 595.A NE GLY 511.A O no hydrogen 3.197 N/A ARG 595.A NH1 TRP 544.A O no hydrogen 2.936 N/A ARG 595.A NH2 GLY 511.A O no hydrogen 2.865 N/A GLN 596.A N THR 546.A OG1 no hydrogen 2.803 N/A GLN 596.A NE2 ALA 512.A O no hydrogen 2.957 N/A GLN 596.A NE2 VAL 514.A O no hydrogen 2.967 N/A