Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3pya_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LYS 5.A NZ ASN 2.A OD1 no hydrogen 3.148 N/A GLU 6.A N ASN 2.A O no hydrogen 2.760 N/A ALA 7.A N ALA 3.A O no hydrogen 2.967 N/A ALA 7.A N PHE 4.A O no hydrogen 3.096 N/A VAL 8.A N PHE 4.A O no hydrogen 2.990 N/A LYS 9.A N LYS 5.A O no hydrogen 3.016 N/A SER 10.A N GLU 6.A O no hydrogen 3.181 N/A SER 10.A OG GLU 6.A O no hydrogen 3.564 N/A SER 10.A OG ALA 7.A O no hydrogen 3.073 N/A VAL 11.A N ALA 7.A O no hydrogen 3.244 N/A LYS 12.A N VAL 8.A O no hydrogen 2.931 N/A THR 13.A N LYS 9.A O no hydrogen 3.033 N/A THR 13.A OG1 SER 10.A O no hydrogen 3.421 N/A ILE 14.A N SER 10.A O no hydrogen 3.240 N/A LEU 15.A N VAL 11.A O no hydrogen 3.047 N/A ARG 16.A N LYS 12.A O no hydrogen 2.869 N/A ASN 17.A N THR 13.A O no hydrogen 2.987 N/A ASN 17.A N ILE 14.A O no hydrogen 3.093 N/A ASN 17.A ND2 THR 13.A O no hydrogen 2.918 N/A GLU 22.A N GLU 240.A OE2 no hydrogen 2.794 N/A THR 24.A N ARG 422.A O no hydrogen 3.327 N/A SER 26.A N VAL 230.A O no hydrogen 2.809 N/A SER 26.A OG ASP 29.A OD1 no hydrogen 2.746 N/A SER 26.A OG THR 419.A OG1 no hydrogen 2.990 N/A TYR 28.A N ASN 76.A OD1 no hydrogen 2.823 N/A TYR 28.A OH GLU 176.A OE2 no hydrogen 2.658 N/A ASP 29.A N SER 26.A OG no hydrogen 3.199 N/A THR 30.A N SER 26.A O no hydrogen 2.972 N/A ALA 31.A N ALA 27.A O no hydrogen 2.846 N/A TRP 32.A N TYR 28.A O no hydrogen 3.311 N/A VAL 33.A N ASP 29.A O no hydrogen 3.143 N/A ALA 34.A N THR 30.A O no hydrogen 2.796 N/A LEU 35.A N ALA 31.A O no hydrogen 3.051 N/A ILE 36.A N VAL 33.A O no hydrogen 3.176 N/A ALA 38.A N THR 42.A O no hydrogen 2.664 N/A GLY 39.A N ASP 37.A OD2 no hydrogen 2.715 N/A THR 42.A OG1 ASP 40.A OD1 no hydrogen 2.632 N/A THR 42.A OG1 ASP 40.A OD2 no hydrogen 3.414 N/A ALA 44.A N ILE 36.A O no hydrogen 2.908 N/A ALA 48.A N PHE 45.A O no hydrogen 2.959 N/A VAL 49.A N PHE 45.A O no hydrogen 3.393 N/A LYS 50.A N PRO 46.A O no hydrogen 2.857 N/A TRP 51.A N SER 47.A O no hydrogen 2.947 N/A ILE 52.A N ALA 48.A O no hydrogen 3.153 N/A ALA 53.A N VAL 49.A O no hydrogen 3.169 N/A GLU 54.A N LYS 50.A O no hydrogen 2.906 N/A ASN 55.A N TRP 51.A O no hydrogen 2.884 N/A ASN 55.A N ILE 52.A O no hydrogen 3.228 N/A ASN 55.A ND2 TRP 51.A O no hydrogen 3.020 N/A GLN 56.A NE2 GLY 60.A O no hydrogen 2.964 N/A GLN 56.A NE2 GLN 93.A O no hydrogen 2.913 N/A LEU 57.A N SER 61.A O no hydrogen 2.747 N/A GLY 60.A N LEU 57.A O no hydrogen 2.923 N/A SER 61.A N ASP 59.A OD1 no hydrogen 2.999 N/A SER 61.A OG ASP 59.A OD1 no hydrogen 2.608 N/A SER 61.A OG ASP 59.A OD2 no hydrogen 3.568 N/A TRP 62.A N THR 77.A OG1 no hydrogen 3.002 N/A TRP 62.A NE1 ILE 52.A O no hydrogen 2.799 N/A ASP 64.A N ASP 72.A OD2 no hydrogen 3.089 N/A TYR 66.A N ASP 64.A OD2 no hydrogen 2.947 N/A LEU 67.A N ASP 64.A OD2 no hydrogen 2.940 N/A TYR 70.A N GLU 114.A OE2 no hydrogen 2.614 N/A HIS 71.A N GLU 114.A OE1 no hydrogen 3.484 N/A HIS 71.A ND1 GLU 114.A OE1 no hydrogen 2.858 N/A ASP 72.A N SER 69.A OG no hydrogen 3.244 N/A ARG 73.A N SER 69.A O no hydrogen 2.820 N/A ARG 73.A NE ASP 64.A O no hydrogen 3.240 N/A ARG 73.A NH1 SER 61.A OG no hydrogen 2.855 N/A ARG 73.A NH2 ASP 64.A O no hydrogen 2.720 N/A LEU 74.A N TYR 70.A O no hydrogen 2.893 N/A ILE 75.A N HIS 71.A O no hydrogen 3.148 N/A ASN 76.A N ASP 72.A O no hydrogen 3.097 N/A ASN 76.A ND2 ASP 72.A O no hydrogen 2.750 N/A THR 77.A N ARG 73.A O no hydrogen 2.816 N/A THR 77.A OG1 ARG 73.A O no hydrogen 2.662 N/A LEU 78.A N LEU 74.A O no hydrogen 3.007 N/A ALA 79.A N ILE 75.A O no hydrogen 3.210 N/A CYS 80.A N ASN 76.A O no hydrogen 3.211 N/A CYS 80.A SG ALA 27.A O no hydrogen 3.904 N/A CYS 80.A SG ASN 76.A O no hydrogen 3.385 N/A VAL 81.A N THR 77.A O no hydrogen 2.921 N/A VAL 82.A N LEU 78.A O no hydrogen 2.958 N/A ALA 83.A N ALA 79.A O no hydrogen 2.981 N/A LEU 84.A N CYS 80.A O no hydrogen 2.948 N/A ARG 85.A N VAL 81.A O no hydrogen 2.969 N/A SER 86.A N VAL 82.A O no hydrogen 2.981 N/A SER 86.A OG VAL 82.A O no hydrogen 3.385 N/A SER 86.A OG ALA 83.A O no hydrogen 3.140 N/A TRP 87.A NE1 ALA 34.A O no hydrogen 2.803 N/A ASN 88.A N ARG 85.A O no hydrogen 2.985 N/A LEU 89.A N LEU 84.A O no hydrogen 2.869 N/A CYS 94.A N PHE 90.A O no hydrogen 3.010 N/A CYS 94.A SG VAL 81.A O no hydrogen 3.700 N/A ASN 95.A N PRO 91.A O no hydrogen 2.907 N/A LYS 96.A N HIS 92.A O no hydrogen 3.283 N/A LYS 96.A NZ SER 58.A O no hydrogen 3.085 N/A GLY 97.A N GLN 93.A O no hydrogen 3.038 N/A ILE 98.A N CYS 94.A O no hydrogen 3.223 N/A THR 99.A N ASN 95.A O no hydrogen 3.062 N/A THR 99.A OG1 ASN 95.A O no hydrogen 3.268 N/A PHE 100.A N LYS 96.A O no hydrogen 3.000 N/A PHE 101.A N GLY 97.A O no hydrogen 2.785 N/A ARG 102.A N ILE 98.A O no hydrogen 2.821 N/A ARG 102.A NE ASP 137.A O no hydrogen 3.228 N/A ARG 102.A NH2 ASP 137.A O no hydrogen 3.348 N/A GLU 103.A N THR 99.A O no hydrogen 2.975 N/A ASN 104.A N PHE 101.A O no hydrogen 3.307 N/A ASN 104.A ND2 PHE 100.A O no hydrogen 2.934 N/A ILE 105.A N PHE 101.A O no hydrogen 2.951 N/A LYS 107.A N ASN 104.A O no hydrogen 2.717 N/A LYS 107.A NZ GLU 103.A O no hydrogen 3.145 N/A LEU 108.A N ILE 105.A O no hydrogen 3.217 N/A ASP 110.A N LYS 107.A O no hydrogen 2.910 N/A HIS 115.A ND1.B ASP 113.A O no hydrogen 3.158 N/A ILE 118.A N GLY 417.A O no hydrogen 2.765 N/A PHE 120.A N PRO 117.A O no hydrogen 3.384 N/A ALA 123.A N GLY 119.A O no hydrogen 2.963 N/A PHE 124.A N PHE 120.A O no hydrogen 2.794 N/A SER 126.A OG.A VAL 122.A O no hydrogen 2.794 N/A SER 126.A OG.A GLY 177.A O no hydrogen 3.234 N/A SER 126.A OG.B GLU 176.A O no hydrogen 3.463 N/A LEU 127.A N ALA 123.A O no hydrogen 3.293 N/A LEU 128.A N PHE 124.A O no hydrogen 3.014 N/A GLU 129.A N PRO 125.A O no hydrogen 3.001 N/A ILE 130.A N SER 126.A O no hydrogen 3.178 N/A ALA 131.A N LEU 127.A O no hydrogen 2.903 N/A ARG 132.A N LEU 128.A O no hydrogen 2.879 N/A ARG 132.A NE GLU 129.A OE1 no hydrogen 3.242 N/A ARG 132.A NE GLU 129.A OE2 no hydrogen 3.312 N/A ARG 132.A NH2 GLU 129.A OE1 no hydrogen 3.153 N/A GLY 133.A N GLU 129.A O no hydrogen 3.061 N/A ILE 134.A N ALA 131.A O no hydrogen 2.972 N/A ASN 135.A N ARG 132.A O no hydrogen 3.023 N/A ILE 136.A N ALA 131.A O no hydrogen 3.295 N/A TYR 140.A N VAL 138.A O no hydrogen 2.702 N/A TYR 140.A OH ILE 136.A O no hydrogen 2.625 N/A SER 142.A N PRO 139.A O no hydrogen 3.049 N/A LEU 145.A N SER 142.A O no hydrogen 2.848 N/A LYS 146.A N PRO 143.A O no hydrogen 3.268 N/A ILE 148.A N LEU 145.A O no hydrogen 3.178 N/A TYR 149.A N LEU 145.A O no hydrogen 3.103 N/A TYR 149.A OH GLU 129.A OE1 no hydrogen 2.633 N/A ALA 150.A N LYS 146.A O no hydrogen 3.430 N/A LYS 151.A N ASP 147.A O no hydrogen 3.321 N/A LYS 152.A N ILE 148.A O no hydrogen 3.224 N/A LYS 152.A NZ SER 126.A OG.A no hydrogen 2.712 N/A GLU 153.A N TYR 149.A O no hydrogen 3.438 N/A LEU 154.A N ALA 150.A O no hydrogen 3.330 N/A LYS 155.A N LYS 151.A O no hydrogen 2.956 N/A LEU 156.A N LYS 152.A O no hydrogen 2.934 N/A THR 157.A N GLU 153.A O no hydrogen 3.248 N/A THR 157.A OG1 GLU 153.A O no hydrogen 3.538 N/A THR 157.A OG1 LEU 154.A O no hydrogen 2.694 N/A ARG 158.A N LEU 154.A O no hydrogen 3.278 N/A ARG 158.A N LYS 155.A O no hydrogen 3.148 N/A ILE 159.A N LEU 156.A O no hydrogen 3.290 N/A LYS 161.A N ILE 159.A O no hydrogen 2.843 N/A LYS 161.A NZ ASP 180.A OD2 no hydrogen 2.919 N/A MET 164.A N PRO 160.A O no hydrogen 2.890 N/A HIS 165.A N LYS 161.A O no hydrogen 3.093 N/A HIS 165.A N GLU 162.A O no hydrogen 3.185 N/A HIS 165.A ND1 LYS 161.A O no hydrogen 2.634 N/A LYS 166.A N ILE 163.A O no hydrogen 2.920 N/A ILE 167.A N ILE 163.A O no hydrogen 3.103 N/A LEU 171.A N THR 169.A OG1 no hydrogen 3.111 N/A LEU 172.A N THR 169.A O no hydrogen 3.258 N/A HIS 173.A N THR 170.A O no hydrogen 3.051 N/A HIS 173.A ND1 LEU 197.A O no hydrogen 2.820 N/A SER 174.A N LEU 171.A O no hydrogen 2.946 N/A LEU 175.A N SER 202.A OG no hydrogen 3.111 N/A GLU 176.A N GLU 176.A OE1 no hydrogen 2.706 N/A MET 178.A N LEU 175.A O no hydrogen 2.913 N/A ASP 182.A N HIS 165.A NE2 no hydrogen 3.020 N/A GLU 184.A N ASP 182.A OD1 no hydrogen 3.284 N/A LYS 185.A N ASP 182.A O no hydrogen 3.143 N/A LEU 186.A N ASP 182.A O no hydrogen 3.051 N/A LEU 187.A N TRP 183.A O no hydrogen 3.046 N/A LYS 188.A N LYS 185.A O no hydrogen 3.020 N/A LEU 189.A N LEU 186.A O no hydrogen 2.711 N/A SER 191.A N SER 195.A O no hydrogen 2.789 N/A GLY 194.A N SER 191.A O no hydrogen 2.867 N/A SER 195.A N ASP 193.A OD2 no hydrogen 2.928 N/A SER 195.A OG ASP 193.A OD2 no hydrogen 2.805 N/A PHE 196.A N THR 203.A OG1 no hydrogen 2.838 N/A PHE 198.A N SER 195.A OG no hydrogen 2.851 N/A SER 199.A N PHE 196.A O no hydrogen 3.185 N/A SER 199.A OG HIS 173.A O no hydrogen 3.135 N/A SER 201.A N ASP 29.A OD2 no hydrogen 3.108 N/A SER 201.A OG ASP 29.A OD2 no hydrogen 2.807 N/A SER 201.A OG SER 199.A OG no hydrogen 3.238 N/A SER 202.A N SER 199.A OG no hydrogen 3.074 N/A SER 202.A OG LEU 172.A O no hydrogen 2.649 N/A THR 203.A N SER 199.A O no hydrogen 2.853 N/A THR 203.A OG1 SER 199.A O no hydrogen 2.630 N/A ALA 204.A N PRO 200.A O no hydrogen 2.656 N/A PHE 205.A N SER 201.A O no hydrogen 2.963 N/A ALA 206.A N SER 202.A O no hydrogen 3.061 N/A PHE 207.A N THR 203.A O no hydrogen 2.934 N/A MET 208.A N ALA 204.A O no hydrogen 3.088 N/A GLN 209.A N PHE 205.A O no hydrogen 3.212 N/A GLN 209.A N ALA 206.A O no hydrogen 3.199 N/A THR 210.A N ALA 206.A O no hydrogen 2.982 N/A THR 210.A N PHE 207.A O no hydrogen 3.319 N/A THR 210.A OG1 ALA 206.A O no hydrogen 2.731 N/A ARG 211.A N PHE 207.A O no hydrogen 2.605 N/A ARG 211.A NH1 ASP 37.A O no hydrogen 3.175 N/A ARG 211.A NH2 ASP 37.A O no hydrogen 3.075 N/A ASP 212.A N THR 210.A OG1 no hydrogen 3.152 N/A CYS 215.A N ASP 212.A OD1 no hydrogen 3.003 N/A CYS 215.A SG GLN 190.A OE1 no hydrogen 3.255 N/A CYS 215.A SG GLY 194.A O no hydrogen 3.756 N/A CYS 215.A SG ASP 212.A OD1 no hydrogen 3.539 N/A LEU 216.A N ASP 212.A O no hydrogen 3.273 N/A GLU 217.A N SER 213.A O no hydrogen 3.003 N/A TYR 218.A N ASN 214.A O no hydrogen 3.239 N/A TYR 218.A OH PHE 234.A O no hydrogen 2.559 N/A LEU 219.A N CYS 215.A O no hydrogen 3.073 N/A ARG 220.A N LEU 216.A O no hydrogen 2.659 N/A ASN 221.A N GLU 217.A O no hydrogen 2.835 N/A ALA 222.A N TYR 218.A O no hydrogen 3.087 N/A VAL 223.A N LEU 219.A O no hydrogen 2.868 N/A LYS 224.A N ARG 220.A O no hydrogen 3.044 N/A ARG 225.A N ASN 221.A O no hydrogen 2.971 N/A ARG 225.A NE ARG 225.A O no hydrogen 3.055 N/A ARG 225.A NH1 GLY 21.A O no hydrogen 2.996 N/A ARG 225.A NH2 GLY 21.A O no hydrogen 3.400 N/A PHE 226.A N ALA 222.A O no hydrogen 2.931 N/A ASN 227.A N LYS 224.A O no hydrogen 3.142 N/A GLY 228.A N VAL 223.A O no hydrogen 2.723 N/A ASN 232.A ND2 THR 419.A OG1 no hydrogen 2.978 N/A PHE 234.A N PHE 198.A O no hydrogen 2.892 N/A VAL 236.A N ASP 20.A O no hydrogen 2.761 N/A PHE 239.A N TRP 279.A O no hydrogen 3.023 N/A GLU 240.A N VAL 236.A O no hydrogen 2.945 N/A HIS 241.A N ASP 237.A O no hydrogen 2.983 N/A HIS 241.A ND1 ASP 237.A O no hydrogen 2.709 N/A ILE 242.A N LEU 238.A O no hydrogen 2.863 N/A TRP 243.A N PHE 239.A O no hydrogen 2.930 N/A ILE 244.A N GLU 240.A O no hydrogen 2.915 N/A VAL 245.A N HIS 241.A O no hydrogen 3.363 N/A ASP 246.A N ILE 242.A O no hydrogen 3.049 N/A ARG 247.A N TRP 243.A O no hydrogen 3.031 N/A ARG 247.A NH1 ASP 246.A OD2 no hydrogen 2.803 N/A LEU 248.A N ILE 244.A O no hydrogen 3.049 N/A GLN 249.A N VAL 245.A O no hydrogen 3.157 N/A GLN 249.A NE2 GLN 300.A OE1 no hydrogen 3.473 N/A GLN 249.A NE2 HIS 301.A NE2 no hydrogen 2.682 N/A ARG 250.A N ASP 246.A O no hydrogen 3.035 N/A ARG 250.A NH1 ASP 246.A OD2 no hydrogen 3.215 N/A ARG 250.A NH2 GLU 383.A OE2 no hydrogen 2.853 N/A LEU 251.A N ARG 247.A O no hydrogen 2.871 N/A GLY 252.A N GLN 249.A O no hydrogen 2.869 N/A ILE 253.A N LEU 248.A O no hydrogen 3.135 N/A ARG 255.A NH1 ASP 438.A OD2 no hydrogen 3.243 N/A ARG 255.A NH2 ASP 438.A OD2 no hydrogen 2.903 N/A TYR 256.A N ILE 253.A O no hydrogen 3.232 N/A TYR 256.A OH ASP 438.A OD1 no hydrogen 2.547 N/A PHE 257.A N SER 254.A O no hydrogen 2.915 N/A GLU 260.A N GLU 260.A OE2 no hydrogen 2.680 N/A ILE 261.A N PHE 257.A O no hydrogen 2.715 N/A LYS 262.A N GLU 258.A O no hydrogen 3.001 N/A LYS 262.A NZ ASP 266.A OD2 no hydrogen 2.757 N/A GLU 263.A N GLU 259.A O no hydrogen 3.113 N/A CYS 264.A N GLU 260.A O no hydrogen 2.994 N/A CYS 264.A SG GLU 260.A O no hydrogen 3.412 N/A LEU 265.A N ILE 261.A O no hydrogen 2.922 N/A ASP 266.A N LYS 262.A O no hydrogen 3.015 N/A TYR 267.A N GLU 263.A O no hydrogen 3.179 N/A TYR 267.A OH ASP 237.A OD2 no hydrogen 2.469 N/A VAL 268.A N CYS 264.A O no hydrogen 3.044 N/A HIS 269.A N LEU 265.A O no hydrogen 2.811 N/A ARG 270.A N ASP 266.A O no hydrogen 2.813 N/A TYR 271.A N VAL 268.A O no hydrogen 2.951 N/A TRP 272.A N HIS 269.A O no hydrogen 3.085 N/A THR 273.A OG1 GLY 276.A O no hydrogen 2.683 N/A ASN 275.A N THR 273.A OG1 no hydrogen 3.120 N/A GLY 276.A N THR 273.A O no hydrogen 2.891 N/A ILE 277.A N THR 291.A OG1 no hydrogen 2.965 N/A CYS 278.A SG ALA 280.A O no hydrogen 3.407 N/A CYS 278.A SG SER 283.A OG no hydrogen 3.205 N/A ARG 281.A N ASP 237.A OD1 no hydrogen 3.117 N/A ARG 281.A NH1 ASP 20.A OD2 no hydrogen 3.147 N/A ARG 281.A NH2 ASP 20.A OD2 no hydrogen 2.761 N/A ARG 281.A NH2 ASP 237.A OD2 no hydrogen 2.728 N/A SER 283.A OG VAL 285.A O no hydrogen 2.776 N/A VAL 285.A N SER 283.A OG no hydrogen 3.058 N/A GLN 286.A NE2 SER 283.A O no hydrogen 3.445 N/A ASP 287.A N ILE 277.A O no hydrogen 2.978 N/A ILE 288.A N CYS 321.A O no hydrogen 2.901 N/A ASP 290.A N ASP 287.A OD2 no hydrogen 2.878 N/A THR 291.A N ASP 287.A O no hydrogen 3.063 N/A THR 291.A OG1 ILE 277.A O no hydrogen 3.081 N/A THR 291.A OG1 ASP 287.A O no hydrogen 2.919 N/A ALA 292.A N ILE 288.A O no hydrogen 2.798 N/A MET 293.A N ASP 289.A O no hydrogen 3.169 N/A ALA 294.A N ASP 290.A O no hydrogen 3.023 N/A PHE 295.A N THR 291.A O no hydrogen 2.781 N/A ARG 296.A N ALA 292.A O no hydrogen 3.019 N/A ARG 296.A NH2 ASP 246.A OD1 no hydrogen 2.639 N/A LEU 297.A N MET 293.A O no hydrogen 3.063 N/A LEU 298.A N ALA 294.A O no hydrogen 2.879 N/A ARG 299.A N PHE 295.A O no hydrogen 3.040 N/A ARG 299.A NH1 LEU 342.A O no hydrogen 3.152 N/A ARG 299.A NH1 GLU 347.A OE1 no hydrogen 2.653 N/A ARG 299.A NH1 GLU 347.A OE2 no hydrogen 3.362 N/A ARG 299.A NH2 VAL 305.A O no hydrogen 2.849 N/A ARG 299.A NH2 GLU 347.A OE2 no hydrogen 2.764 N/A GLN 300.A N ARG 296.A O no hydrogen 2.973 N/A HIS 301.A N LEU 297.A O no hydrogen 3.090 N/A HIS 301.A N LEU 298.A O no hydrogen 3.321 N/A GLY 302.A N ARG 299.A O no hydrogen 3.268 N/A TYR 303.A N LEU 298.A O no hydrogen 2.841 N/A TYR 303.A OH ASP 266.A OD1 no hydrogen 2.472 N/A ASP 308.A N SER 306.A OG no hydrogen 3.171 N/A PHE 310.A N ALA 307.A O no hydrogen 3.045 N/A LYS 311.A N ASP 308.A O no hydrogen 2.863 N/A LYS 311.A NZ ASP 308.A OD1 no hydrogen 3.163 N/A PHE 313.A N PHE 310.A O no hydrogen 3.141 N/A GLU 314.A N LYS 311.A O no hydrogen 3.176 N/A LYS 315.A N GLU 318.A O no hydrogen 2.853 N/A GLY 317.A N GLU 314.A OE2 no hydrogen 2.843 N/A GLU 318.A N LYS 315.A O no hydrogen 3.068 N/A PHE 320.A N PHE 313.A O no hydrogen 3.106 N/A CYS 321.A N ASN 327.A O no hydrogen 3.134 N/A CYS 321.A SG ASN 327.A O no hydrogen 4.010 N/A GLN 325.A N PHE 322.A O no hydrogen 3.289 N/A GLN 325.A NE2 THR 170.A OG1 no hydrogen 2.303 N/A GLN 328.A NE2 GLU 318.A OE2 no hydrogen 3.083 N/A GLN 328.A NE2 PHE 319.A O no hydrogen 2.811 N/A THR 331.A N ASP 372.A OD1 no hydrogen 2.793 N/A THR 331.A OG1 ASP 372.A OD1 no hydrogen 3.084 N/A THR 331.A OG1 ASP 372.A OD2 no hydrogen 3.028 N/A MET 333.A N ALA 329.A O no hydrogen 3.053 N/A PHE 334.A N VAL 330.A O no hydrogen 2.839 N/A ASN 335.A N THR 331.A O no hydrogen 2.918 N/A ASN 335.A ND2 ASP 289.A OD1 no hydrogen 2.586 N/A LEU 336.A N GLY 332.A O no hydrogen 2.797 N/A TYR 337.A N MET 333.A O no hydrogen 2.771 N/A ARG 338.A N PHE 334.A O no hydrogen 2.957 N/A ARG 338.A NH1 ASP 246.A OD2 no hydrogen 3.428 N/A ARG 338.A NH1 ASN 335.A OD1 no hydrogen 3.013 N/A ARG 338.A NH2 ASP 246.A OD1 no hydrogen 2.528 N/A ARG 338.A NH2 ASP 246.A OD2 no hydrogen 3.526 N/A ALA 339.A N ASN 335.A O no hydrogen 2.962 N/A SER 340.A N LEU 336.A O no hydrogen 2.847 N/A SER 340.A OG TYR 337.A O no hydrogen 2.867 N/A GLN 341.A N ARG 338.A O no hydrogen 3.427 N/A LEU 342.A N ALA 339.A O no hydrogen 3.085 N/A ALA 343.A N SER 340.A O no hydrogen 3.243 N/A PHE 344.A N GLU 347.A OE1 no hydrogen 2.894 N/A ARG 346.A NE GLU 642.A OE2 no hydrogen 3.477 N/A GLU 347.A N PHE 344.A O no hydrogen 2.987 N/A GLU 348.A N ARG 346.A O no hydrogen 3.161 N/A LEU 350.A N GLU 347.A O no hydrogen 3.077 N/A LYS 351.A N GLU 347.A O no hydrogen 3.419 N/A ASN 352.A N GLU 348.A O no hydrogen 3.045 N/A ALA 353.A N ILE 349.A O no hydrogen 2.930 N/A LYS 354.A N LEU 350.A O no hydrogen 2.811 N/A GLU 355.A N LYS 351.A O no hydrogen 2.877 N/A PHE 356.A N ASN 352.A O no hydrogen 2.837 N/A SER 357.A N ALA 353.A O no hydrogen 2.839 N/A SER 357.A OG ALA 353.A O no hydrogen 2.831 N/A TYR 358.A N LYS 354.A O no hydrogen 3.034 N/A ASN 359.A N GLU 355.A O no hydrogen 3.295 N/A TYR 360.A N PHE 356.A O no hydrogen 2.918 N/A LEU 361.A N SER 357.A O no hydrogen 2.979 N/A LEU 362.A N TYR 358.A O no hydrogen 2.800 N/A GLU 363.A N ASN 359.A O no hydrogen 2.883 N/A LYS 364.A N TYR 360.A O no hydrogen 3.035 N/A LYS 364.A NZ GLU 369.A OE1 no hydrogen 2.688 N/A ARG 365.A N LEU 361.A O no hydrogen 2.921 N/A ARG 365.A N LEU 362.A O no hydrogen 3.240 N/A GLU 366.A N LEU 362.A O no hydrogen 3.098 N/A ARG 367.A N GLU 363.A O no hydrogen 2.810 N/A GLU 369.A N LYS 364.A O no hydrogen 3.014 N/A TRP 374.A N ASP 372.A OD2 no hydrogen 2.886 N/A ILE 376.A N VAL 414.A O no hydrogen 2.640 N/A LYS 378.A N ASP 413.A OD1 no hydrogen 3.171 N/A LYS 378.A NZ ASP 406.A O no hydrogen 3.293 N/A GLY 382.A N ASP 379.A OD1 no hydrogen 2.967 N/A GLU 383.A N ASP 379.A O no hydrogen 3.196 N/A ILE 384.A N LEU 380.A O no hydrogen 3.023 N/A GLY 385.A N PRO 381.A O no hydrogen 2.859 N/A PHE 386.A N GLY 382.A O no hydrogen 2.933 N/A ALA 387.A N GLU 383.A O no hydrogen 3.071 N/A LEU 388.A N ILE 384.A O no hydrogen 2.886 N/A GLU 389.A N GLY 385.A O no hydrogen 2.891 N/A ILE 390.A N PHE 386.A O no hydrogen 2.663 N/A ALA 394.A N PRO 391.A O no hydrogen 2.887 N/A SER 395.A N TRP 392.A O no hydrogen 3.023 N/A SER 395.A OG GLU 400.A OE2 no hydrogen 3.118 N/A ARG 398.A N ALA 481.A O no hydrogen 3.119 N/A VAL 399.A N LEU 396.A O no hydrogen 2.984 N/A GLU 400.A N LEU 396.A O no hydrogen 3.100 N/A THR 401.A N PRO 397.A O no hydrogen 2.917 N/A THR 401.A OG1 ARG 250.A O no hydrogen 3.136 N/A THR 401.A OG1 PRO 397.A O no hydrogen 3.016 N/A ARG 402.A N ARG 398.A O no hydrogen 2.782 N/A ARG 402.A NE LYS 681.A O no hydrogen 3.045 N/A ARG 402.A NE GLN 685.A O no hydrogen 3.266 N/A ARG 402.A NH1 ARG 402.A O no hydrogen 2.906 N/A ARG 402.A NH1 ASP 406.A OD2 no hydrogen 2.800 N/A ARG 402.A NH2 GLN 685.A O no hydrogen 3.202 N/A PHE 403.A N VAL 399.A O no hydrogen 3.332 N/A TYR 404.A N GLU 400.A O no hydrogen 2.967 N/A ILE 405.A N THR 401.A O no hydrogen 2.994 N/A GLN 407.A N TYR 404.A O no hydrogen 2.836 N/A TYR 408.A N TYR 404.A O no hydrogen 2.811 N/A TYR 408.A OH VAL 426.A O no hydrogen 2.600 N/A GLU 411.A N ASN 429.A OD1 no hydrogen 3.095 N/A ASN 412.A N GLY 409.A O no hydrogen 2.995 N/A VAL 414.A N ILE 376.A O no hydrogen 3.067 N/A TRP 415.A N TYR 421.A O no hydrogen 2.824 N/A ILE 416.A N TRP 374.A O no hydrogen 2.978 N/A GLY 417.A N THR 419.A O no hydrogen 2.954 N/A LYS 418.A NZ HIS 173.A O no hydrogen 2.545 N/A LYS 418.A NZ GLU 176.A OE1 no hydrogen 3.100 N/A LYS 418.A NZ GLU 176.A OE2 no hydrogen 2.955 N/A LYS 418.A NZ SER 199.A OG no hydrogen 3.011 N/A LYS 418.A NZ SER 201.A OG no hydrogen 2.859 N/A THR 419.A OG1 SER 26.A OG no hydrogen 2.990 N/A LEU 420.A N ASP 72.A OD1 no hydrogen 3.024 N/A TYR 421.A N TRP 415.A O no hydrogen 2.937 N/A ARG 422.A N THR 24.A OG1 no hydrogen 3.019 N/A ARG 422.A NE ASP 64.A OD1 no hydrogen 3.001 N/A ARG 422.A NH2 ASP 64.A OD1 no hydrogen 3.544 N/A ARG 422.A NH2 ASP 64.A OD2 no hydrogen 2.944 N/A VAL 426.A N MET 423.A O no hydrogen 2.969 N/A ASN 427.A N MET 423.A O no hydrogen 2.889 N/A ASN 427.A ND2 GLY 410.A O no hydrogen 2.872 N/A ASN 427.A ND2 ASP 413.A OD2 no hydrogen 3.101 N/A ASN 428.A N TYR 408.A OH no hydrogen 2.941 N/A TYR 431.A OH TYR 425.A O no hydrogen 2.728 N/A GLU 433.A N ASN 429.A O no hydrogen 3.015 N/A LEU 434.A N GLY 430.A O no hydrogen 3.058 N/A ALA 435.A N TYR 431.A O no hydrogen 2.806 N/A LYS 436.A N LEU 432.A O no hydrogen 2.719 N/A GLN 437.A N GLU 433.A O no hydrogen 3.039 N/A ASP 438.A N LEU 434.A O no hydrogen 2.916 N/A TYR 439.A N ALA 435.A O no hydrogen 2.874 N/A TYR 439.A OH VAL 682.A O no hydrogen 3.007 N/A ASN 440.A N LYS 436.A O no hydrogen 2.929 N/A ASN 440.A ND2 VAL 687.A O no hydrogen 2.964 N/A ASN 441.A N GLN 437.A O no hydrogen 2.919 N/A CYS 442.A N ASP 438.A O no hydrogen 3.146 N/A CYS 442.A SG ASP 438.A O no hydrogen 3.624 N/A CYS 442.A SG PHE 484.A O no hydrogen 3.921 N/A GLN 443.A N TYR 439.A O no hydrogen 2.930 N/A GLN 443.A NE2 VAL 682.A O no hydrogen 3.097 N/A GLN 443.A NE2 GLN 685.A O no hydrogen 2.963 N/A ALA 444.A N ASN 440.A O no hydrogen 2.970 N/A GLN 445.A N ASN 441.A O no hydrogen 3.182 N/A HIS 446.A N CYS 442.A O no hydrogen 2.905 N/A HIS 446.A NE2 PHE 484.A O no hydrogen 2.782 N/A GLN 447.A N GLN 443.A O no hydrogen 3.000 N/A GLN 447.A NE2 LEU 683.A O no hydrogen 2.835 N/A LEU 448.A N ALA 444.A O no hydrogen 3.249 N/A GLU 449.A N GLN 445.A O no hydrogen 3.218 N/A TRP 450.A N HIS 446.A O no hydrogen 2.825 N/A ASP 451.A N GLN 447.A O no hydrogen 3.108 N/A ILE 452.A N LEU 448.A O no hydrogen 2.978 N/A PHE 453.A N GLU 449.A O no hydrogen 2.690 N/A GLN 454.A N TRP 450.A O no hydrogen 3.072 N/A LYS 455.A N ASP 451.A O no hydrogen 3.225 N/A TRP 456.A N ILE 452.A O no hydrogen 2.979 N/A TYR 457.A N PHE 453.A O no hydrogen 3.127 N/A TYR 457.A OH VAL 467.A O no hydrogen 2.557 N/A GLU 458.A N GLN 454.A O no hydrogen 2.926 N/A GLU 459.A N LYS 455.A O no hydrogen 2.794 N/A ASN 460.A N TRP 456.A O no hydrogen 3.109 N/A ASN 460.A ND2 TRP 456.A O no hydrogen 2.789 N/A ARG 461.A N GLU 458.A O no hydrogen 2.703 N/A ARG 461.A NH2 GLU 464.A OE1 no hydrogen 3.496 N/A ARG 461.A NH2 GLU 464.A OE2 no hydrogen 2.919 N/A LEU 462.A N TYR 457.A O no hydrogen 3.025 N/A GLU 464.A N ARG 461.A O no hydrogen 3.234 N/A TRP 465.A N LEU 462.A O no hydrogen 2.987 N/A VAL 467.A N LEU 462.A O no hydrogen 3.358 N/A ARG 468.A N GLU 471.A OE1 no hydrogen 2.842 N/A LEU 472.A N ARG 468.A O no hydrogen 2.985 N/A LEU 473.A N ARG 469.A O no hydrogen 3.140 N/A GLU 474.A N SER 470.A O no hydrogen 3.259 N/A CYS 475.A N GLU 471.A O no hydrogen 2.934 N/A CYS 475.A SG GLU 471.A O no hydrogen 3.237 N/A CYS 475.A SG SER 499.A OG no hydrogen 3.767 N/A TYR 476.A N LEU 472.A O no hydrogen 3.030 N/A TYR 476.A OH HIS 446.A O no hydrogen 2.990 N/A TYR 476.A OH GLU 449.A OE1 no hydrogen 2.730 N/A TYR 477.A N LEU 473.A O no hydrogen 2.789 N/A TYR 477.A OH TYR 667.A OH no hydrogen 2.992 N/A LEU 478.A N GLU 474.A O no hydrogen 3.068 N/A ALA 479.A N CYS 475.A O no hydrogen 3.449 N/A ALA 480.A N TYR 476.A O no hydrogen 2.904 N/A ALA 481.A N TYR 477.A O no hydrogen 2.801 N/A THR 482.A N ALA 479.A O no hydrogen 3.191 N/A THR 482.A OG1 LEU 478.A O no hydrogen 2.767 N/A ILE 483.A N ALA 479.A O no hydrogen 2.824 N/A GLU 485.A N GLU 485.A OE1 no hydrogen 2.535 N/A ARG 488.A N GLU 485.A O no hydrogen 2.939 N/A ARG 488.A NE GLU 491.A OE1 no hydrogen 3.407 N/A ARG 488.A NE GLU 491.A OE2 no hydrogen 3.152 N/A ARG 488.A NH1 GLU 485.A OE1 no hydrogen 3.086 N/A ARG 488.A NH1 GLU 485.A OE2 no hydrogen 3.326 N/A ARG 488.A NH2 GLU 491.A OE2 no hydrogen 2.842 N/A ARG 492.A N ARG 488.A O no hydrogen 3.146 N/A ARG 492.A NE GLU 449.A OE1 no hydrogen 2.563 N/A ARG 492.A NH1 ILE 483.A O no hydrogen 2.734 N/A ARG 492.A NH1 GLU 485.A O no hydrogen 2.937 N/A ARG 492.A NH2 GLU 449.A OE1 no hydrogen 3.345 N/A ARG 492.A NH2 GLU 449.A OE2 no hydrogen 2.603 N/A ARG 492.A NH2 GLU 485.A O no hydrogen 3.392 N/A MET 493.A N SER 489.A O no hydrogen 2.769 N/A VAL 494.A N HIS 490.A O no hydrogen 3.041 N/A TRP 495.A N GLU 491.A O no hydrogen 3.247 N/A ALA 496.A N ARG 492.A O no hydrogen 3.043 N/A LYS 497.A N MET 493.A O no hydrogen 2.833 N/A LYS 497.A NZ GLN 546.A OE1 no hydrogen 3.058 N/A SER 498.A N VAL 494.A O no hydrogen 2.779 N/A SER 498.A OG VAL 494.A O no hydrogen 2.751 N/A SER 499.A N TRP 495.A O no hydrogen 2.963 N/A SER 499.A OG TRP 495.A O no hydrogen 3.124 N/A SER 499.A OG ALA 496.A O no hydrogen 2.946 N/A VAL 500.A N ALA 496.A O no hydrogen 3.238 N/A LEU 501.A N LYS 497.A O no hydrogen 3.012 N/A VAL 502.A N SER 498.A O no hydrogen 2.910 N/A LYS 503.A N SER 499.A O no hydrogen 3.079 N/A ALA 504.A N VAL 500.A O no hydrogen 2.989 N/A ILE 505.A N LEU 501.A O no hydrogen 3.062 N/A SER 506.A N VAL 502.A O no hydrogen 3.064 N/A SER 507.A N LYS 503.A O no hydrogen 3.009 N/A SER 507.A OG LYS 503.A O no hydrogen 2.677 N/A SER 508.A N ALA 504.A O no hydrogen 2.846 N/A SER 508.A OG TRP 465.A O no hydrogen 2.966 N/A SER 508.A OG ALA 504.A O no hydrogen 3.178 N/A PHE 509.A N ILE 505.A O no hydrogen 2.851 N/A GLU 511.A N GLU 511.A OE2 no hydrogen 2.910 N/A SER 512.A N SER 515.A OG no hydrogen 3.003 N/A SER 512.A OG ASP 514.A OD1 no hydrogen 2.310 N/A SER 515.A N ASP 514.A OD1 no hydrogen 2.569 N/A SER 515.A OG PHE 509.A O no hydrogen 3.005 N/A SER 515.A OG SER 512.A O no hydrogen 2.630 N/A ARG 516.A N SER 512.A O no hydrogen 2.993 N/A ARG 516.A NE GLY 510.A O no hydrogen 3.270 N/A ARG 516.A NH1 LYS 575.A O no hydrogen 2.813 N/A ARG 517.A N SER 513.A O no hydrogen 2.717 N/A SER 518.A N ASP 514.A O no hydrogen 2.537 N/A PHE 519.A N SER 515.A O no hydrogen 2.881 N/A SER 520.A N ARG 516.A O no hydrogen 2.934 N/A SER 520.A OG ARG 516.A O no hydrogen 3.039 N/A SER 520.A OG ARG 517.A O no hydrogen 3.205 N/A ASP 521.A N ARG 517.A O no hydrogen 3.023 N/A GLN 522.A N SER 518.A O no hydrogen 3.278 N/A PHE 523.A N PHE 519.A O no hydrogen 2.890 N/A HIS 524.A N SER 520.A O no hydrogen 3.050 N/A HIS 524.A ND1 SER 520.A O no hydrogen 2.982 N/A GLU 525.A N ASP 521.A O no hydrogen 2.654 N/A TYR 526.A N GLN 522.A O no hydrogen 2.783 N/A TYR 526.A N PHE 523.A O no hydrogen 3.205 N/A ILE 527.A N PHE 523.A O no hydrogen 3.109 N/A VAL 531.A N PRO 528.A O no hydrogen 3.403 N/A ALA 533.A N GLY 529.A O no hydrogen 3.105 N/A SER 534.A N SER 530.A O no hydrogen 3.286 N/A ARG 535.A N VAL 531.A O no hydrogen 3.354 N/A LEU 536.A N GLN 532.A O no hydrogen 2.935 N/A ALA 537.A N ALA 533.A O no hydrogen 3.158 N/A GLY 538.A N SER 534.A O no hydrogen 3.030 N/A VAL 539.A N ARG 535.A O no hydrogen 3.115 N/A LEU 540.A N LEU 536.A O no hydrogen 2.952 N/A ILE 541.A N ALA 537.A O no hydrogen 2.759 N/A GLY 542.A N GLY 538.A O no hydrogen 2.609 N/A THR 543.A N VAL 539.A O no hydrogen 2.829 N/A LEU 544.A N LEU 540.A O no hydrogen 2.915 N/A ASN 545.A N ILE 541.A O no hydrogen 2.984 N/A GLN 546.A N GLY 542.A O no hydrogen 3.110 N/A GLN 546.A NE2 ASP 550.A OD2 no hydrogen 3.230 N/A MET 547.A N THR 543.A O no hydrogen 3.020 N/A SER 548.A N LEU 544.A O no hydrogen 3.223 N/A SER 548.A OG LEU 544.A O no hydrogen 3.223 N/A SER 548.A OG ASN 545.A O no hydrogen 3.087 N/A PHE 549.A N ASN 545.A O no hydrogen 2.988 N/A ASP 550.A N GLN 546.A O no hydrogen 3.010 N/A LEU 551.A N MET 547.A O no hydrogen 3.031 N/A PHE 552.A N SER 548.A O no hydrogen 2.822 N/A MET 553.A N PHE 549.A O no hydrogen 2.706 N/A SER 554.A N ASP 550.A O no hydrogen 3.099 N/A SER 554.A N LEU 551.A O no hydrogen 3.277 N/A SER 554.A OG HIS 490.A NE2 no hydrogen 3.309 N/A SER 554.A OG ASP 550.A O no hydrogen 2.799 N/A HIS 555.A N LEU 551.A O no hydrogen 2.734 N/A GLY 556.A N PHE 552.A O no hydrogen 2.877 N/A ARG 557.A NH1 LEU 592.A O no hydrogen 2.979 N/A LEU 563.A N VAL 559.A O no hydrogen 2.921 N/A TYR 564.A N ASN 560.A O no hydrogen 3.149 N/A TYR 564.A OH ASN 545.A OD1 no hydrogen 2.417 N/A LEU 565.A N ASN 561.A O no hydrogen 2.973 N/A SER 566.A N LEU 562.A O no hydrogen 2.976 N/A SER 566.A OG LEU 562.A O no hydrogen 2.960 N/A TRP 567.A N LEU 563.A O no hydrogen 3.220 N/A GLY 568.A N TYR 564.A O no hydrogen 2.728 N/A ASP 569.A N LEU 565.A O no hydrogen 2.712 N/A TRP 570.A N SER 566.A O no hydrogen 3.006 N/A MET 571.A N TRP 567.A O no hydrogen 2.913 N/A GLU 572.A N GLY 568.A O no hydrogen 3.254 N/A LYS 573.A NZ GLU 584.A OE1 no hydrogen 3.416 N/A TRP 574.A N TRP 570.A O no hydrogen 3.012 N/A LYS 575.A N MET 571.A O no hydrogen 2.765 N/A LEU 576.A N GLU 572.A O no hydrogen 3.162 N/A TYR 577.A N LYS 573.A O no hydrogen 2.964 N/A GLY 578.A N TRP 574.A O no hydrogen 2.608 N/A LEU 585.A N GLY 581.A O no hydrogen 3.312 N/A MET 586.A N GLU 582.A O no hydrogen 2.992 N/A VAL 587.A N GLY 583.A O no hydrogen 3.138 N/A LYS 588.A N GLU 584.A O no hydrogen 3.008 N/A MET 589.A N LEU 585.A O no hydrogen 2.955 N/A ILE 590.A N MET 586.A O no hydrogen 2.956 N/A ILE 591.A N VAL 587.A O no hydrogen 2.925 N/A LEU 592.A N LYS 588.A O no hydrogen 2.937 N/A MET 593.A N MET 589.A O no hydrogen 3.057 N/A LYS 594.A N ILE 591.A O no hydrogen 3.116 N/A LYS 594.A NZ GLU 491.A OE2 no hydrogen 3.177 N/A PHE 601.A N LEU 598.A O no hydrogen 2.983 N/A PHE 602.A N THR 599.A O no hydrogen 3.144 N/A HIS 606.A N HIS 604.A ND1 no hydrogen 3.129 N/A VAL 608.A N HIS 604.A O no hydrogen 3.261 N/A ARG 609.A N THR 605.A O no hydrogen 2.878 N/A LEU 610.A N HIS 606.A O no hydrogen 3.087 N/A ALA 611.A N PHE 607.A O no hydrogen 2.941 N/A GLU 612.A N VAL 608.A O no hydrogen 3.158 N/A ILE 613.A N ARG 609.A O no hydrogen 3.317 N/A ILE 614.A N LEU 610.A O no hydrogen 2.875 N/A ASN 615.A N ALA 611.A O no hydrogen 3.060 N/A ASN 615.A ND2 GLU 584.A OE1 no hydrogen 2.808 N/A ARG 616.A N ILE 613.A O no hydrogen 2.975 N/A ILE 617.A N ILE 613.A O no hydrogen 3.198 N/A ILE 617.A N ILE 614.A O no hydrogen 2.878 N/A CYS 618.A N ILE 614.A O no hydrogen 2.812 N/A CYS 618.A SG ILE 614.A O no hydrogen 3.859 N/A LEU 619.A N ILE 617.A O no hydrogen 2.927 N/A LYS 626.A N ASN 623.A O no hydrogen 3.149 N/A LYS 626.A NZ GLN 622.A O no hydrogen 3.326 N/A THR 629.A N GLU 625.A O no hydrogen 3.436 N/A THR 629.A OG1 GLU 625.A O no hydrogen 2.898 N/A ILE 630.A N LYS 626.A O no hydrogen 2.950 N/A LYS 631.A N GLU 627.A O no hydrogen 2.843 N/A SER 632.A N LYS 628.A O no hydrogen 2.967 N/A SER 632.A OG LYS 628.A O no hydrogen 3.147 N/A SER 632.A OG THR 629.A O no hydrogen 2.620 N/A MET 633.A N THR 629.A O no hydrogen 3.157 N/A GLU 634.A N ILE 630.A O no hydrogen 3.249 N/A LYS 635.A N LYS 631.A O no hydrogen 3.414 N/A GLU 636.A N SER 632.A O no hydrogen 3.349 N/A MET 637.A N MET 633.A O no hydrogen 2.799 N/A GLY 638.A N GLU 634.A O no hydrogen 2.701 N/A LYS 639.A N LYS 635.A O no hydrogen 3.426 N/A MET 640.A N GLU 636.A O no hydrogen 3.179 N/A VAL 641.A N MET 637.A O no hydrogen 2.779 N/A GLU 642.A N GLY 638.A O no hydrogen 3.267 N/A LEU 643.A N LYS 639.A O no hydrogen 3.047 N/A ALA 644.A N MET 640.A O no hydrogen 2.743 N/A LEU 645.A N VAL 641.A O no hydrogen 2.942 N/A SER 646.A N GLU 642.A O no hydrogen 3.364 N/A SER 646.A OG GLU 642.A O no hydrogen 2.852 N/A SER 646.A OG LEU 643.A O no hydrogen 3.361 N/A SER 646.A OG SER 646.A O no hydrogen 2.604 N/A SER 648.A OG THR 650.A OG1 no hydrogen 3.285 N/A THR 650.A OG1 SER 648.A OG no hydrogen 3.285 N/A ARG 652.A N SER 648.A O no hydrogen 3.165 N/A ARG 652.A NH2 GLN 300.A O no hydrogen 3.078 N/A ARG 652.A NH2 LEU 645.A O no hydrogen 2.858 N/A VAL 654.A N PHE 651.A O no hydrogen 2.905 N/A SER 655.A N PHE 651.A O no hydrogen 3.020 N/A SER 655.A OG ALA 644.A O no hydrogen 3.316 N/A SER 655.A OG ARG 652.A O no hydrogen 2.936 N/A ILE 656.A N ARG 652.A O no hydrogen 2.799 N/A THR 657.A N ASP 653.A O no hydrogen 3.371 N/A THR 657.A OG1 ASP 653.A O no hydrogen 2.769 N/A PHE 658.A N VAL 654.A O no hydrogen 3.213 N/A LEU 659.A N SER 655.A O no hydrogen 3.227 N/A ASP 660.A N ILE 656.A O no hydrogen 2.937 N/A VAL 661.A N THR 657.A O no hydrogen 3.102 N/A ALA 662.A N PHE 658.A O no hydrogen 2.968 N/A LYS 663.A N LEU 659.A O no hydrogen 2.811 N/A LYS 663.A NZ SER 395.A O no hydrogen 3.181 N/A ALA 664.A N ASP 660.A O no hydrogen 3.119 N/A PHE 665.A N VAL 661.A O no hydrogen 3.138 N/A TYR 666.A N ALA 662.A O no hydrogen 2.897 N/A TYR 666.A OH GLU 634.A OE2 no hydrogen 2.795 N/A TYR 667.A N LYS 663.A O no hydrogen 2.728 N/A TYR 667.A OH TYR 477.A OH no hydrogen 2.992 N/A TYR 667.A OH HIS 678.A ND1 no hydrogen 2.598 N/A PHE 668.A N ALA 664.A O no hydrogen 2.965 N/A ALA 669.A N PHE 665.A O no hydrogen 2.862 N/A LEU 670.A N TYR 666.A O no hydrogen 2.950 N/A CYS 671.A N TYR 667.A O no hydrogen 2.780 N/A GLY 672.A N PHE 668.A O no hydrogen 2.746 N/A HIS 674.A N CYS 671.A O no hydrogen 2.990 N/A HIS 678.A ND1 TYR 667.A OH no hydrogen 2.598 N/A HIS 678.A NE2 GLU 389.A OE1 no hydrogen 3.093 N/A ILE 679.A N LEU 675.A O no hydrogen 2.801 N/A SER 680.A N GLN 676.A O no hydrogen 3.056 N/A LYS 681.A N THR 677.A O no hydrogen 2.901 N/A LYS 681.A NZ GLN 685.A OE1 no hydrogen 3.166 N/A VAL 682.A N HIS 678.A O no hydrogen 2.908 N/A LEU 683.A N ILE 679.A O no hydrogen 2.929 N/A PHE 684.A N SER 680.A O no hydrogen 2.941 N/A GLN 685.A NE2 SER 680.A OG no hydrogen 2.728 N/A VAL 687.A N ASN 440.A OD1 no hydrogen 2.888 N/A