Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3k1a_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): VAL 5.A N ARG 2.A O no hydrogen 2.248 N/A SER 7.A N GLU 3.A O no hydrogen 3.428 N/A SER 7.A OG GLU 3.A O no hydrogen 2.837 N/A LEU 8.A N GLU 4.A O no hydrogen 2.721 N/A ILE 9.A N VAL 5.A O no hydrogen 2.883 N/A GLN 10.A N GLU 6.A O no hydrogen 3.183 N/A GLN 10.A NE2 GLU 14.A OE2 no hydrogen 2.780 N/A GLU 11.A N SER 7.A O no hydrogen 3.161 N/A VAL 12.A N LEU 8.A O no hydrogen 3.063 N/A LEU 13.A N ILE 9.A O no hydrogen 3.011 N/A GLU 14.A N GLU 11.A O no hydrogen 3.439 N/A TYR 16.A N LEU 13.A O no hydrogen 3.191 N/A TYR 16.A OH GLU 395.A OE2 no hydrogen 2.681 N/A ARG 21.A N PRO 17.A O no hydrogen 2.832 N/A ARG 21.A NH2 GLU 18.A OE2 no hydrogen 3.420 N/A LYS 22.A N GLU 18.A O no hydrogen 2.828 N/A ASP 23.A N LYS 19.A O no hydrogen 3.214 N/A ARG 24.A N ALA 20.A O no hydrogen 2.734 N/A ARG 24.A NE GLU 395.A OE2 no hydrogen 2.912 N/A ARG 24.A NH1 ASP 389.A O no hydrogen 3.168 N/A ARG 24.A NH2 ASP 389.A O no hydrogen 2.942 N/A ARG 24.A NH2 GLU 395.A OE1 no hydrogen 2.926 N/A ASN 25.A N ARG 21.A O no hydrogen 3.150 N/A LYS 26.A N ASP 23.A O no hydrogen 2.967 N/A HIS 27.A N ARG 24.A O no hydrogen 2.936 N/A HIS 27.A ND1 ASP 23.A O no hydrogen 2.930 N/A ALA 29.A N LEU 387.A O no hydrogen 2.938 N/A ASN 31.A N THR 385.A O no hydrogen 2.908 N/A ASN 31.A ND2 MET 378.A O no hydrogen 3.080 N/A ASN 31.A ND2 GLY 382.A O no hydrogen 3.180 N/A ILE 34.A N LYS 26.A O no hydrogen 3.155 N/A SER 35.A OG ALA 369.A O no hydrogen 3.310 N/A LYS 37.A NZ SER 35.A O no hydrogen 2.991 N/A SER 39.A OG ASP 390.A OD2 no hydrogen 2.669 N/A THR 45.A OG1 ASP 390.A OD1 no hydrogen 2.497 N/A ARG 47.A N THR 45.A OG1 no hydrogen 3.133 N/A ARG 47.A NE GLU 367.A O no hydrogen 2.853 N/A ARG 47.A NH1 LYS 37.A O no hydrogen 2.896 N/A ARG 47.A NH1 SER 39.A OG no hydrogen 3.167 N/A ARG 47.A NH2 LYS 37.A O no hydrogen 3.452 N/A ARG 47.A NH2 GLU 367.A O no hydrogen 3.431 N/A GLY 48.A N GLN 178.A OE1 no hydrogen 2.973 N/A TYR 51.A OH SER 69.A OG no hydrogen 2.651 N/A TYR 51.A OH SER 79.A OG no hydrogen 3.157 N/A GLY 53.A N CYS 49.A O no hydrogen 3.118 N/A SER 54.A N ALA 50.A O no hydrogen 2.855 N/A SER 54.A OG GLN 138.A OE1 no hydrogen 2.732 N/A LYS 55.A N TYR 51.A O no hydrogen 2.773 N/A LYS 55.A NZ SER 79.A OG no hydrogen 3.094 N/A GLY 56.A N TYR 51.A O no hydrogen 3.432 N/A VAL 58.A N GLY 53.A O no hydrogen 3.169 N/A TRP 59.A N SER 54.A O no hydrogen 2.724 N/A GLY 60.A N LYS 55.A O no hydrogen 2.780 N/A ILE 62.A N TRP 59.A O no hydrogen 2.953 N/A LYS 63.A N GLY 244.A O no hydrogen 2.913 N/A LYS 63.A NZ ILE 88.A O no hydrogen 3.015 N/A LYS 63.A NZ ASP 243.A OD1 no hydrogen 2.600 N/A ILE 66.A N GLY 134.A O no hydrogen 2.977 N/A HIS 67.A ND1 SER 136.A OG no hydrogen 2.780 N/A HIS 67.A NE2 ILE 62.A O no hydrogen 2.755 N/A ILE 68.A N SER 136.A O no hydrogen 2.769 N/A SER 69.A N PHE 101.A O no hydrogen 2.897 N/A SER 69.A OG TYR 51.A OH no hydrogen 2.651 N/A HIS 70.A N GLN 138.A O no hydrogen 2.930 N/A HIS 70.A ND1 SER 103.A OG no hydrogen 2.849 N/A GLY 71.A N SER 103.A OG no hydrogen 2.910 N/A GLN 77.A N VAL 73.A O no hydrogen 3.370 N/A TYR 78.A N GLY 74.A O no hydrogen 2.894 N/A SER 79.A N CYS 75.A O no hydrogen 3.126 N/A SER 79.A OG TYR 51.A OH no hydrogen 3.157 N/A SER 79.A OG CYS 75.A O no hydrogen 2.662 N/A SER 79.A OG GLY 76.A O no hydrogen 3.428 N/A ARG 80.A N GLN 77.A O no hydrogen 3.142 N/A ARG 80.A NH1 THR 98.A O no hydrogen 3.404 N/A ARG 83.A NE ASN 85.A OD1 no hydrogen 3.095 N/A ARG 83.A NH2 ASN 85.A OD1 no hydrogen 3.474 N/A ARG 84.A NH1 SER 434.A O no hydrogen 2.991 N/A ARG 84.A NH2 SER 434.A O no hydrogen 3.543 N/A ASN 85.A ND2 ASN 85.A O no hydrogen 2.765 N/A TYR 86.A N ASN 217.A O no hydrogen 2.993 N/A TYR 87.A OH THR 91.A OG1 no hydrogen 2.654 N/A TYR 87.A OH THR 98.A OG1 no hydrogen 3.355 N/A ILE 88.A N ASP 243.A OD1 no hydrogen 2.940 N/A THR 91.A OG1 TYR 87.A OH no hydrogen 2.654 N/A GLY 92.A N ALA 95.A O no hydrogen 2.630 N/A VAL 93.A N THR 90.A O no hydrogen 3.062 N/A ASN 94.A N THR 90.A O no hydrogen 3.072 N/A ASN 94.A ND2 THR 90.A O no hydrogen 3.349 N/A ALA 95.A N THR 90.A O no hydrogen 3.247 N/A PHE 96.A N LYS 63.A O no hydrogen 3.075 N/A THR 98.A OG1 TYR 87.A OH no hydrogen 3.355 N/A MET 99.A N PHE 96.A O no hydrogen 3.072 N/A ASN 100.A ND2 GLN 77.A OE1 no hydrogen 3.321 N/A THR 102.A OG1 SER 69.A O no hydrogen 2.948 N/A SER 103.A N SER 69.A O no hydrogen 3.312 N/A SER 103.A OG HIS 70.A ND1 no hydrogen 2.849 N/A SER 103.A OG GLY 71.A O no hydrogen 3.357 N/A ASP 104.A N THR 102.A OG1 no hydrogen 3.164 N/A PHE 105.A N GLY 71.A O no hydrogen 2.876 N/A GLN 106.A N ASP 109.A OD2 no hydrogen 2.890 N/A GLN 106.A NE2 ASP 104.A O no hydrogen 3.121 N/A ASP 109.A N GLN 106.A O no hydrogen 2.950 N/A ILE 110.A N GLN 106.A O no hydrogen 3.238 N/A VAL 111.A N GLU 107.A O no hydrogen 2.954 N/A PHE 112.A N LYS 108.A O no hydrogen 2.872 N/A GLY 113.A N ASP 109.A O no hydrogen 2.872 N/A GLY 114.A N ASP 148.A OD1 no hydrogen 3.332 N/A GLY 114.A N ASP 148.A OD2 no hydrogen 3.094 N/A LYS 117.A NZ SER 103.A O no hydrogen 2.734 N/A LYS 117.A NZ ASP 104.A O no hydrogen 3.207 N/A LYS 117.A NZ ASP 109.A OD2 no hydrogen 2.834 N/A LEU 118.A N GLY 114.A O no hydrogen 2.822 N/A ALA 119.A N ASP 115.A O no hydrogen 3.184 N/A LYS 120.A N LYS 116.A O no hydrogen 3.293 N/A LEU 121.A N LYS 117.A O no hydrogen 2.900 N/A ILE 122.A N LEU 118.A O no hydrogen 2.926 N/A ASP 123.A N ALA 119.A O no hydrogen 3.243 N/A GLU 124.A N LYS 120.A O no hydrogen 3.054 N/A VAL 125.A N LEU 121.A O no hydrogen 2.866 N/A GLU 126.A N ILE 122.A O no hydrogen 3.074 N/A THR 127.A N ASP 123.A O no hydrogen 3.099 N/A THR 127.A OG1 GLU 124.A O no hydrogen 2.797 N/A LEU 128.A N GLU 124.A O no hydrogen 3.147 N/A PHE 129.A N VAL 125.A O no hydrogen 2.723 N/A ASN 132.A N PHE 129.A O no hydrogen 3.183 N/A ASN 132.A ND2 GLU 126.A OE2 no hydrogen 3.325 N/A ASN 132.A ND2 PHE 129.A O no hydrogen 2.686 N/A LYS 133.A N ASP 64.A O no hydrogen 2.997 N/A GLY 134.A N ASN 132.A OD1 no hydrogen 3.136 N/A ILE 135.A N THR 164.A O no hydrogen 2.855 N/A SER 136.A N ILE 66.A O no hydrogen 2.962 N/A SER 136.A OG HIS 67.A ND1 no hydrogen 2.780 N/A VAL 137.A N VAL 166.A O no hydrogen 2.799 N/A GLN 138.A N ILE 68.A O no hydrogen 2.749 N/A GLN 138.A NE2 SER 136.A OG no hydrogen 2.977 N/A SER 139.A N VAL 168.A O no hydrogen 3.077 N/A SER 139.A OG VAL 168.A O no hydrogen 2.774 N/A GLU 140.A N HIS 70.A O no hydrogen 2.913 N/A ILE 143.A N GLU 140.A O no hydrogen 3.028 N/A ILE 146.A N PRO 142.A O no hydrogen 2.843 N/A GLY 147.A N GLY 144.A O no hydrogen 3.244 N/A ASP 148.A N ILE 143.A O no hydrogen 3.237 N/A ASP 149.A N ASP 115.A OD2 no hydrogen 3.005 N/A GLU 151.A N GLU 151.A OE1 no hydrogen 3.004 N/A SER 152.A N ASP 149.A OD2 no hydrogen 3.277 N/A SER 152.A OG ASP 149.A OD2 no hydrogen 2.429 N/A SER 154.A N ILE 150.A O no hydrogen 2.869 N/A SER 154.A OG ILE 150.A O no hydrogen 2.972 N/A LYS 155.A N GLU 151.A O no hydrogen 2.897 N/A VAL 156.A N SER 152.A O no hydrogen 2.958 N/A LYS 157.A N VAL 153.A O no hydrogen 2.928 N/A LYS 157.A NZ ASP 123.A OD1 no hydrogen 2.719 N/A LYS 157.A NZ ASP 123.A OD2 no hydrogen 3.061 N/A LYS 157.A NZ GLU 160.A OE1 no hydrogen 3.222 N/A GLY 158.A N SER 154.A O no hydrogen 2.822 N/A ALA 159.A N LYS 155.A O no hydrogen 2.985 N/A GLU 160.A N VAL 156.A O no hydrogen 2.925 N/A LEU 161.A N LYS 157.A O no hydrogen 2.945 N/A LYS 163.A N GLY 158.A O no hydrogen 2.968 N/A LYS 163.A NZ GLU 126.A OE1 no hydrogen 3.269 N/A LYS 163.A NZ GLU 126.A OE2 no hydrogen 2.647 N/A LYS 163.A NZ ASN 132.A O no hydrogen 2.802 N/A LYS 163.A NZ ASN 132.A OD1 no hydrogen 3.090 N/A VAL 166.A N ILE 135.A O no hydrogen 2.799 N/A VAL 168.A N VAL 137.A O no hydrogen 2.993 N/A ARG 169.A NH1 ASP 148.A O no hydrogen 3.109 N/A ARG 169.A NH2 ASP 148.A O no hydrogen 3.403 N/A CYS 170.A SG GLN 138.A OE1 no hydrogen 3.560 N/A CYS 170.A SG SER 139.A O no hydrogen 3.241 N/A CYS 170.A SG VAL 168.A O no hydrogen 3.915 N/A GLU 171.A N GLU 171.A OE1 no hydrogen 2.870 N/A ARG 174.A N GLU 171.A O no hydrogen 3.064 N/A ARG 174.A NE GLU 171.A OE1 no hydrogen 3.103 N/A ARG 174.A NH2 GLU 171.A OE1 no hydrogen 3.536 N/A GLN 178.A N GLN 178.A OE1 no hydrogen 2.819 N/A GLN 178.A NE2 GLU 367.A OE1 no hydrogen 3.080 N/A SER 179.A N SER 177.A OG no hydrogen 3.151 N/A HIS 182.A N GLN 178.A O no hydrogen 3.361 N/A HIS 183.A N SER 179.A O no hydrogen 3.399 N/A ILE 184.A N LEU 180.A O no hydrogen 2.827 N/A ALA 185.A N GLY 181.A O no hydrogen 2.786 N/A ASN 186.A N HIS 182.A O no hydrogen 2.663 N/A ASN 186.A ND2 HIS 182.A O no hydrogen 3.080 N/A ASN 186.A ND2 SER 265.A O no hydrogen 3.103 N/A ASP 187.A N HIS 183.A O no hydrogen 2.946 N/A ALA 188.A N ILE 184.A O no hydrogen 2.937 N/A VAL 189.A N ALA 185.A O no hydrogen 3.068 N/A ARG 190.A N ASN 186.A O no hydrogen 3.028 N/A ARG 190.A NH1 ASP 191.A OD1 no hydrogen 2.858 N/A ASP 191.A N ASP 187.A O no hydrogen 2.916 N/A TRP 192.A N ALA 188.A O no hydrogen 3.112 N/A VAL 193.A N VAL 189.A O no hydrogen 3.031 N/A LEU 194.A N VAL 189.A O no hydrogen 2.731 N/A LYS 196.A N VAL 193.A O no hydrogen 3.234 N/A LYS 196.A NZ VAL 193.A O no hydrogen 3.454 N/A LYS 196.A NZ GLU 250.A OE2 no hydrogen 2.945 N/A ARG 197.A NH1 GLU 250.A OE1 no hydrogen 2.792 N/A ASP 198.A N GLY 195.A O no hydrogen 3.372 N/A ASP 200.A N ARG 197.A O no hydrogen 3.114 N/A THR 202.A N ASP 200.A OD1 no hydrogen 3.222 N/A THR 202.A OG1 ASP 200.A OD1 no hydrogen 2.515 N/A THR 206.A N ASP 209.A OD2 no hydrogen 3.024 N/A THR 206.A OG1 ASP 209.A OD1 no hydrogen 2.529 N/A TYR 208.A OH ASP 304.A OD2 no hydrogen 2.580 N/A ASP 209.A N THR 206.A O no hydrogen 3.353 N/A VAL 210.A N ARG 235.A O no hydrogen 2.935 N/A ALA 211.A N LEU 257.A O no hydrogen 3.181 N/A ILE 212.A N ALA 238.A O no hydrogen 2.938 N/A ILE 213.A N LEU 259.A O no hydrogen 2.684 N/A GLY 214.A N TRP 240.A O no hydrogen 2.754 N/A ASP 215.A N TRP 240.A O no hydrogen 3.017 N/A TYR 216.A OH SER 265.A OG no hydrogen 2.686 N/A ASN 217.A N ASP 215.A OD1 no hydrogen 3.196 N/A ASN 217.A ND2 TYR 86.A O no hydrogen 2.783 N/A GLY 219.A N ARG 84.A O no hydrogen 3.142 N/A GLY 220.A N ASN 217.A O no hydrogen 3.110 N/A ASP 221.A N ILE 218.A O no hydrogen 3.415 N/A ALA 222.A N ASN 217.A OD1 no hydrogen 2.735 N/A TRP 223.A N ASN 217.A OD1 no hydrogen 3.101 N/A TRP 223.A NE1 ASP 243.A OD2 no hydrogen 2.994 N/A SER 224.A N GLY 220.A O no hydrogen 3.024 N/A SER 225.A N ASP 221.A O no hydrogen 3.158 N/A SER 225.A N ALA 222.A O no hydrogen 3.139 N/A SER 225.A OG ASP 215.A OD2 no hydrogen 3.548 N/A SER 225.A OG ASP 221.A O no hydrogen 2.870 N/A ARG 226.A N ALA 222.A O no hydrogen 2.764 N/A ILE 227.A N TRP 223.A O no hydrogen 3.293 N/A LEU 228.A N SER 225.A O no hydrogen 3.096 N/A LEU 229.A N SER 225.A O no hydrogen 3.303 N/A GLU 230.A N ARG 226.A O no hydrogen 2.956 N/A GLU 231.A N ILE 227.A O no hydrogen 2.995 N/A MET 232.A N LEU 228.A O no hydrogen 2.991 N/A GLY 233.A N GLU 230.A O no hydrogen 3.202 N/A LEU 234.A N LEU 229.A O no hydrogen 3.068 N/A ARG 235.A N TYR 208.A O no hydrogen 2.838 N/A ARG 235.A NE ASP 209.A OD1 no hydrogen 3.022 N/A ARG 235.A NH2 ALA 204.A O no hydrogen 2.999 N/A ARG 235.A NH2 ASP 209.A OD1 no hydrogen 3.379 N/A ARG 235.A NH2 ASP 209.A OD2 no hydrogen 3.294 N/A CYS 236.A N GLU 230.A OE2 no hydrogen 3.372 N/A VAL 237.A N VAL 210.A O no hydrogen 2.796 N/A GLN 239.A N GLU 248.A OE1 no hydrogen 3.116 N/A TRP 240.A N ILE 212.A O no hydrogen 2.848 N/A TRP 240.A NE1 THR 252.A OG1 no hydrogen 2.686 N/A SER 241.A OG VAL 58.A O no hydrogen 2.666 N/A GLY 242.A N ASP 215.A O no hydrogen 3.083 N/A GLY 244.A N SER 241.A O no hydrogen 2.855 N/A SER 245.A N GLU 248.A OE2 no hydrogen 2.969 N/A SER 245.A OG SER 247.A OG no hydrogen 3.275 N/A SER 245.A OG GLU 248.A OE2 no hydrogen 2.691 N/A ILE 246.A N ASP 64.A OD1 no hydrogen 3.079 N/A SER 247.A OG SER 245.A OG no hydrogen 3.275 N/A GLU 248.A N SER 245.A OG no hydrogen 3.162 N/A ILE 249.A N SER 245.A O no hydrogen 3.367 N/A GLU 250.A N ILE 246.A O no hydrogen 2.915 N/A LEU 251.A N SER 247.A O no hydrogen 2.814 N/A LEU 251.A N GLU 248.A O no hydrogen 3.293 N/A THR 252.A N ILE 249.A O no hydrogen 3.170 N/A THR 252.A OG1 GLU 248.A O no hydrogen 2.815 N/A THR 252.A OG1 ILE 249.A O no hydrogen 2.981 N/A LYS 254.A N LEU 251.A O no hydrogen 2.892 N/A LYS 254.A NZ ARG 197.A O no hydrogen 2.809 N/A LYS 254.A NZ ASP 200.A O no hydrogen 2.823 N/A VAL 255.A N THR 252.A O no hydrogen 2.990 N/A LYS 256.A N ASP 209.A O no hydrogen 3.021 N/A LYS 256.A NZ THR 206.A O no hydrogen 3.365 N/A ASN 258.A N PRO 280.A O no hydrogen 2.941 N/A LEU 259.A N ALA 211.A O no hydrogen 2.722 N/A VAL 260.A N MET 282.A O no hydrogen 2.880 N/A HIS 261.A N ILE 213.A O no hydrogen 2.858 N/A CYS 262.A N GLY 214.A O no hydrogen 3.147 N/A CYS 262.A SG SER 265.A OG no hydrogen 2.952 N/A TYR 263.A OH ASP 372.A OD2 no hydrogen 2.603 N/A ARG 264.A NE ASP 373.A OD2 no hydrogen 2.838 N/A ARG 264.A NH1 TYR 268.A OH no hydrogen 2.942 N/A ARG 264.A NH2 ASP 372.A OD2 no hydrogen 3.374 N/A ARG 264.A NH2 ASP 373.A OD2 no hydrogen 3.186 N/A SER 265.A OG TYR 216.A OH no hydrogen 2.686 N/A MET 266.A N TYR 263.A O no hydrogen 3.235 N/A ASN 267.A N TYR 263.A O no hydrogen 2.825 N/A ASN 267.A ND2 TYR 263.A O no hydrogen 2.851 N/A ILE 269.A N ASN 186.A OD1 no hydrogen 3.022 N/A SER 270.A N MET 266.A O no hydrogen 3.304 N/A SER 270.A OG MET 266.A O no hydrogen 3.029 N/A ARG 271.A N ASN 267.A O no hydrogen 3.012 N/A ARG 271.A NH1 TYR 263.A OH no hydrogen 3.266 N/A ARG 271.A NH2 TYR 263.A OH no hydrogen 3.476 N/A HIS 272.A N TYR 268.A O no hydrogen 3.060 N/A MET 273.A N ILE 269.A O no hydrogen 3.052 N/A GLU 274.A N SER 270.A O no hydrogen 3.227 N/A GLU 275.A N ARG 271.A O no hydrogen 3.101 N/A LYS 276.A N HIS 272.A O no hydrogen 2.816 N/A LYS 276.A NZ ASP 198.A OD2 no hydrogen 2.691 N/A LYS 276.A NZ TYR 277.A OH no hydrogen 3.014 N/A TYR 277.A N MET 273.A O no hydrogen 3.000 N/A TYR 277.A OH ASP 198.A OD1 no hydrogen 2.481 N/A ILE 279.A N MET 273.A O no hydrogen 3.263 N/A MET 282.A N ASN 258.A O no hydrogen 3.000 N/A TYR 284.A N VAL 260.A O no hydrogen 2.913 N/A ASN 285.A N SER 295.A OG no hydrogen 3.014 N/A ASN 285.A ND2 HIS 349.A O no hydrogen 2.937 N/A PHE 286.A N HIS 261.A NE2 no hydrogen 3.242 N/A PHE 287.A N ASN 285.A OD1 no hydrogen 2.843 N/A THR 290.A OG1 ASP 356.A OD1 no hydrogen 2.483 N/A THR 290.A OG1 ASP 356.A OD2 no hydrogen 3.545 N/A LYS 291.A NZ GLU 380.A OE1 no hydrogen 2.943 N/A LYS 291.A NZ GLU 380.A OE2 no hydrogen 3.137 N/A THR 292.A N GLY 288.A O no hydrogen 2.962 N/A THR 292.A OG1 GLY 288.A O no hydrogen 2.589 N/A ILE 293.A N PRO 289.A O no hydrogen 2.775 N/A GLU 294.A N THR 290.A O no hydrogen 3.100 N/A SER 295.A N LYS 291.A O no hydrogen 2.913 N/A SER 295.A OG ASN 285.A O no hydrogen 2.569 N/A SER 295.A OG LYS 291.A O no hydrogen 2.754 N/A LEU 296.A N THR 292.A O no hydrogen 2.850 N/A ARG 297.A N ILE 293.A O no hydrogen 3.122 N/A ARG 297.A NH1 GLU 312.A OE2 no hydrogen 3.328 N/A ALA 298.A N GLU 294.A O no hydrogen 3.049 N/A ILE 299.A N SER 295.A O no hydrogen 2.861 N/A ALA 300.A N LEU 296.A O no hydrogen 2.925 N/A ALA 301.A N ARG 297.A O no hydrogen 3.063 N/A LYS 302.A N ILE 299.A O no hydrogen 3.156 N/A PHE 303.A N ALA 300.A O no hydrogen 3.100 N/A SER 306.A OG TYR 208.A OH no hydrogen 3.359 N/A SER 306.A OG ASP 304.A OD1 no hydrogen 2.698 N/A ILE 307.A N ASP 304.A OD1 no hydrogen 3.231 N/A GLN 308.A N ASP 304.A O no hydrogen 3.058 N/A LYS 309.A N GLU 305.A O no hydrogen 2.906 N/A LYS 309.A NZ GLN 308.A O no hydrogen 3.430 N/A LYS 310.A N SER 306.A O no hydrogen 3.230 N/A CYS 311.A N ILE 307.A O no hydrogen 2.893 N/A GLU 312.A N GLN 308.A O no hydrogen 3.420 N/A GLU 313.A N LYS 309.A O no hydrogen 3.109 N/A VAL 314.A N LYS 310.A O no hydrogen 2.973 N/A ILE 315.A N CYS 311.A O no hydrogen 2.936 N/A ALA 316.A N GLU 312.A O no hydrogen 2.887 N/A LYS 317.A N GLU 313.A O no hydrogen 2.949 N/A LYS 317.A NZ GLU 231.A OE2 no hydrogen 2.829 N/A TYR 318.A N VAL 314.A O no hydrogen 3.169 N/A TYR 318.A OH GLU 231.A OE1 no hydrogen 2.753 N/A TYR 318.A OH GLU 231.A OE2 no hydrogen 3.127 N/A GLU 321.A N TYR 318.A O no hydrogen 3.014 N/A TRP 322.A N TYR 318.A O no hydrogen 3.095 N/A GLU 323.A N LYS 319.A O no hydrogen 2.989 N/A ALA 324.A N PRO 320.A O no hydrogen 3.159 N/A VAL 325.A N GLU 321.A O no hydrogen 3.125 N/A VAL 326.A N TRP 322.A O no hydrogen 3.005 N/A ALA 327.A N GLU 323.A O no hydrogen 2.980 N/A LYS 328.A N ALA 324.A O no hydrogen 3.091 N/A TYR 329.A N VAL 325.A O no hydrogen 2.894 N/A ARG 330.A N VAL 326.A O no hydrogen 2.733 N/A ARG 330.A NE ASP 356.A O no hydrogen 3.463 N/A ARG 330.A NH1 GLU 334.A OE1 no hydrogen 3.012 N/A ARG 332.A N TYR 329.A O no hydrogen 2.959 N/A ARG 332.A NE ASP 451.A OD1 no hydrogen 2.749 N/A ARG 332.A NH2 ASP 451.A OD1 no hydrogen 3.500 N/A LEU 333.A N ARG 330.A O no hydrogen 2.951 N/A GLU 334.A N ARG 330.A O no hydrogen 2.657 N/A GLY 335.A N GLY 358.A O no hydrogen 2.716 N/A LYS 336.A N LEU 333.A O no hydrogen 3.161 N/A ARG 337.A N ASP 406.A OD2 no hydrogen 2.966 N/A ARG 337.A NH1 LYS 404.A O no hydrogen 3.225 N/A ARG 337.A NH2 ILE 403.A O no hydrogen 2.603 N/A ARG 337.A NH2 LYS 404.A O no hydrogen 3.303 N/A VAL 338.A N GLU 360.A O no hydrogen 2.598 N/A MET 339.A N LEU 407.A O no hydrogen 3.075 N/A LEU 340.A N GLY 363.A O no hydrogen 2.918 N/A TYR 341.A N GLY 409.A O no hydrogen 3.114 N/A TYR 341.A OH TYR 366.A O no hydrogen 3.362 N/A ILE 342.A N GLY 365.A O no hydrogen 3.222 N/A ARG 346.A NE MET 428.A O no hydrogen 3.467 N/A ARG 346.A NH2 MET 428.A O no hydrogen 3.312 N/A ARG 348.A N LEU 345.A O no hydrogen 3.217 N/A ARG 348.A NE TYR 366.A OH no hydrogen 2.738 N/A HIS 349.A N LEU 345.A O no hydrogen 3.156 N/A VAL 350.A N ARG 346.A O no hydrogen 3.355 N/A ILE 351.A N ARG 348.A O no hydrogen 3.270 N/A TYR 354.A N VAL 350.A O no hydrogen 3.195 N/A GLU 355.A N ILE 351.A O no hydrogen 3.033 N/A ASP 356.A N GLY 352.A O no hydrogen 2.962 N/A LEU 357.A N TYR 354.A O no hydrogen 3.012 N/A GLY 358.A N GLU 355.A O no hydrogen 3.059 N/A MET 359.A N TYR 354.A O no hydrogen 3.050 N/A GLU 360.A N LYS 336.A O no hydrogen 2.925 N/A VAL 362.A N VAL 338.A O no hydrogen 2.791 N/A THR 364.A N LEU 386.A O no hydrogen 2.985 N/A THR 364.A OG1 PRO 347.A O no hydrogen 2.708 N/A TYR 366.A OH THR 377.A OG1 no hydrogen 2.624 N/A GLU 367.A N ILE 342.A O no hydrogen 2.858 N/A PHE 368.A N GLY 343.A O no hydrogen 3.197 N/A HIS 370.A N ASP 373.A OD2 no hydrogen 2.857 N/A ASP 373.A N HIS 370.A O no hydrogen 3.064 N/A TYR 374.A N HIS 370.A O no hydrogen 3.385 N/A TYR 374.A OH ASP 389.A OD1 no hydrogen 2.677 N/A ASP 375.A N ASN 371.A O no hydrogen 2.868 N/A ARG 376.A N ASP 372.A O no hydrogen 3.332 N/A ARG 376.A NE GLU 283.A OE1 no hydrogen 3.017 N/A ARG 376.A NE GLU 283.A OE2 no hydrogen 3.336 N/A ARG 376.A NH1 ASP 372.A O no hydrogen 2.949 N/A ARG 376.A NH2 GLU 283.A OE2 no hydrogen 3.005 N/A THR 377.A N ASP 373.A O no hydrogen 2.853 N/A THR 377.A OG1 TYR 366.A OH no hydrogen 2.624 N/A THR 377.A OG1 ASP 373.A O no hydrogen 2.660 N/A MET 378.A N TYR 374.A O no hydrogen 2.886 N/A MET 381.A N THR 377.A O no hydrogen 3.105 N/A SER 384.A OG ASP 383.A OD2 no hydrogen 3.169 N/A THR 385.A OG1 GLY 382.A O no hydrogen 2.952 N/A LEU 386.A N VAL 362.A O no hydrogen 3.235 N/A LEU 387.A N ALA 29.A O no hydrogen 2.702 N/A TYR 388.A N THR 364.A O no hydrogen 3.306 N/A TYR 388.A OH LEU 340.A O no hydrogen 2.733 N/A ASP 389.A N HIS 27.A O no hydrogen 2.888 N/A ASP 390.A N TYR 366.A O no hydrogen 2.839 N/A THR 392.A N GLU 395.A OE1 no hydrogen 3.385 N/A THR 392.A OG1 TYR 16.A OH no hydrogen 2.918 N/A GLY 393.A N MET 44.A O no hydrogen 3.295 N/A TYR 394.A OH VAL 12.A O no hydrogen 3.414 N/A GLU 395.A N THR 392.A OG1 no hydrogen 2.930 N/A PHE 396.A N THR 392.A O no hydrogen 3.107 N/A GLU 397.A N GLY 393.A O no hydrogen 3.337 N/A GLU 398.A N TYR 394.A O no hydrogen 3.093 N/A PHE 399.A N GLU 395.A O no hydrogen 2.785 N/A VAL 400.A N PHE 396.A O no hydrogen 3.091 N/A LYS 401.A N GLU 397.A O no hydrogen 2.914 N/A LYS 401.A NZ GLU 397.A OE2 no hydrogen 3.481 N/A LYS 401.A NZ GLU 398.A OE2 no hydrogen 2.704 N/A ARG 402.A N GLU 398.A O no hydrogen 3.187 N/A ARG 402.A NH2 GLU 11.A OE1 no hydrogen 3.537 N/A ILE 403.A N PHE 399.A O no hydrogen 2.801 N/A LYS 404.A N VAL 400.A O no hydrogen 2.771 N/A ASP 406.A N ARG 337.A O no hydrogen 2.812 N/A LEU 407.A N ARG 337.A O no hydrogen 3.170 N/A ILE 408.A N PRO 424.A O no hydrogen 2.945 N/A GLY 409.A N MET 339.A O no hydrogen 2.952 N/A SER 410.A N ARG 426.A O no hydrogen 3.196 N/A SER 410.A OG TYR 341.A O no hydrogen 2.836 N/A SER 410.A OG GLU 414.A OE1 no hydrogen 2.993 N/A GLY 411.A N GLU 414.A OE1 no hydrogen 2.916 N/A LYS 413.A NZ ILE 46.A O no hydrogen 2.935 N/A GLU 414.A N GLY 411.A O no hydrogen 3.198 N/A LYS 415.A N GLY 411.A O no hydrogen 3.002 N/A LYS 415.A NZ ASP 432.A OD1 no hydrogen 2.737 N/A LYS 415.A NZ ASP 432.A OD2 no hydrogen 3.569 N/A ILE 417.A N GLU 414.A O no hydrogen 3.227 N/A GLN 419.A N LYS 415.A O no hydrogen 3.237 N/A LYS 420.A N PHE 416.A O no hydrogen 3.434 N/A MET 421.A N ILE 417.A O no hydrogen 3.246 N/A GLY 422.A N GLN 419.A O no hydrogen 3.055 N/A ILE 423.A N PHE 418.A O no hydrogen 2.928 N/A ARG 426.A N ILE 408.A O no hydrogen 2.859 N/A ARG 426.A NH1 THR 453.A OG1 no hydrogen 3.102 N/A ARG 426.A NH2 TRP 431.A O no hydrogen 3.453 N/A GLU 427.A N ASP 432.A OD2 no hydrogen 2.902 N/A MET 428.A N SER 410.A O no hydrogen 2.732 N/A SER 430.A OG GLU 427.A OE1 no hydrogen 2.856 N/A TRP 431.A NE1 ASP 221.A OD2 no hydrogen 2.860 N/A TYR 433.A N SER 430.A O no hydrogen 3.180 N/A SER 434.A N TRP 431.A O no hydrogen 2.920 N/A SER 434.A OG ASP 449.A OD1 no hydrogen 3.424 N/A SER 434.A OG ASP 449.A OD2 no hydrogen 2.664 N/A GLY 435.A N SER 434.A OG no hydrogen 2.582 N/A TYR 437.A N ASP 221.A OD1 no hydrogen 2.701 N/A TYR 437.A OH ASP 449.A OD2 no hydrogen 2.578 N/A HIS 438.A N ASP 221.A OD1 no hydrogen 3.154 N/A HIS 438.A ND1 ASP 215.A OD2 no hydrogen 2.977 N/A GLY 439.A N PHE 286.A O no hydrogen 2.807 N/A PHE 443.A N GLY 439.A O no hydrogen 3.217 N/A PHE 446.A N GLY 442.A O no hydrogen 2.849 N/A ALA 447.A N PHE 443.A O no hydrogen 2.833 N/A ARG 448.A N ALA 444.A O no hydrogen 3.119 N/A ARG 448.A NH1 ASP 449.A OD1 no hydrogen 3.054 N/A ASP 449.A N ILE 445.A O no hydrogen 2.926 N/A MET 450.A N PHE 446.A O no hydrogen 2.919 N/A ASP 451.A N ALA 447.A O no hydrogen 3.083 N/A MET 452.A N ARG 448.A O no hydrogen 2.948 N/A THR 453.A N ASP 449.A O no hydrogen 3.341 N/A LEU 454.A N MET 450.A O no hydrogen 2.948 N/A ASN 455.A N ASP 451.A O no hydrogen 2.965 N/A ASN 455.A ND2 ARG 332.A O no hydrogen 2.948 N/A ASN 455.A ND2 ASP 451.A OD1 no hydrogen 2.885 N/A ASN 456.A N THR 453.A O no hydrogen 3.107 N/A ASN 456.A ND2 MET 452.A O no hydrogen 3.024 N/A CYS 458.A N ASN 456.A OD1 no hydrogen 3.290 N/A CYS 458.A SG ASN 456.A OD1 no hydrogen 3.369 N/A TRP 459.A N ASN 456.A O no hydrogen 3.384 N/A TRP 459.A NE1 THR 453.A O no hydrogen 2.724 N/A LYS 460.A N PRO 457.A O no hydrogen 3.282 N/A LYS 461.A N CYS 458.A O no hydrogen 3.204 N/A GLU 467.A N ALA 464.A O no hydrogen 2.837 N/A