Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4ufk_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): TYR 3.A N THR 370.A O no hydrogen 2.701 N/A LEU 5.A N THR 372.A O no hydrogen 2.908 N/A ASP 6.A N THR 320.A OG1 no hydrogen 3.198 N/A ASP 7.A N ASP 6.A OD1 no hydrogen 2.648 N/A SER 8.A N ASP 6.A OD1 no hydrogen 3.025 N/A SER 8.A OG ASP 6.A OD1 no hydrogen 3.461 N/A SER 8.A OG ASP 6.A OD2 no hydrogen 2.505 N/A GLY 10.A N ASP 7.A O no hydrogen 3.089 N/A GLY 12.A N TYR 317.A O no hydrogen 2.696 N/A ARG 13.A N TYR 256.A OH no hydrogen 2.949 N/A ARG 13.A NH1 LYS 228.A O no hydrogen 3.385 N/A PHE 15.A N TRP 315.A O no hydrogen 2.778 N/A ASP 16.A N THR 262.A O no hydrogen 2.826 N/A ILE 18.A N HIS 56.A ND1 no hydrogen 3.017 N/A GLY 19.A N THR 264.A O no hydrogen 3.153 N/A ALA 20.A N ILE 57.A O no hydrogen 3.278 N/A VAL 21.A N ALA 266.A O no hydrogen 2.664 N/A SER 22.A N LYS 59.A O no hydrogen 2.657 N/A SER 22.A OG SER 28.A OG no hydrogen 2.779 N/A SER 22.A OG GLU 90.A OE1 no hydrogen 2.867 N/A SER 22.A OG GLU 90.A OE2 no hydrogen 3.354 N/A GLY 23.A N THR 27.A OG1 no hydrogen 3.017 N/A GLY 24.A N GLU 61.A OE1 no hydrogen 2.786 N/A ALA 26.A N GLU 73.A OE2 no hydrogen 2.734 N/A SER 28.A OG SER 22.A OG no hydrogen 2.779 N/A ARG 29.A N ALA 26.A O no hydrogen 3.342 N/A ARG 29.A NE PHE 463.A O no hydrogen 2.922 N/A ARG 29.A NH1 ARG 29.A O no hydrogen 3.028 N/A ARG 29.A NH2 ALA 460.A O no hydrogen 2.760 N/A ARG 29.A NH2 PHE 463.A O no hydrogen 2.684 N/A LEU 30.A N SER 272.A O no hydrogen 2.800 N/A LEU 31.A N SER 28.A O no hydrogen 3.159 N/A ASN 33.A ND2 ASN 462.A OD1 no hydrogen 3.082 N/A TYR 34.A N LEU 31.A O no hydrogen 3.151 N/A TYR 34.A OH HIS 294.A O no hydrogen 2.746 N/A ARG 39.A N PRO 35.A O no hydrogen 3.131 N/A ARG 39.A NH1 VAL 32.A O no hydrogen 2.698 N/A SER 40.A N GLU 36.A OE1 no hydrogen 3.273 N/A GLU 41.A N PRO 37.A O no hydrogen 3.006 N/A ILE 42.A N TYR 38.A O no hydrogen 2.847 N/A LEU 43.A N ARG 39.A O no hydrogen 3.124 N/A ASP 44.A N SER 40.A O no hydrogen 3.006 N/A TYR 45.A N GLU 41.A O no hydrogen 3.004 N/A LEU 46.A N LEU 43.A O no hydrogen 3.217 N/A PHE 47.A N LEU 43.A O no hydrogen 2.848 N/A LYS 48.A N ASP 44.A O no hydrogen 3.024 N/A ALA 53.A N TYR 45.A O no hydrogen 2.706 N/A SER 54.A OG LYS 48.A O no hydrogen 3.359 N/A SER 54.A OG GLY 52.A O no hydrogen 2.815 N/A LEU 55.A N LEU 46.A O no hydrogen 3.204 N/A HIS 56.A N ILE 18.A O no hydrogen 2.839 N/A HIS 56.A NE2 THR 308.A O no hydrogen 3.142 N/A LEU 58.A N ILE 105.A O no hydrogen 2.739 N/A LYS 59.A N ALA 20.A O no hydrogen 3.026 N/A LYS 59.A NZ ASP 187.A OD1 no hydrogen 3.084 N/A LYS 59.A NZ SER 233.A O no hydrogen 2.796 N/A VAL 60.A N MET 107.A O no hydrogen 2.935 N/A GLU 61.A N SER 22.A O no hydrogen 2.979 N/A ILE 62.A N LEU 109.A O no hydrogen 2.871 N/A ASP 65.A N GLU 73.A O no hydrogen 2.967 N/A GLY 66.A N SER 112.A OG no hydrogen 3.034 N/A GLN 67.A N ASP 499.A OD2 no hydrogen 2.873 N/A GLN 67.A NE2 GLN 466.A O no hydrogen 2.843 N/A GLN 67.A NE2 GLN 466.A OE1 no hydrogen 3.085 N/A THR 68.A N GLY 71.A O no hydrogen 2.869 N/A THR 68.A OG1 GLU 61.A OE1 no hydrogen 3.047 N/A THR 68.A OG1 GLU 61.A OE2 no hydrogen 3.251 N/A THR 68.A OG1 GLY 71.A O no hydrogen 3.561 N/A THR 69.A N GLN 67.A OE1 no hydrogen 2.818 N/A THR 69.A OG1 GLY 24.A O no hydrogen 3.480 N/A THR 69.A OG1 THR 68.A O no hydrogen 2.476 N/A ASP 70.A N GLY 25.A O no hydrogen 3.098 N/A GLY 71.A N GLN 67.A OE1 no hydrogen 2.961 N/A THR 72.A N ASP 465.A O no hydrogen 2.938 N/A THR 72.A OG1 GLY 468.A O no hydrogen 2.848 N/A SER 75.A N ASP 65.A OD1 no hydrogen 2.723 N/A SER 75.A OG GLY 63.A O no hydrogen 3.418 N/A SER 75.A OG TYR 134.A OH no hydrogen 2.823 N/A HIS 76.A NE2 TYR 134.A O no hydrogen 2.944 N/A MET 77.A N SER 75.A OG no hydrogen 3.120 N/A HIS 78.A N ASP 82.A OD2 no hydrogen 2.973 N/A HIS 78.A ND1 ASP 65.A OD2 no hydrogen 2.788 N/A HIS 78.A NE2 GLU 471.A OE2 no hydrogen 2.742 N/A TYR 79.A OH VAL 488.A O no hydrogen 2.521 N/A ASP 82.A N TYR 79.A O no hydrogen 3.177 N/A ASN 84.A N HIS 76.A O no hydrogen 3.021 N/A TYR 85.A OH GLU 83.A OE1 no hydrogen 2.729 N/A TYR 85.A OH ARG 137.A O no hydrogen 3.376 N/A PHE 86.A N ASN 84.A OD1 no hydrogen 2.868 N/A ARG 87.A NH1 SER 75.A O no hydrogen 2.924 N/A ARG 87.A NH1 ASP 82.A OD2 no hydrogen 3.018 N/A ARG 87.A NH2 ASP 82.A OD1 no hydrogen 3.299 N/A ARG 87.A NH2 ASP 82.A OD2 no hydrogen 3.040 N/A GLY 88.A N SER 458.A OG no hydrogen 3.049 N/A LEU 93.A N TYR 89.A O no hydrogen 2.923 N/A MET 94.A N GLU 90.A O no hydrogen 2.951 N/A LYS 95.A N TRP 91.A O no hydrogen 3.118 N/A LYS 95.A NZ HIS 146.A ND1 no hydrogen 3.100 N/A GLU 96.A N TRP 92.A O no hydrogen 2.988 N/A ALA 97.A N LEU 93.A O no hydrogen 3.010 N/A LYS 98.A N MET 94.A O no hydrogen 2.950 N/A LYS 98.A NZ.A PRO 102.A O no hydrogen 2.838 N/A LYS 98.A NZ.A ILE 104.A O no hydrogen 2.980 N/A LYS 98.A NZ.B ASP 147.A O no hydrogen 2.461 N/A LYS 99.A N LYS 95.A O no hydrogen 2.980 N/A LYS 99.A NZ GLU 96.A OE1 no hydrogen 3.252 N/A LYS 99.A NZ GLU 96.A OE2 no hydrogen 3.167 N/A ARG 100.A N GLU 96.A O no hydrogen 3.424 N/A ARG 100.A NE ASP 44.A OD1 no hydrogen 2.598 N/A ARG 100.A NH1 GLU 96.A O no hydrogen 2.869 N/A ARG 100.A NH1 GLU 96.A OE1 no hydrogen 2.913 N/A ARG 100.A NH2 SER 40.A O no hydrogen 3.426 N/A ASN 101.A N ALA 97.A O no hydrogen 2.843 N/A ASN 101.A ND2 LEU 55.A O no hydrogen 3.528 N/A ASP 103.A N ASN 101.A OD1 no hydrogen 3.067 N/A ILE 104.A N ASN 101.A O no hydrogen 3.097 N/A ILE 105.A N HIS 56.A O no hydrogen 2.876 N/A LEU 106.A N ASP 151.A OD2 no hydrogen 2.833 N/A MET 107.A N LEU 58.A O no hydrogen 2.944 N/A GLY 108.A N TYR 152.A O no hydrogen 2.960 N/A LEU 109.A N VAL 60.A O no hydrogen 3.305 N/A PHE 113.A N ILE 494.A O no hydrogen 3.167 N/A TRP 116.A NE1 MET 77.A O no hydrogen 3.109 N/A LEU 117.A N PRO 114.A O no hydrogen 3.247 N/A GLY 118.A N GLY 115.A O no hydrogen 2.882 N/A LYS 119.A N TRP 116.A O no hydrogen 3.305 N/A PHE 121.A N GLY 118.A O no hydrogen 3.177 N/A TYR 125.A OH PRO 160.A O no hydrogen 2.839 N/A LEU 130.A N ASN 127.A OD1 no hydrogen 3.372 N/A THR 131.A N ASN 127.A O no hydrogen 3.191 N/A THR 131.A OG1 PRO 124.A O no hydrogen 2.587 N/A ALA 132.A N LEU 128.A O no hydrogen 3.067 N/A TYR 133.A N GLN 129.A O no hydrogen 2.813 N/A TYR 134.A N LEU 130.A O no hydrogen 2.912 N/A TYR 134.A OH SER 75.A OG no hydrogen 2.823 N/A VAL 135.A N THR 131.A O no hydrogen 3.038 N/A VAL 136.A N ALA 132.A O no hydrogen 2.786 N/A ARG 137.A N TYR 133.A O no hydrogen 2.965 N/A TRP 138.A N VAL 135.A O no hydrogen 3.072 N/A ILE 139.A N VAL 135.A O no hydrogen 3.388 N/A LEU 140.A N VAL 136.A O no hydrogen 2.952 N/A GLY 141.A N ARG 137.A O no hydrogen 2.912 N/A ALA 142.A N TRP 138.A O no hydrogen 3.074 N/A LYS 143.A N ILE 139.A O no hydrogen 3.407 N/A LYS 143.A NZ ASP 149.A OD1 no hydrogen 2.711 N/A HIS 144.A N LEU 140.A O no hydrogen 2.855 N/A TYR 145.A N GLY 141.A O no hydrogen 2.822 N/A HIS 146.A N ALA 142.A O no hydrogen 3.253 N/A HIS 146.A NE2 TYR 85.A O no hydrogen 2.768 N/A ASP 147.A N LYS 143.A O no hydrogen 3.046 N/A LEU 148.A N ALA 142.A O no hydrogen 2.853 N/A ASP 151.A N LEU 106.A O no hydrogen 2.783 N/A TYR 152.A N LEU 106.A O no hydrogen 3.124 N/A ILE 153.A N ARG 182.A O no hydrogen 2.876 N/A GLY 154.A N GLY 108.A O no hydrogen 3.059 N/A TRP 156.A NE1 TRP 111.A O no hydrogen 2.811 N/A ASN 157.A N PRO 110.A O no hydrogen 3.029 N/A GLU 158.A N ASP 187.A O no hydrogen 2.842 N/A ARG 159.A N TRP 156.A O no hydrogen 3.025 N/A ARG 159.A NH1 GLU 158.A O no hydrogen 2.695 N/A ARG 159.A NH2 TRP 496.A O no hydrogen 2.728 N/A TYR 165.A N ASP 162.A OD1 no hydrogen 3.044 N/A ILE 166.A N ASP 162.A O no hydrogen 3.060 N/A LYS 167.A N ALA 163.A O no hydrogen 3.079 N/A LYS 167.A NZ ASP 200.A OD2 no hydrogen 2.899 N/A GLU 168.A N ASN 164.A O no hydrogen 2.935 N/A LEU 169.A N TYR 165.A O no hydrogen 2.807 N/A ARG 170.A N ILE 166.A O no hydrogen 3.109 N/A ARG 170.A NE ARG 170.A O no hydrogen 3.317 N/A ARG 170.A NE ASP 174.A OD1 no hydrogen 3.045 N/A ARG 170.A NH1 VAL 181.A O no hydrogen 2.845 N/A ARG 170.A NH2 ASP 174.A OD1 no hydrogen 3.028 N/A ARG 170.A NH2 VAL 181.A O no hydrogen 3.171 N/A LYS 171.A N LYS 167.A O no hydrogen 3.058 N/A MET 172.A N GLU 168.A O no hydrogen 2.781 N/A LEU 173.A N LEU 169.A O no hydrogen 2.885 N/A ASP 174.A N ARG 170.A O no hydrogen 3.076 N/A TYR 175.A N LYS 171.A O no hydrogen 3.102 N/A GLN 176.A N MET 172.A O no hydrogen 3.100 N/A GLN 176.A N LEU 173.A O no hydrogen 3.107 N/A GLY 177.A N ASP 174.A O no hydrogen 2.989 N/A LEU 178.A N LEU 173.A O no hydrogen 2.769 N/A GLN 179.A N GLN 179.A OE1 no hydrogen 2.567 N/A ARG 180.A NH1 ILE 150.A O no hydrogen 2.894 N/A VAL 181.A N LEU 178.A O no hydrogen 3.000 N/A ARG 182.A N ASP 151.A O no hydrogen 3.055 N/A ILE 183.A N ASP 208.A OD2 no hydrogen 2.885 N/A ILE 184.A N ILE 153.A O no hydrogen 2.972 N/A ALA 185.A N VAL 209.A O no hydrogen 2.988 N/A ASP 187.A N GLY 211.A O no hydrogen 3.200 N/A SER 194.A N TRP 190.A O no hydrogen 2.966 N/A SER 194.A OG TRP 190.A O no hydrogen 2.803 N/A SER 195.A N GLU 191.A OE1 no hydrogen 2.940 N/A SER 195.A OG GLU 191.A OE1 no hydrogen 2.835 N/A SER 195.A OG PRO 192.A O no hydrogen 3.322 N/A SER 196.A N PRO 192.A O no hydrogen 3.174 N/A SER 196.A OG PRO 192.A O no hydrogen 2.587 N/A LEU 197.A N ILE 193.A O no hydrogen 3.145 N/A LEU 198.A N SER 195.A O no hydrogen 2.984 N/A LEU 199.A N SER 195.A O no hydrogen 3.192 N/A GLU 202.A N ASP 200.A OD1 no hydrogen 3.061 N/A LEU 203.A N ASP 200.A OD1 no hydrogen 3.306 N/A TRP 204.A N ASP 200.A O no hydrogen 2.993 N/A TRP 204.A NE1 SER 226.A O no hydrogen 3.001 N/A LYS 205.A N GLN 201.A O no hydrogen 3.026 N/A VAL 206.A N LEU 203.A O no hydrogen 3.014 N/A VAL 207.A N LEU 203.A O no hydrogen 3.127 N/A ASP 208.A N ILE 183.A O no hydrogen 2.902 N/A VAL 209.A N ILE 183.A O no hydrogen 3.230 N/A ILE 210.A N LYS 229.A O no hydrogen 2.934 N/A GLY 211.A N ALA 185.A O no hydrogen 2.953 N/A ALA 212.A N TRP 231.A O no hydrogen 3.017 N/A HIS 213.A N ASN 188.A O no hydrogen 2.835 N/A HIS 213.A ND1 GLU 158.A OE2 no hydrogen 2.894 N/A HIS 213.A NE2 ASP 187.A OD1 no hydrogen 2.885 N/A TYR 214.A N GLU 234.A O no hydrogen 2.885 N/A TYR 214.A OH GLU 234.A OE2 no hydrogen 2.701 N/A THR 217.A OG1 GLY 216.A O no hydrogen 2.491 N/A TYR 218.A N PRO 215.A O no hydrogen 3.274 N/A VAL 220.A N THR 219.A OG1 no hydrogen 2.644 N/A ASN 222.A ND2 GLU 191.A OE2 no hydrogen 2.797 N/A LYS 224.A N VAL 220.A O no hydrogen 3.232 N/A LYS 224.A NZ ASN 260.A OD1 no hydrogen 2.423 N/A MET 225.A N TRP 221.A O no hydrogen 2.912 N/A SER 226.A N ASN 222.A O no hydrogen 3.116 N/A SER 226.A OG ALA 223.A O no hydrogen 2.721 N/A GLY 227.A N LYS 224.A O no hydrogen 3.311 N/A LYS 228.A N SER 226.A OG no hydrogen 3.114 N/A LYS 228.A NZ TRP 204.A O no hydrogen 2.712 N/A LYS 228.A NZ VAL 207.A O no hydrogen 2.771 N/A LYS 229.A NZ GLU 14.A OE1 no hydrogen 3.099 N/A LYS 229.A NZ ASP 16.A OD1 no hydrogen 2.936 N/A TRP 231.A N ILE 210.A O no hydrogen 2.951 N/A TRP 231.A NE1 ASP 16.A OD2 no hydrogen 2.845 N/A SER 232.A N SER 263.A O no hydrogen 2.858 N/A SER 232.A OG ASP 235.A OD2 no hydrogen 2.744 N/A SER 233.A N ALA 212.A O no hydrogen 2.993 N/A SER 233.A OG ASP 187.A OD1 no hydrogen 2.807 N/A ASP 235.A N ILE 265.A O no hydrogen 2.947 N/A SER 237.A N TRP 267.A O no hydrogen 2.823 N/A SER 237.A OG SER 237.A O no hydrogen 2.607 N/A THR 238.A OG1 PHE 236.A O no hydrogen 2.942 N/A ASN 240.A N ARG 281.A O no hydrogen 2.980 N/A ASN 240.A ND2 GLY 283.A O no hydrogen 2.986 N/A ASN 240.A ND2 THR 286.A OG1 no hydrogen 2.973 N/A GLY 244.A N SER 241.A O no hydrogen 3.121 N/A ALA 245.A N SER 241.A O no hydrogen 3.097 N/A GLY 246.A N ASN 242.A O no hydrogen 2.962 N/A CYS 247.A N VAL 243.A O no hydrogen 3.073 N/A TRP 248.A N GLY 244.A O no hydrogen 2.986 N/A TRP 248.A NE1 SER 304.A OG no hydrogen 3.032 N/A SER 249.A N ALA 245.A O no hydrogen 2.865 N/A ARG 250.A N GLY 246.A O no hydrogen 2.971 N/A ARG 250.A NE SER 352.A OG no hydrogen 3.225 N/A ARG 250.A NH2 SER 352.A O no hydrogen 2.751 N/A ILE 251.A N CYS 247.A O no hydrogen 3.148 N/A LEU 252.A N TRP 248.A O no hydrogen 3.113 N/A ASN 253.A ND2 SER 329.A O no hydrogen 3.690 N/A ASN 253.A ND2 SER 329.A OG no hydrogen 3.347 N/A ASN 253.A ND2 ILE 343.A O no hydrogen 3.049 N/A GLN 254.A N ARG 250.A O no hydrogen 2.940 N/A GLN 254.A NE2 GLU 345.A OE1 no hydrogen 3.502 N/A ASN 255.A N ILE 251.A O no hydrogen 2.918 N/A ASN 255.A ND2 ASP 235.A OD2 no hydrogen 3.409 N/A ASN 255.A ND2 THR 264.A OG1 no hydrogen 2.822 N/A TYR 256.A N ASN 253.A O no hydrogen 3.367 N/A ILE 257.A N ASN 253.A O no hydrogen 3.409 N/A ASN 258.A N GLN 254.A O no hydrogen 2.882 N/A ASN 258.A ND2 THR 217.A OG1 no hydrogen 3.220 N/A ASN 258.A ND2 GLN 254.A OE1 no hydrogen 3.471 N/A GLY 259.A N ASN 255.A O no hydrogen 3.193 N/A ASN 260.A N TYR 256.A O no hydrogen 2.985 N/A MET 261.A N ASN 255.A O no hydrogen 3.013 N/A THR 262.A N LEU 230.A O no hydrogen 2.919 N/A THR 262.A OG1 ASP 16.A OD2 no hydrogen 2.662 N/A SER 263.A OG GLY 17.A O no hydrogen 2.835 N/A ILE 265.A N SER 232.A O no hydrogen 2.920 N/A ALA 266.A N GLY 19.A O no hydrogen 2.990 N/A TRP 267.A N ASP 235.A O no hydrogen 2.982 N/A TRP 267.A NE1 GLY 23.A O no hydrogen 2.892 N/A ASN 268.A N SER 282.A O no hydrogen 2.990 N/A ASN 268.A ND2 TYR 273.A OH no hydrogen 3.238 N/A LEU 269.A N VAL 21.A O no hydrogen 2.699 N/A ALA 271.A N MET 285.A O no hydrogen 2.825 N/A SER 272.A N THR 27.A O no hydrogen 2.970 N/A SER 272.A N VAL 270.A O no hydrogen 2.911 N/A SER 272.A OG ALA 287.A O no hydrogen 2.904 N/A TYR 273.A OH TYR 279.A O no hydrogen 2.543 N/A TYR 274.A OH ASN 462.A O no hydrogen 2.867 N/A GLU 276.A N GLU 276.A OE1 no hydrogen 2.760 N/A LEU 277.A N TYR 274.A O no hydrogen 3.010 N/A SER 282.A N TYR 273.A OH no hydrogen 3.434 N/A SER 282.A OG TYR 279.A O no hydrogen 3.037 N/A LEU 284.A N ASN 268.A O no hydrogen 3.222 N/A LEU 284.A N LEU 269.A O no hydrogen 3.333 N/A THR 286.A N VAL 296.A O no hydrogen 3.037 N/A ALA 287.A N ALA 271.A O no hydrogen 3.036 N/A GLN 288.A NE2 GLU 275.A OE1 no hydrogen 3.131 N/A GLU 289.A N TYR 34.A OH no hydrogen 2.883 N/A TRP 291.A NE1 LYS 440.A O no hydrogen 3.007 N/A SER 292.A N GLU 289.A O no hydrogen 3.145 N/A SER 292.A OG GLU 289.A O no hydrogen 3.396 N/A SER 292.A OG GLU 289.A OE1 no hydrogen 2.743 N/A GLY 293.A N GLU 289.A O no hydrogen 2.896 N/A HIS 294.A N SER 292.A OG no hydrogen 3.154 N/A TYR 295.A OH GLU 41.A OE1 no hydrogen 2.680 N/A VAL 296.A N THR 286.A O no hydrogen 2.788 N/A ILE 301.A N ALA 298.A O no hydrogen 3.012 N/A TRP 302.A N SER 299.A O no hydrogen 3.027 N/A VAL 303.A N SER 299.A O no hydrogen 3.142 N/A SER 304.A N PRO 300.A O no hydrogen 3.012 N/A SER 304.A OG PRO 300.A O no hydrogen 2.739 N/A ALA 305.A N ILE 301.A O no hydrogen 3.324 N/A HIS 306.A N TRP 302.A O no hydrogen 3.295 N/A HIS 306.A N VAL 303.A O no hydrogen 3.294 N/A HIS 306.A ND1 THR 421.A OG1 no hydrogen 2.933 N/A HIS 306.A NE2 THR 388.A OG1 no hydrogen 2.397 N/A THR 307.A N SER 304.A O no hydrogen 2.825 N/A THR 308.A N SER 304.A O no hydrogen 2.769 N/A THR 308.A OG1 ALA 53.A O no hydrogen 2.539 N/A THR 308.A OG1 SER 304.A O no hydrogen 3.054 N/A GLN 309.A N ALA 305.A O no hydrogen 3.091 N/A GLN 309.A NE2 GLY 52.A O no hydrogen 3.366 N/A GLN 309.A NE2 ARG 429.A O no hydrogen 2.912 N/A PHE 310.A N THR 307.A O no hydrogen 3.177 N/A THR 311.A OG1 THR 307.A O no hydrogen 2.380 N/A GLY 314.A N PHE 15.A O no hydrogen 3.003 N/A TRP 315.A N GLN 312.A O no hydrogen 3.034 N/A TYR 316.A N THR 334.A O no hydrogen 3.006 N/A TYR 317.A N ARG 13.A O no hydrogen 2.996 N/A LEU 318.A N ALA 332.A O no hydrogen 2.829 N/A LYS 319.A NZ ASP 9.A O no hydrogen 3.147 N/A THR 320.A OG1 ASP 6.A O no hydrogen 3.555 N/A VAL 321.A N LYS 319.A O no hydrogen 3.142 N/A GLY 322.A N TYR 330.A O no hydrogen 3.172 N/A HIS 323.A NE2 ASN 258.A OD1 no hydrogen 2.857 N/A LEU 324.A N GLY 328.A O no hydrogen 2.819 N/A GLU 325.A N TYR 3.A OH no hydrogen 3.028 N/A LYS 326.A N GLN 367.A OE1 no hydrogen 3.110 N/A GLY 327.A N LEU 324.A O no hydrogen 3.322 N/A SER 329.A N GLU 345.A O no hydrogen 2.899 N/A SER 329.A OG GLU 345.A OE1 no hydrogen 2.637 N/A TYR 330.A N GLY 322.A O no hydrogen 2.936 N/A VAL 331.A N ILE 343.A O no hydrogen 3.058 N/A LEU 333.A N THR 341.A O no hydrogen 2.903 N/A THR 334.A N TYR 316.A O no hydrogen 3.061 N/A LEU 337.A N ASP 335.A OD1 no hydrogen 2.814 N/A ASN 339.A N ASP 335.A OD1 no hydrogen 3.060 N/A ASN 339.A ND2 ASP 335.A OD2 no hydrogen 2.838 N/A LEU 340.A N THR 424.A OG1 no hydrogen 3.285 N/A THR 341.A N LEU 333.A O no hydrogen 2.898 N/A THR 341.A OG1 PHE 310.A O no hydrogen 2.747 N/A THR 341.A OG1 THR 423.A OG1 no hydrogen 3.115 N/A ILE 342.A N LEU 422.A O no hydrogen 2.681 N/A ILE 343.A N VAL 331.A O no hydrogen 2.953 N/A ILE 344.A N PHE 420.A O no hydrogen 2.846 N/A GLU 345.A N SER 329.A O no hydrogen 3.096 N/A THR 346.A N GLU 418.A O no hydrogen 3.054 N/A THR 346.A OG1 GLU 415.A O no hydrogen 2.489 N/A MET 347.A N GLU 345.A OE2 no hydrogen 3.001 N/A SER 348.A N ASP 417.A OD1 no hydrogen 2.803 N/A SER 348.A OG ASP 417.A OD1 no hydrogen 2.919 N/A HIS 349.A NE2 LEU 359.A O no hydrogen 2.693 N/A HIS 351.A N SER 348.A O no hydrogen 3.404 N/A HIS 351.A ND1 ASP 417.A OD2 no hydrogen 2.710 N/A SER 352.A N HIS 349.A O no hydrogen 3.371 N/A SER 352.A OG SER 348.A O no hydrogen 2.594 N/A SER 352.A OG TYR 362.A OH no hydrogen 3.038 N/A CYS 354.A SG SER 352.A O no hydrogen 3.942 N/A TYR 362.A OH MET 347.A O no hydrogen 2.856 N/A TYR 362.A OH SER 352.A OG no hydrogen 3.038 N/A SER 365.A N LYS 326.A O no hydrogen 3.199 N/A GLN 367.A N LEU 414.A O no hydrogen 3.137 N/A GLN 367.A NE2 GLY 327.A O no hydrogen 2.771 N/A ALA 369.A N LEU 412.A O no hydrogen 2.913 N/A THR 370.A N GLY 1.A O no hydrogen 3.119 N/A THR 370.A OG1 THR 411.A OG1 no hydrogen 3.240 N/A PHE 371.A N PHE 410.A O no hydrogen 2.836 N/A THR 372.A N TYR 3.A O no hydrogen 3.161 N/A LEU 373.A N GLY 408.A O no hydrogen 2.747 N/A LYS 374.A N LEU 5.A O no hydrogen 2.929 N/A SER 376.A N ASP 7.A OD1 no hydrogen 3.071 N/A SER 376.A OG ASP 7.A OD1 no hydrogen 3.223 N/A SER 376.A OG ASP 7.A OD2 no hydrogen 2.501 N/A LEU 377.A N LYS 374.A O no hydrogen 3.048 N/A ARG 378.A N GLY 375.A O no hydrogen 3.277 N/A ARG 378.A NE LEU 373.A O no hydrogen 3.218 N/A ARG 378.A NH1 GLY 406.A O no hydrogen 2.227 N/A ILE 380.A N LEU 377.A O no hydrogen 3.171 N/A LEU 383.A N LEU 401.A O no hydrogen 3.113 N/A GLN 384.A N THR 423.A O no hydrogen 2.696 N/A GLN 384.A NE2 GLU 382.A OE2 no hydrogen 3.385 N/A TRP 386.A N THR 421.A O no hydrogen 2.991 N/A TYR 387.A N LYS 396.A O no hydrogen 2.781 N/A TYR 387.A OH GLU 418.A OE2 no hydrogen 2.856 N/A THR 388.A N ILE 419.A O no hydrogen 3.034 N/A THR 388.A OG1 HIS 306.A NE2 no hydrogen 2.397 N/A LYS 389.A N LEU 393.A O no hydrogen 2.750 N/A LYS 389.A NZ GLU 416.A O no hydrogen 2.708 N/A LEU 390.A N ASP 417.A O no hydrogen 3.200 N/A LEU 393.A N LYS 389.A O no hydrogen 3.016 N/A PHE 395.A N THR 388.A OG1 no hydrogen 2.887 N/A LYS 396.A N TYR 387.A O no hydrogen 2.984 N/A GLN 397.A NE2 GLN 384.A OE1 no hydrogen 3.686 N/A LEU 398.A N VAL 385.A O no hydrogen 2.801 N/A THR 400.A OG1 GLN 384.A OE1 no hydrogen 3.264 N/A LEU 401.A N LEU 383.A O no hydrogen 3.143 N/A LEU 403.A N GLN 381.A O no hydrogen 2.840 N/A SER 409.A OG PHE 371.A O no hydrogen 3.137 N/A PHE 410.A N PHE 371.A O no hydrogen 3.071 N/A THR 411.A OG1 THR 370.A OG1 no hydrogen 3.240 N/A LEU 412.A N ALA 369.A O no hydrogen 2.915 N/A LEU 414.A N GLN 367.A O no hydrogen 2.822 N/A GLU 415.A N GLU 418.A OE1 no hydrogen 2.881 N/A ASP 417.A N THR 346.A O no hydrogen 2.873 N/A GLU 418.A N THR 346.A OG1 no hydrogen 3.156 N/A ILE 419.A N THR 388.A O no hydrogen 2.992 N/A PHE 420.A N ILE 344.A O no hydrogen 2.857 N/A THR 421.A N TRP 386.A O no hydrogen 2.971 N/A THR 421.A OG1 HIS 306.A ND1 no hydrogen 2.933 N/A THR 421.A OG1 HIS 306.A O no hydrogen 2.918 N/A LEU 422.A N ILE 342.A O no hydrogen 2.785 N/A THR 423.A N GLN 384.A O no hydrogen 3.075 N/A THR 423.A OG1 LEU 340.A O no hydrogen 3.509 N/A THR 423.A OG1 THR 341.A OG1 no hydrogen 3.115 N/A THR 424.A N LEU 340.A O no hydrogen 3.170 N/A THR 424.A OG1 ASN 339.A OD1 no hydrogen 2.574 N/A LEU 425.A N THR 423.A OG1 no hydrogen 2.998 N/A THR 427.A OG1 ASN 50.A OD1 no hydrogen 3.563 N/A ARG 429.A N GLN 309.A OE1 no hydrogen 2.965 N/A LYS 430.A NZ HIS 394.A O no hydrogen 2.986 N/A GLY 431.A N PHE 51.A O no hydrogen 2.827 N/A TYR 433.A N TYR 45.A OH no hydrogen 2.926 N/A TYR 433.A OH ASP 44.A OD2 no hydrogen 2.483 N/A SER 439.A OG GLU 289.A OE2 no hydrogen 2.762 N/A LYS 440.A N GLU 289.A OE1 no hydrogen 2.938 N/A LYS 440.A NZ SER 438.A O no hydrogen 2.824 N/A LYS 440.A NZ SER 438.A OG no hydrogen 2.806 N/A TYR 446.A N VAL 636.A O no hydrogen 3.064 N/A ASP 448.A N PHE 634.A O no hydrogen 2.821 N/A PHE 450.A N ASP 448.A OD1 no hydrogen 2.829 N/A ASN 451.A N ASP 449.A OD1 no hydrogen 3.282 N/A VAL 452.A N PHE 450.A O no hydrogen 3.010 N/A ASN 462.A ND2 TYR 446.A OH no hydrogen 3.041 N/A ALA 464.A N VAL 506.A O no hydrogen 2.919 N/A GLN 466.A N ILE 504.A O no hydrogen 2.795 N/A GLN 466.A NE2 ASP 70.A O no hydrogen 3.044 N/A GLN 466.A NE2 ALA 464.A O no hydrogen 3.350 N/A THR 467.A N ILE 504.A O no hydrogen 3.202 N/A THR 467.A OG1 GLN 466.A O no hydrogen 2.631 N/A VAL 469.A N GLN 487.A OE1 no hydrogen 3.033 N/A PHE 470.A N ASP 465.A OD2 no hydrogen 2.807 N/A GLU 471.A N ARG 486.A O no hydrogen 2.824 N/A TYR 472.A N SER 458.A O no hydrogen 2.894 N/A TYR 473.A N THR 484.A O no hydrogen 2.900 N/A ASN 475.A N ARG 482.A O no hydrogen 2.652 N/A GLU 477.A N ASN 475.A OD1 no hydrogen 2.964 N/A ASP 478.A N ASN 475.A O no hydrogen 3.358 N/A HIS 481.A N ASP 478.A OD1 no hydrogen 2.741 N/A HIS 481.A ND1 ASP 632.A OD2 no hydrogen 2.835 N/A ARG 482.A NE ASN 476.A OD1 no hydrogen 3.358 N/A THR 484.A N TYR 473.A O no hydrogen 2.908 N/A THR 484.A OG1 GLN 630.A OE1 no hydrogen 2.944 N/A LEU 485.A N PHE 631.A O no hydrogen 2.810 N/A ARG 486.A N GLU 471.A O no hydrogen 2.873 N/A ARG 486.A NE GLU 524.A OE2 no hydrogen 2.879 N/A ARG 486.A NH2 GLU 524.A OE1 no hydrogen 2.928 N/A ARG 486.A NH2 GLU 524.A OE2 no hydrogen 3.275 N/A GLN 487.A N ALA 629.A O no hydrogen 2.990 N/A GLN 487.A NE2 LEU 489.A O no hydrogen 2.926 N/A GLN 487.A NE2 GLU 627.A O no hydrogen 2.930 N/A VAL 488.A N VAL 469.A O no hydrogen 2.949 N/A LEU 489.A N GLN 487.A OE1 no hydrogen 2.885 N/A ARG 492.A NH1 ASP 499.A O no hydrogen 3.513 N/A ARG 492.A NH1 ALA 500.A O no hydrogen 2.927 N/A ARG 492.A NH2 ASP 499.A O no hydrogen 2.751 N/A ILE 494.A N PHE 113.A O no hydrogen 2.812 N/A TRP 496.A NE1 ASN 157.A O no hydrogen 2.767 N/A ALA 500.A N THR 467.A OG1 no hydrogen 3.136 N/A SER 502.A OG HIS 624.A O no hydrogen 2.674 N/A THR 503.A N THR 623.A O no hydrogen 3.135 N/A THR 503.A OG1 THR 623.A OG1 no hydrogen 2.638 N/A ILE 504.A N THR 467.A O no hydrogen 2.877 N/A SER 505.A N ILE 621.A O no hydrogen 3.031 N/A SER 505.A OG ASP 465.A OD1 no hydrogen 2.631 N/A VAL 506.A N ALA 464.A O no hydrogen 3.037 N/A ILE 507.A N ALA 619.A O no hydrogen 2.953 N/A GLY 508.A N TYR 274.A OH no hydrogen 3.282 N/A HIS 510.A NE2 ASN 538.A O no hydrogen 2.853 N/A HIS 511.A N ASP 509.A OD1 no hydrogen 2.900 N/A HIS 511.A ND1 ASP 509.A OD1 no hydrogen 2.789 N/A TRP 512.A N ASP 509.A O no hydrogen 3.042 N/A THR 513.A N ALA 639.A O no hydrogen 3.220 N/A THR 513.A OG1 HIS 511.A O no hydrogen 3.414 N/A MET 515.A N ILE 591.A O no hydrogen 3.039 N/A THR 516.A N GLU 637.A O no hydrogen 2.746 N/A VAL 517.A N LEU 589.A O no hydrogen 2.815 N/A GLN 518.A N ARG 635.A O no hydrogen 2.904 N/A CYS 519.A N LEU 587.A O no hydrogen 2.992 N/A CYS 519.A SG ASP 520.A O no hydrogen 3.592 N/A CYS 519.A SG ASP 632.A O no hydrogen 3.661 N/A ASP 520.A N ASP 632.A O no hydrogen 2.801 N/A VAL 521.A N TYR 585.A O no hydrogen 2.836 N/A TYR 522.A N GLN 630.A O no hydrogen 2.922 N/A SER 528.A N PRO 526.A O no hydrogen 2.660 N/A SER 528.A OG PRO 526.A O no hydrogen 3.561 N/A GLY 529.A N THR 525.A O no hydrogen 3.206 N/A GLY 530.A N GLU 627.A OE1 no hydrogen 3.022 N/A VAL 531.A N ILE 554.A O no hydrogen 3.037 N/A PHE 532.A N GLY 622.A O no hydrogen 2.967 N/A ILE 533.A N PHE 552.A O no hydrogen 3.173 N/A ALA 534.A N ALA 620.A O no hydrogen 2.915 N/A GLY 535.A N VAL 550.A O no hydrogen 3.114 N/A ARG 536.A NE THR 513.A O no hydrogen 2.699 N/A ARG 536.A NH1 GLY 593.A O no hydrogen 3.075 N/A ARG 536.A NH2 THR 513.A O no hydrogen 2.985 N/A ARG 536.A NH2 GLY 593.A O no hydrogen 3.095 N/A VAL 537.A N TRP 618.A O no hydrogen 3.091 N/A ASN 538.A N THR 548.A O no hydrogen 3.252 N/A GLY 541.A N GLN 466.A OE1 no hydrogen 2.760 N/A ILE 542.A N THR 69.A O no hydrogen 3.043 N/A LEU 543.A N GLY 540.A O no hydrogen 3.163 N/A ILE 544.A N GLY 541.A O no hydrogen 3.037 N/A ARG 545.A NE ASP 499.A O no hydrogen 3.072 N/A ARG 545.A NH2 ASP 499.A O no hydrogen 3.517 N/A ARG 545.A NH2 SER 501.A OG no hydrogen 2.909 N/A SER 546.A N LEU 543.A O no hydrogen 2.698 N/A SER 546.A OG LEU 543.A O no hydrogen 2.882 N/A ALA 547.A N ILE 544.A O no hydrogen 3.282 N/A THR 548.A N ASN 538.A OD1 no hydrogen 2.933 N/A GLY 549.A N ALA 564.A O no hydrogen 2.817 N/A VAL 550.A N GLY 535.A O no hydrogen 2.822 N/A PHE 551.A N THR 563.A O no hydrogen 2.861 N/A PHE 552.A N ILE 533.A O no hydrogen 2.881 N/A TRP 553.A N ARG 561.A O no hydrogen 2.879 N/A TRP 553.A NE1 THR 563.A OG1 no hydrogen 2.997 N/A ILE 554.A N VAL 531.A O no hydrogen 2.973 N/A PHE 555.A N SER 559.A O no hydrogen 2.917 N/A ALA 556.A N GLY 529.A O no hydrogen 2.847 N/A GLY 558.A N PHE 555.A O no hydrogen 3.139 N/A SER 559.A OG ASN 557.A OD1 no hydrogen 2.744 N/A TYR 560.A N GLY 575.A O no hydrogen 2.925 N/A ARG 561.A N TRP 553.A O no hydrogen 3.144 N/A VAL 562.A N ALA 573.A O no hydrogen 2.601 N/A THR 563.A N PHE 551.A O no hydrogen 2.961 N/A THR 563.A OG1 ASP 565.A O no hydrogen 2.866 N/A ALA 564.A N ILE 570.A O no hydrogen 2.952 N/A LEU 566.A N ALA 547.A O no hydrogen 3.079 N/A GLY 568.A N ASP 565.A O no hydrogen 2.973 N/A TRP 569.A N ASP 565.A OD2 no hydrogen 2.688 N/A ILE 570.A N ASP 565.A OD1 no hydrogen 2.828 N/A TYR 572.A N VAL 562.A O no hydrogen 2.592 N/A ALA 573.A N VAL 562.A O no hydrogen 3.226 N/A GLY 575.A N TYR 560.A O no hydrogen 3.058 N/A ALA 577.A N GLY 558.A O no hydrogen 3.278 N/A THR 580.A N TYR 585.A OH no hydrogen 2.717 N/A LYS 582.A N ILE 523.A O no hydrogen 2.770 N/A TYR 585.A N VAL 521.A O no hydrogen 3.107 N/A THR 586.A N ASN 601.A OD1 no hydrogen 2.950 N/A THR 586.A OG1 ASP 520.A OD1 no hydrogen 2.624 N/A LEU 587.A N CYS 519.A O no hydrogen 2.888 N/A THR 588.A N MET 599.A O no hydrogen 3.062 N/A THR 588.A OG1 GLN 518.A OE1 no hydrogen 3.527 N/A LEU 589.A N VAL 517.A O no hydrogen 2.788 N/A GLY 590.A N PHE 597.A O no hydrogen 2.999 N/A ILE 591.A N MET 515.A O no hydrogen 2.892 N/A LYS 592.A N PHE 595.A O no hydrogen 2.964 N/A GLY 593.A N ASN 514.A OD1 no hydrogen 3.322 N/A PHE 595.A N LYS 592.A O no hydrogen 3.019 N/A ALA 596.A N VAL 609.A O no hydrogen 2.918 N/A PHE 597.A N GLY 590.A O no hydrogen 2.870 N/A GLY 598.A N TRP 606.A O no hydrogen 2.876 N/A MET 599.A N THR 588.A O no hydrogen 2.802 N/A LEU 600.A N THR 603.A O no hydrogen 2.875 N/A ASN 601.A N THR 586.A O no hydrogen 2.847 N/A THR 603.A N LEU 600.A O no hydrogen 3.100 N/A LEU 605.A N GLY 598.A O no hydrogen 2.862 N/A TRP 606.A N GLY 598.A O no hydrogen 3.361 N/A VAL 609.A N ALA 596.A O no hydrogen 3.077 N/A VAL 611.A N TYR 594.A O no hydrogen 2.768 N/A LYS 612.A N TYR 572.A OH no hydrogen 3.071 N/A GLY 617.A N TRP 512.A O no hydrogen 3.091 N/A TRP 618.A N VAL 537.A O no hydrogen 2.965 N/A ALA 619.A N ILE 507.A O no hydrogen 3.028 N/A ALA 620.A N ALA 534.A O no hydrogen 3.015 N/A ILE 621.A N SER 505.A O no hydrogen 3.199 N/A GLY 622.A N PHE 532.A O no hydrogen 3.133 N/A THR 623.A N THR 503.A O no hydrogen 3.313 N/A THR 623.A N THR 503.A OG1 no hydrogen 3.162 N/A THR 623.A OG1 THR 503.A OG1 no hydrogen 2.638 N/A THR 623.A OG1 THR 625.A O no hydrogen 2.546 N/A HIS 624.A N GLY 530.A O no hydrogen 2.891 N/A THR 625.A N GLU 627.A OE2 no hydrogen 2.963 N/A PHE 626.A N THR 625.A OG1 no hydrogen 2.520 N/A GLN 630.A N TYR 522.A O no hydrogen 2.972 N/A GLN 630.A NE2 GLU 524.A OE2 no hydrogen 2.958 N/A PHE 631.A N LEU 485.A O no hydrogen 2.685 N/A ASP 632.A N ASP 520.A O no hydrogen 2.874 N/A ASN 633.A N ASP 632.A OD1 no hydrogen 2.774 N/A ASN 633.A ND2 ASP 520.A OD2 no hydrogen 2.495 N/A PHE 634.A N ASP 448.A O no hydrogen 2.839 N/A ARG 635.A N GLN 518.A O no hydrogen 2.868 N/A VAL 636.A N TYR 446.A O no hydrogen 2.928 N/A GLU 637.A N THR 516.A O no hydrogen 2.918 N/A ALA 638.A N THR 444.A O no hydrogen 2.879 N/A ALA 639.A N ASN 514.A O no hydrogen 2.817 N/A ARG 640.A NH1 ASP 509.A OD2 no hydrogen 2.773 N/A