Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 7lu4_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): PHE 4.A N ARG 179.A O no hydrogen 2.862 N/A GLN 5.A N TRP 180.A O no hydrogen 3.385 N/A ILE 7.A N ASP 3.A O no hydrogen 2.832 N/A ILE 8.A N PHE 4.A O no hydrogen 3.199 N/A MET 9.A N GLN 5.A O no hydrogen 2.966 N/A LYS 10.A N SER 6.A O no hydrogen 2.827 N/A LYS 10.A NZ GLN 13.A OE1 no hydrogen 3.338 N/A LEU 11.A N ILE 7.A O no hydrogen 2.986 N/A GLN 12.A N ILE 8.A O no hydrogen 2.952 N/A GLN 13.A N MET 9.A O no hydrogen 2.883 N/A PHE 14.A N LYS 10.A O no hydrogen 2.805 N/A TRP 15.A N LEU 11.A O no hydrogen 2.947 N/A TRP 15.A NE1 TYR 160.A OH no hydrogen 2.985 N/A ALA 16.A N GLN 12.A O no hydrogen 2.947 N/A GLU 17.A N GLN 13.A O no hydrogen 2.976 N/A GLN 18.A N PHE 14.A O no hydrogen 3.208 N/A GLY 19.A N ALA 16.A O no hydrogen 3.071 N/A SER 20.A N TRP 15.A O no hydrogen 3.112 N/A LEU 21.A N ASN 50.A O no hydrogen 2.725 N/A TRP 23.A N ALA 52.A O no hydrogen 2.861 N/A TYR 26.A N GLU 55.A OE2 no hydrogen 3.172 N/A TYR 26.A OH ASP 235.A OD1 no hydrogen 2.208 N/A TYR 27.A OH ASP 235.A OD2 no hydrogen 2.728 N/A GLY 33.A N GLN 77.A OE1 no hydrogen 2.979 N/A THR 34.A OG1 GLU 157.A OE2 no hydrogen 2.342 N/A MET 35.A N ALA 32.A O no hydrogen 3.120 N/A ASN 36.A N GLY 33.A O no hydrogen 3.013 N/A ASN 36.A ND2 GLN 24.A O no hydrogen 3.496 N/A ASN 36.A ND2 GLU 55.A OE1 no hydrogen 2.535 N/A ALA 38.A N ASN 36.A OD1 no hydrogen 3.015 N/A THR 39.A N ASN 36.A O no hydrogen 2.814 N/A THR 39.A OG1 TYR 53.A OH no hydrogen 2.689 N/A PHE 40.A N ASN 36.A O no hydrogen 2.925 N/A LEU 41.A N PRO 37.A O no hydrogen 3.162 N/A ARG 42.A N PRO 37.A O no hydrogen 3.408 N/A ARG 42.A NH1 TYR 276.A OH no hydrogen 2.706 N/A VAL 43.A N THR 39.A O no hydrogen 3.088 N/A LEU 44.A N LEU 41.A O no hydrogen 3.167 N/A TRP 49.A N LYS 83.A O no hydrogen 2.811 N/A TRP 49.A NE1 ALA 38.A O no hydrogen 2.669 N/A VAL 51.A N ILE 81.A O no hydrogen 3.106 N/A ALA 52.A N LEU 21.A O no hydrogen 2.858 N/A TYR 53.A N GLN 79.A O no hydrogen 2.946 N/A TYR 53.A OH GLY 33.A O no hydrogen 2.650 N/A TYR 53.A OH THR 39.A OG1 no hydrogen 2.689 N/A GLU 55.A N GLN 77.A O no hydrogen 2.880 N/A SER 57.A N HIS 75.A O no hydrogen 2.859 N/A SER 57.A OG GLU 55.A O no hydrogen 3.543 N/A ILE 58.A N VAL 30.A O no hydrogen 2.730 N/A ARG 59.A N GLN 73.A O no hydrogen 2.747 N/A ARG 59.A NE GLY 31.A O no hydrogen 3.030 N/A ARG 59.A NH2 GLY 31.A O no hydrogen 3.469 N/A ASP 62.A N ARG 59.A O no hydrogen 2.984 N/A GLY 63.A N PRO 60.A O no hydrogen 3.319 N/A ARG 64.A NH1 ASP 61.A O no hydrogen 2.945 N/A ARG 64.A NH1 GLY 63.A O no hydrogen 2.687 N/A TYR 65.A N SER 198.A OG no hydrogen 3.315 N/A TYR 65.A OH GLU 203.A OE2 no hydrogen 2.718 N/A GLU 67.A N ARG 64.A O no hydrogen 3.163 N/A ASN 70.A N ASN 68.A OD1 no hydrogen 3.496 N/A GLN 73.A N GLU 194.A OE1 no hydrogen 2.797 N/A GLN 73.A NE2 GLU 194.A OE2 no hydrogen 3.515 N/A GLN 74.A N GLU 194.A OE2 no hydrogen 3.266 N/A HIS 75.A N SER 57.A O no hydrogen 3.128 N/A TYR 76.A N GLU 163.A OE2 no hydrogen 2.800 N/A GLN 77.A N GLU 55.A O no hydrogen 2.969 N/A GLN 77.A NE2 HIS 75.A NE2 no hydrogen 3.287 N/A PHE 78.A N TYR 160.A O no hydrogen 3.051 N/A GLN 79.A N TYR 53.A O no hydrogen 2.840 N/A GLN 79.A NE2 THR 39.A OG1 no hydrogen 3.161 N/A GLN 79.A NE2 GLU 157.A OE2 no hydrogen 2.481 N/A VAL 80.A N ILE 158.A O no hydrogen 2.778 N/A ILE 81.A N VAL 51.A O no hydrogen 2.908 N/A LEU 82.A N VAL 156.A O no hydrogen 2.898 N/A LYS 83.A N ASN 50.A OD1 no hydrogen 3.174 N/A LYS 83.A NZ ARG 42.A O no hydrogen 2.862 N/A LYS 83.A NZ VAL 43.A O no hydrogen 3.281 N/A LYS 83.A NZ LEU 44.A O no hydrogen 3.106 N/A LYS 83.A NZ GLY 45.A O no hydrogen 3.001 N/A LYS 83.A NZ GLU 47.A O no hydrogen 2.613 N/A GLN 90.A NE2 GLU 303.A OE1 no hydrogen 3.104 N/A ILE 92.A N ASN 88.A O no hydrogen 3.055 N/A TYR 93.A N PRO 89.A O no hydrogen 2.873 N/A TYR 93.A OH THR 138.A OG1 no hydrogen 2.608 N/A LEU 94.A N GLN 90.A O no hydrogen 2.913 N/A ARG 95.A N GLU 91.A O no hydrogen 2.950 N/A SER 96.A N ILE 92.A O no hydrogen 2.987 N/A SER 96.A OG TYR 93.A O no hydrogen 2.669 N/A SER 96.A OG TYR 160.A OH no hydrogen 2.624 N/A LEU 97.A N TYR 93.A O no hydrogen 3.069 N/A GLU 98.A N LEU 94.A O no hydrogen 3.015 N/A ALA 99.A N ARG 95.A O no hydrogen 2.986 N/A LEU 100.A N SER 96.A O no hydrogen 3.078 N/A LEU 100.A N LEU 97.A O no hydrogen 3.010 N/A GLY 101.A N GLU 98.A O no hydrogen 2.909 N/A ILE 102.A N LEU 97.A O no hydrogen 2.916 N/A ARG 105.A N ASP 103.A OD1 no hydrogen 2.971 N/A ARG 105.A NH1 GLU 98.A OE2 no hydrogen 2.947 N/A ARG 105.A NH1 ASP 103.A OD1 no hydrogen 2.618 N/A GLU 106.A N ASP 103.A O no hydrogen 2.982 N/A HIS 107.A N ASP 103.A O no hydrogen 3.000 N/A HIS 107.A ND1 ASP 133.A OD2 no hydrogen 2.631 N/A ASP 108.A N ASP 133.A OD1 no hydrogen 2.716 N/A ARG 110.A N TRP 131.A O no hydrogen 3.042 N/A ARG 110.A NE ASP 108.A OD1 no hydrogen 3.143 N/A ARG 110.A NE ASP 108.A OD2 no hydrogen 3.277 N/A ARG 110.A NH1 LEU 543.A O no hydrogen 3.232 N/A ARG 110.A NH2 ASP 108.A OD2 no hydrogen 2.476 N/A ARG 110.A NH2 VAL 593.A O no hydrogen 2.840 N/A VAL 112.A N GLU 129.A O no hydrogen 2.952 N/A ASP 114.A N GLY 127.A O no hydrogen 2.910 N/A TRP 116.A N GLY 125.A O no hydrogen 3.110 N/A SER 118.A N ALA 123.A O no hydrogen 2.819 N/A LEU 121.A N SER 118.A O no hydrogen 3.082 N/A GLY 122.A N PRO 119.A O no hydrogen 3.064 N/A ALA 123.A N SER 118.A O no hydrogen 2.982 N/A TRP 124.A N GLN 145.A O no hydrogen 3.192 N/A GLY 125.A N TRP 116.A O no hydrogen 2.888 N/A LEU 126.A N TYR 142.A O no hydrogen 3.210 N/A GLY 127.A N ASN 115.A OD1 no hydrogen 3.377 N/A TRP 128.A N PHE 140.A O no hydrogen 2.788 N/A TRP 128.A NE1 GLU 303.A O no hydrogen 2.615 N/A GLU 129.A N VAL 112.A O no hydrogen 2.761 N/A VAL 130.A N THR 138.A O no hydrogen 2.847 N/A TRP 131.A N ARG 110.A O no hydrogen 2.826 N/A TRP 131.A NE1 GLU 129.A OE2 no hydrogen 2.739 N/A LEU 132.A N LEU 135.A O no hydrogen 2.756 N/A ASP 133.A N ASP 108.A O no hydrogen 2.908 N/A LEU 135.A N LEU 132.A O no hydrogen 2.913 N/A ILE 137.A N VAL 130.A O no hydrogen 2.943 N/A THR 138.A OG1 TYR 93.A OH no hydrogen 2.608 N/A THR 138.A OG1 ILE 137.A O no hydrogen 2.616 N/A GLN 139.A N THR 159.A O no hydrogen 2.924 N/A PHE 140.A N TRP 128.A O no hydrogen 2.890 N/A THR 141.A N GLU 157.A O no hydrogen 2.915 N/A TYR 142.A N LEU 126.A O no hydrogen 2.820 N/A TYR 142.A OH GLU 302.A OE1 no hydrogen 2.776 N/A TYR 142.A OH GLU 302.A OE2 no hydrogen 3.144 N/A PHE 143.A N SER 155.A O no hydrogen 2.841 N/A GLN 144.A N TRP 124.A O no hydrogen 3.013 N/A GLN 144.A NE2 TYR 142.A O no hydrogen 3.642 N/A GLN 144.A NE2 ARG 438.A O no hydrogen 2.714 N/A GLN 145.A N TRP 124.A O no hydrogen 3.326 N/A GLN 145.A NE2 GLY 122.A O no hydrogen 3.366 N/A ALA 146.A N MET 149.A O no hydrogen 3.112 N/A GLY 147.A N LEU 121.A O no hydrogen 2.840 N/A GLY 148.A N GLY 122.A O no hydrogen 3.093 N/A MET 149.A N ALA 146.A O no hydrogen 3.148 N/A LEU 151.A N GLN 144.A O no hydrogen 3.064 N/A VAL 156.A N LEU 82.A O no hydrogen 2.852 N/A GLU 157.A N THR 141.A O no hydrogen 2.791 N/A ILE 158.A N VAL 80.A O no hydrogen 2.899 N/A THR 159.A N GLN 139.A O no hydrogen 2.879 N/A THR 159.A OG1 GLN 79.A OE1 no hydrogen 2.788 N/A TYR 160.A N PHE 78.A O no hydrogen 2.768 N/A TYR 160.A OH SER 96.A OG no hydrogen 2.624 N/A GLY 161.A N ILE 137.A O no hydrogen 2.946 N/A LEU 162.A N TYR 76.A O no hydrogen 3.312 N/A GLU 163.A N GLU 163.A OE1 no hydrogen 2.900 N/A ILE 165.A N GLY 161.A O no hydrogen 3.149 N/A ALA 166.A N LEU 162.A O no hydrogen 2.919 N/A MET 167.A N GLU 163.A O no hydrogen 2.891 N/A ALA 168.A N ARG 164.A O no hydrogen 3.026 N/A LEU 169.A N ILE 165.A O no hydrogen 2.898 N/A GLN 170.A N ALA 166.A O no hydrogen 2.863 N/A GLN 170.A NE2 LEU 2.A O no hydrogen 2.978 N/A GLN 170.A NE2 ARG 179.A O no hydrogen 3.430 N/A VAL 172.A N MET 167.A O no hydrogen 3.280 N/A PHE 175.A N PRO 69.A O no hydrogen 3.186 N/A ARG 176.A NH1 GLU 67.A O no hydrogen 3.529 N/A ASP 177.A N ASN 174.A O no hydrogen 3.123 N/A ILE 178.A N PHE 175.A O no hydrogen 3.119 N/A ARG 179.A N GLN 170.A OE1 no hydrogen 2.831 N/A TRP 180.A N ARG 184.A O no hydrogen 3.084 N/A ASN 181.A N ARG 184.A O no hydrogen 3.347 N/A GLU 183.A N ASN 181.A OD1 no hydrogen 3.039 N/A ARG 184.A N ASN 181.A OD1 no hydrogen 2.768 N/A ARG 184.A NE ASP 188.A OD2 no hydrogen 3.014 N/A ARG 184.A NH2 ASP 188.A OD2 no hydrogen 3.335 N/A THR 185.A N ASP 188.A OD2 no hydrogen 3.308 N/A THR 185.A OG1 ARG 176.A O no hydrogen 3.439 N/A TYR 186.A N ILE 178.A O no hydrogen 2.779 N/A TYR 186.A OH GLU 163.A OE2 no hydrogen 2.622 N/A GLY 187.A N ARG 176.A O no hydrogen 3.356 N/A ASP 188.A N THR 185.A OG1 no hydrogen 3.047 N/A VAL 189.A N THR 185.A O no hydrogen 3.362 N/A VAL 189.A N TYR 186.A O no hydrogen 3.366 N/A ASN 190.A N TYR 186.A O no hydrogen 2.998 N/A LEU 191.A N GLY 187.A O no hydrogen 3.081 N/A GLU 194.A N ASN 190.A O no hydrogen 2.887 N/A ARG 195.A N LEU 191.A O no hydrogen 2.971 N/A ARG 195.A NE GLN 192.A OE1 no hydrogen 3.044 N/A ARG 195.A NH2 GLN 192.A OE1 no hydrogen 3.122 N/A GLU 196.A N GLN 192.A O no hydrogen 2.849 N/A HIS 197.A N GLY 193.A O no hydrogen 2.861 N/A SER 198.A N GLU 194.A O no hydrogen 3.059 N/A SER 198.A OG GLU 194.A O no hydrogen 2.737 N/A THR 199.A N ARG 195.A O no hydrogen 3.039 N/A THR 199.A OG1 ARG 195.A O no hydrogen 2.736 N/A TYR 200.A N GLU 196.A O no hydrogen 2.953 N/A TYR 201.A N HIS 197.A O no hydrogen 2.874 N/A PHE 202.A N SER 198.A O no hydrogen 2.996 N/A GLU 203.A N THR 199.A O no hydrogen 2.939 N/A VAL 204.A N TYR 200.A O no hydrogen 3.375 N/A ALA 205.A N TYR 200.A O no hydrogen 3.022 N/A ARG 209.A N ASP 206.A OD1 no hydrogen 3.211 N/A LEU 210.A N ASP 206.A O no hydrogen 3.118 N/A ARG 211.A N VAL 207.A O no hydrogen 2.982 N/A ARG 211.A NE GLU 257.A OE2 no hydrogen 2.574 N/A ARG 211.A NH1 GLU 208.A OE1 no hydrogen 3.396 N/A ARG 211.A NH2 GLU 257.A OE1 no hydrogen 2.907 N/A GLN 212.A N GLU 208.A O no hydrogen 2.986 N/A GLN 212.A NE2 GLU 208.A O no hydrogen 3.660 N/A MET 213.A N ARG 209.A O no hydrogen 2.852 N/A PHE 214.A N LEU 210.A O no hydrogen 2.935 N/A ALA 215.A N ARG 211.A O no hydrogen 3.044 N/A LEU 216.A N GLN 212.A O no hydrogen 2.957 N/A PHE 217.A N MET 213.A O no hydrogen 2.795 N/A GLU 218.A N PHE 214.A O no hydrogen 2.918 N/A ALA 219.A N ALA 215.A O no hydrogen 2.957 N/A GLU 220.A N LEU 216.A O no hydrogen 2.966 N/A ALA 221.A N PHE 217.A O no hydrogen 2.991 N/A GLU 222.A N GLU 218.A O no hydrogen 2.914 N/A ALA 223.A N ALA 219.A O no hydrogen 2.969 N/A ALA 224.A N GLU 220.A O no hydrogen 2.876 N/A LEU 225.A N ALA 221.A O no hydrogen 2.910 N/A ALA 226.A N GLU 222.A O no hydrogen 2.914 N/A ARG 227.A N ALA 224.A O no hydrogen 3.068 N/A GLY 228.A N LEU 225.A O no hydrogen 2.876 N/A LEU 229.A N ALA 224.A O no hydrogen 2.881 N/A ALA 233.A N LEU 229.A O no hydrogen 3.250 N/A HIS 234.A N VAL 230.A O no hydrogen 2.842 N/A HIS 234.A NE2 MET 35.A O no hydrogen 3.001 N/A ASP 235.A N LEU 231.A O no hydrogen 2.850 N/A TYR 236.A N PRO 232.A O no hydrogen 3.239 N/A VAL 237.A N ALA 233.A O no hydrogen 2.873 N/A LEU 238.A N HIS 234.A O no hydrogen 3.011 N/A LYS 239.A N ASP 235.A O no hydrogen 2.965 N/A SER 240.A N TYR 236.A O no hydrogen 2.976 N/A SER 240.A OG TYR 236.A O no hydrogen 2.959 N/A SER 241.A N VAL 237.A O no hydrogen 2.945 N/A SER 241.A OG VAL 237.A O no hydrogen 3.101 N/A HIS 242.A N LEU 238.A O no hydrogen 2.972 N/A THR 243.A N LYS 239.A O no hydrogen 3.004 N/A THR 243.A OG1 LYS 239.A O no hydrogen 2.634 N/A PHE 244.A N SER 240.A O no hydrogen 2.834 N/A ASN 245.A N SER 241.A O no hydrogen 2.923 N/A VAL 246.A N HIS 242.A O no hydrogen 2.939 N/A LEU 247.A N THR 243.A O no hydrogen 2.927 N/A ASP 248.A N PHE 244.A O no hydrogen 2.849 N/A THR 249.A N ASN 245.A O no hydrogen 3.006 N/A THR 249.A OG1 TYR 201.A O no hydrogen 2.958 N/A THR 249.A OG1 ASN 245.A O no hydrogen 3.341 N/A THR 249.A OG1 VAL 246.A O no hydrogen 2.603 N/A ARG 250.A N VAL 246.A O no hydrogen 3.112 N/A ARG 250.A NE ALA 205.A O no hydrogen 2.715 N/A ARG 250.A NH1 PHE 202.A O no hydrogen 2.730 N/A ARG 250.A NH2 ALA 205.A O no hydrogen 3.422 N/A GLY 251.A N ASP 248.A O no hydrogen 2.908 N/A ALA 252.A N LEU 247.A O no hydrogen 3.378 N/A GLY 254.A N GLU 257.A OE1 no hydrogen 3.151 N/A ARG 258.A N GLY 254.A O no hydrogen 2.969 N/A ARG 258.A NH1 ASP 248.A OD2 no hydrogen 3.093 N/A ARG 258.A NH2 ASP 248.A OD1 no hydrogen 2.893 N/A VAL 260.A N THR 256.A O no hydrogen 3.006 N/A LEU 261.A N GLU 257.A O no hydrogen 2.962 N/A PHE 262.A N ARG 258.A O no hydrogen 3.028 N/A ALA 263.A N GLN 259.A O no hydrogen 3.078 N/A ARG 264.A N VAL 260.A O no hydrogen 3.037 N/A ARG 264.A NE GLU 218.A OE1 no hydrogen 2.822 N/A ARG 264.A NH2 GLU 218.A OE1 no hydrogen 3.210 N/A MET 265.A N LEU 261.A O no hydrogen 2.984 N/A ARG 266.A N PHE 262.A O no hydrogen 2.912 N/A ASP 267.A N ALA 263.A O no hydrogen 2.972 N/A MET 268.A N ARG 264.A O no hydrogen 2.986 N/A ALA 269.A N MET 265.A O no hydrogen 2.998 N/A ARG 270.A N ARG 266.A O no hydrogen 2.930 N/A ARG 270.A NE ASP 267.A OD1 no hydrogen 3.212 N/A ARG 270.A NH1 GLU 274.A OE2 no hydrogen 2.902 N/A ARG 270.A NH2 ASP 267.A OD1 no hydrogen 2.342 N/A ARG 271.A N ASP 267.A O no hydrogen 2.945 N/A ARG 271.A NE ASP 267.A OD2 no hydrogen 3.254 N/A ARG 271.A NH1 GLU 222.A OE1 no hydrogen 2.736 N/A ARG 271.A NH2 GLU 222.A OE2 no hydrogen 2.370 N/A ARG 271.A NH2 ASP 267.A OD2 no hydrogen 3.417 N/A VAL 272.A N MET 268.A O no hydrogen 2.820 N/A ALA 273.A N ALA 269.A O no hydrogen 3.047 N/A GLU 274.A N ARG 270.A O no hydrogen 2.922 N/A ALA 275.A N ARG 271.A O no hydrogen 2.891 N/A TYR 276.A N VAL 272.A O no hydrogen 2.930 N/A VAL 277.A N ALA 273.A O no hydrogen 3.076 N/A ALA 278.A N GLU 274.A O no hydrogen 3.019 N/A GLN 279.A N ALA 275.A O no hydrogen 2.940 N/A ARG 280.A N TYR 276.A O no hydrogen 2.967 N/A ARG 280.A NE GLU 47.A OE1 no hydrogen 2.699 N/A ARG 280.A NH2 GLU 47.A OE1 no hydrogen 3.134 N/A ARG 280.A NH2 GLU 47.A OE2 no hydrogen 2.729 N/A GLN 281.A N VAL 277.A O no hydrogen 2.902 N/A ALA 282.A N ALA 278.A O no hydrogen 2.922 N/A LEU 283.A N GLN 279.A O no hydrogen 3.177 N/A GLY 284.A N GLN 281.A O no hydrogen 2.807 N/A PHE 285.A N ARG 280.A O no hydrogen 2.995 N/A TRP 287.A N GLU 47.A OE2 no hydrogen 2.832 N/A LEU 288.A N PHE 285.A O no hydrogen 3.177 N/A GLU 293.A N LEU 350.A O no hydrogen 2.795 N/A THR 294.A N GLU 293.A OE1 no hydrogen 2.820 N/A THR 294.A OG1 GLU 293.A OE1 no hydrogen 3.465 N/A THR 294.A OG1 GLU 348.A O no hydrogen 2.869 N/A LEU 295.A N VAL 347.A O no hydrogen 2.859 N/A LEU 296.A N LEU 456.A O no hydrogen 2.747 N/A ILE 297.A N VAL 345.A O no hydrogen 2.952 N/A GLU 298.A N VAL 454.A O no hydrogen 2.819 N/A ILE 299.A N LEU 343.A O no hydrogen 2.795 N/A GLY 300.A N TRP 452.A O no hydrogen 2.760 N/A THR 301.A N ARG 341.A O no hydrogen 2.960 N/A THR 301.A OG1 GLU 302.A O no hydrogen 3.217 N/A THR 301.A OG1 PRO 340.A O no hydrogen 3.516 N/A GLU 302.A N PRO 449.A O no hydrogen 3.088 N/A GLU 303.A N GLU 303.A OE1 no hydrogen 2.592 N/A LEU 304.A N PRO 340.A O no hydrogen 2.773 N/A LEU 309.A N PRO 305.A O no hydrogen 2.809 N/A GLU 310.A N PRO 306.A O no hydrogen 2.769 N/A ALA 311.A N ALA 307.A O no hydrogen 3.078 N/A ALA 312.A N ASP 308.A O no hydrogen 2.951 N/A LEU 313.A N LEU 309.A O no hydrogen 2.900 N/A ALA 314.A N GLU 310.A O no hydrogen 3.129 N/A GLN 315.A N ALA 311.A O no hydrogen 3.185 N/A GLN 315.A NE2 ARG 432.A O no hydrogen 3.091 N/A LEU 316.A N ALA 312.A O no hydrogen 3.052 N/A ARG 317.A N LEU 313.A O no hydrogen 3.003 N/A ARG 317.A NH2 VAL 336.A O no hydrogen 3.497 N/A GLN 318.A N ALA 314.A O no hydrogen 2.964 N/A ARG 319.A N LEU 316.A O no hydrogen 3.388 N/A ARG 319.A NH2 GLU 326.A OE1 no hydrogen 2.981 N/A VAL 320.A N LEU 316.A O no hydrogen 2.935 N/A LEU 323.A N ARG 319.A O no hydrogen 2.766 N/A LEU 324.A N VAL 320.A O no hydrogen 3.065 N/A ASP 325.A N PRO 321.A O no hydrogen 3.183 N/A GLU 326.A N ALA 322.A O no hydrogen 2.942 N/A LEU 327.A N LEU 323.A O no hydrogen 3.029 N/A LEU 327.A N LEU 324.A O no hydrogen 3.217 N/A HIS 328.A N ASP 325.A O no hydrogen 2.650 N/A LEU 329.A N LEU 324.A O no hydrogen 3.001 N/A HIS 331.A ND1 GLY 332.A O no hydrogen 2.423 N/A GLY 332.A N ASP 349.A O no hydrogen 2.442 N/A GLN 335.A N TRP 346.A O no hydrogen 2.750 N/A TRP 337.A N VAL 344.A O no hydrogen 2.854 N/A GLY 338.A N VAL 505.A O no hydrogen 3.244 N/A THR 339.A N ARG 342.A O no hydrogen 3.022 N/A THR 339.A OG1 GLU 545.A OE2 no hydrogen 2.364 N/A ARG 341.A N THR 339.A OG1 no hydrogen 3.123 N/A ARG 341.A NH1 GLY 477.A O no hydrogen 2.631 N/A ARG 341.A NH1 GLU 545.A OE1 no hydrogen 3.412 N/A ARG 342.A N THR 339.A O no hydrogen 3.089 N/A ARG 342.A NH2 ARG 476.A O no hydrogen 2.128 N/A LEU 343.A N ILE 299.A O no hydrogen 3.085 N/A VAL 344.A N TRP 337.A O no hydrogen 2.801 N/A VAL 345.A N ILE 297.A O no hydrogen 2.717 N/A TRP 346.A N GLN 335.A O no hydrogen 2.771 N/A VAL 347.A N LEU 295.A O no hydrogen 3.078 N/A ALA 351.A N PRO 330.A O no hydrogen 2.921 N/A GLY 352.A N GLU 291.A O no hydrogen 2.604 N/A GLN 354.A N ARG 414.A O no hydrogen 2.649 N/A GLN 354.A NE2 LEU 327.A O no hydrogen 2.470 N/A ARG 357.A N GLU 411.A O no hydrogen 3.198 N/A LEU 359.A N VAL 409.A O no hydrogen 2.637 N/A ILE 361.A N ALA 407.A O no hydrogen 3.044 N/A GLY 363.A N VAL 405.A O no hydrogen 2.791 N/A ALA 366.A N ARG 403.A O no hydrogen 2.844 N/A ARG 368.A N PRO 365.A O no hydrogen 3.049 N/A ALA 369.A N PRO 365.A O no hydrogen 3.033 N/A ALA 369.A N ALA 366.A O no hydrogen 3.135 N/A PHE 370.A N ALA 366.A O no hydrogen 3.241 N/A ASP 371.A N ARG 375.A O no hydrogen 2.921 N/A GLY 374.A N ASP 371.A O no hydrogen 3.312 N/A ARG 375.A N ASP 371.A OD1 no hydrogen 2.479 N/A THR 377.A N ALA 369.A O no hydrogen 2.597 N/A THR 377.A OG1 ARG 368.A O no hydrogen 2.592 N/A THR 377.A OG1 ALA 369.A O no hydrogen 2.748 N/A GLU 381.A N THR 377.A O no hydrogen 3.070 N/A GLY 382.A N ALA 378.A O no hydrogen 2.798 N/A PHE 383.A N ALA 379.A O no hydrogen 3.192 N/A ALA 384.A N ALA 380.A O no hydrogen 2.832 N/A ARG 385.A N GLU 381.A O no hydrogen 2.713 N/A SER 386.A N GLY 382.A O no hydrogen 2.705 N/A SER 386.A OG PHE 383.A O no hydrogen 2.489 N/A LYS 387.A N PHE 383.A O no hydrogen 3.367 N/A LYS 387.A NZ SER 386.A OG no hydrogen 2.623 N/A GLU 392.A N GLU 392.A OE1 no hydrogen 2.590 N/A ALA 393.A N PRO 390.A O no hydrogen 2.891 N/A LEU 394.A N VAL 391.A O no hydrogen 3.080 N/A THR 395.A N VAL 406.A O no hydrogen 3.231 N/A THR 395.A OG1 HIS 408.A NE2 no hydrogen 2.620 N/A ALA 397.A N TYR 404.A O no hydrogen 3.189 N/A TYR 404.A N ALA 397.A O no hydrogen 3.291 N/A VAL 405.A N PRO 364.A O no hydrogen 3.044 N/A VAL 406.A N THR 395.A O no hydrogen 2.796 N/A ALA 407.A N ILE 361.A O no hydrogen 3.136 N/A HIS 408.A NE2 THR 395.A OG1 no hydrogen 2.620 N/A VAL 409.A N LEU 359.A O no hydrogen 2.997 N/A GLY 413.A N ASP 356.A OD2 no hydrogen 2.800 N/A ARG 414.A NH1 GLU 422.A OE1 no hydrogen 2.818 N/A ARG 414.A NH2 GLU 422.A OE2 no hydrogen 3.029 N/A ALA 416.A N GLY 352.A O no hydrogen 3.002 N/A VAL 419.A N PRO 415.A O no hydrogen 3.203 N/A LEU 420.A N ALA 416.A O no hydrogen 2.933 N/A ALA 421.A N VAL 417.A O no hydrogen 3.213 N/A GLU 422.A N VAL 419.A O no hydrogen 3.228 N/A VAL 423.A N LEU 420.A O no hydrogen 3.042 N/A LEU 424.A N LEU 420.A O no hydrogen 2.988 N/A VAL 427.A N VAL 423.A O no hydrogen 2.927 N/A ILE 428.A N LEU 424.A O no hydrogen 3.229 N/A ALA 429.A N PRO 425.A O no hydrogen 3.096 N/A ASP 430.A N GLY 426.A O no hydrogen 3.252 N/A ASP 430.A N VAL 427.A O no hydrogen 3.315 N/A LEU 431.A N ILE 428.A O no hydrogen 3.071 N/A ARG 432.A N GLN 315.A OE1 no hydrogen 2.904 N/A MET 437.A N PHE 446.A O no hydrogen 2.672 N/A ARG 438.A N GLN 144.A OE1 no hydrogen 2.963 N/A ARG 438.A NH2 GLN 144.A O no hydrogen 3.531 N/A ARG 438.A NH2 LEU 151.A O no hydrogen 2.355 N/A ASN 440.A ND2 ALA 467.A O no hydrogen 3.163 N/A SER 442.A OG ASN 440.A OD1 no hydrogen 3.005 N/A GLY 443.A N ASN 440.A O no hydrogen 3.445 N/A VAL 444.A N SER 442.A OG no hydrogen 3.225 N/A PHE 446.A N MET 437.A O no hydrogen 2.788 N/A SER 447.A OG ASP 308.A OD2 no hydrogen 2.635 N/A ARG 448.A NH1 SER 447.A O no hydrogen 2.777 N/A ARG 448.A NH2 GLY 127.A O no hydrogen 3.099 N/A ARG 451.A N GLY 300.A O no hydrogen 2.807 N/A ARG 451.A NE GLU 302.A OE2 no hydrogen 2.677 N/A ARG 451.A NH1 ASP 85.A OD2 no hydrogen 2.989 N/A ARG 451.A NH2 ASP 85.A OD1 no hydrogen 3.112 N/A ARG 451.A NH2 GLU 302.A OE2 no hydrogen 2.816 N/A TRP 452.A N GLY 300.A O no hydrogen 3.372 N/A TRP 452.A NE1 GLU 298.A OE1 no hydrogen 2.892 N/A VAL 454.A N GLU 298.A O no hydrogen 2.821 N/A ALA 455.A N GLY 472.A O no hydrogen 3.322 N/A LEU 456.A N LEU 296.A O no hydrogen 2.790 N/A HIS 457.A N THR 460.A O no hydrogen 3.046 N/A GLY 458.A N THR 294.A O no hydrogen 2.939 N/A THR 460.A N HIS 457.A O no hydrogen 3.331 N/A ILE 462.A N ALA 455.A O no hydrogen 2.940 N/A PHE 464.A N SER 471.A OG no hydrogen 2.896 N/A TYR 466.A N LEU 469.A O no hydrogen 3.116 N/A LEU 469.A N TYR 466.A O no hydrogen 2.726 N/A SER 471.A N PHE 464.A O no hydrogen 2.935 N/A SER 471.A OG ILE 462.A O no hydrogen 2.599 N/A SER 471.A OG PHE 464.A O no hydrogen 3.210 N/A GLY 472.A N LEU 453.A O no hydrogen 3.152 N/A ARG 473.A NH1 GLU 459.A O no hydrogen 3.459 N/A ARG 473.A NH1 LEU 488.A O no hydrogen 3.112 N/A ARG 473.A NH2 GLU 459.A O no hydrogen 3.054 N/A THR 475.A N PHE 486.A O no hydrogen 2.827 N/A THR 475.A OG1 GLU 298.A OE1 no hydrogen 2.213 N/A THR 475.A OG1 GLU 298.A OE2 no hydrogen 3.210 N/A GLY 477.A N ALA 484.A O no hydrogen 3.210 N/A LEU 478.A N GLN 501.A OE1 no hydrogen 2.631 N/A ARG 479.A NE GLU 91.A OE2 no hydrogen 3.186 N/A ARG 479.A NH1 GLU 303.A OE2 no hydrogen 2.364 N/A ARG 479.A NH2 GLN 90.A OE1 no hydrogen 2.921 N/A ARG 479.A NH2 GLU 303.A OE1 no hydrogen 2.623 N/A ARG 479.A NH2 GLU 303.A OE2 no hydrogen 3.014 N/A ALA 481.A N LEU 478.A O no hydrogen 3.211 N/A PHE 486.A N THR 475.A O no hydrogen 2.721 N/A LEU 488.A N ARG 473.A O no hydrogen 2.646 N/A SER 489.A OG ASP 493.A OD2 no hydrogen 2.431 N/A HIS 490.A N ASP 493.A OD2 no hydrogen 3.042 N/A ARG 492.A N HIS 490.A ND1 no hydrogen 3.149 N/A ASP 493.A N HIS 490.A O no hydrogen 2.820 N/A TYR 494.A N PRO 491.A O no hydrogen 3.181 N/A TYR 494.A OH GLU 298.A OE2 no hydrogen 2.444 N/A PHE 497.A N ASP 493.A O no hydrogen 2.830 N/A LEU 498.A N TYR 494.A O no hydrogen 3.139 N/A GLU 499.A N ARG 495.A O no hydrogen 3.244 N/A ARG 500.A N ILE 496.A O no hydrogen 3.203 N/A GLY 502.A N GLU 499.A O no hydrogen 3.289 N/A VAL 503.A N LEU 498.A O no hydrogen 2.930 N/A VAL 504.A N GLU 545.A O no hydrogen 2.973 N/A GLU 506.A N GLU 506.A OE2 no hydrogen 2.877 N/A ARG 510.A N GLU 506.A O no hydrogen 2.923 N/A ARG 510.A NE THR 541.A O no hydrogen 2.693 N/A ARG 510.A NH1 GLY 338.A O no hydrogen 3.113 N/A ARG 510.A NH1 VAL 504.A O no hydrogen 2.927 N/A ARG 510.A NH1 VAL 505.A O no hydrogen 3.551 N/A ARG 510.A NH2 GLY 338.A O no hydrogen 3.240 N/A ARG 510.A NH2 THR 541.A O no hydrogen 3.070 N/A ARG 510.A NH2 HIS 542.A ND1 no hydrogen 3.021 N/A ARG 511.A N PRO 507.A O no hydrogen 2.925 N/A ARG 511.A NE ASN 538.A OD1 no hydrogen 2.612 N/A ARG 511.A NH2 ASN 538.A OD1 no hydrogen 3.247 N/A ALA 512.A N GLU 508.A O no hydrogen 3.217 N/A ARG 513.A N ILE 509.A O no hydrogen 2.951 N/A ILE 514.A N ARG 510.A O no hydrogen 3.102 N/A ALA 515.A N ARG 511.A O no hydrogen 3.227 N/A GLU 516.A N ALA 512.A O no hydrogen 2.866 N/A GLN 517.A N ARG 513.A O no hydrogen 2.891 N/A ALA 518.A N ILE 514.A O no hydrogen 2.866 N/A ARG 519.A N ALA 515.A O no hydrogen 3.061 N/A ARG 519.A NE PRO 529.A O no hydrogen 2.629 N/A THR 520.A N GLU 516.A O no hydrogen 3.301 N/A THR 520.A OG1 GLU 516.A O no hydrogen 3.110 N/A LEU 521.A N GLN 517.A O no hydrogen 3.180 N/A ILE 522.A N ALA 518.A O no hydrogen 2.955 N/A ALA 523.A N ARG 519.A O no hydrogen 2.846 N/A ASP 524.A N THR 520.A O no hydrogen 2.965 N/A GLY 526.A N ALA 523.A O no hydrogen 3.170 N/A GLY 527.A N ILE 522.A O no hydrogen 2.777 N/A ASP 528.A N TYR 580.A O no hydrogen 2.808 N/A GLU 530.A N ASP 528.A OD2 no hydrogen 2.843 N/A HIS 531.A N ASP 528.A O no hydrogen 3.373 N/A LEU 532.A N GLU 530.A O no hydrogen 2.972 N/A ALA 535.A N ASP 533.A OD2 no hydrogen 2.671 N/A LEU 537.A N ASP 533.A O no hydrogen 3.260 N/A ASN 538.A N GLU 534.A O no hydrogen 3.010 N/A GLU 539.A N ALA 535.A O no hydrogen 3.142 N/A VAL 540.A N VAL 536.A O no hydrogen 2.817 N/A THR 541.A N LEU 537.A O no hydrogen 3.044 N/A THR 541.A OG1 LEU 537.A O no hydrogen 2.474 N/A HIS 542.A N GLU 539.A O no hydrogen 2.862 N/A LEU 543.A N VAL 540.A O no hydrogen 3.267 N/A GLU 545.A N ASN 595.A OD1 no hydrogen 2.760 N/A ALA 546.A N ASN 595.A OD1 no hydrogen 3.141 N/A THR 548.A OG1 PRO 547.A O no hydrogen 2.664 N/A THR 548.A OG1 GLY 596.A O no hydrogen 2.467 N/A ALA 549.A N GLN 517.A OE1 no hydrogen 2.774 N/A LEU 550.A N ALA 592.A O no hydrogen 2.559 N/A ARG 551.A NH1 LEU 521.A O no hydrogen 3.452 N/A GLY 552.A N PHE 590.A O no hydrogen 2.922 N/A ARG 553.A N GLU 609.A OE2 no hydrogen 2.703 N/A PHE 554.A N PRO 588.A O no hydrogen 3.477 N/A TYR 558.A N GLU 555.A O no hydrogen 3.262 N/A LEU 559.A N ASP 556.A O no hydrogen 2.952 N/A ARG 560.A N GLU 557.A O no hydrogen 3.033 N/A LEU 561.A N TYR 558.A O no hydrogen 3.185 N/A GLU 564.A N GLU 564.A OE1 no hydrogen 2.385 N/A VAL 565.A N PRO 562.A O no hydrogen 3.049 N/A LEU 566.A N PRO 562.A O no hydrogen 3.356 N/A VAL 567.A N GLU 563.A O no hydrogen 2.814 N/A SER 568.A N GLU 564.A O no hydrogen 3.034 N/A SER 568.A OG GLU 564.A O no hydrogen 2.643 N/A VAL 569.A N VAL 565.A O no hydrogen 3.043 N/A MET 570.A N LEU 566.A O no hydrogen 3.126 N/A LYS 571.A N VAL 567.A O no hydrogen 3.029 N/A LYS 571.A NZ ASP 533.A OD1 no hydrogen 2.656 N/A LYS 572.A N SER 568.A O no hydrogen 2.956 N/A HIS 573.A N VAL 569.A O no hydrogen 3.226 N/A GLN 574.A N VAL 569.A O no hydrogen 3.187 N/A GLN 574.A NE2 GLY 134.A O no hydrogen 2.972 N/A ARG 575.A NE GLU 539.A OE2 no hydrogen 2.627 N/A ARG 575.A NH1 HIS 573.A O no hydrogen 3.025 N/A ARG 575.A NH2 GLU 539.A OE2 no hydrogen 2.904 N/A TYR 576.A N MET 570.A O no hydrogen 2.535 N/A TYR 576.A OH ASN 608.A OD1 no hydrogen 2.272 N/A PHE 577.A N ILE 591.A O no hydrogen 2.949 N/A THR 581.A N GLN 585.A O no hydrogen 3.052 N/A GLY 584.A N THR 581.A O no hydrogen 3.041 N/A LEU 587.A N VAL 579.A O no hydrogen 2.580 N/A TYR 589.A N LEU 587.A O no hydrogen 2.754 N/A PHE 590.A N GLY 552.A O no hydrogen 2.972 N/A ILE 591.A N PHE 577.A O no hydrogen 2.861 N/A ALA 592.A N LEU 550.A O no hydrogen 2.807 N/A ARG 594.A N THR 548.A O no hydrogen 2.883 N/A ARG 594.A NH1 GLU 599.A O no hydrogen 2.842 N/A ASN 595.A N ASP 108.A OD2 no hydrogen 3.168 N/A GLY 596.A N ALA 546.A O no hydrogen 3.037 N/A VAL 603.A N GLY 600.A O no hydrogen 3.300 N/A THR 605.A N LEU 601.A O no hydrogen 2.821 N/A THR 605.A OG1 LEU 601.A O no hydrogen 2.893 N/A ASP 606.A N ASP 602.A O no hydrogen 2.912 N/A GLY 607.A N VAL 603.A O no hydrogen 3.133 N/A ASN 608.A N VAL 604.A O no hydrogen 3.021 N/A ASN 608.A ND2 VAL 604.A O no hydrogen 2.832 N/A GLU 609.A N THR 605.A O no hydrogen 3.034 N/A GLN 610.A N ASP 606.A O no hydrogen 3.007 N/A GLN 610.A NE2 ASP 606.A OD1 no hydrogen 3.262 N/A VAL 611.A N GLY 607.A O no hydrogen 3.014 N/A ILE 612.A N ASN 608.A O no hydrogen 3.036 N/A ARG 613.A N GLU 609.A O no hydrogen 3.034 N/A ALA 614.A N GLN 610.A O no hydrogen 3.140 N/A ARG 615.A N VAL 611.A O no hydrogen 2.978 N/A ARG 615.A NH2 ASP 618.A OD2 no hydrogen 3.449 N/A PHE 616.A N ILE 612.A O no hydrogen 2.928 N/A ALA 617.A N ARG 613.A O no hydrogen 2.947 N/A ASP 618.A N ALA 614.A O no hydrogen 2.814 N/A ALA 619.A N ARG 615.A O no hydrogen 3.105 N/A ALA 620.A N PHE 616.A O no hydrogen 2.912 N/A TYR 621.A N ALA 617.A O no hydrogen 2.902 N/A PHE 622.A N ASP 618.A O no hydrogen 2.954 N/A ILE 623.A N ALA 619.A O no hydrogen 2.874 N/A ARG 624.A N ALA 620.A O no hydrogen 2.752 N/A ARG 624.A NH2 GLU 67.A OE1 no hydrogen 3.334 N/A GLU 625.A N TYR 621.A O no hydrogen 3.178 N/A ASP 626.A N PHE 622.A O no hydrogen 3.133 N/A LEU 627.A N ILE 623.A O no hydrogen 2.963 N/A LYS 628.A N GLU 625.A O no hydrogen 3.149 N/A LYS 628.A NZ GLU 625.A OE1 no hydrogen 2.776 N/A LYS 628.A NZ GLU 625.A OE2 no hydrogen 3.027 N/A LEU 631.A N SER 712.A OG no hydrogen 3.280 N/A TYR 633.A N PRO 630.A O no hydrogen 2.825 N/A TYR 634.A N LEU 631.A O no hydrogen 3.314 N/A TYR 634.A OH ASP 626.A O no hydrogen 2.709 N/A LEU 635.A N GLU 632.A O no hydrogen 3.470 N/A ARG 637.A N TYR 634.A O no hydrogen 3.150 N/A ARG 637.A NH1 VAL 690.A O no hydrogen 3.334 N/A LEU 638.A N LEU 635.A O no hydrogen 2.981 N/A SER 639.A N PRO 636.A O no hydrogen 3.281 N/A SER 639.A OG PRO 636.A O no hydrogen 2.749 N/A THR 640.A N ARG 637.A O no hydrogen 3.171 N/A THR 640.A OG1 ARG 637.A O no hydrogen 2.489 N/A LEU 641.A N LEU 638.A O no hydrogen 2.842 N/A PHE 643.A N GLY 648.A O no hydrogen 3.111 N/A LYS 646.A N GLN 644.A OE1 no hydrogen 2.674 N/A LEU 647.A N GLN 644.A O no hydrogen 3.297 N/A GLY 648.A N GLN 644.A O no hydrogen 3.018 N/A SER 649.A N ASP 652.A OD2 no hydrogen 3.181 N/A SER 649.A OG ASP 652.A OD2 no hydrogen 3.113 N/A MET 650.A N LEU 641.A O no hydrogen 2.871 N/A ASP 652.A N SER 649.A OG no hydrogen 3.184 N/A LYS 653.A N SER 649.A O no hydrogen 3.056 N/A LYS 653.A NZ ASP 751.A OD2 no hydrogen 2.731 N/A LYS 653.A NZ THR 752.A OG1 no hydrogen 2.919 N/A THR 654.A N MET 650.A O no hydrogen 2.769 N/A THR 654.A OG1 MET 650.A O no hydrogen 2.827 N/A HIS 655.A N LEU 651.A O no hydrogen 2.919 N/A ARG 656.A N ASP 652.A O no hydrogen 2.908 N/A ARG 656.A NE ASP 751.A OD1 no hydrogen 2.823 N/A ARG 656.A NE ASP 751.A OD2 no hydrogen 3.353 N/A ARG 656.A NH1 LEU 647.A O no hydrogen 3.119 N/A ARG 656.A NH2 ASP 751.A OD2 no hydrogen 3.240 N/A ILE 657.A N LYS 653.A O no hydrogen 2.864 N/A GLU 658.A N THR 654.A O no hydrogen 3.009 N/A VAL 659.A N HIS 655.A O no hydrogen 3.233 N/A LEU 660.A N ARG 656.A O no hydrogen 2.878 N/A VAL 661.A N ILE 657.A O no hydrogen 2.792 N/A GLU 662.A N GLU 658.A O no hydrogen 3.183 N/A ARG 663.A N VAL 659.A O no hydrogen 3.269 N/A LEU 664.A N LEU 660.A O no hydrogen 3.012 N/A ILE 665.A N VAL 661.A O no hydrogen 3.067 N/A VAL 668.A N LEU 664.A O no hydrogen 2.880 N/A VAL 668.A N ILE 665.A O no hydrogen 3.281 N/A GLY 669.A N ILE 665.A O no hydrogen 2.785 N/A LEU 670.A N ILE 665.A O no hydrogen 3.496 N/A ALA 675.A N GLU 671.A O no hydrogen 2.736 N/A ALA 676.A N ALA 672.A O no hydrogen 3.121 N/A ALA 677.A N GLU 673.A O no hydrogen 3.327 N/A VAL 678.A N ASP 674.A O no hydrogen 3.001 N/A ARG 679.A N ALA 675.A O no hydrogen 3.260 N/A ARG 679.A NE GLU 662.A OE1 no hydrogen 2.924 N/A ARG 679.A NE GLU 662.A OE2 no hydrogen 2.784 N/A ARG 679.A NH2 GLU 662.A OE2 no hydrogen 2.595 N/A ARG 680.A N ALA 676.A O no hydrogen 3.139 N/A ARG 680.A NE GLU 714.A OE1 no hydrogen 2.901 N/A ARG 680.A NE GLU 714.A OE2 no hydrogen 3.175 N/A ARG 680.A NH2 GLU 632.A OE1 no hydrogen 3.385 N/A ARG 680.A NH2 GLU 714.A OE2 no hydrogen 2.602 N/A ALA 681.A N ALA 677.A O no hydrogen 2.715 N/A ALA 682.A N VAL 678.A O no hydrogen 2.995 N/A HIS 683.A N ARG 679.A O no hydrogen 3.417 N/A HIS 683.A ND1 GLU 658.A OE2 no hydrogen 3.212 N/A LEU 684.A N ARG 680.A O no hydrogen 3.307 N/A LEU 684.A N ALA 681.A O no hydrogen 2.944 N/A SER 685.A N ALA 682.A O no hydrogen 3.418 N/A SER 685.A OG ALA 682.A O no hydrogen 2.796 N/A LYS 686.A NZ ASP 748.A OD1 no hydrogen 3.295 N/A LYS 686.A NZ ASP 748.A OD2 no hydrogen 2.766 N/A ALA 687.A N LEU 684.A O no hydrogen 3.311 N/A LEU 689.A N LYS 686.A O no hydrogen 3.043 N/A THR 691.A N ASP 688.A O no hydrogen 2.974 N/A THR 691.A OG1 ASP 688.A O no hydrogen 2.493 N/A HIS 692.A N ASP 626.A OD1 no hydrogen 2.883 N/A MET 693.A N ASP 626.A OD2 no hydrogen 3.002 N/A VAL 695.A N THR 691.A O no hydrogen 3.031 N/A GLU 696.A N HIS 692.A O no hydrogen 3.177 N/A MET 697.A N MET 693.A O no hydrogen 2.933 N/A LEU 700.A N MET 697.A O no hydrogen 3.000 N/A GLN 701.A N THR 698.A O no hydrogen 3.316 N/A GLY 702.A N ASP 688.A OD2 no hydrogen 2.795 N/A MET 704.A N LEU 700.A O no hydrogen 3.127 N/A ARG 706.A N GLY 702.A O no hydrogen 2.875 N/A ARG 706.A NH1 GLU 720.A OE1 no hydrogen 3.095 N/A ARG 706.A NH2 GLU 564.A OE2 no hydrogen 3.020 N/A TYR 707.A N VAL 703.A O no hydrogen 3.146 N/A TYR 708.A N MET 704.A O no hydrogen 2.743 N/A TYR 708.A OH ASP 626.A OD2 no hydrogen 2.871 N/A ALA 709.A N GLY 705.A O no hydrogen 3.069 N/A LEU 710.A N ARG 706.A O no hydrogen 3.044 N/A GLN 711.A N TYR 707.A O no hydrogen 3.051 N/A GLN 711.A NE2 TYR 707.A OH no hydrogen 2.949 N/A SER 712.A N TYR 708.A O no hydrogen 2.910 N/A SER 712.A OG TYR 708.A O no hydrogen 2.742 N/A GLY 713.A N LEU 710.A O no hydrogen 3.029 N/A GLU 714.A N ALA 709.A O no hydrogen 2.900 N/A ALA 719.A N PRO 715.A O no hydrogen 3.064 N/A GLU 720.A N ARG 716.A O no hydrogen 2.848 N/A ALA 721.A N ALA 717.A O no hydrogen 3.249 N/A ILE 722.A N VAL 718.A O no hydrogen 3.165 N/A PHE 723.A N ALA 719.A O no hydrogen 3.420 N/A GLU 724.A N GLU 720.A O no hydrogen 2.780 N/A ALA 725.A N ALA 721.A O no hydrogen 3.020 N/A LEU 727.A N GLU 724.A O no hydrogen 3.082 N/A ARG 729.A N ASP 733.A OD2 no hydrogen 2.829 N/A ARG 729.A NE ASP 733.A OD2 no hydrogen 2.841 N/A ARG 729.A NH2 ASP 733.A OD1 no hydrogen 3.274 N/A ARG 729.A NH2 ASP 733.A OD2 no hydrogen 3.540 N/A ASP 733.A N PHE 730.A O no hydrogen 3.045 N/A ARG 734.A N ASP 733.A OD1 no hydrogen 2.642 N/A GLU 737.A N GLU 724.A OE2 no hydrogen 2.655 N/A THR 738.A N GLU 724.A OE1 no hydrogen 3.022 N/A THR 738.A OG1 GLU 724.A OE1 no hydrogen 2.456 N/A GLY 741.A N THR 738.A OG1 no hydrogen 3.238 N/A LEU 742.A N THR 738.A O no hydrogen 3.080 N/A VAL 743.A N PRO 739.A O no hydrogen 3.011 N/A LEU 744.A N ALA 740.A O no hydrogen 2.938 N/A GLY 745.A N GLY 741.A O no hydrogen 3.182 N/A LEU 746.A N LEU 742.A O no hydrogen 2.853 N/A ALA 747.A N VAL 743.A O no hydrogen 2.877 N/A ASP 748.A N LEU 744.A O no hydrogen 2.877 N/A ARG 749.A N GLY 745.A O no hydrogen 3.120 N/A ARG 749.A NH1 ALA 725.A O no hydrogen 3.256 N/A ARG 749.A NH1 LEU 727.A O no hydrogen 3.435 N/A ARG 749.A NH1 GLY 745.A O no hydrogen 3.466 N/A ARG 749.A NH2 TYR 726.A O no hydrogen 3.245 N/A LEU 750.A N LEU 746.A O no hydrogen 3.211 N/A ASP 751.A N ALA 747.A O no hydrogen 3.127 N/A THR 752.A N ASP 748.A O no hydrogen 3.228 N/A THR 752.A OG1 ASP 748.A O no hydrogen 2.875 N/A LEU 753.A N ARG 749.A O no hydrogen 2.940 N/A MET 754.A N LEU 750.A O no hydrogen 2.853 N/A GLY 755.A N ASP 751.A O no hydrogen 2.781 N/A LEU 756.A N THR 752.A O no hydrogen 3.079 N/A PHE 757.A N LEU 753.A O no hydrogen 3.152 N/A ALA 758.A N MET 754.A O no hydrogen 3.077 N/A VAL 759.A N LEU 756.A O no hydrogen 3.297 N/A GLY 760.A N PHE 757.A O no hydrogen 3.177 N/A LEU 761.A N LEU 756.A O no hydrogen 2.989 N/A THR 764.A N LYS 767.A O no hydrogen 3.357 N/A LYS 767.A N THR 764.A O no hydrogen 3.050 N/A ALA 771.A N ASP 768.A O no hydrogen 3.196 N/A LEU 772.A N ASP 768.A OD1 no hydrogen 3.032 N/A ARG 773.A N ASP 768.A OD2 no hydrogen 3.133 N/A ALA 775.A N ALA 771.A O no hydrogen 2.892 N/A ALA 776.A N LEU 772.A O no hydrogen 2.957 N/A LEU 777.A N ARG 773.A O no hydrogen 2.987 N/A GLY 778.A N ARG 774.A O no hydrogen 2.811 N/A LEU 779.A N ALA 775.A O no hydrogen 3.042 N/A VAL 780.A N ALA 776.A O no hydrogen 3.207 N/A GLN 781.A N LEU 777.A O no hydrogen 2.875 N/A GLN 781.A NE2 GLU 826.A OE1 no hydrogen 3.117 N/A ASN 782.A N GLY 778.A O no hydrogen 3.073 N/A ASN 782.A ND2 LEU 727.A O no hydrogen 3.029 N/A LEU 783.A N LEU 779.A O no hydrogen 3.478 N/A ILE 784.A N VAL 780.A O no hydrogen 3.043 N/A HIS 785.A N GLN 781.A O no hydrogen 2.895 N/A TRP 786.A N ASN 782.A O no hydrogen 3.027 N/A TRP 786.A NE1 PRO 736.A O no hydrogen 2.881 N/A ASN 787.A N ILE 784.A O no hydrogen 3.099 N/A LEU 788.A N LEU 783.A O no hydrogen 3.062 N/A PHE 790.A N ASN 847.A OD1 no hydrogen 3.210 N/A LEU 792.A N HIS 846.A O no hydrogen 2.927 N/A ARG 793.A N ASP 791.A OD1 no hydrogen 3.180 N/A GLN 794.A NE2 ASP 791.A OD2 no hydrogen 3.217 N/A GLY 795.A N ASP 791.A O no hydrogen 3.084 N/A LEU 796.A N LEU 792.A O no hydrogen 2.792 N/A GLU 797.A N ARG 793.A O no hydrogen 2.817 N/A ALA 798.A N GLN 794.A O no hydrogen 3.036 N/A ALA 799.A N GLY 795.A O no hydrogen 3.149 N/A ALA 800.A N LEU 796.A O no hydrogen 2.784 N/A GLN 801.A N GLU 797.A O no hydrogen 3.039 N/A GLY 802.A N ALA 799.A O no hydrogen 3.149 N/A LEU 803.A N ALA 800.A O no hydrogen 3.095 N/A GLU 810.A N GLU 810.A OE1 no hydrogen 2.737 N/A ALA 811.A N SER 808.A OG no hydrogen 2.974 N/A LYS 812.A N SER 808.A O no hydrogen 3.025 N/A LYS 812.A NZ GLU 797.A OE1 no hydrogen 3.527 N/A MET 813.A N PRO 809.A O no hydrogen 2.886 N/A GLU 814.A N GLU 810.A O no hydrogen 2.692 N/A SER 815.A N ALA 811.A O no hydrogen 2.881 N/A SER 815.A OG ALA 811.A O no hydrogen 2.974 N/A LEU 816.A N LYS 812.A O no hydrogen 3.220 N/A GLU 817.A N MET 813.A O no hydrogen 3.156 N/A PHE 818.A N GLU 814.A O no hydrogen 3.078 N/A ILE 819.A N SER 815.A O no hydrogen 3.048 N/A VAL 820.A N LEU 816.A O no hydrogen 2.753 N/A GLY 821.A N GLU 817.A O no hydrogen 2.631 N/A ARG 822.A N PHE 818.A O no hydrogen 3.030 N/A LEU 823.A N ILE 819.A O no hydrogen 2.899 N/A LEU 823.A N VAL 820.A O no hydrogen 3.000 N/A GLN 824.A N VAL 820.A O no hydrogen 3.293 N/A GLU 826.A N ARG 822.A O no hydrogen 3.410 N/A LEU 827.A N LEU 823.A O no hydrogen 3.125 N/A LEU 828.A N GLN 824.A O no hydrogen 2.558 N/A GLU 829.A N ASN 825.A O no hydrogen 2.752 N/A GLN 830.A N LEU 827.A O no hydrogen 3.222 N/A GLY 831.A N LEU 828.A O no hydrogen 3.020 N/A ARG 833.A NE ASP 835.A OD1 no hydrogen 2.788 N/A ARG 833.A NE ASP 835.A OD2 no hydrogen 3.030 N/A ARG 833.A NH2 ASP 835.A OD2 no hydrogen 2.414 N/A VAL 837.A N ARG 833.A O no hydrogen 3.031 N/A ALA 838.A N TYR 834.A O no hydrogen 3.003 N/A ALA 839.A N ASP 835.A O no hydrogen 3.123 N/A VAL 840.A N VAL 836.A O no hydrogen 3.288 N/A LEU 841.A N VAL 837.A O no hydrogen 2.852 N/A ALA 842.A N ALA 838.A O no hydrogen 3.105 N/A ALA 843.A N VAL 840.A O no hydrogen 3.285 N/A GLN 844.A N VAL 840.A O no hydrogen 2.782 N/A GLN 844.A NE2 GLY 918.A O no hydrogen 2.932 N/A GLN 844.A NE2 VAL 968.A O no hydrogen 2.549 N/A GLY 845.A N LEU 841.A O no hydrogen 2.882 N/A ASN 847.A N GLN 844.A O no hydrogen 3.104 N/A ASN 847.A ND2 ASP 789.A OD1 no hydrogen 3.061 N/A ALA 850.A N ASN 847.A OD1 no hydrogen 3.386 N/A THR 851.A N ASN 847.A O no hydrogen 2.884 N/A THR 851.A OG1 ASN 847.A O no hydrogen 2.809 N/A ALA 852.A N PRO 848.A O no hydrogen 3.013 N/A ARG 853.A N ALA 849.A O no hydrogen 3.172 N/A ARG 853.A NH1 ASN 787.A OD1 no hydrogen 2.654 N/A ARG 853.A NH1 ASP 789.A OD1 no hydrogen 3.343 N/A ARG 853.A NH2 ASP 789.A OD1 no hydrogen 2.832 N/A GLY 854.A N ALA 850.A O no hydrogen 2.897 N/A VAL 855.A N THR 851.A O no hydrogen 2.941 N/A ARG 856.A N ALA 852.A O no hydrogen 3.132 N/A GLU 857.A N ARG 853.A O no hydrogen 2.902 N/A LEU 858.A N GLY 854.A O no hydrogen 2.818 N/A SER 859.A N VAL 855.A O no hydrogen 2.903 N/A ALA 860.A N ARG 856.A O no hydrogen 3.358 N/A TRP 861.A N GLU 857.A O no hydrogen 3.035 N/A VAL 862.A N LEU 858.A O no hydrogen 3.101 N/A SER 863.A OG VAL 862.A O no hydrogen 2.448 N/A TRP 867.A N ARG 864.A O no hydrogen 3.232 N/A THR 869.A N ASP 866.A O no hydrogen 3.285 N/A THR 869.A OG1 ASP 866.A O no hydrogen 2.623 N/A ILE 870.A N TRP 867.A O no hydrogen 3.052 N/A TYR 874.A OH VAL 962.A O no hydrogen 3.312 N/A ALA 875.A N LEU 871.A O no hydrogen 2.938 N/A ARG 876.A N PRO 872.A O no hydrogen 2.823 N/A SER 877.A N ALA 873.A O no hydrogen 3.320 N/A SER 877.A OG ALA 873.A O no hydrogen 2.700 N/A VAL 878.A N TYR 874.A O no hydrogen 2.872 N/A ARG 879.A N ALA 875.A O no hydrogen 2.802 N/A ILE 880.A N ARG 876.A O no hydrogen 3.419 N/A THR 881.A N VAL 878.A O no hydrogen 3.106 N/A THR 881.A OG1 SER 877.A O no hydrogen 2.727 N/A THR 881.A OG1 VAL 878.A O no hydrogen 3.061 N/A PHE 888.A N GLN 959.A OE1 no hydrogen 2.863 N/A ASP 891.A N ASN 953.A OD1 no hydrogen 3.011 N/A ALA 893.A N ASP 891.A OD1 no hydrogen 3.084 N/A ARG 894.A N ASP 891.A O no hydrogen 3.098 N/A LEU 895.A N PRO 892.A O no hydrogen 3.092 N/A VAL 896.A N GLU 900.A OE1 no hydrogen 3.130 N/A GLU 897.A N GLU 900.A OE1 no hydrogen 2.757 N/A LYS 901.A N GLU 897.A O no hydrogen 3.408 N/A HIS 902.A N PRO 898.A O no hydrogen 3.082 N/A LEU 903.A N ALA 899.A O no hydrogen 2.911 N/A LEU 904.A N GLU 900.A O no hydrogen 2.971 N/A SER 905.A N LYS 901.A O no hydrogen 3.105 N/A ALA 906.A N HIS 902.A O no hydrogen 3.072 N/A LEU 907.A N LEU 903.A O no hydrogen 2.803 N/A LEU 908.A N LEU 904.A O no hydrogen 2.889 N/A GLN 909.A N SER 905.A O no hydrogen 3.049 N/A GLN 909.A NE2 SER 905.A O no hydrogen 3.111 N/A GLN 909.A NE2 SER 905.A OG no hydrogen 2.964 N/A ALA 910.A N ALA 906.A O no hydrogen 3.016 N/A GLU 911.A N LEU 907.A O no hydrogen 2.759 N/A VAL 912.A N LEU 908.A O no hydrogen 3.083 N/A THR 913.A N GLN 909.A O no hydrogen 3.273 N/A THR 913.A OG1 GLN 909.A O no hydrogen 2.539 N/A ARG 915.A NH1 LEU 964.A O no hydrogen 3.143 N/A ARG 915.A NH2 LEU 964.A O no hydrogen 3.257 N/A ARG 916.A N ASP 922.A OD2 no hydrogen 3.128 N/A ARG 916.A NE ASP 922.A OD2 no hydrogen 2.734 N/A ARG 916.A NH2 ASP 922.A OD1 no hydrogen 2.470 N/A SER 919.A N ARG 916.A O no hydrogen 3.100 N/A GLU 921.A N GLU 857.A OE1 no hydrogen 2.819 N/A ASP 922.A N SER 919.A OG no hydrogen 3.006 N/A PHE 923.A N SER 919.A O no hydrogen 3.248 N/A PHE 923.A N VAL 920.A O no hydrogen 3.070 N/A PHE 924.A N VAL 920.A O no hydrogen 3.105 N/A GLN 925.A N GLU 921.A O no hydrogen 2.988 N/A VAL 926.A N PHE 923.A O no hydrogen 3.217 N/A PHE 927.A N PHE 923.A O no hydrogen 2.901 N/A LEU 928.A N PHE 924.A O no hydrogen 2.974 N/A MET 930.A N PHE 927.A O no hydrogen 2.907 N/A ILE 931.A N LEU 928.A O no hydrogen 3.158 N/A ILE 934.A N MET 930.A O no hydrogen 2.766 N/A ASN 935.A N ILE 931.A O no hydrogen 2.919 N/A ARG 936.A N PRO 932.A O no hydrogen 3.015 N/A PHE 937.A N VAL 933.A O no hydrogen 3.101 N/A PHE 938.A N ILE 934.A O no hydrogen 3.071 N/A ASP 939.A N ASN 935.A O no hydrogen 3.262 N/A GLU 940.A N ARG 936.A O no hydrogen 3.076 N/A LEU 950.A N ASP 947.A OD2 no hydrogen 3.197 N/A ARG 951.A N ASP 947.A O no hydrogen 3.062 N/A ALA 952.A N ALA 948.A O no hydrogen 3.046 N/A ASN 953.A N GLY 949.A O no hydrogen 3.138 N/A ASN 953.A ND2 ASP 891.A O no hydrogen 2.826 N/A ARG 954.A N LEU 950.A O no hydrogen 2.988 N/A ARG 954.A NE GLU 900.A OE2 no hydrogen 2.804 N/A ARG 954.A NH2 GLU 900.A OE1 no hydrogen 2.916 N/A LEU 955.A N ARG 951.A O no hydrogen 2.809 N/A GLY 956.A N ALA 952.A O no hydrogen 2.848 N/A LEU 957.A N ASN 953.A O no hydrogen 3.090 N/A LEU 958.A N ARG 954.A O no hydrogen 3.347 N/A GLN 959.A N LEU 955.A O no hydrogen 2.782 N/A GLN 959.A NE2 GLU 886.A O no hydrogen 2.768 N/A ARG 960.A N GLY 956.A O no hydrogen 2.967 N/A ARG 960.A NH1 PHE 888.A O no hydrogen 2.785 N/A ARG 960.A NH1 GLY 956.A O no hydrogen 3.504 N/A ILE 961.A N LEU 957.A O no hydrogen 3.085 N/A VAL 962.A N LEU 958.A O no hydrogen 3.130 N/A ALA 963.A N GLN 959.A O no hydrogen 2.972 N/A LEU 964.A N ILE 961.A O no hydrogen 3.120 N/A ALA 965.A N VAL 962.A O no hydrogen 3.068 N/A ASP 966.A N ALA 963.A O no hydrogen 3.017 N/A VAL 968.A N ALA 965.A O no hydrogen 2.853 N/A ALA 969.A N ALA 965.A O no hydrogen 3.295 N/A ASP 970.A N ALA 839.A O no hydrogen 2.771 N/A SER 972.A OG ASP 970.A OD1 no hydrogen 2.719 N/A LYS 973.A N ASP 970.A O no hydrogen 3.044 N/A LYS 973.A NZ ASP 970.A OD2 no hydrogen 3.387 N/A LEU 974.A N PHE 971.A O no hydrogen 3.050 N/A GLU 975.A N ASP 835.A OD2 no hydrogen 3.411 N/A PHE 977.A N LEU 974.A O no hydrogen 3.465 N/A