Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 8jfl_B.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ASP 5.A N THR 2.A OG1 no hydrogen 3.094 N/A LYS 6.A N THR 2.A O no hydrogen 3.044 N/A LEU 7.A N LEU 3.A O no hydrogen 2.909 N/A ASP 8.A N TRP 4.A O no hydrogen 2.764 N/A HIS 9.A N ASP 5.A O no hydrogen 3.366 N/A TYR 10.A OH ASP 414.A OD2 no hydrogen 2.705 N/A TYR 11.A N LEU 7.A O no hydrogen 3.020 N/A TYR 11.A OH GLU 71.A OE1 no hydrogen 3.254 N/A TYR 11.A OH GLU 71.A OE2 no hydrogen 2.606 N/A ARG 12.A N ASP 8.A O no hydrogen 3.047 N/A ARG 12.A NH1 ASP 8.A OD2 no hydrogen 2.989 N/A ILE 13.A N HIS 9.A O no hydrogen 3.377 N/A VAL 14.A N TYR 10.A O no hydrogen 2.784 N/A LYS 15.A N TYR 11.A O no hydrogen 2.834 N/A LYS 15.A NZ GLU 71.A OE1 no hydrogen 2.862 N/A SER 16.A N ARG 12.A O no hydrogen 2.913 N/A SER 16.A OG ARG 12.A O no hydrogen 2.841 N/A THR 17.A N ILE 13.A O no hydrogen 2.873 N/A THR 17.A OG1 ILE 13.A O no hydrogen 2.486 N/A THR 17.A OG1 GLN 403.A OE1 no hydrogen 3.480 N/A LEU 18.A N VAL 14.A O no hydrogen 2.873 N/A LEU 19.A N VAL 14.A O no hydrogen 2.760 N/A TYR 21.A N LEU 18.A O no hydrogen 3.147 N/A GLN 22.A NE2 GLY 27.A O no hydrogen 3.008 N/A GLN 22.A NE2 SER 75.A O no hydrogen 2.853 N/A SER 23.A N LEU 28.A O no hydrogen 2.845 N/A SER 23.A OG THR 25.A OG1 no hydrogen 3.033 N/A SER 23.A OG THR 26.A OG1 no hydrogen 3.225 N/A SER 23.A OG VAL 113.A O no hydrogen 2.901 N/A THR 25.A OG1 SER 23.A OG no hydrogen 3.033 N/A THR 25.A OG1 HIS 114.A O no hydrogen 2.538 N/A THR 26.A N THR 25.A OG1 no hydrogen 2.716 N/A THR 26.A OG1 VAL 113.A O no hydrogen 2.399 N/A LEU 28.A N THR 26.A OG1 no hydrogen 3.429 N/A THR 31.A N LYS 39.A O no hydrogen 2.873 N/A THR 31.A OG1 LYS 39.A O no hydrogen 2.681 N/A THR 33.A OG1 GLY 396.A O no hydrogen 2.553 N/A CYS 34.A SG CYS 34.A O no hydrogen 2.738 N/A CYS 34.A SG GLY 396.A O no hydrogen 3.114 N/A GLN 38.A N ASP 37.A OD1 no hydrogen 3.163 N/A ALA 40.A N PHE 111.A O no hydrogen 2.942 N/A LYS 41.A NZ GLU 180.A OE2 no hydrogen 3.153 N/A ILE 42.A N SER 109.A O no hydrogen 2.722 N/A SER 45.A N LYS 41.A O no hydrogen 3.467 N/A SER 45.A OG LYS 41.A O no hydrogen 2.769 N/A LEU 46.A N ILE 42.A O no hydrogen 3.183 N/A TYR 47.A N GLN 43.A O no hydrogen 2.924 N/A CYS 48.A N ASP 44.A O no hydrogen 2.945 N/A CYS 48.A SG ASP 44.A O no hydrogen 2.782 N/A ALA 49.A N SER 45.A O no hydrogen 2.864 N/A ALA 50.A N LEU 46.A O no hydrogen 3.077 N/A GLY 51.A N TYR 47.A O no hydrogen 3.109 N/A ALA 52.A N CYS 48.A O no hydrogen 3.227 N/A TRP 53.A N ALA 49.A O no hydrogen 3.017 N/A ALA 54.A N ALA 50.A O no hydrogen 2.858 N/A LEU 55.A N GLY 51.A O no hydrogen 3.313 N/A ALA 56.A N ALA 52.A O no hydrogen 3.049 N/A LEU 57.A N TRP 53.A O no hydrogen 2.867 N/A ALA 58.A N ALA 54.A O no hydrogen 3.221 N/A TYR 59.A N LEU 55.A O no hydrogen 2.884 N/A TYR 59.A OH LEU 7.A O no hydrogen 3.112 N/A ARG 60.A NE GLU 73.A OE2 no hydrogen 3.183 N/A ARG 60.A NH1 SER 146.A O no hydrogen 2.840 N/A ARG 60.A NH2 GLU 73.A OE2 no hydrogen 3.285 N/A ARG 60.A NH2 SER 146.A O no hydrogen 3.047 N/A ARG 61.A N ALA 58.A O no hydrogen 3.358 N/A ARG 61.A NH2 ASP 421.A OD2 no hydrogen 3.297 N/A ILE 62.A N TYR 59.A O no hydrogen 3.178 N/A LYS 66.A NZ ASP 64.A OD2 no hydrogen 3.451 N/A GLY 67.A N ASP 65.A OD1 no hydrogen 3.055 N/A ARG 68.A N ASP 65.A O no hydrogen 3.389 N/A ARG 68.A NE TYR 59.A OH no hydrogen 3.107 N/A ARG 68.A NH2 ASP 8.A OD1 no hydrogen 2.628 N/A THR 69.A OG1 TYR 59.A O no hydrogen 3.191 N/A THR 69.A OG1 ASP 65.A OD2 no hydrogen 2.757 N/A GLU 71.A N GLY 67.A O no hydrogen 3.086 N/A LEU 72.A N ARG 68.A O no hydrogen 3.067 N/A GLU 73.A N THR 69.A O no hydrogen 2.996 N/A HIS 74.A N HIS 70.A O no hydrogen 2.865 N/A SER 75.A N GLU 71.A O no hydrogen 2.839 N/A SER 75.A OG GLN 22.A OE1 no hydrogen 2.756 N/A ALA 76.A N LEU 72.A O no hydrogen 3.287 N/A ILE 77.A N GLU 73.A O no hydrogen 3.026 N/A LYS 78.A N HIS 74.A O no hydrogen 2.985 N/A LYS 78.A NZ PRO 24.A O no hydrogen 2.946 N/A LYS 78.A NZ THR 25.A O no hydrogen 3.492 N/A CYS 79.A N SER 75.A O no hydrogen 2.950 N/A CYS 79.A SG SER 45.A O no hydrogen 3.149 N/A MET 80.A N ALA 76.A O no hydrogen 2.995 N/A ARG 81.A N ILE 77.A O no hydrogen 2.696 N/A ARG 81.A NH1 ILE 150.A O no hydrogen 2.654 N/A ARG 81.A NH1 GLU 156.A OE1 no hydrogen 3.561 N/A ARG 81.A NH1 GLU 156.A OE2 no hydrogen 2.599 N/A ARG 81.A NH2 GLU 156.A OE1 no hydrogen 3.036 N/A GLY 82.A N CYS 79.A O no hydrogen 3.183 N/A ILE 83.A N CYS 79.A O no hydrogen 2.944 N/A LEU 84.A N MET 80.A O no hydrogen 3.398 N/A CYS 86.A N GLY 82.A O no hydrogen 3.040 N/A CYS 86.A SG GLY 82.A O no hydrogen 3.454 N/A CYS 86.A SG GLY 116.A O no hydrogen 3.658 N/A TYR 87.A N ILE 83.A O no hydrogen 2.930 N/A MET 88.A N LEU 84.A O no hydrogen 2.563 N/A ARG 89.A N TYR 85.A O no hydrogen 2.886 N/A ARG 89.A NH1 ASP 117.A OD1 no hydrogen 2.701 N/A ARG 89.A NH2 ASP 117.A OD1 no hydrogen 2.693 N/A GLN 90.A N CYS 86.A O no hydrogen 3.360 N/A GLN 90.A NE2 GLU 118.A OE2 no hydrogen 3.177 N/A GLN 95.A N ALA 91.A O no hydrogen 3.472 N/A GLN 96.A N ASP 92.A O no hydrogen 3.360 N/A PHE 97.A N LYS 93.A O no hydrogen 2.826 N/A LYS 98.A N VAL 94.A O no hydrogen 3.103 N/A LYS 98.A NZ GLN 95.A OE1 no hydrogen 3.250 N/A LYS 98.A NZ ASN 162.A OD1 no hydrogen 2.698 N/A LYS 98.A NZ SER 508.A OG no hydrogen 2.874 N/A LYS 98.A NZ GLY 509.A O no hydrogen 3.050 N/A GLN 99.A N GLN 95.A O no hydrogen 3.334 N/A ASP 100.A N GLN 96.A O no hydrogen 2.798 N/A ARG 102.A NE ASP 100.A OD2 no hydrogen 3.010 N/A ARG 102.A NH2 ASP 100.A OD2 no hydrogen 2.959 N/A THR 105.A N ARG 102.A O no hydrogen 3.308 N/A THR 105.A OG1 ASP 100.A O no hydrogen 2.937 N/A THR 105.A OG1 ARG 102.A O no hydrogen 3.242 N/A CYS 106.A SG PRO 103.A O no hydrogen 2.927 N/A HIS 108.A N GLN 90.A OE1 no hydrogen 2.982 N/A SER 109.A N HIS 127.A ND1 no hydrogen 2.950 N/A SER 109.A OG HIS 127.A O no hydrogen 2.931 N/A PHE 111.A N ALA 40.A O no hydrogen 3.013 N/A ASN 112.A N ASP 117.A O no hydrogen 2.785 N/A VAL 113.A N GLN 38.A O no hydrogen 2.880 N/A HIS 114.A N ASN 112.A OD1 no hydrogen 3.206 N/A HIS 114.A ND1 GLN 38.A OE1 no hydrogen 3.019 N/A GLY 116.A N ASN 112.A O no hydrogen 2.806 N/A ASP 117.A N THR 115.A OG1 no hydrogen 3.173 N/A SER 121.A OG GLU 123.A OE2 no hydrogen 3.437 N/A SER 121.A OG GLU 124.A OE2 no hydrogen 3.493 N/A TYR 122.A OH CYS 106.A O no hydrogen 2.607 N/A GLU 124.A N SER 121.A OG no hydrogen 3.231 N/A TYR 125.A N SER 121.A O no hydrogen 2.932 N/A TYR 125.A OH GLU 180.A OE1 no hydrogen 3.341 N/A HIS 127.A NE2 LEU 120.A O no hydrogen 2.673 N/A GLN 129.A N HIS 127.A O no hydrogen 2.886 N/A SER 134.A N ILE 130.A O no hydrogen 3.275 N/A SER 134.A OG ILE 130.A O no hydrogen 2.542 N/A LEU 135.A N ASN 131.A O no hydrogen 2.795 N/A TYR 136.A N ALA 132.A O no hydrogen 2.921 N/A TYR 136.A OH MET 80.A O no hydrogen 2.608 N/A LEU 137.A N VAL 133.A O no hydrogen 3.190 N/A LEU 138.A N SER 134.A O no hydrogen 3.020 N/A TYR 139.A N LEU 135.A O no hydrogen 2.969 N/A TYR 139.A OH TYR 260.A OH no hydrogen 2.511 N/A LEU 140.A N TYR 136.A O no hydrogen 2.793 N/A VAL 141.A N LEU 137.A O no hydrogen 3.170 N/A GLU 142.A N LEU 138.A O no hydrogen 2.987 N/A MET 143.A N TYR 139.A O no hydrogen 2.773 N/A ILE 144.A N LEU 140.A O no hydrogen 2.875 N/A SER 145.A N VAL 141.A O no hydrogen 3.020 N/A SER 145.A OG VAL 141.A O no hydrogen 2.598 N/A SER 146.A N MET 143.A O no hydrogen 3.082 N/A SER 146.A OG GLU 142.A O no hydrogen 3.414 N/A GLY 147.A N ILE 144.A O no hydrogen 3.390 N/A LEU 148.A N MET 143.A O no hydrogen 3.100 N/A TYR 152.A N GLU 156.A OE2 no hydrogen 3.120 N/A ASN 153.A ND2 ASP 155.A OD2 no hydrogen 3.100 N/A VAL 157.A N ASN 153.A O no hydrogen 3.399 N/A SER 158.A N THR 154.A O no hydrogen 2.908 N/A SER 158.A OG THR 154.A O no hydrogen 3.019 N/A PHE 159.A N ASP 155.A O no hydrogen 3.131 N/A ILE 160.A N GLU 156.A O no hydrogen 3.074 N/A GLN 161.A N VAL 157.A O no hydrogen 2.950 N/A GLN 161.A NE2 GLN 161.A O no hydrogen 3.636 N/A GLN 161.A NE2 PHE 224.A O no hydrogen 2.944 N/A ASN 162.A N SER 158.A O no hydrogen 3.025 N/A ASN 162.A ND2 SER 158.A O no hydrogen 2.793 N/A ASN 162.A ND2 GLY 500.A O no hydrogen 2.548 N/A LEU 163.A N PHE 159.A O no hydrogen 2.740 N/A VAL 164.A N ILE 160.A O no hydrogen 3.046 N/A PHE 165.A N GLN 161.A O no hydrogen 2.879 N/A CYS 166.A N ASN 162.A O no hydrogen 3.309 N/A CYS 166.A SG VAL 94.A O no hydrogen 3.827 N/A CYS 166.A SG ASN 162.A O no hydrogen 3.095 N/A VAL 167.A N LEU 163.A O no hydrogen 3.156 N/A GLU 168.A N VAL 164.A O no hydrogen 2.999 N/A TYR 171.A N ASN 233.A OD1 no hydrogen 3.227 N/A ARG 172.A N ARG 169.A O no hydrogen 3.226 N/A VAL 173.A N VAL 170.A O no hydrogen 2.987 N/A ASP 175.A N GLU 191.A O no hydrogen 3.199 N/A PHE 176.A N LEU 128.A O no hydrogen 2.836 N/A TRP 179.A NE1 ASP 251.A OD1 no hydrogen 2.714 N/A GLU 180.A N GLY 177.A O no hydrogen 2.989 N/A SER 183.A OG SER 247.A OG no hydrogen 2.796 N/A LYS 184.A NZ GLU 916.A OE1 no hydrogen 3.355 N/A TYR 185.A OH ASP 911.A O no hydrogen 3.192 N/A TYR 185.A OH GLU 916.A OE2 no hydrogen 2.717 N/A GLU 191.A N ASP 175.A O no hydrogen 2.945 N/A HIS 193.A ND1 ASP 175.A OD1 no hydrogen 3.161 N/A HIS 193.A NE2 GLY 182.A O no hydrogen 2.946 N/A SER 194.A N GLU 244.A O no hydrogen 2.894 N/A SER 194.A OG LEU 240.A O no hydrogen 2.655 N/A SER 194.A OG ARG 243.A O no hydrogen 2.877 N/A SER 194.A OG GLU 244.A O no hydrogen 3.037 N/A SER 195.A OG GLU 244.A OE2 no hydrogen 3.453 N/A SER 195.A OG ALA 253.A O no hydrogen 2.769 N/A SER 196.A OG ASP 175.A OD1 no hydrogen 3.479 N/A SER 196.A OG ASP 175.A OD2 no hydrogen 2.640 N/A VAL 197.A N HIS 193.A O no hydrogen 3.132 N/A GLY 198.A N SER 194.A O no hydrogen 2.740 N/A LEU 199.A N SER 195.A O no hydrogen 3.131 N/A ALA 200.A N SER 196.A O no hydrogen 3.159 N/A LYS 201.A N VAL 197.A O no hydrogen 2.936 N/A LYS 201.A NZ GLU 205.A OE1 no hydrogen 2.601 N/A LYS 201.A NZ GLU 205.A OE2 no hydrogen 3.376 N/A LYS 201.A NZ ALA 264.A O no hydrogen 3.051 N/A LYS 201.A NZ ASP 266.A OD2 no hydrogen 3.174 N/A ALA 202.A N GLY 198.A O no hydrogen 3.269 N/A ALA 203.A N LEU 199.A O no hydrogen 2.857 N/A LEU 204.A N ALA 200.A O no hydrogen 3.134 N/A GLU 205.A N LYS 201.A O no hydrogen 2.876 N/A ALA 206.A N ALA 202.A O no hydrogen 3.112 N/A ILE 207.A N ALA 203.A O no hydrogen 2.858 N/A ASN 208.A N LEU 204.A O no hydrogen 3.103 N/A GLY 209.A N ILE 223.A O no hydrogen 2.701 N/A ASN 211.A ND2 CYS 218.A O no hydrogen 2.887 N/A LEU 212.A N SER 221.A O no hydrogen 3.162 N/A LEU 212.A N SER 221.A OG no hydrogen 3.125 N/A GLY 214.A N ASN 211.A O no hydrogen 3.147 N/A CYS 218.A SG SER 219.A OG no hydrogen 3.508 N/A SER 221.A OG ASN 211.A OD1 no hydrogen 2.772 N/A ILE 223.A N PHE 210.A O no hydrogen 3.306 N/A PHE 224.A N GLN 161.A OE1 no hydrogen 3.271 N/A VAL 225.A N ASN 208.A OD1 no hydrogen 3.199 N/A ASP 226.A N GLU 168.A OE1 no hydrogen 3.248 N/A HIS 230.A N ASP 226.A O no hydrogen 2.946 N/A HIS 230.A NE2 GLU 205.A OE1 no hydrogen 2.896 N/A ASN 231.A N LEU 227.A O no hydrogen 3.076 N/A ARG 232.A N ASP 228.A O no hydrogen 3.137 N/A ARG 232.A N ALA 229.A O no hydrogen 3.053 N/A ARG 232.A NH1 THR 742.A OG1 no hydrogen 2.779 N/A ARG 232.A NH2 GLN 235.A OE1 no hydrogen 3.513 N/A ASN 233.A N ALA 229.A O no hydrogen 3.156 N/A ASN 233.A ND2 VAL 167.A O no hydrogen 3.682 N/A ASN 233.A ND2 GLU 168.A O no hydrogen 2.953 N/A ARG 234.A N HIS 230.A O no hydrogen 3.021 N/A ARG 234.A NH1 TYR 566.A O no hydrogen 3.057 N/A ARG 234.A NH2 MET 439.A O no hydrogen 2.996 N/A GLN 235.A N ASN 231.A O no hydrogen 2.764 N/A THR 236.A N ARG 232.A O no hydrogen 3.087 N/A THR 236.A OG1 ARG 232.A O no hydrogen 2.617 N/A LEU 237.A N ASN 233.A O no hydrogen 3.124 N/A CYS 238.A N ARG 234.A O no hydrogen 3.197 N/A CYS 238.A SG ARG 234.A O no hydrogen 3.611 N/A SER 239.A N THR 236.A O no hydrogen 3.293 N/A SER 239.A OG GLN 235.A O no hydrogen 2.867 N/A SER 239.A OG VAL 745.A O no hydrogen 3.435 N/A LEU 240.A N LEU 237.A O no hydrogen 3.373 N/A GLU 244.A N HIS 248.A O no hydrogen 3.065 N/A SER 245.A N HIS 248.A O no hydrogen 3.105 N/A SER 245.A OG GLU 191.A OE2 no hydrogen 2.773 N/A SER 245.A OG GLU 244.A OE1 no hydrogen 3.163 N/A ARG 246.A NH2 THR 190.A O no hydrogen 3.508 N/A SER 247.A OG SER 183.A OG no hydrogen 2.796 N/A SER 247.A OG GLU 191.A OE1 no hydrogen 2.548 N/A SER 247.A OG GLU 191.A OE2 no hydrogen 3.523 N/A HIS 248.A N SER 245.A OG no hydrogen 3.183 N/A HIS 248.A ND1 GLU 244.A OE1 no hydrogen 2.958 N/A ALA 252.A N ARG 290.A O no hydrogen 2.756 N/A ALA 253.A N ASP 251.A OD1 no hydrogen 2.998 N/A LEU 255.A N ALA 252.A O no hydrogen 3.123 N/A CYS 257.A SG SER 194.A O no hydrogen 4.050 N/A ILE 258.A N LEU 254.A O no hydrogen 2.779 N/A SER 259.A N LEU 255.A O no hydrogen 3.094 N/A SER 259.A OG ASP 333.A OD1 no hydrogen 2.779 N/A TYR 260.A OH TYR 139.A OH no hydrogen 2.511 N/A ALA 264.A N CYS 257.A O no hydrogen 3.225 N/A PHE 271.A N ASP 267.A O no hydrogen 3.009 N/A SER 272.A N GLU 268.A O no hydrogen 3.133 N/A SER 272.A OG GLU 268.A O no hydrogen 3.189 N/A GLN 273.A N VAL 269.A O no hydrogen 2.858 N/A THR 274.A N LEU 270.A O no hydrogen 2.762 N/A THR 274.A OG1 LEU 241.A O no hydrogen 2.244 N/A THR 274.A OG1 LEU 270.A O no hydrogen 2.681 N/A LEU 275.A N PHE 271.A O no hydrogen 2.769 N/A ASP 276.A N SER 272.A O no hydrogen 2.991 N/A LYS 277.A N GLN 273.A O no hydrogen 3.493 N/A VAL 278.A N THR 274.A O no hydrogen 3.148 N/A VAL 279.A N LEU 275.A O no hydrogen 2.777 N/A ARG 280.A N ASP 276.A O no hydrogen 2.883 N/A LYS 281.A N LYS 277.A O no hydrogen 2.870 N/A LYS 283.A N VAL 279.A O no hydrogen 3.063 N/A LYS 283.A NZ GLU 345.A OE1 no hydrogen 2.719 N/A TYR 286.A N GLU 322.A OE2 no hydrogen 3.017 N/A PHE 288.A N PHE 323.A O no hydrogen 3.172 N/A LYS 289.A N LEU 282.A O no hydrogen 2.702 N/A LYS 289.A NZ GLU 320.A OE2 no hydrogen 2.673 N/A ARG 290.A NH1 ASP 294.A OD1 no hydrogen 2.924 N/A ARG 293.A N GLU 320.A OE1 no hydrogen 2.547 N/A ARG 293.A NH1 LEU 909.A O no hydrogen 3.032 N/A ARG 297.A NH1 GLU 301.A OE2 no hydrogen 3.190 N/A THR 298.A N GLY 295.A O no hydrogen 3.450 N/A THR 298.A OG1 GLY 295.A O no hydrogen 3.041 N/A SER 299.A OG VAL 370.A O no hydrogen 2.598 N/A GLU 301.A N THR 298.A O no hydrogen 3.277 N/A ARG 305.A N ASP 302.A OD2 no hydrogen 2.966 N/A TYR 308.A OH GLU 301.A OE2 no hydrogen 2.614 N/A LYS 309.A N GLU 312.A OE2 no hydrogen 3.085 N/A ALA 311.A N ASP 911.A OD1 no hydrogen 2.928 N/A GLU 312.A N LYS 309.A O no hydrogen 3.023 N/A LYS 314.A N ALA 311.A O no hydrogen 3.266 N/A LYS 314.A NZ ASP 317.A OD2 no hydrogen 3.026 N/A LEU 315.A N GLU 312.A O no hydrogen 2.693 N/A PHE 316.A N ILE 313.A O no hydrogen 3.311 N/A ASP 317.A N LYS 314.A O no hydrogen 3.160 N/A GLY 318.A N GLU 320.A OE2 no hydrogen 3.238 N/A CYS 321.A SG TYR 296.A O no hydrogen 2.833 N/A CYS 321.A SG ARG 297.A O no hydrogen 3.335 N/A GLU 322.A N TYR 368.A O no hydrogen 3.404 N/A PHE 323.A N PHE 288.A O no hydrogen 2.959 N/A PHE 326.A N PHE 323.A O no hydrogen 3.263 N/A PHE 327.A N PRO 324.A O no hydrogen 3.065 N/A TYR 329.A N ILE 325.A O no hydrogen 3.061 N/A MET 330.A N PHE 326.A O no hydrogen 3.096 N/A MET 331.A N PHE 327.A O no hydrogen 3.128 N/A ILE 332.A N LEU 328.A O no hydrogen 2.998 N/A ASP 333.A N TYR 329.A O no hydrogen 2.847 N/A GLY 334.A N MET 330.A O no hydrogen 3.102 N/A VAL 335.A N MET 331.A O no hydrogen 3.161 N/A PHE 336.A N ILE 332.A O no hydrogen 3.081 N/A ARG 337.A N ASP 333.A O no hydrogen 2.847 N/A ARG 337.A NE ASP 333.A OD1 no hydrogen 2.871 N/A ARG 337.A NH2 ILE 258.A O no hydrogen 3.141 N/A ASN 339.A N GLY 334.A O no hydrogen 2.916 N/A ASN 339.A ND2 ARG 337.A O no hydrogen 3.672 N/A GLN 342.A N ASN 339.A O no hydrogen 3.337 N/A GLN 342.A NE2 ASP 333.A OD2 no hydrogen 2.981 N/A GLU 345.A N LYS 341.A O no hydrogen 3.362 N/A TYR 346.A N GLN 342.A O no hydrogen 3.255 N/A GLN 347.A N VAL 343.A O no hydrogen 2.747 N/A GLN 347.A NE2 GLN 347.A O no hydrogen 3.063 N/A GLN 347.A NE2 THR 351.A OG1 no hydrogen 3.253 N/A ASP 348.A N GLN 344.A O no hydrogen 2.852 N/A LEU 349.A N GLU 345.A O no hydrogen 3.277 N/A LEU 350.A N TYR 346.A O no hydrogen 3.288 N/A LEU 350.A N GLN 347.A O no hydrogen 2.978 N/A THR 351.A N GLN 347.A O no hydrogen 2.959 N/A THR 351.A OG1 GLN 347.A O no hydrogen 3.268 N/A VAL 353.A N LEU 350.A O no hydrogen 3.080 N/A HIS 355.A N VAL 363.A O no hydrogen 2.990 N/A THR 357.A N TYR 361.A O no hydrogen 2.933 N/A THR 357.A OG1 TYR 361.A O no hydrogen 2.986 N/A GLY 360.A N THR 357.A O no hydrogen 2.964 N/A TYR 361.A N THR 357.A OG1 no hydrogen 2.905 N/A VAL 363.A N HIS 355.A O no hydrogen 2.754 N/A LYS 366.A NZ TYR 296.A OH no hydrogen 2.948 N/A TYR 367.A N SER 390.A OG no hydrogen 3.016 N/A TYR 368.A N GLU 322.A O no hydrogen 2.929 N/A TYR 368.A OH VAL 353.A O no hydrogen 2.400 N/A TYR 368.A OH HIS 355.A NE2 no hydrogen 3.071 N/A TYR 369.A N PHE 388.A O no hydrogen 3.156 N/A PHE 374.A N PRO 371.A O no hydrogen 2.949 N/A VAL 375.A N ALA 372.A O no hydrogen 3.274 N/A GLU 378.A N PHE 374.A O no hydrogen 3.218 N/A LYS 379.A N VAL 375.A O no hydrogen 2.965 N/A LYS 379.A NZ LEU 315.A O no hydrogen 3.035 N/A ASN 380.A N GLU 376.A O no hydrogen 2.888 N/A ASN 381.A N TYR 377.A O no hydrogen 3.013 N/A GLY 383.A N GLU 378.A OE2 no hydrogen 2.681 N/A SER 384.A N ASN 381.A O no hydrogen 3.207 N/A SER 384.A OG ASN 381.A O no hydrogen 2.721 N/A GLN 385.A NE2 SER 384.A OG no hydrogen 3.371 N/A ARG 387.A NH1 GLU 320.A O no hydrogen 2.852 N/A ARG 387.A NH1 TYR 368.A O no hydrogen 2.902 N/A ARG 387.A NH2 GLU 320.A O no hydrogen 2.859 N/A PHE 388.A N TYR 369.A O no hydrogen 2.988 N/A SER 390.A OG TYR 367.A O no hydrogen 2.889 N/A CYS 392.A N ASP 395.A OD2 no hydrogen 3.360 N/A GLY 396.A N GLY 393.A O no hydrogen 2.838 N/A LEU 398.A N THR 33.A OG1 no hydrogen 3.023 N/A TRP 401.A NE1 TYR 329.A OH no hydrogen 3.054 N/A GLN 403.A N PHE 399.A O no hydrogen 2.906 N/A ALA 404.A N LEU 400.A O no hydrogen 3.070 N/A LEU 405.A N TRP 401.A O no hydrogen 3.060 N/A TYR 406.A N GLY 402.A O no hydrogen 2.988 N/A ILE 407.A N GLN 403.A O no hydrogen 3.342 N/A ILE 408.A N ALA 404.A O no hydrogen 3.053 N/A ALA 409.A N LEU 405.A O no hydrogen 2.886 N/A LYS 410.A N TYR 406.A O no hydrogen 2.772 N/A LYS 410.A NZ GLN 347.A OE1 no hydrogen 3.462 N/A LEU 411.A N ILE 407.A O no hydrogen 3.012 N/A LEU 412.A N ILE 408.A O no hydrogen 2.947 N/A ALA 413.A N ALA 409.A O no hydrogen 2.858 N/A ASP 414.A N LYS 410.A O no hydrogen 2.916 N/A GLU 415.A N LEU 412.A O no hydrogen 3.112 N/A LEU 416.A N LEU 411.A O no hydrogen 2.828 N/A ASP 421.A N SER 418.A O no hydrogen 2.996 N/A ILE 422.A N SER 418.A O no hydrogen 3.369 N/A ARG 427.A N VAL 425.A O no hydrogen 2.891 N/A ARG 427.A NE ALA 262.A O no hydrogen 2.643 N/A ARG 427.A NH1 GLU 205.A OE2 no hydrogen 2.745 N/A ARG 427.A NH2 GLU 205.A OE2 no hydrogen 2.932 N/A ARG 427.A NH2 ALA 262.A O no hydrogen 3.235 N/A TYR 428.A N ASP 423.A OD2 no hydrogen 2.692 N/A LYS 432.A NZ ASP 433.A OD1 no hydrogen 3.220 N/A LYS 432.A NZ ASP 433.A OD2 no hydrogen 3.087 N/A ASP 433.A N PRO 430.A O no hydrogen 2.814 N/A GLN 434.A N LEU 431.A O no hydrogen 2.988 N/A GLN 434.A NE2 VAL 429.A O no hydrogen 3.232 N/A ARG 435.A N ASP 433.A O no hydrogen 2.883 N/A MET 439.A N LYS 568.A O no hydrogen 3.284 N/A ARG 440.A N VAL 437.A O no hydrogen 3.230 N/A ARG 440.A NE ASP 266.A OD1 no hydrogen 3.389 N/A ARG 440.A NH1 ARG 427.A O no hydrogen 2.933 N/A ARG 440.A NH2 ASP 266.A OD1 no hydrogen 3.142 N/A ARG 440.A NH2 ARG 427.A O no hydrogen 3.173 N/A PHE 441.A N VAL 437.A O no hydrogen 2.789 N/A GLN 444.A NE2 ASP 450.A O no hydrogen 2.413 N/A GLY 445.A N SER 442.A O no hydrogen 2.638 N/A LEU 451.A N ASN 449.A O no hydrogen 2.839 N/A VAL 453.A N LYS 608.A O no hydrogen 3.055 N/A HIS 454.A N PRO 573.A O no hydrogen 2.795 N/A ALA 456.A N PHE 575.A O no hydrogen 2.965 N/A ILE 458.A N VAL 577.A O no hydrogen 3.474 N/A ALA 459.A N GLN 476.A O no hydrogen 3.017 N/A GLU 460.A N ILE 579.A O no hydrogen 2.867 N/A SER 461.A OG GLU 581.A OE1 no hydrogen 2.233 N/A GLN 462.A N GLU 645.A OE2 no hydrogen 2.953 N/A LEU 464.A N SER 461.A OG no hydrogen 2.961 N/A GLN 465.A N SER 461.A O no hydrogen 3.028 N/A GLN 465.A NE2 THR 475.A O no hydrogen 2.784 N/A GLN 465.A NE2 GLN 480.A OE1 no hydrogen 2.806 N/A VAL 466.A N GLN 462.A O no hydrogen 2.928 N/A PHE 467.A N ARG 463.A O no hydrogen 2.899 N/A LEU 468.A N LEU 464.A O no hydrogen 2.739 N/A ASN 469.A N GLN 465.A O no hydrogen 2.935 N/A THR 470.A N VAL 466.A O no hydrogen 3.275 N/A THR 470.A OG1 PHE 467.A O no hydrogen 2.632 N/A TYR 471.A N PHE 467.A O no hydrogen 3.405 N/A TYR 471.A N LEU 468.A O no hydrogen 3.151 N/A GLY 472.A N ASN 469.A O no hydrogen 2.909 N/A ILE 473.A N LEU 468.A O no hydrogen 2.920 N/A GLN 476.A N LEU 457.A O no hydrogen 3.052 N/A GLN 476.A NE2 GLN 615.A OE1 no hydrogen 2.825 N/A THR 477.A OG1 GLU 645.A OE1 no hydrogen 3.155 N/A GLN 479.A NE2 GLU 647.A OE2 no hydrogen 2.980 N/A GLN 480.A N THR 477.A O no hydrogen 3.273 N/A GLN 480.A NE2 GLN 462.A OE1 no hydrogen 3.622 N/A GLN 480.A NE2 GLN 465.A OE1 no hydrogen 2.679 N/A GLN 485.A N THR 530.A O no hydrogen 2.773 N/A TRP 487.A N VAL 532.A O no hydrogen 3.032 N/A TRP 487.A NE1 GLN 485.A OE1 no hydrogen 3.304 N/A GLN 490.A NE2 ASP 539.A OD2 no hydrogen 2.957 N/A GLU 491.A N PRO 488.A O no hydrogen 3.096 N/A LEU 492.A N GLN 489.A O no hydrogen 2.863 N/A VAL 493.A N GLN 489.A O no hydrogen 3.125 N/A LYS 494.A N GLN 490.A O no hydrogen 3.084 N/A LYS 494.A NZ GLU 491.A OE1 no hydrogen 3.188 N/A LYS 494.A NZ GLU 491.A OE2 no hydrogen 2.986 N/A ALA 495.A N GLU 491.A O no hydrogen 3.248 N/A TYR 496.A N LEU 492.A O no hydrogen 2.847 N/A TYR 496.A OH GLU 624.A OE2 no hydrogen 2.737 N/A LEU 497.A N LYS 494.A O no hydrogen 3.259 N/A GLN 498.A N ALA 495.A O no hydrogen 3.199 N/A LEU 499.A N TYR 496.A O no hydrogen 2.859 N/A ASN 502.A ND2 ASP 155.A OD1 no hydrogen 2.798 N/A SER 508.A OG GLN 95.A OE1 no hydrogen 2.804 N/A ARG 510.A N TYR 496.A O no hydrogen 3.406 N/A ARG 510.A NH2 ASP 226.A OD2 no hydrogen 3.221 N/A ARG 513.A N PRO 511.A O no hydrogen 2.974 N/A ARG 513.A NH1 GLU 168.A OE2 no hydrogen 3.449 N/A ARG 513.A NH2 GLU 168.A OE2 no hydrogen 3.093 N/A GLY 516.A N ASP 228.A OD2 no hydrogen 3.303 N/A LEU 518.A N ASP 228.A OD1 no hydrogen 2.889 N/A THR 520.A N GLY 516.A O no hydrogen 3.082 N/A THR 520.A OG1 GLY 516.A O no hydrogen 2.644 N/A SER 521.A OG CYS 517.A O no hydrogen 2.693 N/A LYS 522.A NZ GLU 624.A OE1 no hydrogen 2.782 N/A TYR 524.A N VAL 531.A O no hydrogen 2.795 N/A TYR 524.A OH GLY 519.A O no hydrogen 2.473 N/A ARG 525.A N GLU 624.A O no hydrogen 2.768 N/A ILE 526.A N LYS 529.A O no hydrogen 3.025 N/A VAL 531.A N TYR 524.A O no hydrogen 2.666 N/A VAL 532.A N GLN 485.A O no hydrogen 2.971 N/A CYS 533.A SG TRP 487.A O no hydrogen 3.741 N/A CYS 533.A SG PRO 488.A O no hydrogen 3.994 N/A TYR 534.A N TRP 487.A O no hydrogen 3.276 N/A PHE 538.A N PRO 535.A O no hydrogen 3.305 N/A ASP 539.A N ILE 536.A O no hydrogen 3.273 N/A TYR 544.A OH VAL 788.A O no hydrogen 2.936 N/A TYR 544.A OH GLU 792.A OE1 no hydrogen 2.409 N/A SER 546.A N PHE 543.A O no hydrogen 3.496 N/A SER 546.A OG PHE 543.A O no hydrogen 3.155 N/A SER 546.A OG GLN 547.A OE1 no hydrogen 2.916 N/A GLN 547.A N TYR 544.A O no hydrogen 3.268 N/A ASP 548.A N MET 545.A O no hydrogen 3.258 N/A LEU 552.A N ASP 548.A O no hydrogen 3.231 N/A ILE 553.A N VAL 549.A O no hydrogen 2.872 N/A ASP 554.A N PHE 550.A O no hydrogen 3.022 N/A ASP 555.A N LEU 551.A O no hydrogen 2.663 N/A ILE 556.A N LEU 552.A O no hydrogen 2.840 N/A LYS 557.A N ILE 553.A O no hydrogen 3.030 N/A ASN 558.A N ASP 554.A O no hydrogen 2.649 N/A ALA 559.A N ASP 555.A O no hydrogen 2.795 N/A LEU 560.A N ILE 556.A O no hydrogen 3.161 N/A GLN 561.A N LYS 557.A O no hydrogen 3.048 N/A GLN 561.A NE2 LYS 557.A O no hydrogen 3.171 N/A PHE 562.A N ASN 558.A O no hydrogen 3.035 N/A ILE 563.A N ALA 559.A O no hydrogen 2.945 N/A LYS 564.A N LEU 560.A O no hydrogen 2.961 N/A LYS 564.A NZ GLY 606.A O no hydrogen 2.832 N/A GLN 565.A N GLN 561.A O no hydrogen 3.048 N/A GLN 565.A NE2 SER 802.A O no hydrogen 3.445 N/A TYR 566.A N PHE 562.A O no hydrogen 2.889 N/A TYR 566.A OH SER 802.A O no hydrogen 3.388 N/A TRP 567.A N ILE 563.A O no hydrogen 3.073 N/A TRP 567.A NE1 GLY 571.A O no hydrogen 2.791 N/A ARG 572.A NH1 HIS 454.A NE2 no hydrogen 3.380 N/A LEU 574.A N SER 521.A O no hydrogen 3.096 N/A VAL 577.A N ALA 456.A O no hydrogen 3.050 N/A ILE 579.A N ILE 458.A O no hydrogen 2.869 N/A ARG 580.A N ASN 583.A OD1 no hydrogen 3.333 N/A ARG 580.A NH2 TYR 534.A OH no hydrogen 3.529 N/A ARG 580.A NH2 PHE 538.A O no hydrogen 2.828 N/A GLU 581.A N GLU 460.A OE1 no hydrogen 3.178 N/A ASN 583.A N ARG 580.A O no hydrogen 2.814 N/A ILE 584.A N GLU 581.A O no hydrogen 3.398 N/A ARG 585.A N ASP 582.A O no hydrogen 3.293 N/A ARG 585.A NH2 SER 715.A O no hydrogen 3.420 N/A ARG 588.A N ARG 585.A O no hydrogen 3.304 N/A ARG 588.A NH1 ASP 582.A O no hydrogen 2.635 N/A PHE 589.A N GLY 586.A O no hydrogen 3.332 N/A ILE 592.A N ARG 588.A O no hydrogen 3.098 N/A LEU 593.A N PHE 589.A O no hydrogen 2.922 N/A ASP 594.A N ASN 590.A O no hydrogen 3.298 N/A MET 595.A N PRO 591.A O no hydrogen 3.242 N/A LEU 596.A N ILE 592.A O no hydrogen 2.857 N/A ALA 597.A N LEU 593.A O no hydrogen 2.739 N/A ALA 598.A N ASP 594.A O no hydrogen 2.976 N/A LEU 599.A N MET 595.A O no hydrogen 2.866 N/A LYS 600.A N LEU 596.A O no hydrogen 3.034 N/A LYS 600.A NZ GLY 472.A O no hydrogen 2.866 N/A LYS 601.A N ALA 597.A O no hydrogen 2.907 N/A GLY 602.A N ALA 598.A O no hydrogen 2.982 N/A ILE 603.A N ALA 598.A O no hydrogen 3.169 N/A ILE 604.A N VAL 607.A O no hydrogen 3.017 N/A VAL 609.A N GLY 602.A O no hydrogen 3.223 N/A HIS 610.A N VAL 453.A O no hydrogen 3.090 N/A ASP 612.A N VAL 455.A O no hydrogen 3.341 N/A LEU 614.A N GLN 476.A OE1 no hydrogen 2.957 N/A LEU 617.A N ARG 613.A O no hydrogen 3.045 N/A ILE 618.A N LEU 614.A O no hydrogen 2.795 N/A GLU 624.A N ILE 523.A O no hydrogen 2.945 N/A LEU 626.A N ARG 525.A O no hydrogen 3.003 N/A SER 632.A OG ILE 631.A O no hydrogen 2.602 N/A THR 634.A OG1 ILE 631.A O no hydrogen 3.409 N/A THR 634.A OG1 GLU 636.A O no hydrogen 2.936 N/A LYS 641.A N GLU 491.A OE2 no hydrogen 3.146 N/A PHE 643.A N ILE 486.A O no hydrogen 2.548 N/A LEU 646.A N GLU 460.A O no hydrogen 3.274 N/A GLU 647.A N GLU 645.A O no hydrogen 2.813 N/A TRP 659.A N ILE 656.A O no hydrogen 3.033 N/A LYS 660.A N SER 657.A O no hydrogen 3.346 N/A ASP 661.A N SER 657.A O no hydrogen 3.290 N/A ILE 667.A N THR 664.A O no hydrogen 3.092 N/A LYS 670.A N GLU 666.A O no hydrogen 2.685 N/A LEU 671.A N ILE 667.A O no hydrogen 2.968 N/A ASN 672.A N GLN 669.A O no hydrogen 3.106 N/A ASP 673.A N LYS 670.A O no hydrogen 2.464 N/A CYS 674.A SG LYS 670.A O no hydrogen 3.139 N/A GLN 680.A N CYS 676.A O no hydrogen 2.792 N/A ALA 681.A N LEU 677.A O no hydrogen 3.164 N/A ILE 682.A N ALA 678.A O no hydrogen 2.971 N/A LEU 683.A N SER 679.A O no hydrogen 2.712 N/A LEU 684.A N GLN 680.A O no hydrogen 2.554 N/A GLY 685.A N ILE 682.A O no hydrogen 3.404 N/A ILE 686.A N ILE 682.A O no hydrogen 3.033 N/A LYS 689.A N ILE 686.A O no hydrogen 3.171 N/A LYS 689.A NZ GLY 685.A O no hydrogen 2.973 N/A ARG 690.A N ILE 686.A O no hydrogen 3.161 N/A ARG 690.A NH1 LYS 660.A O no hydrogen 3.160 N/A ARG 690.A NH2 LYS 660.A O no hydrogen 3.272 N/A GLU 691.A N LEU 687.A O no hydrogen 3.263 N/A GLY 692.A N LEU 687.A O no hydrogen 3.151 N/A PHE 695.A N GLY 692.A O no hydrogen 3.433 N/A THR 697.A N GLY 700.A O no hydrogen 2.865 N/A THR 697.A OG1 PHE 695.A O no hydrogen 3.470 N/A THR 697.A OG1 GLY 700.A O no hydrogen 2.609 N/A THR 701.A OG1 ASP 704.A OD1 no hydrogen 2.511 N/A SER 703.A N PRO 693.A O no hydrogen 3.332 N/A ASP 704.A N THR 701.A O no hydrogen 2.841 N/A HIS 705.A N THR 701.A O no hydrogen 3.291 N/A ILE 706.A N VAL 702.A O no hydrogen 3.015 N/A GLU 707.A N SER 703.A O no hydrogen 3.385 N/A ARG 708.A N ASP 704.A O no hydrogen 2.770 N/A VAL 709.A N HIS 705.A O no hydrogen 2.866 N/A TYR 710.A N ILE 706.A O no hydrogen 2.719 N/A TYR 710.A OH ASP 542.A O no hydrogen 2.606 N/A ARG 711.A N GLU 707.A O no hydrogen 3.299 N/A ARG 711.A NE GLU 707.A O no hydrogen 3.406 N/A ARG 712.A N ARG 708.A O no hydrogen 2.755 N/A ALA 713.A N VAL 709.A O no hydrogen 3.101 N/A GLY 714.A N TYR 710.A O no hydrogen 2.928 N/A SER 715.A N ARG 711.A O no hydrogen 3.353 N/A GLN 716.A N ARG 712.A O no hydrogen 3.075 N/A LYS 717.A N GLY 714.A O no hydrogen 3.375 N/A LYS 717.A NZ GLN 547.A O no hydrogen 2.905 N/A LYS 717.A NZ ASP 548.A OD1 no hydrogen 3.515 N/A LEU 718.A N ALA 713.A O no hydrogen 2.764 N/A ALA 721.A N LEU 718.A O no hydrogen 3.208 N/A VAL 722.A N LEU 718.A O no hydrogen 3.368 N/A ARG 723.A N LEU 720.A O no hydrogen 3.329 N/A ARG 723.A NH1 LEU 842.A O no hydrogen 2.689 N/A TYR 724.A N LEU 720.A O no hydrogen 2.942 N/A GLY 725.A N ALA 721.A O no hydrogen 2.656 N/A ALA 726.A N VAL 722.A O no hydrogen 3.125 N/A ALA 727.A N ARG 723.A O no hydrogen 3.118 N/A PHE 728.A N TYR 724.A O no hydrogen 2.918 N/A THR 729.A N GLY 725.A O no hydrogen 3.127 N/A THR 729.A OG1 GLY 725.A O no hydrogen 2.466 N/A GLN 730.A N ALA 727.A O no hydrogen 2.632 N/A GLN 730.A NE2 GLU 784.A OE2 no hydrogen 2.758 N/A LYS 731.A N ALA 726.A O no hydrogen 2.642 N/A SER 733.A OG SER 735.A OG no hydrogen 2.756 N/A SER 735.A N SER 733.A OG no hydrogen 3.265 N/A SER 735.A OG SER 733.A OG no hydrogen 2.756 N/A ILE 736.A N SER 733.A O no hydrogen 3.423 N/A HIS 739.A N SER 735.A O no hydrogen 3.036 N/A ILE 740.A N ILE 736.A O no hydrogen 3.082 N/A THR 741.A OG1 ALA 737.A O no hydrogen 3.363 N/A THR 742.A N HIS 739.A O no hydrogen 2.708 N/A PHE 743.A N HIS 739.A O no hydrogen 3.329 N/A LEU 744.A N ILE 740.A O no hydrogen 3.329 N/A VAL 745.A N THR 741.A O no hydrogen 2.725 N/A HIS 746.A N THR 742.A O no hydrogen 3.171 N/A HIS 746.A N PHE 743.A O no hydrogen 3.285 N/A HIS 746.A ND1 THR 742.A O no hydrogen 2.740 N/A GLY 747.A N LEU 744.A O no hydrogen 3.279 N/A LYS 748.A N PHE 743.A O no hydrogen 2.834 N/A GLN 749.A N LEU 812.A O no hydrogen 2.947 N/A THR 751.A N ILE 814.A O no hydrogen 3.092 N/A THR 751.A OG1 ILE 814.A O no hydrogen 3.531 N/A LEU 752.A N GLU 760.A O no hydrogen 3.159 N/A GLY 753.A N GLN 790.A OE1 no hydrogen 3.028 N/A GLU 758.A N GLU 758.A OE1 no hydrogen 2.822 N/A GLU 760.A N LEU 752.A O no hydrogen 2.911 N/A ILE 762.A N VAL 750.A O no hydrogen 2.735 N/A VAL 770.A N SER 767.A OG no hydrogen 2.887 N/A ILE 771.A N SER 767.A O no hydrogen 3.047 N/A GLN 772.A N PRO 768.A O no hydrogen 3.011 N/A ASN 773.A N ARG 769.A O no hydrogen 3.460 N/A ILE 774.A N VAL 770.A O no hydrogen 3.194 N/A ILE 775.A N ILE 771.A O no hydrogen 3.123 N/A ILE 775.A N GLN 772.A O no hydrogen 3.231 N/A TYR 776.A N GLN 772.A O no hydrogen 3.073 N/A TYR 776.A OH LYS 731.A O no hydrogen 2.859 N/A TYR 777.A N ASN 773.A O no hydrogen 2.921 N/A LYS 778.A N ASN 773.A O no hydrogen 3.015 N/A CYS 779.A N ILE 774.A O no hydrogen 3.012 N/A CYS 779.A SG ILE 774.A O no hydrogen 2.928 N/A CYS 779.A SG ILE 775.A O no hydrogen 3.586 N/A CYS 779.A SG ASN 780.A OD1 no hydrogen 3.213 N/A ARG 785.A N ASP 783.A OD1 no hydrogen 3.349 N/A ALA 787.A N GLU 784.A O no hydrogen 3.173 N/A ILE 789.A N ARG 785.A O no hydrogen 3.388 N/A GLN 790.A N GLU 786.A O no hydrogen 2.904 N/A GLN 790.A NE2 GLU 786.A OE1 no hydrogen 3.529 N/A GLN 791.A N ALA 787.A O no hydrogen 3.038 N/A GLN 791.A NE2 LYS 731.A O no hydrogen 3.359 N/A GLU 792.A N VAL 788.A O no hydrogen 2.936 N/A LEU 793.A N ILE 789.A O no hydrogen 3.082 N/A VAL 794.A N GLN 790.A O no hydrogen 3.139 N/A ILE 795.A N GLN 791.A O no hydrogen 3.377 N/A HIS 796.A N GLU 792.A O no hydrogen 3.164 N/A ILE 797.A N LEU 793.A O no hydrogen 2.778 N/A GLY 798.A N VAL 794.A O no hydrogen 2.928 N/A TRP 799.A N ILE 795.A O no hydrogen 3.377 N/A ILE 800.A N HIS 796.A O no hydrogen 3.151 N/A ILE 801.A N ILE 797.A O no hydrogen 2.734 N/A SER 802.A N GLY 798.A O no hydrogen 3.208 N/A SER 802.A OG GLY 798.A O no hydrogen 3.501 N/A SER 802.A OG TRP 799.A O no hydrogen 2.462 N/A ASN 803.A N TRP 799.A O no hydrogen 2.944 N/A ASN 803.A ND2 ASN 558.A O no hydrogen 2.789 N/A ASN 803.A ND2 ASN 558.A OD1 no hydrogen 3.492 N/A ASN 804.A N ILE 800.A O no hydrogen 2.900 N/A LEU 807.A N ASN 804.A O no hydrogen 3.249 N/A ILE 814.A N GLN 749.A O no hydrogen 2.892 N/A ARG 815.A NE GLU 759.A OE2 no hydrogen 3.523 N/A ARG 815.A NH2 GLY 928.A O no hydrogen 3.473 N/A ILE 816.A N THR 751.A O no hydrogen 3.163 N/A ILE 819.A N ARG 815.A O no hydrogen 2.821 N/A ILE 820.A N ILE 816.A O no hydrogen 2.972 N/A HIS 821.A N GLY 817.A O no hydrogen 3.142 N/A ALA 822.A N TRP 818.A O no hydrogen 2.983 N/A MET 823.A N ILE 819.A O no hydrogen 3.164 N/A GLU 824.A N ILE 820.A O no hydrogen 2.893 N/A TYR 825.A N HIS 821.A O no hydrogen 3.005 N/A TYR 825.A OH ASN 866.A OD1 no hydrogen 2.812 N/A GLU 826.A N ALA 822.A O no hydrogen 2.861 N/A LEU 827.A N MET 823.A O no hydrogen 2.990 N/A GLN 828.A N GLU 824.A O no hydrogen 3.165 N/A ILE 829.A N TYR 825.A O no hydrogen 2.834 N/A ARG 830.A N GLU 826.A O no hydrogen 2.797 N/A ARG 830.A NE GLU 826.A OE1 no hydrogen 3.288 N/A ARG 830.A NH2 GLU 826.A OE1 no hydrogen 3.173 N/A ARG 830.A NH2 ASP 853.A OD2 no hydrogen 3.222 N/A GLY 831.A N LEU 827.A O no hydrogen 2.683 N/A GLY 832.A N GLN 828.A O no hydrogen 3.200 N/A TYR 840.A OH GLU 824.A OE2 no hydrogen 2.920 N/A LEU 842.A N ASP 838.A O no hydrogen 3.288 N/A LEU 842.A N LEU 839.A O no hydrogen 3.097 N/A SER 843.A N GLU 846.A OE2 no hydrogen 3.110 N/A SER 843.A OG ASP 548.A OD2 no hydrogen 3.034 N/A SER 845.A N ASP 548.A OD2 no hydrogen 3.163 N/A SER 845.A OG ASP 548.A OD2 no hydrogen 2.598 N/A GLU 846.A N SER 843.A OG no hydrogen 2.947 N/A VAL 847.A N SER 843.A O no hydrogen 2.945 N/A LYS 848.A N PRO 844.A O no hydrogen 3.064 N/A GLN 849.A N SER 845.A O no hydrogen 2.922 N/A LEU 850.A N GLU 846.A O no hydrogen 2.899 N/A LEU 851.A N VAL 847.A O no hydrogen 3.108 N/A LEU 852.A N LYS 848.A O no hydrogen 2.871 N/A ASP 853.A N GLN 849.A O no hydrogen 2.856 N/A ILE 854.A N LEU 850.A O no hydrogen 2.961 N/A LEU 855.A N LEU 851.A O no hydrogen 3.006 N/A GLN 856.A N ASP 853.A O no hydrogen 3.158 N/A ARG 867.A N CYS 863.A O no hydrogen 2.962 N/A ARG 868.A NE GLU 941.A OE1 no hydrogen 3.320 N/A ARG 868.A NH1 THR 997.A O no hydrogen 3.028 N/A ARG 868.A NH2 GLU 941.A OE1 no hydrogen 3.472 N/A ARG 868.A NH2 THR 1005.A OG1 no hydrogen 2.939 N/A GLN 869.A N LEU 865.A O no hydrogen 2.997 N/A ILE 870.A N ASN 866.A O no hydrogen 3.110 N/A ASP 871.A N ARG 867.A O no hydrogen 2.949 N/A GLY 872.A N ARG 868.A O no hydrogen 2.740 N/A SER 873.A N GLN 869.A O no hydrogen 2.981 N/A SER 873.A OG GLN 869.A O no hydrogen 2.548 N/A SER 873.A OG ILE 870.A O no hydrogen 2.874 N/A LEU 874.A N ILE 870.A O no hydrogen 2.894 N/A ASN 875.A N GLY 872.A O no hydrogen 2.992 N/A ARG 876.A N ASP 871.A O no hydrogen 2.973 N/A ARG 876.A NE ASP 871.A OD1 no hydrogen 3.017 N/A ARG 876.A NH1 LEU 855.A O no hydrogen 3.213 N/A ARG 876.A NH2 ILE 854.A O no hydrogen 3.451 N/A ARG 876.A NH2 ASP 871.A OD1 no hydrogen 3.389 N/A THR 877.A N GLY 810.A O no hydrogen 2.961 N/A THR 877.A OG1 GLY 810.A O no hydrogen 3.278 N/A ARG 884.A N GLY 880.A O no hydrogen 3.014 N/A ARG 884.A NE SER 947.A OG no hydrogen 2.827 N/A VAL 885.A N PHE 881.A O no hydrogen 2.894 N/A TRP 886.A N TYR 882.A O no hydrogen 3.182 N/A GLN 887.A N ASP 883.A O no hydrogen 3.203 N/A ILE 888.A N ARG 884.A O no hydrogen 3.048 N/A LEU 889.A N VAL 885.A O no hydrogen 3.021 N/A GLU 890.A N TRP 886.A O no hydrogen 2.746 N/A ARG 891.A N GLN 887.A O no hydrogen 3.289 N/A ARG 891.A NH2 ASN 953.A O no hydrogen 3.385 N/A ARG 891.A NH2 LEU 956.A O no hydrogen 2.593 N/A THR 892.A N LEU 889.A O no hydrogen 3.202 N/A THR 892.A OG1 ILE 888.A O no hydrogen 2.707 N/A ILE 896.A N LEU 903.A O no hydrogen 3.178 N/A ILE 897.A N VAL 962.A O no hydrogen 2.853 N/A VAL 898.A N LYS 901.A O no hydrogen 3.178 N/A ALA 899.A N ASP 965.A OD2 no hydrogen 2.772 N/A LYS 901.A N VAL 898.A O no hydrogen 2.950 N/A LYS 901.A NZ ASP 925.A O no hydrogen 3.253 N/A LEU 903.A N ILE 896.A O no hydrogen 2.852 N/A GLN 905.A NE2 LEU 889.A O no hydrogen 2.850 N/A GLN 906.A NE2 GLN 905.A OE1 no hydrogen 3.174 N/A THR 908.A OG1 PRO 904.A O no hydrogen 3.462 N/A LEU 909.A N GLN 905.A O no hydrogen 2.675 N/A SER 910.A OG GLN 906.A OE1 no hydrogen 2.592 N/A ASP 911.A N PRO 907.A O no hydrogen 2.950 N/A MET 912.A N THR 908.A O no hydrogen 2.803 N/A GLU 916.A N THR 913.A O no hydrogen 3.320 N/A ASN 918.A N ARG 246.A O no hydrogen 3.286 N/A PHE 919.A N GLU 916.A O no hydrogen 3.092 N/A LEU 921.A N MET 917.A O no hydrogen 3.231 N/A LEU 922.A N ASN 918.A O no hydrogen 3.093 N/A VAL 923.A N PHE 919.A O no hydrogen 2.750 N/A GLU 924.A N SER 920.A O no hydrogen 2.974 N/A ASP 925.A N LEU 921.A O no hydrogen 2.814 N/A THR 926.A N LEU 922.A O no hydrogen 2.906 N/A THR 926.A OG1 LEU 922.A O no hydrogen 2.612 N/A LEU 927.A N VAL 923.A O no hydrogen 3.071 N/A GLY 928.A N ASP 925.A O no hydrogen 2.940 N/A TYR 935.A OH ASP 965.A OD1 no hydrogen 3.065 N/A ARG 936.A N GLN 932.A O no hydrogen 3.199 N/A GLN 937.A N PRO 933.A O no hydrogen 3.198 N/A ILE 938.A N GLN 934.A O no hydrogen 3.037 N/A VAL 939.A N TYR 935.A O no hydrogen 2.787 N/A VAL 940.A N ARG 936.A O no hydrogen 2.798 N/A GLU 941.A N GLN 937.A O no hydrogen 2.884 N/A LEU 942.A N ILE 938.A O no hydrogen 2.691 N/A LEU 943.A N VAL 939.A O no hydrogen 3.073 N/A MET 944.A N VAL 940.A O no hydrogen 2.998 N/A VAL 945.A N GLU 941.A O no hydrogen 2.831 N/A VAL 946.A N LEU 942.A O no hydrogen 2.735 N/A SER 947.A N LEU 943.A O no hydrogen 3.112 N/A ILE 948.A N MET 944.A O no hydrogen 3.150 N/A VAL 949.A N VAL 945.A O no hydrogen 2.801 N/A LEU 950.A N VAL 946.A O no hydrogen 2.892 N/A GLU 951.A N SER 947.A O no hydrogen 2.873 N/A ARG 952.A N ILE 948.A O no hydrogen 2.755 N/A ASN 953.A N VAL 949.A O no hydrogen 2.857 N/A VAL 962.A N GLY 895.A O no hydrogen 2.958 N/A LEU 964.A N ILE 897.A O no hydrogen 3.019 N/A LEU 967.A N ASP 963.A O no hydrogen 3.098 N/A VAL 968.A N LEU 964.A O no hydrogen 3.019 N/A LYS 969.A N ASP 965.A O no hydrogen 2.859 N/A GLU 970.A N ARG 966.A O no hydrogen 3.000 N/A ALA 971.A N LEU 967.A O no hydrogen 3.168 N/A PHE 972.A N VAL 968.A O no hydrogen 2.952 N/A ASN 973.A N LYS 969.A O no hydrogen 2.802 N/A GLU 974.A N GLU 970.A O no hydrogen 3.024 N/A PHE 975.A N ALA 971.A O no hydrogen 2.957 N/A GLN 976.A N PHE 972.A O no hydrogen 2.576 N/A LYS 977.A N ASN 973.A O no hydrogen 2.959 N/A ASP 978.A N GLU 974.A O no hydrogen 2.872 N/A GLN 979.A N PHE 975.A O no hydrogen 2.827 N/A SER 980.A N GLN 976.A O no hydrogen 2.848 N/A SER 980.A OG LYS 977.A O no hydrogen 2.838 N/A ARG 981.A N LYS 977.A O no hydrogen 3.048 N/A LEU 982.A N ASP 978.A O no hydrogen 3.136 N/A LYS 983.A N GLN 979.A O no hydrogen 2.793 N/A GLU 984.A N SER 980.A O no hydrogen 2.552 N/A GLN 988.A NE2 GLU 986.A O no hydrogen 3.674 N/A THR 992.A OG1 ASP 990.A OD2 no hydrogen 3.055 N/A TYR 995.A N MET 991.A O no hydrogen 2.810 N/A ASN 996.A N THR 992.A O no hydrogen 3.021 N/A THR 997.A N SER 993.A O no hydrogen 3.103 N/A THR 997.A N PHE 994.A O no hydrogen 3.182 N/A THR 997.A OG1 SER 993.A O no hydrogen 3.119 N/A THR 1005.A N PRO 998.A O no hydrogen 3.131 N/A THR 1005.A OG1 PRO 998.A O no hydrogen 3.459 N/A CYS 1006.A N PRO 999.A O no hydrogen 2.930 N/A SER 1007.A N GLY 1004.A O no hydrogen 3.219 N/A TYR 1008.A OH ASP 978.A OD2 no hydrogen 3.342 N/A LEU 1009.A N THR 1005.A O no hydrogen 3.290 N/A THR 1010.A N CYS 1006.A O no hydrogen 3.049 N/A THR 1010.A OG1 CYS 1006.A O no hydrogen 2.905 N/A LYS 1011.A N SER 1007.A O no hydrogen 2.931 N/A LYS 1011.A NZ GLU 974.A OE2 no hydrogen 2.820 N/A ALA 1012.A N TYR 1008.A O no hydrogen 2.953 N/A VAL 1013.A N LEU 1009.A O no hydrogen 2.922 N/A MET 1014.A N THR 1010.A O no hydrogen 2.908 N/A ASN 1015.A N LYS 1011.A O no hydrogen 2.905 N/A LEU 1016.A N ALA 1012.A O no hydrogen 2.973 N/A LEU 1017.A N VAL 1013.A O no hydrogen 2.892 N/A LEU 1018.A N MET 1014.A O no hydrogen 2.882 N/A GLU 1019.A N ASN 1015.A O no hydrogen 3.021 N/A GLU 1019.A N LEU 1016.A O no hydrogen 3.184 N/A GLY 1020.A N LEU 1017.A O no hydrogen 3.278 N/A LYS 1023.A N GLU 955.A O no hydrogen 3.333 N/A LYS 1023.A NZ GLU 1021.A O no hydrogen 2.896 N/A ASN 1025.A ND2 PRO 954.A O no hydrogen 3.067 N/A ASP 1028.A N ASP 1027.A OD1 no hydrogen 2.811 N/A CYS 1030.A SG ILE 1032.A O no hydrogen 3.283 N/A