Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 5npp_B.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ALA 3.A N ILE 38.A O no hydrogen 2.869 N/A CYS 5.A N ASP 4.A OD1 no hydrogen 2.768 N/A CYS 5.A SG ASP 4.A OD1 no hydrogen 3.824 N/A CYS 5.A SG SER 7.A O no hydrogen 3.932 N/A SER 6.A N SER 33.A O no hydrogen 2.992 N/A SER 7.A N ARG 34.A O no hydrogen 3.083 N/A SER 7.A OG SER 9.A O no hydrogen 3.546 N/A SER 7.A OG GLU 12.A OE2 no hydrogen 2.900 N/A LYS 8.A NZ.B ASP 4.A OD2 no hydrogen 3.440 N/A SER 9.A N SER 7.A OG no hydrogen 3.008 N/A SER 9.A OG GLU 11.A OE2.A no hydrogen 2.557 N/A GLU 12.A N SER 9.A O no hydrogen 3.200 N/A CYS 13.A N PRO 10.A O no hydrogen 3.172 N/A CYS 13.A SG SER 7.A O no hydrogen 3.610 N/A CYS 13.A SG SER 7.A OG no hydrogen 3.463 N/A CYS 13.A SG SER 9.A O no hydrogen 3.297 N/A GLU 14.A N THR 35.A O no hydrogen 2.744 N/A ILE 15.A N LYS 86.A O no hydrogen 2.757 N/A PHE 16.A N ALA 37.A O no hydrogen 2.896 N/A LEU 17.A N VAL 88.A O no hydrogen 2.860 N/A VAL 18.A N LEU 39.A O no hydrogen 3.273 N/A GLY 24.A N GLY 20.A O no hydrogen 3.094 N/A GLY 25.A N ASP 21.A O no hydrogen 3.389 N/A SER 26.A OG SER 22.A O no hydrogen 3.425 N/A THR 27.A N ALA 23.A O no hydrogen 3.060 N/A THR 27.A OG1 ALA 23.A O no hydrogen 2.824 N/A LYS 28.A N.A GLY 24.A O no hydrogen 2.839 N/A LYS 28.A N.B GLY 24.A O no hydrogen 2.837 N/A LYS 28.A NZ.B LYS 1.A O no hydrogen 3.376 N/A SER 29.A N GLY 25.A O no hydrogen 3.232 N/A GLY 30.A N SER 26.A O no hydrogen 2.857 N/A ARG 31.A N THR 27.A O no hydrogen 3.084 N/A ARG 31.A NE LYS 28.A O.A no hydrogen 3.180 N/A ARG 31.A NE LYS 28.A O.B no hydrogen 3.179 N/A ARG 31.A NH2 ASP 4.A O no hydrogen 3.410 N/A ARG 31.A NH2 GLN 36.A O no hydrogen 2.730 N/A ASP 32.A N GLN 36.A OE1 no hydrogen 2.868 N/A ARG 34.A N ASP 32.A OD1 no hydrogen 3.189 N/A ARG 34.A NH1 GLU 12.A OE2 no hydrogen 3.194 N/A ARG 34.A NH2 GLU 12.A OE1 no hydrogen 3.113 N/A THR 35.A N ASP 32.A O no hydrogen 3.193 N/A GLN 36.A N ASP 32.A O no hydrogen 2.921 N/A GLN 36.A NE2 GLU 14.A OE2 no hydrogen 3.163 N/A GLN 36.A NE2 MET 146.A O no hydrogen 2.922 N/A ALA 37.A N GLU 14.A O no hydrogen 2.718 N/A ILE 38.A N ALA 3.A O no hydrogen 2.787 N/A LEU 39.A N PHE 16.A O no hydrogen 2.912 N/A LEU 41.A N VAL 18.A O no hydrogen 2.658 N/A GLY 43.A N GLU 19.A O no hydrogen 3.225 N/A LYS 44.A NZ ASP 96.A OD1 no hydrogen 2.725 N/A LYS 44.A NZ HIS 99.A ND1 no hydrogen 3.051 N/A ASN 47.A ND2 MET 172.A O no hydrogen 3.194 N/A GLU 49.A N ASN 47.A OD1 no hydrogen 2.881 N/A LYS 50.A N ASN 47.A O no hydrogen 3.278 N/A ALA 51.A N VAL 48.A O no hydrogen 3.379 N/A ILE 56.A N ARG 52.A O no hydrogen 3.169 N/A LEU 57.A N LEU 53.A O no hydrogen 2.974 N/A ASN 58.A N ASP 54.A O no hydrogen 3.211 N/A ASN 58.A ND2 ASP 54.A O no hydrogen 2.737 N/A ASN 59.A N ILE 56.A O no hydrogen 3.274 N/A ILE 62.A N ASN 59.A OD1 no hydrogen 3.182 N/A ARG 63.A N ASN 59.A O no hydrogen 2.992 N/A GLN 64.A N ASN 60.A O no hydrogen 3.007 N/A MET 65.A N GLU 61.A O no hydrogen 3.199 N/A ILE 66.A N ILE 62.A O no hydrogen 2.969 N/A THR 67.A N ARG 63.A O no hydrogen 2.807 N/A THR 67.A OG1 ARG 63.A O no hydrogen 2.909 N/A ALA 68.A N GLN 64.A O no hydrogen 2.867 N/A PHE 69.A N MET 65.A O no hydrogen 2.962 N/A GLY 70.A N ILE 66.A O no hydrogen 3.133 N/A THR 71.A OG1 GLY 72.A O no hydrogen 3.002 N/A GLY 74.A N PHE 111.A O no hydrogen 2.728 N/A ASP 76.A N ILE 73.A O no hydrogen 3.212 N/A PHE 77.A N GLY 74.A O no hydrogen 3.243 N/A ASP 78.A N THR 71.A O no hydrogen 2.788 N/A ALA 80.A N ASP 78.A OD1 no hydrogen 3.219 N/A LYS 81.A N ASP 78.A O no hydrogen 3.050 N/A ALA 82.A N LEU 79.A O no hydrogen 3.202 N/A ARG 83.A N PHE 69.A O no hydrogen 2.945 N/A ARG 83.A NH1 ALA 68.A O no hydrogen 2.762 N/A ARG 83.A NH1 TYR 84.A OH no hydrogen 3.195 N/A ARG 83.A NH2 ASP 4.A OD2 no hydrogen 3.026 N/A TYR 84.A OH ASP 4.A OD1 no hydrogen 2.684 N/A HIS 85.A N CYS 13.A O no hydrogen 3.186 N/A LYS 86.A N CYS 13.A O no hydrogen 3.420 N/A ILE 87.A N TYR 120.A O no hydrogen 2.789 N/A VAL 88.A N ILE 15.A O no hydrogen 2.706 N/A ILE 89.A N TYR 122.A O no hydrogen 2.784 N/A MET 90.A N LEU 17.A O no hydrogen 2.829 N/A THR 91.A OG1 ASP 92.A O no hydrogen 3.195 N/A THR 91.A OG1 GLY 97.A O no hydrogen 3.092 N/A ASP 92.A N GLU 19.A OE1 no hydrogen 2.701 N/A GLY 97.A N ASP 94.A OD1 no hydrogen 2.769 N/A ALA 98.A N ASP 94.A O no hydrogen 3.040 N/A HIS 99.A N VAL 95.A O no hydrogen 3.096 N/A ILE 100.A N ASP 96.A O no hydrogen 3.105 N/A ARG 101.A N GLY 97.A O no hydrogen 3.043 N/A ARG 101.A NE GLU 198.A OE2 no hydrogen 2.828 N/A ARG 101.A NE SER 202.A OG no hydrogen 3.287 N/A ARG 101.A NH2 SER 202.A OG no hydrogen 2.756 N/A THR 102.A N ALA 98.A O no hydrogen 3.212 N/A THR 102.A OG1 HIS 99.A O no hydrogen 2.785 N/A LEU 103.A N HIS 99.A O no hydrogen 3.023 N/A LEU 104.A N ILE 100.A O no hydrogen 2.905 N/A LEU 105.A N ARG 101.A O no hydrogen 3.021 N/A THR 106.A N THR 102.A O no hydrogen 2.938 N/A THR 106.A OG1 THR 102.A O no hydrogen 2.674 N/A PHE 107.A N LEU 103.A O no hydrogen 3.162 N/A PHE 108.A N LEU 104.A O no hydrogen 2.910 N/A TYR 109.A N LEU 105.A O no hydrogen 2.833 N/A TYR 109.A OH ASP 165.A OD1 no hydrogen 2.654 N/A ARG 110.A N THR 106.A O no hydrogen 3.116 N/A ARG 110.A NE GLU 49.A OE2 no hydrogen 2.998 N/A ARG 110.A NH2 GLU 49.A OE1 no hydrogen 3.206 N/A PHE 111.A N PHE 107.A O no hydrogen 2.923 N/A MET 112.A N PHE 108.A O no hydrogen 2.812 N/A ARG 113.A NE GLU 117.A OE2 no hydrogen 3.315 N/A LEU 115.A N MET 112.A O no hydrogen 3.071 N/A GLU 117.A N ARG 113.A O no hydrogen 2.926 N/A ALA 118.A N PRO 114.A O no hydrogen 2.675 N/A GLY 119.A N ILE 116.A O no hydrogen 3.058 N/A TYR 120.A N LEU 115.A O no hydrogen 3.187 N/A TYR 122.A N ILE 87.A O no hydrogen 2.911 N/A ILE 123.A N LEU 154.A O no hydrogen 2.820 N/A ALA 124.A N ILE 89.A O no hydrogen 2.937 N/A LYS 131.A NZ.B MET 256.A O.B no hydrogen 2.733 N/A LEU 133.A N ASP 92.A OD1 no hydrogen 3.267 N/A GLU 135.A N GLY 132.A O.A no hydrogen 2.892 N/A GLU 135.A N GLY 132.A O.B no hydrogen 3.009 N/A MET 136.A N LEU 133.A O no hydrogen 3.063 N/A ASN 137.A N GLN 140.A OE1 no hydrogen 2.930 N/A LEU 141.A N ASN 137.A O no hydrogen 3.210 N/A TRP 142.A N ALA 138.A O no hydrogen 3.125 N/A GLU 143.A N ASP 139.A O no hydrogen 3.088 N/A THR 144.A N GLN 140.A O no hydrogen 3.087 N/A THR 144.A OG1 GLN 140.A O no hydrogen 2.708 N/A THR 144.A OG1 THR 145.A OG1 no hydrogen 2.712 N/A THR 145.A N LEU 141.A O no hydrogen 3.081 N/A THR 145.A OG1 LEU 141.A O no hydrogen 3.527 N/A THR 145.A OG1 THR 144.A OG1 no hydrogen 2.712 N/A MET 146.A N LEU 141.A O no hydrogen 3.199 N/A MET 146.A N TRP 142.A O no hydrogen 3.226 N/A ASN 147.A N TRP 142.A O no hydrogen 2.514 N/A HIS 150.A N ASN 147.A O no hydrogen 3.311 N/A ARG 151.A N ASN 147.A O no hydrogen 2.848 N/A ARG 151.A NH1 GLU 14.A OE1 no hydrogen 3.385 N/A ARG 151.A NH1 GLU 14.A OE2 no hydrogen 2.731 N/A ARG 151.A NH1 MET 146.A O no hydrogen 3.256 N/A ARG 151.A NH2 GLU 14.A OE1 no hydrogen 2.619 N/A ARG 151.A NH2 GLU 14.A OE2 no hydrogen 3.522 N/A LEU 154.A N ILE 123.A O no hydrogen 2.936 N/A GLN 155.A N ASN 191.A O no hydrogen 2.861 N/A GLN 155.A NE2 GLY 119.A O no hydrogen 2.587 N/A VAL 156.A N VAL 121.A O no hydrogen 2.881 N/A LYS 157.A N ARG 193.A O no hydrogen 2.733 N/A ILE 162.A N ASP 160.A OD1 no hydrogen 3.159 N/A ALA 164.A N ASP 160.A O no hydrogen 3.008 N/A ASP 165.A N ALA 161.A O no hydrogen 3.091 N/A GLN 166.A N ILE 162.A O no hydrogen 3.264 N/A THR 167.A N GLU 163.A O no hydrogen 3.000 N/A THR 167.A OG1 GLU 163.A O no hydrogen 2.826 N/A PHE 168.A N ALA 164.A O no hydrogen 2.994 N/A GLU 169.A N.A ASP 165.A O no hydrogen 3.062 N/A GLU 169.A N.B ASP 165.A O no hydrogen 3.080 N/A MET 170.A N GLN 166.A O no hydrogen 2.937 N/A LEU 171.A N THR 167.A O no hydrogen 2.908 N/A MET 172.A N PHE 168.A O no hydrogen 2.982 N/A GLY 173.A N GLU 169.A O.A no hydrogen 2.973 N/A GLY 173.A N GLU 169.A O.B no hydrogen 2.963 N/A ARG 179.A NH1 LEU 171.A O no hydrogen 3.009 N/A ARG 179.A NH1 GLY 173.A O no hydrogen 2.770 N/A ARG 179.A NH2 GLY 173.A O no hydrogen 2.842 N/A ARG 180.A N VAL 176.A O no hydrogen 2.809 N/A ARG 180.A NE GLU 177.A OE1 no hydrogen 3.067 N/A ARG 180.A NH1 GLU 184.A OE2 no hydrogen 3.063 N/A ARG 180.A NH2 GLU 177.A OE2 no hydrogen 2.789 N/A GLN 181.A N GLU 177.A O no hydrogen 2.836 N/A GLN 181.A NE2 ASP 185.A OD1 no hydrogen 2.957 N/A GLN 181.A NE2 ASP 185.A OD2 no hydrogen 3.421 N/A PHE 182.A N ASN 178.A O no hydrogen 2.923 N/A ILE 183.A N ARG 179.A O no hydrogen 3.133 N/A GLU 184.A N ARG 180.A O no hydrogen 3.064 N/A ASP 185.A N GLN 181.A O no hydrogen 3.013 N/A ASN 186.A N PHE 182.A O no hydrogen 3.125 N/A ASN 186.A ND2 PHE 182.A O no hydrogen 2.725 N/A ALA 187.A N.A ILE 183.A O no hydrogen 2.785 N/A TYR 189.A N.B ALA 187.A O.B no hydrogen 2.495 N/A TYR 189.A OH.A GLY 522.A O no hydrogen 2.652 N/A ARG 193.A N GLN 155.A O no hydrogen 2.790 N/A ARG 193.A NE GLU 198.A OE1 no hydrogen 2.665 N/A ARG 193.A NH1 GLU 201.A OE1 no hydrogen 3.471 N/A ARG 193.A NH1 GLU 201.A OE2 no hydrogen 3.320 N/A ARG 193.A NH2 GLU 198.A OE1 no hydrogen 3.350 N/A ARG 193.A NH2 GLU 201.A OE2 no hydrogen 2.497 N/A ASN 194.A ND2 LYS 157.A O no hydrogen 3.480 N/A ILE 195.A N LYS 157.A O no hydrogen 2.925 N/A SER 197.A N ASN 194.A OD1 no hydrogen 3.281 N/A SER 197.A OG ASN 194.A OD1 no hydrogen 3.354 N/A GLU 198.A N ASN 194.A O no hydrogen 2.959 N/A MET 199.A N ILE 195.A O no hydrogen 2.905 N/A ARG 200.A N THR 196.A O no hydrogen 2.987 N/A GLU 201.A N SER 197.A O no hydrogen 2.960 N/A SER 202.A N GLU 198.A O no hydrogen 2.897 N/A SER 202.A OG GLU 198.A O no hydrogen 3.243 N/A SER 202.A OG GLU 198.A OE2 no hydrogen 2.613 N/A PHE 203.A N MET 199.A O no hydrogen 2.919 N/A LEU 204.A N ARG 200.A O no hydrogen 3.057 N/A ASP 205.A N.A GLU 201.A O no hydrogen 3.191 N/A ASP 205.A N.B GLU 201.A O no hydrogen 3.167 N/A TYR 206.A N SER 202.A O no hydrogen 3.298 N/A ALA 207.A N PHE 203.A O no hydrogen 2.817 N/A MET 208.A N LEU 204.A O no hydrogen 2.967 N/A SER 209.A N ASP 205.A O.A no hydrogen 3.228 N/A SER 209.A N ASP 205.A O.B no hydrogen 3.255 N/A VAL 210.A N TYR 206.A O no hydrogen 3.127 N/A ILE 211.A N ALA 207.A O no hydrogen 3.125 N/A VAL 212.A N MET 208.A O no hydrogen 2.874 N/A ALA 213.A N SER 209.A O no hydrogen 2.639 N/A ARG 214.A NH1 ASP 96.A OD1 no hydrogen 3.118 N/A ARG 214.A NH1 ASP 96.A OD2 no hydrogen 3.565 N/A ARG 214.A NH2 ASP 96.A OD2 no hydrogen 2.945 N/A ALA 215.A N VAL 210.A O no hydrogen 3.002 N/A ASP 218.A N LEU 223.A O no hydrogen 2.896 N/A VAL 219.A N LEU 519.A O no hydrogen 3.042 N/A ARG 220.A N ASP 218.A OD1 no hydrogen 2.739 N/A ARG 220.A NE ASP 218.A OD1 no hydrogen 2.816 N/A ARG 220.A NH2 ASP 218.A OD2 no hydrogen 2.848 N/A GLY 222.A N ASP 218.A O no hydrogen 2.815 N/A LEU 223.A N ASP 221.A OD1 no hydrogen 2.978 N/A LYS 224.A NZ SER 354.A O no hydrogen 2.728 N/A ARG 228.A N LYS 224.A O no hydrogen 2.974 N/A ARG 228.A NE ASP 221.A OD2 no hydrogen 2.775 N/A ARG 228.A NH2 ASP 221.A OD1 no hydrogen 3.046 N/A ARG 228.A NH2 ASP 221.A OD2 no hydrogen 3.360 N/A ARG 229.A N PRO 225.A O no hydrogen 2.909 N/A ARG 229.A NE GLU 337.A OE2 no hydrogen 2.763 N/A ARG 229.A NH1 HIS 260.A ND1 no hydrogen 2.979 N/A ARG 229.A NH2 GLU 337.A OE1 no hydrogen 2.942 N/A ILE 230.A N VAL 226.A O no hydrogen 3.002 N/A LEU 231.A N HIS 227.A O no hydrogen 3.039 N/A TYR 232.A N ARG 228.A O no hydrogen 2.924 N/A GLY 233.A N ARG 229.A O no hydrogen 2.772 N/A LEU 234.A N ILE 230.A O no hydrogen 2.947 N/A ASN 235.A N LEU 231.A O no hydrogen 3.040 N/A GLU 236.A N TYR 232.A O no hydrogen 2.878 N/A GLN 237.A N.A GLY 233.A O no hydrogen 2.993 N/A GLN 237.A N.B GLY 233.A O no hydrogen 3.043 N/A GLN 237.A NE2.B ASP 254.A OD1 no hydrogen 2.956 N/A GLY 238.A N ASN 235.A O no hydrogen 3.068 N/A MET 239.A N.A LEU 234.A O no hydrogen 2.781 N/A MET 239.A N.B LEU 234.A O no hydrogen 2.827 N/A THR 240.A N GLY 238.A O no hydrogen 2.857 N/A THR 240.A OG1 ASP 242.A OD1 no hydrogen 2.063 N/A LYS 243.A N THR 240.A O no hydrogen 3.076 N/A TYR 245.A OH ASP 286.A OD1 no hydrogen 2.819 N/A TYR 245.A OH ASP 286.A OD2 no hydrogen 3.161 N/A LYS 246.A N ALA 307.A O no hydrogen 3.019 N/A LYS 247.A NZ ARG 303.A O no hydrogen 3.335 N/A SER 248.A N THR 305.A O no hydrogen 2.762 N/A SER 248.A OG THR 305.A OG1 no hydrogen 2.837 N/A ALA 249.A N MET 302.A O no hydrogen 3.228 N/A ILE 251.A N LYS 247.A O no hydrogen 3.191 N/A VAL 252.A N SER 248.A O no hydrogen 2.849 N/A GLY 253.A N ALA 249.A O no hydrogen 2.974 N/A ASP 254.A N ARG 250.A O no hydrogen 3.130 N/A VAL 255.A N ILE 251.A O no hydrogen 2.986 N/A MET 256.A N.A VAL 252.A O no hydrogen 2.948 N/A MET 256.A N.B VAL 252.A O no hydrogen 2.897 N/A GLY 257.A N GLY 253.A O no hydrogen 2.919 N/A LYS 258.A N ASP 254.A O no hydrogen 3.093 N/A LYS 258.A NZ ASP 254.A OD1 no hydrogen 3.248 N/A TYR 259.A N VAL 255.A O no hydrogen 2.905 N/A HIS 260.A N VAL 255.A O no hydrogen 2.951 N/A HIS 262.A N HIS 260.A O no hydrogen 2.930 N/A ILE 267.A N GLY 263.A O no hydrogen 3.435 N/A TYR 268.A N ASP 264.A O no hydrogen 2.893 N/A TYR 268.A OH ALA 300.A O no hydrogen 2.728 N/A TYR 268.A OH THR 305.A OG1 no hydrogen 2.668 N/A GLU 269.A N SER 265.A O no hydrogen 2.903 N/A ALA 270.A N SER 266.A O no hydrogen 3.271 N/A MET 271.A N ILE 267.A O no hydrogen 3.096 N/A VAL 272.A N TYR 268.A O no hydrogen 2.954 N/A ARG 273.A N GLU 269.A O no hydrogen 3.165 N/A MET 274.A N ALA 270.A O no hydrogen 3.397 N/A ALA 275.A N MET 271.A O no hydrogen 3.305 N/A ALA 275.A N VAL 272.A O no hydrogen 3.134 N/A GLN 276.A N ARG 273.A O no hydrogen 2.977 N/A GLN 276.A NE2 PHE 291.A O no hydrogen 2.823 N/A SER 279.A N GLN 276.A O no hydrogen 3.142 N/A SER 279.A OG GLN 276.A OE1 no hydrogen 2.827 N/A TYR 280.A N GLN 276.A O no hydrogen 2.979 N/A ARG 281.A NE ASP 398.A OD2 no hydrogen 3.319 N/A ARG 281.A NH1 ARG 281.A O no hydrogen 3.209 N/A ARG 281.A NH1 ASP 663.A OD1 no hydrogen 3.535 N/A ARG 281.A NH1 ASP 663.A OD2 no hydrogen 2.899 N/A ARG 281.A NH2 ASP 398.A OD2 no hydrogen 2.594 N/A ARG 281.A NH2 ASP 663.A OD1 no hydrogen 3.218 N/A ARG 281.A NH2 ASP 664.A O no hydrogen 3.194 N/A TYR 282.A N ASN 351.A OD1 no hydrogen 2.818 N/A TYR 282.A OH ASP 663.A OD1 no hydrogen 2.802 N/A LEU 284.A N MET 274.A O no hydrogen 3.091 N/A VAL 285.A N MET 274.A O no hydrogen 3.328 N/A ASP 286.A N ARG 308.A O no hydrogen 2.621 N/A GLN 288.A N GLU 306.A O no hydrogen 2.901 N/A GLY 292.A N ASN 290.A OD1 no hydrogen 2.866 N/A SER 293.A N ASP 297.A O no hydrogen 3.267 N/A SER 293.A OG ASP 297.A OD2 no hydrogen 3.031 N/A ASP 295.A N SER 293.A OG no hydrogen 3.154 N/A GLY 296.A N SER 293.A O no hydrogen 3.281 N/A ALA 300.A N ASN 290.A O no hydrogen 2.896 N/A TYR 304.A N ALA 301.A O no hydrogen 2.988 N/A THR 305.A OG1 SER 248.A OG no hydrogen 2.837 N/A THR 305.A OG1 TYR 268.A OH no hydrogen 2.668 N/A GLU 306.A N GLN 288.A O no hydrogen 3.204 N/A ALA 307.A N LYS 246.A O no hydrogen 2.720 N/A ARG 308.A N ASP 286.A O no hydrogen 2.848 N/A ARG 308.A NE ASP 286.A OD2 no hydrogen 2.855 N/A ARG 308.A NH1 LYS 243.A O no hydrogen 2.924 N/A ARG 308.A NH2 ASP 286.A OD2 no hydrogen 3.328 N/A MET 309.A N MET 239.A O.A no hydrogen 3.150 N/A MET 309.A N MET 239.A O.B no hydrogen 3.159 N/A THR 310.A N LEU 284.A O no hydrogen 3.512 N/A THR 310.A OG1 PRO 283.A O no hydrogen 2.796 N/A THR 310.A OG1 THR 313.A OG1 no hydrogen 3.131 N/A THR 313.A N THR 310.A O no hydrogen 3.247 N/A THR 313.A OG1 LEU 284.A O no hydrogen 2.667 N/A THR 313.A OG1 THR 310.A OG1 no hydrogen 3.131 N/A LEU 314.A N LYS 311.A O no hydrogen 3.173 N/A GLU 315.A N ILE 312.A O no hydrogen 3.016 N/A LEU 316.A N THR 313.A O no hydrogen 2.936 N/A LEU 317.A N THR 313.A O no hydrogen 3.280 N/A ARG 318.A NH1 GLU 315.A OE2 no hydrogen 2.829 N/A ILE 320.A N LEU 317.A O no hydrogen 3.186 N/A LYS 322.A N ASP 319.A O no hydrogen 3.126 N/A LYS 322.A NZ ASP 319.A OD1 no hydrogen 3.459 N/A THR 324.A OG1 ASP 319.A O no hydrogen 2.636 N/A ILE 328.A N GLU 337.A O no hydrogen 2.767 N/A ASN 330.A N GLU 335.A O no hydrogen 2.688 N/A ASN 330.A ND2 LYS 258.A O no hydrogen 2.939 N/A ASN 330.A ND2 ASP 332.A OD1 no hydrogen 2.739 N/A TYR 331.A OH GLY 257.A O no hydrogen 2.700 N/A ASN 334.A N ASP 332.A OD1 no hydrogen 2.808 N/A ASN 334.A ND2 ASP 332.A OD2 no hydrogen 3.402 N/A GLU 335.A N ASN 330.A OD1 no hydrogen 2.949 N/A ARG 336.A NH1 ASP 329.A OD1 no hydrogen 2.621 N/A GLU 337.A N ILE 328.A O no hydrogen 2.797 N/A SER 339.A N ASP 326.A O no hydrogen 2.965 N/A SER 339.A OG ASP 326.A O no hydrogen 2.743 N/A LEU 341.A N ASP 221.A OD2 no hydrogen 2.809 N/A ALA 343.A N LEU 316.A O no hydrogen 2.913 N/A ARG 344.A N GLU 315.A O no hydrogen 2.932 N/A ARG 344.A NE GLN 540.A OE1 no hydrogen 2.980 N/A ARG 344.A NH1 GLU 653.A OE1 no hydrogen 3.049 N/A ARG 344.A NH2 GLU 653.A OE1 no hydrogen 2.690 N/A ASN 347.A ND2 ASP 221.A O no hydrogen 2.973 N/A ALA 350.A N PRO 346.A O no hydrogen 2.973 N/A ASN 351.A N ASN 347.A O no hydrogen 3.000 N/A ASN 351.A ND2 TYR 282.A O no hydrogen 2.914 N/A ASN 351.A ND2 ASN 347.A OD1 no hydrogen 2.866 N/A ALA 353.A N ILE 364.A O no hydrogen 2.708 N/A GLY 355.A N THR 362.A O no hydrogen 3.004 N/A ALA 357.A N MET 360.A O no hydrogen 3.027 N/A THR 362.A N GLY 355.A O no hydrogen 2.761 N/A THR 362.A OG1 ASN 515.A O no hydrogen 3.339 N/A THR 362.A OG1 ILE 517.A O no hydrogen 2.704 N/A ASN 363.A N ASN 515.A O no hydrogen 2.849 N/A ASN 363.A ND2 GLY 513.A O no hydrogen 2.900 N/A ILE 364.A N ALA 353.A O no hydrogen 2.660 N/A HIS 367.A N ALA 350.A O no hydrogen 2.968 N/A HIS 367.A ND1 LEU 349.A O no hydrogen 2.853 N/A HIS 367.A NE2 TYR 415.A OH no hydrogen 2.651 N/A ASN 368.A ND2 ASP 398.A OD2 no hydrogen 3.276 N/A ASN 368.A ND2 ASP 663.A O no hydrogen 2.880 N/A LEU 369.A N TYR 282.A OH no hydrogen 2.744 N/A THR 370.A OG1 ASP 663.A O no hydrogen 3.241 N/A GLU 371.A N ASN 368.A OD1 no hydrogen 2.915 N/A LEU 372.A N ASN 368.A O no hydrogen 2.851 N/A ILE 373.A N LEU 369.A O no hydrogen 2.986 N/A ASN 374.A N THR 370.A O no hydrogen 3.103 N/A GLY 375.A N GLU 371.A O no hydrogen 2.940 N/A VAL 376.A N LEU 372.A O no hydrogen 2.925 N/A LEU 377.A N ILE 373.A O no hydrogen 2.851 N/A SER 378.A N ASN 374.A O no hydrogen 2.893 N/A SER 378.A OG ASN 374.A O no hydrogen 3.184 N/A SER 378.A OG ASP 393.A OD2 no hydrogen 2.741 N/A LEU 379.A N GLY 375.A O no hydrogen 2.827 N/A SER 380.A N VAL 376.A O no hydrogen 2.764 N/A SER 380.A OG LEU 377.A O no hydrogen 2.656 N/A LYS 381.A N LEU 377.A O no hydrogen 3.156 N/A LYS 381.A N SER 378.A O no hydrogen 3.222 N/A ASN 382.A N LEU 379.A O no hydrogen 2.991 N/A ASP 384.A N ASN 382.A OD1 no hydrogen 2.777 N/A ILE 385.A N ASN 382.A O no hydrogen 2.821 N/A SER 386.A N GLU 389.A OE2 no hydrogen 3.211 N/A SER 386.A OG GLU 389.A OE2 no hydrogen 3.361 N/A GLU 389.A N SER 386.A OG no hydrogen 3.160 N/A LEU 390.A N SER 386.A O no hydrogen 2.899 N/A MET 391.A N ILE 387.A O no hydrogen 2.860 N/A MET 391.A N ALA 388.A O no hydrogen 3.205 N/A GLU 392.A N GLU 389.A O no hydrogen 2.895 N/A ASP 393.A N LEU 390.A O no hydrogen 2.833 N/A ILE 394.A N LEU 390.A O no hydrogen 2.900 N/A GLU 395.A N GLU 371.A OE1 no hydrogen 3.077 N/A ASP 398.A N PRO 366.A O no hydrogen 2.930 N/A PHE 399.A N THR 667.A OG1 no hydrogen 2.830 N/A ALA 402.A N PHE 399.A O no hydrogen 2.912 N/A GLY 403.A N GLU 444.A OE2 no hydrogen 2.727 N/A LEU 404.A N ARG 425.A O no hydrogen 2.980 N/A ILE 405.A N GLU 668.A O no hydrogen 2.840 N/A LEU 406.A N GLN 423.A O no hydrogen 2.985 N/A GLY 407.A N GLN 670.A O no hydrogen 2.705 N/A ARG 412.A N LYS 408.A O no hydrogen 2.950 N/A ARG 413.A N.A SER 409.A O no hydrogen 3.221 N/A ARG 413.A N.B SER 409.A O no hydrogen 3.213 N/A ALA 414.A N GLY 410.A O no hydrogen 3.091 N/A TYR 415.A N ILE 411.A O no hydrogen 2.986 N/A TYR 415.A OH HIS 367.A NE2 no hydrogen 2.651 N/A GLU 416.A N ARG 412.A O no hydrogen 2.984 N/A THR 417.A N ARG 413.A O.A no hydrogen 2.904 N/A THR 417.A N ARG 413.A O.B no hydrogen 2.857 N/A THR 417.A OG1 ARG 413.A O.A no hydrogen 2.784 N/A THR 417.A OG1 ARG 413.A O.B no hydrogen 2.857 N/A GLY 418.A N ALA 414.A O no hydrogen 2.581 N/A ARG 419.A N THR 417.A OG1 no hydrogen 3.094 N/A GLY 420.A N VAL 514.A O no hydrogen 3.183 N/A SER 421.A OG SER 511.A OG no hydrogen 2.869 N/A ILE 422.A N PHE 512.A O no hydrogen 2.987 N/A MET 424.A N THR 510.A O no hydrogen 2.840 N/A ARG 425.A N LEU 404.A O no hydrogen 2.787 N/A ARG 425.A NE GLN 509.A OE1 no hydrogen 2.776 N/A ARG 425.A NH2 GLN 509.A OE1 no hydrogen 2.899 N/A SER 426.A N LEU 508.A O no hydrogen 2.996 N/A SER 426.A OG LEU 508.A O no hydrogen 2.845 N/A ARG 427.A N GLU 444.A O no hydrogen 2.799 N/A ARG 427.A NE GLU 444.A OE2 no hydrogen 3.113 N/A ARG 427.A NH2 GLU 668.A OE1 no hydrogen 3.020 N/A VAL 429.A N VAL 441.A O no hydrogen 2.932 N/A GLU 431.A N ARG 439.A O no hydrogen 2.905 N/A ARG 433.A N ARG 437.A O no hydrogen 2.779 N/A ARG 433.A NE GLN 438.A O no hydrogen 2.683 N/A ARG 433.A NH1 VAL 489.A O no hydrogen 2.468 N/A ARG 437.A N GLY 434.A O no hydrogen 3.253 N/A ARG 439.A N GLU 431.A O no hydrogen 2.642 N/A ARG 439.A NE GLU 431.A OE2 no hydrogen 2.728 N/A ARG 439.A NH2 GLU 431.A OE2 no hydrogen 2.985 N/A ILE 440.A N ILE 487.A O no hydrogen 2.853 N/A VAL 441.A N VAL 429.A O no hydrogen 2.797 N/A VAL 442.A N VAL 485.A O no hydrogen 2.792 N/A THR 443.A N ARG 427.A O no hydrogen 2.883 N/A VAL 449.A N PRO 446.A O no hydrogen 3.300 N/A ASN 450.A ND2 ASP 295.A O no hydrogen 2.962 N/A LYS 451.A N MET 294.A O no hydrogen 3.126 N/A LYS 451.A NZ ASP 295.A OD1 no hydrogen 3.169 N/A LYS 451.A NZ ASP 475.A OD2 no hydrogen 2.684 N/A ARG 453.A N ASN 450.A OD1 no hydrogen 3.047 N/A MET 454.A N ASN 450.A O no hydrogen 2.898 N/A ILE 455.A N LYS 451.A O no hydrogen 2.928 N/A GLU 456.A N.A ALA 452.A O no hydrogen 2.971 N/A GLU 456.A N.B ALA 452.A O no hydrogen 3.026 N/A LYS 457.A N ARG 453.A O no hydrogen 3.118 N/A ILE 458.A N MET 454.A O no hydrogen 3.257 N/A ALA 459.A N ILE 455.A O no hydrogen 2.972 N/A GLU 460.A N GLU 456.A O.A no hydrogen 2.880 N/A GLU 460.A N GLU 456.A O.B no hydrogen 2.842 N/A LEU 461.A N LYS 457.A O no hydrogen 3.005 N/A VAL 462.A N ILE 458.A O no hydrogen 3.100 N/A ARG 463.A N ALA 459.A O no hydrogen 3.027 N/A ARG 463.A NH2 GLU 456.A OE2.B no hydrogen 3.503 N/A ASP 464.A N GLU 460.A O no hydrogen 3.003 N/A LYS 465.A N VAL 462.A O no hydrogen 3.239 N/A LYS 466.A N LEU 461.A O no hydrogen 2.871 N/A THR 471.A N ASP 488.A O no hydrogen 3.045 N/A LEU 473.A N ASP 472.A OD1 no hydrogen 2.991 N/A ARG 474.A N VAL 486.A O no hydrogen 2.976 N/A ARG 474.A NE GLU 476.A OE2 no hydrogen 3.185 N/A ARG 474.A NH1 ASP 472.A OD2 no hydrogen 3.097 N/A ARG 474.A NH1 ASP 488.A OD2 no hydrogen 3.091 N/A ARG 474.A NH2 GLU 476.A OE2 no hydrogen 2.918 N/A GLU 476.A N ARG 484.A O no hydrogen 2.839 N/A THR 477.A N ASP 475.A OD1 no hydrogen 3.142 N/A THR 477.A OG1 ASP 475.A OD1 no hydrogen 2.614 N/A SER 478.A N GLY 482.A O no hydrogen 3.320 N/A THR 481.A N SER 478.A OG no hydrogen 3.009 N/A THR 481.A OG1 GLY 482.A O no hydrogen 3.076 N/A GLY 482.A N SER 478.A O no hydrogen 2.887 N/A ARG 484.A N THR 477.A OG1 no hydrogen 3.001 N/A ARG 484.A NE GLU 476.A OE1 no hydrogen 2.754 N/A VAL 485.A N VAL 442.A O no hydrogen 2.860 N/A VAL 486.A N ARG 474.A O no hydrogen 2.937 N/A ILE 487.A N ILE 440.A O no hydrogen 2.867 N/A ASP 488.A N ASP 472.A O no hydrogen 2.962 N/A VAL 489.A N GLN 438.A O no hydrogen 3.137 N/A ARG 490.A N GLY 469.A O no hydrogen 2.875 N/A ARG 490.A NH1 ASP 468.A OD1 no hydrogen 3.414 N/A ARG 490.A NH2 ASP 468.A OD2 no hydrogen 3.095 N/A ALA 493.A N ARG 490.A O no hydrogen 3.012 N/A VAL 497.A N ASN 494.A OD1 no hydrogen 3.261 N/A ILE 498.A N ASN 494.A O no hydrogen 3.181 N/A LEU 499.A N ALA 495.A O no hydrogen 3.029 N/A ASN 500.A N SER 496.A O no hydrogen 2.970 N/A ASN 501.A N VAL 497.A O no hydrogen 3.085 N/A LEU 502.A N ILE 498.A O no hydrogen 2.991 N/A TYR 503.A N LEU 499.A O no hydrogen 3.071 N/A LYS 504.A N ASN 500.A O no hydrogen 3.219 N/A GLN 505.A N ASN 501.A O no hydrogen 2.913 N/A GLN 505.A NE2 ASN 501.A O no hydrogen 3.308 N/A THR 506.A N LEU 502.A O no hydrogen 3.010 N/A THR 506.A OG1 LEU 502.A O no hydrogen 2.442 N/A LEU 508.A N THR 506.A OG1 no hydrogen 3.222 N/A GLN 509.A N THR 506.A O no hydrogen 3.498 N/A GLN 509.A NE2 GLN 423.A OE1 no hydrogen 2.839 N/A THR 510.A N MET 424.A O no hydrogen 2.908 N/A THR 510.A OG1 PRO 507.A O no hydrogen 2.970 N/A SER 511.A OG SER 421.A OG no hydrogen 2.869 N/A PHE 512.A N ILE 422.A O no hydrogen 2.898 N/A VAL 514.A N GLY 420.A O no hydrogen 2.786 N/A ASN 515.A N ASN 363.A O no hydrogen 2.950 N/A MET 516.A N GLY 418.A O no hydrogen 2.810 N/A ILE 517.A N THR 362.A OG1 no hydrogen 3.156 N/A ALA 518.A N LYS 525.A O no hydrogen 3.107 N/A LEU 519.A N PRO 217.A O no hydrogen 2.907 N/A VAL 520.A N ARG 523.A O no hydrogen 2.863 N/A ARG 523.A N VAL 520.A O no hydrogen 3.170 N/A LYS 525.A N ALA 518.A O no hydrogen 2.999 N/A LYS 525.A NZ GLU 531.A OE1 no hydrogen 3.185 N/A LYS 525.A NZ GLU 531.A OE2 no hydrogen 3.139 N/A ILE 527.A N MET 516.A O no hydrogen 2.898 N/A ASN 528.A ND2 GLU 416.A O no hydrogen 3.172 N/A LEU 529.A N TYR 415.A O no hydrogen 2.876 N/A LYS 530.A NZ PRO 383.A O no hydrogen 2.851 N/A LYS 530.A NZ ILE 385.A O no hydrogen 2.742 N/A GLU 531.A N ASN 528.A OD1 no hydrogen 3.049 N/A ALA 532.A N ASN 528.A O no hydrogen 3.184 N/A LEU 533.A N LEU 529.A O no hydrogen 3.118 N/A VAL 534.A N LYS 530.A O no hydrogen 2.857 N/A HIS 535.A N GLU 531.A O no hydrogen 3.100 N/A HIS 535.A NE2 GLU 531.A OE2 no hydrogen 2.962 N/A TYR 536.A N ALA 532.A O no hydrogen 3.227 N/A TYR 536.A OH ALA 343.A O no hydrogen 2.868 N/A LEU 537.A N LEU 533.A O no hydrogen 2.818 N/A GLU 538.A N VAL 534.A O no hydrogen 2.942 N/A HIS 539.A N HIS 535.A O no hydrogen 3.065 N/A HIS 539.A NE2 LEU 341.A O no hydrogen 2.926 N/A GLN 540.A N TYR 536.A O no hydrogen 3.087 N/A GLN 540.A NE2 PRO 342.A O no hydrogen 3.070 N/A LYS 541.A N LEU 537.A O no hydrogen 2.950 N/A LYS 541.A NZ GLU 538.A OE2 no hydrogen 3.027 N/A THR 542.A N GLU 538.A O no hydrogen 2.925 N/A THR 542.A OG1 GLU 538.A O no hydrogen 3.103 N/A VAL 543.A N HIS 539.A O no hydrogen 2.785 N/A VAL 544.A N GLN 540.A O no hydrogen 3.037 N/A ARG 545.A N LYS 541.A O no hydrogen 2.881 N/A ARG 546.A N THR 542.A O no hydrogen 3.006 N/A ARG 546.A NE ASP 323.A O no hydrogen 2.740 N/A ARG 546.A NH1 ASP 326.A OD1 no hydrogen 2.777 N/A ARG 546.A NH2 ASP 323.A O no hydrogen 3.400 N/A ARG 546.A NH2 ASP 323.A OD1 no hydrogen 2.998 N/A ARG 546.A NH2 ASP 326.A OD1 no hydrogen 2.796 N/A ARG 547.A N VAL 543.A O no hydrogen 2.813 N/A ARG 547.A NH1 ASP 319.A OD2 no hydrogen 3.082 N/A ARG 547.A NH1 GLU 653.A OE1 no hydrogen 3.052 N/A ARG 547.A NH1 GLU 653.A OE2 no hydrogen 3.280 N/A ARG 547.A NH2 GLU 653.A OE2 no hydrogen 2.890 N/A THR 548.A N VAL 544.A O no hydrogen 2.878 N/A THR 548.A OG1 VAL 544.A O no hydrogen 2.863 N/A GLN 549.A N ARG 545.A O no hydrogen 3.009 N/A TYR 550.A N ARG 546.A O no hydrogen 2.954 N/A ASN 551.A N ARG 547.A O no hydrogen 2.927 N/A LEU 552.A N THR 548.A O no hydrogen 2.930 N/A ARG 553.A N GLN 549.A O no hydrogen 2.994 N/A ARG 553.A NH2 ASP 323.A OD2 no hydrogen 3.077 N/A LYS 554.A N TYR 550.A O no hydrogen 2.895 N/A ALA 555.A N ASN 551.A O no hydrogen 2.783 N/A LYS 556.A N LEU 552.A O no hydrogen 3.004 N/A ASP 557.A N ARG 553.A O no hydrogen 3.063 N/A ARG 558.A N LYS 554.A O no hydrogen 3.034 N/A ARG 558.A NE GLU 625.A OE1 no hydrogen 2.862 N/A ARG 558.A NH2 GLU 625.A OE1 no hydrogen 3.360 N/A ARG 558.A NH2 GLU 625.A OE2 no hydrogen 2.949 N/A ALA 559.A N ALA 555.A O no hydrogen 2.916 N/A HIS 560.A N LYS 556.A O no hydrogen 3.086 N/A HIS 560.A NE2 SER 599.A OG no hydrogen 2.687 N/A ILE 561.A N ASP 557.A O no hydrogen 3.226 N/A LEU 562.A N ARG 558.A O no hydrogen 3.091 N/A GLU 563.A N ALA 559.A O no hydrogen 2.999 N/A GLY 564.A N HIS 560.A O no hydrogen 3.290 N/A LEU 565.A N ILE 561.A O no hydrogen 2.899 N/A ARG 566.A N.A LEU 562.A O no hydrogen 2.807 N/A ARG 566.A N.B LEU 562.A O no hydrogen 2.837 N/A ARG 566.A NE.B ARG 566.A O.B no hydrogen 3.108 N/A ARG 566.A NE.B ASP 570.A OD1 no hydrogen 3.132 N/A ARG 566.A NH1.B ARG 619.A O.A no hydrogen 2.903 N/A ARG 566.A NH1.B GLU 623.A OE1 no hydrogen 3.420 N/A ARG 566.A NH2.B ASP 570.A OD1 no hydrogen 3.307 N/A ILE 567.A N GLU 563.A O no hydrogen 3.227 N/A ALA 568.A N GLY 564.A O no hydrogen 3.011 N/A LEU 569.A N LEU 565.A O no hydrogen 2.977 N/A ASP 570.A N ARG 566.A O.A no hydrogen 3.032 N/A ASP 570.A N ARG 566.A O.B no hydrogen 3.019 N/A HIS 571.A N ILE 567.A O no hydrogen 3.235 N/A HIS 571.A N ALA 568.A O no hydrogen 3.355 N/A ILE 575.A N HIS 571.A O no hydrogen 3.059 N/A ILE 576.A N ILE 572.A O no hydrogen 3.027 N/A SER 577.A N ASP 573.A O no hydrogen 3.081 N/A SER 577.A OG GLU 574.A O no hydrogen 3.469 N/A THR 578.A N GLU 574.A O no hydrogen 2.909 N/A THR 578.A OG1 GLU 574.A O no hydrogen 2.739 N/A ILE 579.A N ILE 575.A O no hydrogen 3.078 N/A ARG 580.A N ILE 576.A O no hydrogen 2.801 N/A GLU 581.A N SER 577.A O no hydrogen 3.052 N/A SER 582.A N ILE 579.A O no hydrogen 2.967 N/A SER 582.A OG THR 578.A O no hydrogen 2.852 N/A VAL 587.A N THR 584.A OG1 no hydrogen 3.388 N/A ALA 588.A N THR 584.A O no hydrogen 3.121 N/A MET 589.A N ASP 585.A O no hydrogen 3.068 N/A GLU 590.A N LYS 586.A O no hydrogen 3.138 N/A SER 591.A N VAL 587.A O no hydrogen 2.949 N/A SER 591.A OG VAL 587.A O no hydrogen 3.167 N/A LEU 592.A N ALA 588.A O no hydrogen 2.893 N/A GLN 593.A N MET 589.A O no hydrogen 3.058 N/A GLN 593.A NE2 MET 589.A O no hydrogen 3.254 N/A GLN 594.A N GLU 590.A O no hydrogen 3.056 N/A ARG 595.A N SER 591.A O no hydrogen 3.044 N/A ARG 595.A NH1 THR 578.A OG1 no hydrogen 2.726 N/A PHE 596.A N LEU 592.A O no hydrogen 2.879 N/A LEU 598.A N GLN 593.A O no hydrogen 3.126 N/A SER 599.A N GLN 602.A OE1 no hydrogen 2.900 N/A SER 599.A OG HIS 560.A NE2 no hydrogen 2.687 N/A GLN 602.A N SER 599.A OG no hydrogen 3.276 N/A GLN 602.A NE2 HIS 560.A O no hydrogen 2.761 N/A ALA 603.A N SER 599.A O no hydrogen 3.055 N/A GLN 604.A N GLU 600.A O no hydrogen 3.216 N/A ALA 605.A N LYS 601.A O no hydrogen 3.162 N/A ILE 606.A N GLN 602.A O no hydrogen 2.964 N/A LEU 607.A N ALA 603.A O no hydrogen 2.972 N/A ASP 608.A N GLN 604.A O no hydrogen 2.875 N/A MET 609.A N ILE 606.A O no hydrogen 3.115 N/A ARG 613.A N ARG 610.A O no hydrogen 3.048 N/A LEU 614.A N LEU 611.A O no hydrogen 2.998 N/A THR 615.A OG1 ARG 612.A O no hydrogen 3.252 N/A ARG 619.A N.B THR 615.A O no hydrogen 3.229 N/A ARG 619.A NE.A ASP 570.A OD1 no hydrogen 2.835 N/A ARG 619.A NH1.A ARG 619.A O.A no hydrogen 2.843 N/A ARG 619.A NH1.A GLU 623.A OE1 no hydrogen 3.431 N/A ARG 619.A NH2.A ASP 570.A OD1 no hydrogen 3.541 N/A ARG 619.A NH2.A ASP 570.A OD2 no hydrogen 3.403 N/A ASP 620.A N.B GLY 616.A O.B no hydrogen 3.079 N/A LYS 621.A N.A LEU 617.A O.A no hydrogen 2.998 N/A LYS 621.A N.B LEU 617.A O.A no hydrogen 2.349 N/A LYS 621.A N.B LEU 617.A O.B no hydrogen 3.223 N/A LYS 621.A NZ.B GLU 618.A OE1.B no hydrogen 2.485 N/A ILE 622.A N GLU 618.A O.A no hydrogen 2.657 N/A ILE 622.A N ARG 619.A O.B no hydrogen 3.034 N/A GLU 623.A N ARG 619.A O.A no hydrogen 3.173 N/A ALA 624.A N ASP 620.A O.A no hydrogen 2.565 N/A ALA 624.A N ASP 620.A O.B no hydrogen 3.479 N/A GLU 625.A N LYS 621.A O.A no hydrogen 3.171 N/A GLU 625.A N LYS 621.A O.B no hydrogen 3.023 N/A TYR 626.A N ILE 622.A O no hydrogen 2.942 N/A TYR 626.A OH GLU 563.A OE2 no hydrogen 2.751 N/A ASN 627.A N GLU 623.A O no hydrogen 2.959 N/A GLU 628.A N ALA 624.A O no hydrogen 3.298 N/A LEU 629.A N GLU 625.A O no hydrogen 3.060 N/A LEU 630.A N TYR 626.A O no hydrogen 3.363 N/A ASN 631.A N.A ASN 627.A O no hydrogen 3.336 N/A ASN 631.A N.B ASN 627.A O no hydrogen 3.351 N/A TYR 632.A N GLU 628.A O no hydrogen 2.836 N/A ILE 633.A N LEU 629.A O no hydrogen 2.604 N/A SER 634.A N LEU 630.A O no hydrogen 3.214 N/A GLU 635.A N.A ASN 631.A O.A no hydrogen 3.082 N/A GLU 635.A N.A ASN 631.A O.B no hydrogen 2.961 N/A GLU 635.A N.B ASN 631.A O.A no hydrogen 3.108 N/A GLU 635.A N.B ASN 631.A O.B no hydrogen 2.990 N/A LEU 636.A N TYR 632.A O no hydrogen 3.002 N/A GLU 637.A N ILE 633.A O no hydrogen 3.010 N/A THR 638.A N SER 634.A O no hydrogen 3.149 N/A THR 638.A OG1 SER 634.A O no hydrogen 3.100 N/A ILE 639.A N GLU 635.A O.A no hydrogen 3.408 N/A ILE 639.A N GLU 635.A O.B no hydrogen 3.292 N/A LEU 640.A N LEU 636.A O no hydrogen 3.187 N/A ALA 641.A N GLU 637.A O no hydrogen 2.956 N/A ASP 642.A N THR 638.A O no hydrogen 3.308 N/A GLU 644.A N ASP 642.A OD1 no hydrogen 3.005 N/A LEU 646.A N ASP 642.A O no hydrogen 3.102 N/A LEU 647.A N GLU 643.A O no hydrogen 2.787 N/A GLN 648.A N GLU 644.A O no hydrogen 2.895 N/A GLN 648.A NE2 ASP 652.A OD1 no hydrogen 3.072 N/A LEU 649.A N VAL 645.A O no hydrogen 3.065 N/A VAL 650.A N LEU 646.A O no hydrogen 3.147 N/A ARG 651.A N LEU 647.A O no hydrogen 2.924 N/A ARG 651.A NE SER 380.A OG no hydrogen 2.834 N/A ARG 651.A NH1 GLU 644.A OE1 no hydrogen 3.133 N/A ARG 651.A NH1 GLN 648.A OE1 no hydrogen 2.378 N/A ARG 651.A NH2 SER 380.A O no hydrogen 3.275 N/A ARG 651.A NH2 GLU 644.A OE1 no hydrogen 3.520 N/A ASP 652.A N GLN 648.A O no hydrogen 2.792 N/A GLU 653.A N LEU 649.A O no hydrogen 2.961 N/A LEU 654.A N VAL 650.A O no hydrogen 3.038 N/A THR 655.A N ARG 651.A O no hydrogen 2.994 N/A THR 655.A OG1 ARG 651.A O no hydrogen 2.890 N/A GLU 656.A N.A ASP 652.A O no hydrogen 3.002 N/A GLU 656.A N.B ASP 652.A O no hydrogen 3.010 N/A ILE 657.A N GLU 653.A O no hydrogen 3.083 N/A ARG 658.A N LEU 654.A O no hydrogen 2.889 N/A ARG 658.A NE ASP 659.A OD1 no hydrogen 3.452 N/A ARG 658.A NH1 ASN 374.A OD1 no hydrogen 2.748 N/A ARG 658.A NH2 ASP 659.A OD1 no hydrogen 3.113 N/A ASP 659.A N THR 655.A O no hydrogen 3.057 N/A ARG 660.A N.A GLU 656.A O.A no hydrogen 2.912 N/A ARG 660.A N.A GLU 656.A O.B no hydrogen 2.869 N/A ARG 660.A N.A ILE 657.A O no hydrogen 3.229 N/A ARG 660.A N.B GLU 656.A O.A no hydrogen 2.877 N/A ARG 660.A N.B GLU 656.A O.B no hydrogen 2.836 N/A ARG 660.A NH2.A GLU 656.A OE2.A no hydrogen 2.359 N/A PHE 661.A N ILE 657.A O no hydrogen 2.971 N/A GLY 662.A N ARG 658.A O no hydrogen 2.778 N/A ARG 665.A NE GLU 371.A OE2 no hydrogen 2.893 N/A ARG 665.A NH1 PRO 397.A O no hydrogen 3.180 N/A ARG 665.A NH1 THR 667.A O no hydrogen 2.790 N/A ARG 665.A NH2 GLU 371.A OE1 no hydrogen 2.974 N/A ARG 665.A NH2 GLU 371.A OE2 no hydrogen 3.267 N/A ARG 665.A NH2 GLY 396.A O no hydrogen 3.146 N/A ARG 666.A N ASP 398.A OD1 no hydrogen 2.873 N/A ARG 666.A NH1 PRO 400.A O no hydrogen 3.077 N/A THR 667.A N ASP 398.A OD1 no hydrogen 2.839 N/A THR 667.A OG1 ALA 402.A O no hydrogen 2.928 N/A GLU 668.A N GLY 403.A O no hydrogen 2.819 N/A GLN 670.A N ILE 405.A O no hydrogen 2.915 N/A GLN 670.A NE2 GLU 668.A OE2 no hydrogen 3.064 N/A