Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1j3b_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LEU 6.A N LEU 3.A O no hydrogen 2.758 N/A GLY 7.A N GLU 4.A O no hydrogen 2.838 N/A HIS 9.A N SER 94.A OG no hydrogen 2.996 N/A LYS 11.A N SER 94.A O no hydrogen 2.812 N/A ARG 13.A N ASP 97.A OD2 no hydrogen 3.255 N/A ARG 13.A NE ASP 97.A OD2 no hydrogen 3.561 N/A ARG 13.A NH2 ASP 97.A OD1 no hydrogen 2.752 N/A PHE 15.A N LEU 98.A O no hydrogen 2.760 N/A ASN 17.A N VAL 100.A O no hydrogen 2.737 N/A ASN 17.A ND2 ASP 102.A OD2 no hydrogen 3.462 N/A LEU 23.A N VAL 19.A O no hydrogen 3.125 N/A VAL 24.A N SER 20.A O no hydrogen 2.897 N/A GLU 25.A N PRO 21.A O no hydrogen 2.950 N/A HIS 26.A N VAL 22.A O no hydrogen 2.930 N/A HIS 26.A ND1 TYR 99.A OH no hydrogen 2.632 N/A THR 27.A N LEU 23.A O no hydrogen 2.954 N/A THR 27.A OG1 LEU 23.A O no hydrogen 2.813 N/A LEU 28.A N VAL 24.A O no hydrogen 2.917 N/A LEU 29.A N GLU 25.A O no hydrogen 2.907 N/A ARG 30.A N HIS 26.A O no hydrogen 2.863 N/A ARG 30.A NE GLU 32.A OE1 no hydrogen 3.475 N/A ARG 30.A NE GLU 32.A OE2 no hydrogen 2.817 N/A ARG 30.A NH2 GLU 32.A OE1 no hydrogen 2.966 N/A ARG 30.A NH2 GLU 32.A OE2 no hydrogen 3.514 N/A GLY 31.A N LEU 28.A O no hydrogen 2.941 N/A GLU 32.A N THR 27.A O no hydrogen 2.902 N/A LEU 34.A N VAL 42.A O no hydrogen 3.111 N/A ALA 36.A N PRO 40.A O no hydrogen 2.871 N/A HIS 37.A N ARG 298.A O no hydrogen 2.828 N/A GLY 39.A N ALA 36.A O no hydrogen 2.900 N/A LEU 41.A N ALA 286.A O no hydrogen 2.794 N/A VAL 42.A N LEU 34.A O no hydrogen 2.737 N/A VAL 43.A N LEU 288.A O no hydrogen 2.905 N/A THR 45.A N ASN 290.A OD1 no hydrogen 2.727 N/A THR 45.A OG1 TYR 48.A O no hydrogen 2.713 N/A THR 46.A N ASP 44.A OD1 no hydrogen 2.765 N/A THR 46.A OG1 ASP 44.A OD1 no hydrogen 2.619 N/A TYR 48.A N THR 45.A O no hydrogen 3.046 N/A SER 52.A N GLU 187.A OE2 no hydrogen 2.722 N/A ASP 55.A N SER 52.A O no hydrogen 2.923 N/A LYS 56.A N PRO 53.A O no hydrogen 3.273 N/A LYS 56.A NZ THR 194.A OG1 no hydrogen 2.623 N/A LYS 56.A NZ PRO 381.A O no hydrogen 3.367 N/A PHE 57.A N VAL 168.A O no hydrogen 2.762 N/A VAL 58.A N GLN 75.A O no hydrogen 2.931 N/A VAL 59.A N ILE 170.A O no hydrogen 2.884 N/A ARG 60.A N PHE 77.A O no hydrogen 2.779 N/A ARG 60.A NE GLU 65.A OE2 no hydrogen 2.630 N/A GLU 63.A N GLU 63.A OE1 no hydrogen 2.738 N/A VAL 64.A N GLU 61.A O no hydrogen 2.959 N/A GLU 65.A N GLU 61.A O no hydrogen 2.747 N/A GLU 67.A N VAL 64.A O no hydrogen 2.911 N/A ILE 68.A N VAL 64.A O no hydrogen 2.981 N/A TRP 69.A N PRO 384.A O no hydrogen 2.882 N/A TRP 70.A N ILE 68.A O no hydrogen 3.028 N/A TRP 70.A NE1 GLU 65.A O no hydrogen 2.918 N/A GLY 71.A N ASN 74.A O no hydrogen 2.932 N/A ASN 74.A ND2 TRP 69.A O no hydrogen 2.934 N/A ASN 74.A ND2 LEU 383.A O no hydrogen 2.790 N/A GLN 75.A NE2 LYS 54.A O no hydrogen 2.847 N/A GLN 75.A NE2 LYS 56.A O no hydrogen 3.146 N/A PHE 77.A N VAL 58.A O no hydrogen 3.127 N/A PHE 82.A N ALA 78.A O no hydrogen 2.917 N/A GLU 83.A N PRO 79.A O no hydrogen 2.993 N/A ALA 84.A N GLU 80.A O no hydrogen 3.006 N/A LEU 85.A N ALA 81.A O no hydrogen 3.142 N/A TYR 86.A N PHE 82.A O no hydrogen 2.722 N/A TYR 86.A OH LEU 6.A O no hydrogen 2.647 N/A GLN 87.A N GLU 83.A O no hydrogen 2.803 N/A GLN 87.A NE2 GLU 83.A OE1 no hydrogen 2.907 N/A GLN 87.A NE2 GLU 83.A OE2 no hydrogen 3.557 N/A ARG 88.A N ALA 84.A O no hydrogen 3.240 N/A VAL 89.A N LEU 85.A O no hydrogen 2.985 N/A VAL 90.A N TYR 86.A O no hydrogen 2.949 N/A GLN 91.A N GLN 87.A O no hydrogen 3.094 N/A TYR 92.A N ARG 88.A O no hydrogen 3.006 N/A TYR 92.A OH GLU 120.A OE2 no hydrogen 2.769 N/A LEU 93.A N VAL 89.A O no hydrogen 2.796 N/A SER 94.A N VAL 90.A O no hydrogen 3.012 N/A SER 94.A OG VAL 90.A O no hydrogen 2.630 N/A GLU 95.A N TYR 92.A O no hydrogen 3.196 N/A ARG 96.A N LEU 93.A O no hydrogen 3.178 N/A ARG 96.A NE TYR 92.A O no hydrogen 3.019 N/A ARG 96.A NH2 TYR 92.A O no hydrogen 3.427 N/A LEU 98.A N ARG 13.A O no hydrogen 2.968 N/A TYR 99.A N THR 119.A O no hydrogen 2.720 N/A TYR 99.A OH HIS 26.A ND1 no hydrogen 2.632 N/A VAL 100.A N PHE 15.A O no hydrogen 2.829 N/A GLN 101.A N VAL 117.A O no hydrogen 2.899 N/A GLN 101.A NE2 THR 18.A O no hydrogen 2.962 N/A ASP 102.A N ASN 17.A OD1 no hydrogen 2.752 N/A LEU 103.A N VAL 115.A O no hydrogen 2.751 N/A TYR 104.A N ILE 133.A O no hydrogen 2.915 N/A ALA 105.A N LEU 113.A O no hydrogen 2.990 N/A GLY 106.A N PHE 258.A O no hydrogen 2.785 N/A ALA 107.A N ASN 257.A O no hydrogen 2.829 N/A ARG 110.A N ASP 108.A OD2 no hydrogen 2.950 N/A ARG 110.A NH1 GLU 252.A OE1 no hydrogen 2.611 N/A ARG 110.A NH1 ASP 253.A OD2 no hydrogen 3.364 N/A ARG 110.A NH2 GLU 252.A OE1 no hydrogen 2.934 N/A TYR 111.A N ASP 108.A O no hydrogen 2.919 N/A ARG 112.A N ASP 108.A O no hydrogen 3.088 N/A LEU 113.A N ALA 105.A O no hydrogen 2.876 N/A VAL 115.A N LEU 103.A O no hydrogen 2.665 N/A ARG 116.A N PHE 145.A O no hydrogen 3.023 N/A ARG 116.A NE ASP 102.A OD1 no hydrogen 2.658 N/A ARG 116.A NH2 ASP 102.A OD1 no hydrogen 3.049 N/A ARG 116.A NH2 ASP 102.A OD2 no hydrogen 3.251 N/A VAL 117.A N GLN 101.A O no hydrogen 2.867 N/A VAL 118.A N VAL 147.A O no hydrogen 2.839 N/A THR 119.A N TYR 99.A O no hydrogen 2.872 N/A THR 119.A OG1 HIS 149.A ND1 no hydrogen 2.941 N/A THR 119.A OG1 HIS 149.A O no hydrogen 3.433 N/A GLU 120.A N HIS 149.A O no hydrogen 3.415 N/A SER 121.A N THR 119.A OG1 no hydrogen 2.945 N/A SER 121.A OG HIS 124.A ND1 no hydrogen 2.660 N/A HIS 124.A N SER 121.A O no hydrogen 3.139 N/A HIS 124.A ND1 SER 121.A OG no hydrogen 2.660 N/A HIS 124.A NE2 LYS 183.A O no hydrogen 2.689 N/A ALA 125.A N SER 121.A O no hydrogen 3.104 N/A LEU 126.A N PRO 122.A O no hydrogen 2.996 N/A PHE 127.A N TRP 123.A O no hydrogen 2.832 N/A ALA 128.A N HIS 124.A O no hydrogen 3.016 N/A ARG 129.A N ALA 125.A O no hydrogen 3.024 N/A ARG 129.A NH1 GLN 101.A OE1 no hydrogen 2.918 N/A ASN 130.A N LEU 126.A O no hydrogen 2.838 N/A ASN 130.A ND2 GLU 285.A O no hydrogen 2.924 N/A ASN 130.A ND2 SER 314.A OG no hydrogen 3.270 N/A MET 131.A N PHE 127.A O no hydrogen 2.719 N/A PHE 132.A N ALA 128.A O no hydrogen 2.945 N/A ILE 133.A N TYR 104.A O no hydrogen 2.880 N/A ARG 137.A N LEU 134.A O no hydrogen 2.900 N/A PHE 138.A N PRO 135.A O no hydrogen 3.022 N/A GLY 139.A N ARG 136.A O no hydrogen 3.082 N/A GLY 144.A N ALA 114.A O no hydrogen 2.619 N/A PHE 145.A N ALA 114.A O no hydrogen 3.138 N/A THR 146.A N ARG 175.A O no hydrogen 2.997 N/A VAL 147.A N ARG 116.A O no hydrogen 2.821 N/A VAL 148.A N VAL 177.A O no hydrogen 2.765 N/A HIS 149.A N VAL 118.A O no hydrogen 2.721 N/A HIS 149.A ND1 THR 119.A OG1 no hydrogen 2.941 N/A ALA 150.A N ILE 179.A O no hydrogen 2.807 N/A TYR 152.A N GLU 120.A OE1 no hydrogen 2.785 N/A TYR 152.A OH GLU 32.A OE1 no hydrogen 2.835 N/A PHE 153.A N ALA 150.A O no hydrogen 3.024 N/A ALA 155.A N GLU 165.A O no hydrogen 2.993 N/A VAL 156.A N ASP 160.A OD1 no hydrogen 2.764 N/A ARG 159.A NE ASP 160.A OD2 no hydrogen 2.735 N/A ARG 159.A NH2 ASP 160.A OD1 no hydrogen 2.999 N/A ASP 160.A N VAL 156.A O no hydrogen 2.606 N/A GLY 161.A N PRO 157.A O no hydrogen 2.737 N/A THR 162.A OG1 SER 164.A O no hydrogen 2.754 N/A ARG 163.A NE LYS 54.A O no hydrogen 3.360 N/A ARG 163.A NE ASP 55.A OD1 no hydrogen 2.981 N/A ARG 163.A NH2 ASP 55.A OD2 no hydrogen 2.905 N/A SER 164.A OG ASP 55.A OD1 no hydrogen 2.662 N/A VAL 166.A N SER 164.A OG no hydrogen 3.283 N/A PHE 167.A N VAL 180.A O no hydrogen 3.030 N/A VAL 168.A N ASP 55.A O no hydrogen 2.969 N/A GLY 169.A N LEU 178.A O no hydrogen 2.825 N/A ILE 170.A N PHE 57.A O no hydrogen 2.919 N/A SER 171.A N LEU 176.A O no hydrogen 2.798 N/A SER 171.A OG GLU 61.A OE1 no hydrogen 2.556 N/A GLN 173.A N GLU 61.A OE2 no hydrogen 2.981 N/A ARG 174.A N SER 171.A OG no hydrogen 3.134 N/A ARG 174.A NH1 GLU 83.A OE2 no hydrogen 2.794 N/A ARG 174.A NH2 GLU 83.A OE2 no hydrogen 3.008 N/A LEU 176.A N SER 171.A O no hydrogen 2.979 N/A VAL 177.A N THR 146.A O no hydrogen 2.887 N/A LEU 178.A N GLY 169.A O no hydrogen 2.735 N/A ILE 179.A N VAL 148.A O no hydrogen 2.978 N/A VAL 180.A N PHE 167.A O no hydrogen 2.957 N/A TYR 184.A N THR 182.A OG1 no hydrogen 3.253 N/A ALA 185.A N GLU 289.A OE2 no hydrogen 2.904 N/A GLU 187.A N TYR 184.A O no hydrogen 3.285 N/A ILE 188.A N ALA 185.A O no hydrogen 2.968 N/A LYS 189.A N ALA 185.A O no hydrogen 3.461 N/A LYS 189.A NZ ASP 246.A OD2 no hydrogen 3.067 N/A LYS 189.A NZ GLU 247.A OE2 no hydrogen 3.275 N/A LYS 189.A NZ GLU 259.A OE2 no hydrogen 2.617 N/A LYS 190.A N GLY 186.A O no hydrogen 2.832 N/A LYS 190.A NZ ASP 246.A OD2 no hydrogen 2.754 N/A LYS 190.A NZ GLU 247.A OE2 no hydrogen 3.378 N/A SER 191.A N GLU 187.A O no hydrogen 3.072 N/A SER 191.A OG GLU 187.A O no hydrogen 3.008 N/A SER 191.A OG ILE 188.A O no hydrogen 2.992 N/A ILE 192.A N ILE 188.A O no hydrogen 3.270 N/A PHE 193.A N LYS 189.A O no hydrogen 3.075 N/A THR 194.A N LYS 190.A O no hydrogen 2.898 N/A THR 194.A OG1 LYS 190.A O no hydrogen 2.899 N/A VAL 195.A N SER 191.A O no hydrogen 3.051 N/A MET 196.A N ILE 192.A O no hydrogen 2.936 N/A ASN 197.A N PHE 193.A O no hydrogen 2.868 N/A ASN 197.A ND2 PHE 382.A O no hydrogen 2.854 N/A TYR 198.A N THR 194.A O no hydrogen 3.237 N/A TYR 198.A N VAL 195.A O no hydrogen 3.068 N/A TYR 198.A OH GLU 67.A OE1 no hydrogen 2.637 N/A LEU 199.A N VAL 195.A O no hydrogen 2.915 N/A MET 200.A N MET 196.A O no hydrogen 2.800 N/A LYS 202.A N LEU 199.A O no hydrogen 3.115 N/A LYS 202.A NZ GLU 67.A OE2 no hydrogen 3.120 N/A LYS 202.A NZ TYR 198.A O no hydrogen 2.852 N/A ARG 203.A N MET 200.A O no hydrogen 2.836 N/A GLY 204.A N PRO 201.A O no hydrogen 2.971 N/A VAL 205.A N MET 200.A O no hydrogen 2.928 N/A PHE 206.A N TRP 250.A O no hydrogen 3.048 N/A MET 208.A N HIS 248.A O no hydrogen 2.652 N/A HIS 209.A ND1 PHE 378.A O no hydrogen 2.649 N/A SER 211.A N PHE 223.A O no hydrogen 2.991 N/A SER 211.A OG PHE 223.A O no hydrogen 3.565 N/A ALA 212.A N GLY 244.A O no hydrogen 3.002 N/A ASN 213.A N ALA 221.A O no hydrogen 3.010 N/A ASN 213.A ND2 SER 235.A O no hydrogen 2.812 N/A VAL 214.A N PRO 241.A O no hydrogen 2.941 N/A GLY 215.A N ASP 219.A O no hydrogen 2.949 N/A GLY 218.A N GLY 215.A O no hydrogen 2.748 N/A ALA 221.A N ASN 213.A O no hydrogen 2.883 N/A VAL 222.A N ALA 334.A O no hydrogen 3.105 N/A PHE 223.A N SER 211.A O no hydrogen 2.872 N/A PHE 224.A N PHE 336.A O no hydrogen 2.794 N/A THR 229.A N LEU 226.A O no hydrogen 3.168 N/A THR 229.A OG1 LEU 226.A O no hydrogen 2.385 N/A LYS 231.A NZ ASP 246.A OD1 no hydrogen 2.920 N/A LEU 234.A N GLY 230.A O no hydrogen 3.036 N/A SER 235.A N LYS 231.A O no hydrogen 3.189 N/A SER 235.A N THR 232.A O no hydrogen 3.335 N/A SER 235.A OG LYS 231.A O no hydrogen 2.985 N/A SER 235.A OG THR 232.A O no hydrogen 2.930 N/A THR 236.A N THR 233.A O no hydrogen 3.080 N/A THR 236.A OG1 THR 232.A O no hydrogen 2.937 N/A GLU 239.A N ASP 237.A OD1 no hydrogen 2.732 N/A ARG 240.A N ASP 237.A O no hydrogen 2.950 N/A ARG 240.A NE ASN 213.A OD1 no hydrogen 2.791 N/A ARG 240.A NH1 ASP 219.A OD2 no hydrogen 3.143 N/A ARG 240.A NH2 ASN 213.A OD1 no hydrogen 2.982 N/A ARG 240.A NH2 ASP 219.A O no hydrogen 3.010 N/A LEU 242.A N ASN 322.A O no hydrogen 2.930 N/A ILE 243.A N ALA 212.A O no hydrogen 2.784 N/A GLY 244.A N ALA 212.A O no hydrogen 3.305 N/A HIS 248.A N MET 208.A O no hydrogen 2.960 N/A HIS 248.A ND1 ALA 210.A O no hydrogen 2.717 N/A GLY 249.A N PHE 256.A O no hydrogen 2.847 N/A TRP 250.A N PHE 206.A O no hydrogen 2.806 N/A TRP 250.A NE1 HIS 331.A ND1 no hydrogen 2.878 N/A SER 251.A N GLY 254.A O no hydrogen 2.665 N/A SER 251.A OG GLY 254.A O no hydrogen 3.288 N/A ASP 253.A N SER 251.A OG no hydrogen 3.194 N/A GLY 254.A N SER 251.A OG no hydrogen 3.306 N/A VAL 255.A N ALA 329.A O no hydrogen 3.076 N/A VAL 255.A N GLY 330.A O no hydrogen 3.238 N/A PHE 256.A N GLY 249.A O no hydrogen 2.896 N/A ASN 257.A N GLY 327.A O no hydrogen 2.857 N/A ASN 257.A ND2 ILE 243.A O no hydrogen 2.993 N/A PHE 258.A N GLU 247.A O no hydrogen 2.892 N/A GLU 259.A N ASN 257.A OD1 no hydrogen 2.798 N/A GLY 260.A N MET 131.A O no hydrogen 2.809 N/A CYS 262.A N TYR 315.A O no hydrogen 2.848 N/A TYR 263.A OH GLU 289.A OE1 no hydrogen 2.513 N/A ALA 264.A N SER 313.A O no hydrogen 2.902 N/A VAL 266.A N THR 311.A O no hydrogen 2.990 N/A ARG 268.A N TRP 302.A O no hydrogen 2.732 N/A ARG 268.A NH2 GLU 309.A OE2 no hydrogen 3.051 N/A LEU 269.A N VAL 266.A O no hydrogen 2.871 N/A SER 270.A N GLU 274.A OE1 no hydrogen 3.249 N/A HIS 273.A N SER 270.A OG no hydrogen 3.263 N/A GLU 274.A N SER 270.A O no hydrogen 2.933 N/A TYR 278.A N GLU 274.A O no hydrogen 2.846 N/A LYS 279.A N PRO 275.A O no hydrogen 3.017 N/A ALA 280.A N LEU 276.A O no hydrogen 2.969 N/A SER 281.A N ILE 277.A O no hydrogen 2.805 N/A SER 281.A OG ILE 277.A O no hydrogen 2.741 N/A SER 281.A OG SER 313.A OG no hydrogen 2.674 N/A ASN 282.A N LYS 279.A O no hydrogen 3.304 N/A ASN 282.A ND2 TYR 278.A O no hydrogen 2.736 N/A GLN 283.A NE2 LYS 279.A O no hydrogen 3.092 N/A ALA 286.A N GLN 283.A O no hydrogen 3.393 N/A ILE 287.A N SER 314.A O no hydrogen 2.790 N/A LEU 288.A N LEU 41.A O no hydrogen 2.698 N/A GLU 289.A N ARG 312.A O no hydrogen 2.824 N/A ASN 290.A N VAL 43.A O no hydrogen 2.726 N/A ASN 290.A ND2 THR 45.A OG1 no hydrogen 2.847 N/A ASN 294.A N ARG 299.A O no hydrogen 2.964 N/A GLU 296.A N ASN 294.A OD1 no hydrogen 2.888 N/A SER 297.A N ASN 294.A OD1 no hydrogen 3.104 N/A ARG 298.A NE PRO 295.A O no hydrogen 2.982 N/A ARG 298.A NH1 LEU 35.A O no hydrogen 2.723 N/A ARG 299.A N SER 297.A OG no hydrogen 3.196 N/A GLN 301.A N VAL 292.A O no hydrogen 2.713 N/A GLN 301.A NE2 ARG 299.A O no hydrogen 2.965 N/A ASP 304.A N GLN 301.A O no hydrogen 3.163 N/A SER 306.A N ASP 304.A OD2 no hydrogen 2.742 N/A SER 306.A OG ASP 304.A OD1 no hydrogen 3.451 N/A SER 306.A OG ASP 304.A OD2 no hydrogen 2.516 N/A LYS 307.A NZ ASP 44.A OD2 no hydrogen 2.652 N/A ASN 310.A N THR 308.A OG1 no hydrogen 2.868 N/A ASN 310.A ND2 THR 49.A O no hydrogen 2.727 N/A ASN 310.A ND2 TYR 184.A OH no hydrogen 2.981 N/A ARG 312.A N GLU 289.A O no hydrogen 3.221 N/A ARG 312.A NH1 ASN 310.A OD1 no hydrogen 2.746 N/A ARG 312.A NH2 TYR 263.A O no hydrogen 2.959 N/A SER 313.A N ALA 264.A O no hydrogen 2.707 N/A SER 313.A OG SER 281.A OG no hydrogen 2.674 N/A SER 314.A N ILE 287.A O no hydrogen 2.849 N/A TYR 315.A N CYS 262.A O no hydrogen 3.137 N/A ILE 317.A N GLY 260.A O no hydrogen 2.928 N/A HIS 319.A N PRO 316.A O no hydrogen 2.942 N/A HIS 319.A ND1 ALA 280.A O no hydrogen 2.968 N/A HIS 319.A NE2 GLU 285.A OE2 no hydrogen 2.714 N/A LEU 320.A N ILE 317.A O no hydrogen 2.951 N/A VAL 323.A N GLU 321.A O no hydrogen 3.010 N/A VAL 324.A N LEU 242.A O no hydrogen 2.744 N/A SER 326.A OG VAL 328.A O no hydrogen 3.268 N/A GLY 327.A N VAL 324.A O no hydrogen 3.004 N/A VAL 328.A N SER 326.A OG no hydrogen 3.253 N/A ALA 329.A N VAL 255.A O no hydrogen 2.916 N/A ARG 333.A N VAL 220.A O no hydrogen 2.772 N/A ILE 335.A N ARG 404.A O no hydrogen 2.743 N/A PHE 336.A N VAL 222.A O no hydrogen 2.889 N/A PHE 337.A N TYR 406.A O no hydrogen 2.847 N/A LEU 338.A N PHE 224.A O no hydrogen 2.680 N/A SER 339.A N VAL 408.A O no hydrogen 2.820 N/A SER 339.A OG TYR 365.A O no hydrogen 2.642 N/A ALA 340.A N THR 366.A OG1 no hydrogen 3.126 N/A ASP 341.A N ASN 409.A OD1 no hydrogen 2.993 N/A TYR 343.A N ASP 341.A OD1 no hydrogen 3.150 N/A GLY 344.A N ASP 341.A O no hydrogen 3.228 N/A VAL 345.A N ASP 341.A OD2 no hydrogen 2.755 N/A LEU 346.A N ASP 341.A OD2 no hydrogen 2.744 N/A ALA 350.A N LEU 407.A O no hydrogen 2.948 N/A ARG 351.A N GLU 454.A O no hydrogen 2.817 N/A ARG 351.A NH1 GLU 441.A OE2 no hydrogen 3.383 N/A ARG 351.A NH2 GLU 454.A OE1 no hydrogen 3.179 N/A LEU 352.A N VAL 405.A O no hydrogen 2.799 N/A SER 353.A N GLU 356.A OE2 no hydrogen 2.876 N/A SER 353.A OG GLU 355.A OE1 no hydrogen 3.564 N/A GLU 356.A N SER 353.A OG no hydrogen 3.228 N/A ALA 357.A N SER 353.A O no hydrogen 2.778 N/A MET 358.A N PRO 354.A O no hydrogen 3.102 N/A TYR 359.A N GLU 355.A O no hydrogen 3.020 N/A TYR 359.A OH GLN 491.A OE1 no hydrogen 2.592 N/A TYR 360.A N GLU 356.A O no hydrogen 2.865 N/A PHE 361.A N ALA 357.A O no hydrogen 2.886 N/A LEU 362.A N MET 358.A O no hydrogen 2.993 N/A SER 363.A N TYR 359.A O no hydrogen 3.023 N/A SER 363.A OG TYR 359.A O no hydrogen 2.751 N/A GLY 364.A N TYR 360.A O no hydrogen 2.959 N/A TYR 365.A OH ASP 341.A OD1 no hydrogen 2.601 N/A THR 366.A N THR 373.A O no hydrogen 3.142 N/A ALA 367.A N ALA 340.A O no hydrogen 3.161 N/A ARG 368.A N ARG 371.A O no hydrogen 2.643 N/A ARG 368.A NH1 SER 227.A O no hydrogen 2.900 N/A ARG 368.A NH1 SER 227.A OG no hydrogen 3.423 N/A ARG 368.A NH2 SER 227.A OG no hydrogen 3.384 N/A ARG 371.A N ARG 368.A O no hydrogen 2.668 N/A THR 373.A N THR 366.A O no hydrogen 2.761 N/A SER 375.A N GLY 364.A O no hydrogen 2.910 N/A CYS 377.A N PHE 361.A O no hydrogen 2.822 N/A CYS 377.A SG PRO 387.A O no hydrogen 3.732 N/A PHE 378.A N SER 375.A O no hydrogen 2.769 N/A GLY 379.A N ALA 376.A O no hydrogen 3.047 N/A ALA 380.A N SER 375.A OG no hydrogen 3.179 N/A PHE 382.A N GLY 379.A O no hydrogen 2.997 N/A LEU 383.A N ALA 380.A O no hydrogen 3.172 N/A GLY 388.A N HIS 386.A ND1 no hydrogen 3.071 N/A VAL 389.A N HIS 386.A O no hydrogen 2.768 N/A TYR 390.A OH ASN 197.A O no hydrogen 2.644 N/A ALA 391.A N PRO 387.A O no hydrogen 2.900 N/A ARG 392.A N GLY 388.A O no hydrogen 2.881 N/A ARG 392.A NH1 GLY 500.A O no hydrogen 2.896 N/A MET 393.A N VAL 389.A O no hydrogen 3.227 N/A LEU 394.A N TYR 390.A O no hydrogen 3.024 N/A GLY 395.A N ALA 391.A O no hydrogen 2.976 N/A GLU 396.A N ARG 392.A O no hydrogen 3.217 N/A LYS 397.A N MET 393.A O no hydrogen 2.940 N/A LYS 397.A NZ TRP 250.A O no hydrogen 3.095 N/A LYS 397.A NZ SER 251.A O no hydrogen 2.855 N/A ILE 398.A N LEU 394.A O no hydrogen 2.813 N/A ARG 399.A N GLY 395.A O no hydrogen 2.957 N/A ARG 399.A NE GLU 396.A OE1 no hydrogen 3.403 N/A ARG 399.A NH2 GLU 396.A OE1 no hydrogen 2.985 N/A LYS 400.A N GLU 396.A O no hydrogen 2.995 N/A HIS 401.A N LYS 397.A O no hydrogen 2.907 N/A ALA 402.A N ILE 398.A O no hydrogen 2.758 N/A ARG 404.A N ARG 333.A O no hydrogen 2.913 N/A ARG 404.A NH1 TYR 406.A OH no hydrogen 2.703 N/A TYR 406.A N ILE 335.A O no hydrogen 2.839 N/A LEU 407.A N ALA 350.A O no hydrogen 2.835 N/A VAL 408.A N PHE 337.A O no hydrogen 2.763 N/A ASN 409.A N PRO 348.A O no hydrogen 3.042 N/A ASN 409.A ND2 LEU 346.A O no hydrogen 2.753 N/A ASN 409.A ND2 TRP 412.A O no hydrogen 3.203 N/A THR 410.A N SER 339.A O no hydrogen 2.825 N/A THR 410.A OG1 THR 229.A O no hydrogen 2.656 N/A THR 410.A OG1 SER 339.A O no hydrogen 3.516 N/A GLY 411.A N ASN 409.A OD1 no hydrogen 2.611 N/A TRP 412.A N ASP 341.A O no hydrogen 3.011 N/A THR 413.A N TYR 421.A O no hydrogen 2.977 N/A GLY 414.A N THR 472.A OG1 no hydrogen 2.900 N/A TYR 417.A N ALA 342.A O no hydrogen 2.971 N/A VAL 419.A N PRO 416.A O no hydrogen 2.907 N/A GLY 420.A N PRO 416.A O no hydrogen 2.721 N/A TYR 421.A N THR 413.A O no hydrogen 2.941 N/A ARG 422.A NE THR 410.A O no hydrogen 3.002 N/A ARG 422.A NH2 GLY 228.A O no hydrogen 2.767 N/A ARG 422.A NH2 THR 410.A O no hydrogen 3.506 N/A PHE 423.A N GLY 411.A O no hydrogen 2.961 N/A VAL 427.A N PRO 424.A O no hydrogen 3.007 N/A THR 428.A N PRO 424.A O no hydrogen 3.487 N/A ARG 429.A N LEU 425.A O no hydrogen 2.780 N/A ARG 429.A NH1 THR 233.A O no hydrogen 3.156 N/A ARG 429.A NH2 THR 233.A O no hydrogen 3.236 N/A ALA 430.A N PRO 426.A O no hydrogen 2.854 N/A LEU 431.A N VAL 427.A O no hydrogen 2.963 N/A LEU 432.A N THR 428.A O no hydrogen 3.007 N/A LYS 433.A N ARG 429.A O no hydrogen 2.890 N/A ALA 434.A N ALA 430.A O no hydrogen 3.037 N/A ALA 435.A N LEU 431.A O no hydrogen 2.909 N/A LEU 436.A N LEU 432.A O no hydrogen 2.867 N/A SER 437.A N LYS 433.A O no hydrogen 3.028 N/A SER 437.A OG LYS 433.A O no hydrogen 3.356 N/A SER 437.A OG ALA 434.A O no hydrogen 3.176 N/A ALA 439.A N SER 437.A OG no hydrogen 3.330 N/A GLU 441.A N GLY 438.A O no hydrogen 2.980 N/A ASN 442.A N ALA 439.A O no hydrogen 3.433 N/A TYR 445.A OH LEU 440.A O no hydrogen 2.652 N/A ARG 446.A N VAL 455.A O no hydrogen 2.847 N/A ARG 446.A NH2 LEU 467.A O no hydrogen 3.425 N/A ARG 447.A NH1 GLY 452.A O no hydrogen 3.138 N/A ASP 448.A N PHE 453.A O no hydrogen 2.925 N/A VAL 450.A N ASP 448.A OD2 no hydrogen 2.783 N/A PHE 451.A N ASP 448.A OD2 no hydrogen 2.657 N/A GLY 452.A N ASP 448.A O no hydrogen 2.856 N/A VAL 455.A N ARG 446.A O no hydrogen 2.778 N/A LEU 457.A N PRO 444.A O no hydrogen 2.716 N/A VAL 462.A N ALA 459.A O no hydrogen 2.998 N/A GLU 465.A N GLU 465.A OE2 no hydrogen 2.755 N/A LEU 466.A N PRO 463.A O no hydrogen 3.190 N/A LEU 467.A N GLN 464.A O no hydrogen 3.095 N/A ARG 470.A NE ASP 480.A OD1 no hydrogen 2.798 N/A ARG 470.A NH2 ASP 480.A OD2 no hydrogen 2.972 N/A GLU 471.A N ASN 468.A O no hydrogen 3.017 N/A GLU 471.A N ASN 468.A OD1 no hydrogen 3.345 N/A THR 472.A N PRO 469.A O no hydrogen 3.067 N/A THR 472.A OG1 PRO 469.A O no hydrogen 2.576 N/A TRP 473.A N ARG 470.A O no hydrogen 3.325 N/A TRP 473.A NE1 GLY 344.A O no hydrogen 2.879 N/A LYS 476.A NZ ARG 470.A O no hydrogen 3.518 N/A LYS 476.A NZ GLU 471.A OE1 no hydrogen 3.047 N/A GLU 477.A N ASP 475.A OD2 no hydrogen 2.876 N/A ALA 478.A N ASP 475.A OD2 no hydrogen 3.191 N/A TYR 479.A N ASP 475.A O no hydrogen 3.114 N/A TYR 479.A OH VAL 345.A O no hydrogen 2.670 N/A ASP 480.A N LYS 476.A O no hydrogen 3.146 N/A GLN 481.A N GLU 477.A O no hydrogen 3.189 N/A GLN 482.A N ALA 478.A O no hydrogen 3.043 N/A GLN 482.A NE2 TYR 343.A O no hydrogen 3.061 N/A ALA 483.A N TYR 479.A O no hydrogen 2.732 N/A ARG 484.A N ASP 480.A O no hydrogen 3.087 N/A LYS 485.A N GLN 481.A O no hydrogen 3.158 N/A LEU 486.A N GLN 482.A O no hydrogen 3.109 N/A ALA 487.A N ALA 483.A O no hydrogen 2.956 N/A ARG 488.A N ARG 484.A O no hydrogen 2.863 N/A LEU 489.A N LYS 485.A O no hydrogen 3.186 N/A PHE 490.A N LEU 486.A O no hydrogen 2.998 N/A GLN 491.A N ALA 487.A O no hydrogen 3.012 N/A GLU 492.A N ARG 488.A O no hydrogen 2.939 N/A ASN 493.A N LEU 489.A O no hydrogen 3.041 N/A PHE 494.A N PHE 490.A O no hydrogen 2.855 N/A GLN 495.A N GLN 491.A O no hydrogen 3.238 N/A LYS 496.A NZ ASN 493.A O no hydrogen 2.998 N/A LYS 496.A NZ ASN 493.A OD1 no hydrogen 2.733 N/A TYR 497.A N PHE 494.A O no hydrogen 2.876 N/A ALA 498.A N PHE 494.A O no hydrogen 2.986 N/A GLY 500.A N TYR 497.A O no hydrogen 2.756 N/A VAL 501.A N ALA 498.A O no hydrogen 3.253 N/A VAL 505.A N ALA 502.A O no hydrogen 2.896 N/A GLU 507.A N LYS 503.A O no hydrogen 3.086 N/A ALA 508.A N VAL 505.A O no hydrogen 2.982 N/A GLY 509.A N ALA 506.A O no hydrogen 3.255 N/A ARG 511.A N VAL 450.A O no hydrogen 2.898 N/A ARG 511.A NE GLU 513.A O no hydrogen 3.185 N/A ARG 511.A NH2 GLU 513.A O no hydrogen 3.559 N/A THR 512.A OG1 GLU 513.A OE1 no hydrogen 3.439 N/A