Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 6sce_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): VAL 3.A N GLU 78.A O no hydrogen 3.004 N/A TYR 4.A N LYS 31.A O no hydrogen 3.122 N/A TYR 4.A OH ALA 15.A O no hydrogen 2.660 N/A LEU 5.A N TRP 80.A O no hydrogen 2.795 N/A CYS 6.A N VAL 33.A O no hydrogen 2.931 N/A CYS 6.A SG TYR 4.A OH no hydrogen 3.213 N/A CYS 6.A SG LEU 7.A O no hydrogen 3.408 N/A LEU 7.A N ASN 82.A O no hydrogen 3.299 N/A LEU 8.A N TYR 35.A O no hydrogen 2.975 N/A ALA 13.A N ASP 11.A OD1 no hydrogen 2.965 N/A TYR 16.A N PRO 12.A O no hydrogen 2.885 N/A TYR 16.A OH GLU 140.A OE2 no hydrogen 2.483 N/A LEU 17.A N ALA 13.A O no hydrogen 2.822 N/A GLY 18.A N PRO 14.A O no hydrogen 3.020 N/A LEU 19.A N ALA 15.A O no hydrogen 3.132 N/A LYS 20.A N TYR 16.A O no hydrogen 2.971 N/A LYS 20.A NZ GLU 134.A O no hydrogen 2.798 N/A LYS 20.A NZ GLU 140.A OE1 no hydrogen 3.006 N/A LYS 20.A NZ GLU 140.A OE2 no hydrogen 3.342 N/A VAL 21.A N LEU 17.A O no hydrogen 2.985 N/A VAL 22.A N GLY 18.A O no hydrogen 2.990 N/A GLU 23.A N LEU 19.A O no hydrogen 2.862 N/A ARG 24.A N LYS 20.A O no hydrogen 2.976 N/A ARG 24.A NH1.A GLU 134.A OE2 no hydrogen 3.242 N/A GLU 25.A N VAL 21.A O no hydrogen 3.071 N/A ALA 26.A N VAL 22.A O no hydrogen 2.692 N/A GLY 27.A N GLU 23.A O no hydrogen 2.876 N/A ALA 30.A N PRO 2.A O no hydrogen 2.845 N/A LYS 31.A NZ GLU 63.A OE2 no hydrogen 3.323 N/A ALA 32.A N LEU 61.A O no hydrogen 2.874 N/A VAL 33.A N TYR 4.A O no hydrogen 2.756 N/A PHE 34.A N GLU 63.A O no hydrogen 2.858 N/A TYR 35.A N CYS 6.A O no hydrogen 2.949 N/A SER 36.A OG GLU 64.A OE2 no hydrogen 2.948 N/A PHE 37.A N LEU 8.A O no hydrogen 2.965 N/A TRP 40.A N ASN 10.A OD1 no hydrogen 2.904 N/A TYR 44.A N ASN 41.A OD1 no hydrogen 2.835 N/A GLY 45.A N ASN 41.A O no hydrogen 3.049 N/A LYS 46.A N GLU 42.A O no hydrogen 2.891 N/A LYS 47.A N GLU 43.A O no hydrogen 2.938 N/A LYS 47.A NZ ARG 215.A O no hydrogen 2.898 N/A ARG 48.A N TYR 44.A O no hydrogen 2.895 N/A ARG 48.A NH1 PHE 37.A O no hydrogen 2.818 N/A ARG 48.A NH2 GLY 9.A O no hydrogen 2.847 N/A ARG 48.A NH2 PHE 37.A O no hydrogen 2.780 N/A GLN 49.A N GLY 45.A O no hydrogen 3.062 N/A ALA 50.A N LYS 46.A O no hydrogen 2.942 N/A PHE 51.A N LYS 47.A O no hydrogen 2.936 N/A PHE 52.A N ARG 48.A O no hydrogen 2.966 N/A ARG 53.A N GLN 49.A O no hydrogen 2.941 N/A LEU 54.A N ALA 50.A O no hydrogen 3.018 N/A LEU 55.A N PHE 51.A O no hydrogen 2.862 N/A SER 56.A N PHE 52.A O no hydrogen 2.937 N/A GLU 57.A N ARG 53.A O no hydrogen 2.976 N/A LYS 58.A N LEU 54.A O no hydrogen 2.835 N/A LYS 58.A NZ GLU 23.A OE1 no hydrogen 2.690 N/A LYS 58.A NZ GLU 23.A OE2 no hydrogen 3.312 N/A GLY 59.A N SER 56.A O no hydrogen 2.959 N/A VAL 60.A N LEU 55.A O no hydrogen 2.988 N/A GLU 63.A N ALA 32.A O no hydrogen 3.071 N/A ARG 65.A N PHE 34.A O no hydrogen 2.882 N/A ARG 65.A NE GLU 63.A OE1 no hydrogen 3.152 N/A ARG 65.A NH2 GLU 63.A OE1 no hydrogen 3.349 N/A ARG 65.A NH2 GLU 63.A OE2 no hydrogen 3.326 N/A LYS 69.A N PRO 66.A O no hydrogen 3.048 N/A GLY 70.A N LEU 67.A O no hydrogen 2.944 N/A LEU 71.A N GLU 68.A O no hydrogen 2.956 N/A GLU 73.A N GLU 73.A OE1 no hydrogen 2.750 N/A VAL 79.A N GLY 102.A O no hydrogen 2.869 N/A TRP 80.A N VAL 3.A O no hydrogen 2.838 N/A VAL 81.A N ARG 104.A O no hydrogen 2.731 N/A ASN 82.A N LEU 5.A O no hydrogen 2.860 N/A ASN 82.A ND2 TYR 4.A OH no hydrogen 2.925 N/A ASN 82.A ND2 PRO 14.A O no hydrogen 3.214 N/A LEU 83.A N PHE 106.A O no hydrogen 2.922 N/A THR 84.A N ASN 82.A OD1 no hydrogen 3.114 N/A THR 84.A OG1 ASN 82.A OD1 no hydrogen 3.530 N/A THR 84.A OG1 VAL 108.A O no hydrogen 3.063 N/A LYS 88.A NZ ASN 376.A O no hydrogen 2.722 N/A LYS 88.A NZ GLY 378.A O no hydrogen 2.676 N/A TRP 90.A N ALA 87.A O no hydrogen 2.977 N/A ALA 91.A N ALA 87.A O no hydrogen 3.494 N/A VAL 92.A N LYS 88.A O no hydrogen 2.936 N/A ARG 93.A N TYR 89.A O no hydrogen 3.163 N/A ARG 93.A NH1 TYR 89.A OH no hydrogen 3.085 N/A PHE 94.A N TRP 90.A O no hydrogen 2.838 N/A LEU 95.A N ALA 91.A O no hydrogen 2.821 N/A GLY 96.A N VAL 92.A O no hydrogen 3.139 N/A HIS 97.A N ARG 93.A O no hydrogen 3.278 N/A HIS 97.A NE2 GLU 72.A O no hydrogen 2.824 N/A TRP 98.A N PHE 94.A O no hydrogen 2.836 N/A TRP 98.A NE1 GLY 70.A O no hydrogen 2.970 N/A ARG 100.A N TRP 98.A O no hydrogen 2.801 N/A ARG 100.A NE HIS 97.A O no hydrogen 2.910 N/A ARG 100.A NH2 HIS 97.A O no hydrogen 3.235 N/A ARG 104.A N VAL 79.A O no hydrogen 2.861 N/A VAL 105.A N TRP 123.A O no hydrogen 2.932 N/A PHE 106.A N VAL 81.A O no hydrogen 2.886 N/A LEU 107.A N LEU 120.A O no hydrogen 2.929 N/A VAL 108.A N THR 84.A OG1 no hydrogen 2.657 N/A GLU 109.A N ARG 118.A O no hydrogen 2.825 N/A HIS 111.A N GLU 109.A OE2 no hydrogen 2.893 N/A HIS 111.A ND1 GLU 109.A OE1 no hydrogen 2.834 N/A ARG 112.A NE GLU 321.A OE1 no hydrogen 2.800 N/A ARG 112.A NH2 GLU 321.A OE1 no hydrogen 3.460 N/A ARG 112.A NH2 GLU 321.A OE2 no hydrogen 2.920 N/A ARG 112.A NH2 SER 345.A O no hydrogen 3.292 N/A LEU 114.A N TYR 187.A OH no hydrogen 2.879 N/A GLU 115.A N ARG 112.A O no hydrogen 3.218 N/A ARG 118.A N GLU 109.A O no hydrogen 2.839 N/A ARG 118.A NH1 GLU 128.A OE2 no hydrogen 2.526 N/A ARG 118.A NH2 GLU 115.A OE1 no hydrogen 3.018 N/A ALA 119.A N ARG 129.A O no hydrogen 2.833 N/A LEU 120.A N LEU 107.A O no hydrogen 2.969 N/A PHE 121.A N GLU 127.A O no hydrogen 2.751 N/A LEU 122.A N VAL 105.A O no hydrogen 2.804 N/A TRP 123.A NE1 ARG 100.A O no hydrogen 2.966 N/A ARG 125.A NE GLU 127.A OE2 no hydrogen 3.381 N/A GLU 127.A N PHE 121.A O no hydrogen 3.208 N/A ARG 129.A N ALA 119.A O no hydrogen 3.048 N/A ARG 129.A NH1.B GLU 134.A OE2 no hydrogen 2.408 N/A ARG 129.A NH2.B GLU 134.A OE1 no hydrogen 3.515 N/A ARG 129.A NH2.B GLU 134.A OE2 no hydrogen 2.843 N/A LEU 131.A N PRO 117.A O no hydrogen 2.809 N/A GLU 134.A N GLU 134.A OE1 no hydrogen 2.767 N/A ALA 135.A N LEU 131.A O no hydrogen 2.864 N/A THR 137.A N GLU 140.A OE1 no hydrogen 2.921 N/A THR 137.A OG1 GLU 140.A OE1 no hydrogen 3.407 N/A LEU 138.A N GLN 167.A OE1 no hydrogen 2.983 N/A GLU 140.A N THR 137.A OG1 no hydrogen 3.007 N/A TYR 141.A N THR 137.A O no hydrogen 2.980 N/A TYR 141.A OH GLY 184.A O no hydrogen 2.549 N/A ALA 142.A N LEU 138.A O no hydrogen 2.826 N/A ARG 143.A N GLU 139.A O no hydrogen 3.030 N/A ARG 143.A NH1 GLU 57.A OE1 no hydrogen 3.035 N/A ARG 143.A NH2 GLU 57.A OE2 no hydrogen 2.793 N/A LEU 144.A N GLU 140.A O no hydrogen 3.082 N/A TYR 145.A N TYR 141.A O no hydrogen 2.766 N/A TYR 145.A OH ASP 11.A OD1 no hydrogen 2.604 N/A GLU 147.A N ALA 142.A O no hydrogen 2.750 N/A LEU 149.A N LEU 146.A O no hydrogen 3.052 N/A GLY 150.A N GLU 147.A O no hydrogen 2.995 N/A GLU 151.A N LEU 146.A O no hydrogen 3.030 N/A GLU 154.A N ARG 170.A O no hydrogen 2.907 N/A VAL 156.A N ALA 168.A O no hydrogen 3.037 N/A SER 157.A OG PRO 158.A O no hydrogen 3.529 N/A PHE 162.A N PRO 159.A O no hydrogen 3.219 N/A GLN 167.A N VAL 181.A O no hydrogen 2.904 N/A GLN 167.A NE2 GLU 139.A OE1 no hydrogen 3.383 N/A ALA 169.A N PHE 179.A O no hydrogen 2.802 N/A ARG 170.A N GLU 154.A O no hydrogen 2.760 N/A ARG 170.A NH2 GLU 154.A OE1 no hydrogen 3.190 N/A ARG 174.A N LEU 171.A O no hydrogen 2.773 N/A ARG 174.A NE GLU 151.A OE1 no hydrogen 3.490 N/A ARG 174.A NE GLU 151.A OE2 no hydrogen 2.822 N/A VAL 178.A N TYR 189.A O no hydrogen 2.754 N/A PHE 179.A N ALA 169.A O no hydrogen 2.902 N/A VAL 180.A N TYR 187.A O no hydrogen 2.809 N/A VAL 181.A N GLN 167.A O no hydrogen 2.765 N/A HIS 182.A N LEU 185.A O no hydrogen 2.970 N/A ARG 183.A NE GLU 132.A OE1 no hydrogen 3.438 N/A ARG 183.A NH2 GLU 132.A OE2 no hydrogen 2.229 N/A LEU 185.A N HIS 182.A O no hydrogen 3.055 N/A TYR 187.A N VAL 180.A O no hydrogen 2.789 N/A TRP 188.A N LEU 222.A O no hydrogen 3.063 N/A TRP 188.A NE1 GLU 212.A OE1 no hydrogen 2.914 N/A TYR 189.A N VAL 178.A O no hydrogen 2.880 N/A TRP 190.A N VAL 224.A O no hydrogen 2.943 N/A TRP 190.A NE1 HIS 228.A NE2 no hydrogen 3.064 N/A VAL 191.A N GLY 176.A O no hydrogen 2.934 N/A ARG 192.A NH2 VAL 191.A O no hydrogen 3.187 N/A GLY 197.A N HIS 194.A O no hydrogen 2.825 N/A ALA 199.A N GLY 196.A O no hydrogen 3.061 N/A LYS 200.A N GLY 197.A O no hydrogen 3.368 N/A ARG 203.A NH2 GLU 253.A OE2 no hydrogen 2.850 N/A ARG 203.A NH2 TYR 254.A OH no hydrogen 2.580 N/A ALA 205.A N SER 202.A OG no hydrogen 2.938 N/A LEU 206.A N SER 202.A O no hydrogen 2.983 N/A SER 207.A N ARG 203.A O no hydrogen 2.980 N/A SER 207.A OG ARG 203.A O no hydrogen 3.224 N/A SER 207.A OG LYS 204.A O no hydrogen 3.093 N/A ALA 208.A N LYS 204.A O no hydrogen 3.017 N/A PHE 209.A N ALA 205.A O no hydrogen 3.008 N/A SER 210.A N LEU 206.A O no hydrogen 3.230 N/A SER 210.A OG TYR 254.A O no hydrogen 2.627 N/A GLY 211.A N SER 207.A O no hydrogen 3.183 N/A GLU 212.A N ALA 208.A O no hydrogen 2.886 N/A ALA 213.A N PHE 209.A O no hydrogen 2.968 N/A LYS 214.A N SER 210.A O no hydrogen 3.176 N/A LYS 214.A NZ GLN 219.A O no hydrogen 2.985 N/A LYS 214.A NZ CYS 221.A O no hydrogen 2.939 N/A ARG 215.A N GLY 211.A O no hydrogen 2.970 N/A ARG 215.A NE GLU 43.A OE2 no hydrogen 2.684 N/A ARG 215.A NH1 GLU 151.A OE2 no hydrogen 2.942 N/A ARG 215.A NH2 GLU 151.A OE2 no hydrogen 3.226 N/A LEU 216.A N GLU 212.A O no hydrogen 2.995 N/A GLY 217.A N ALA 213.A O no hydrogen 2.910 N/A GLY 218.A N LYS 214.A O no hydrogen 2.853 N/A CYS 221.A N GLY 218.A O no hydrogen 3.057 N/A CYS 221.A SG ALA 213.A O no hydrogen 3.452 N/A LEU 222.A N PRO 186.A O no hydrogen 3.436 N/A VAL 224.A N TRP 188.A O no hydrogen 2.856 N/A VAL 225.A N PHE 257.A O no hydrogen 2.884 N/A TYR 227.A N VAL 259.A O no hydrogen 2.876 N/A HIS 228.A ND1 LYS 200.A O no hydrogen 2.788 N/A LYS 229.A N TYR 227.A O no hydrogen 2.986 N/A LYS 229.A NZ ASP 260.A OD1 no hydrogen 2.807 N/A HIS 231.A ND1 ALA 199.A O no hydrogen 2.988 N/A LEU 232.A N HIS 228.A O no hydrogen 3.193 N/A ARG 233.A N LYS 229.A O no hydrogen 2.939 N/A SER 234.A N ALA 230.A O no hydrogen 3.317 N/A SER 234.A N HIS 231.A O no hydrogen 3.062 N/A SER 234.A OG HIS 231.A O no hydrogen 2.693 N/A ARG 235.A N LEU 232.A O no hydrogen 3.066 N/A ARG 235.A NE SER 234.A OG no hydrogen 3.021 N/A ARG 235.A NH2 SER 234.A OG no hydrogen 3.028 N/A LYS 238.A N HIS 236.A ND1 no hydrogen 3.044 N/A LYS 238.A NZ ASN 242.A OD1 no hydrogen 3.475 N/A ARG 240.A N HIS 236.A O no hydrogen 2.717 N/A GLU 241.A N PRO 237.A O no hydrogen 3.427 N/A ASN 242.A N LYS 238.A O no hydrogen 3.149 N/A VAL 243.A N GLU 239.A O no hydrogen 2.764 N/A PHE 244.A N ARG 240.A O no hydrogen 3.019 N/A ALA 245.A N GLU 241.A O no hydrogen 3.059 N/A ARG 246.A N ASN 242.A O no hydrogen 3.046 N/A ARG 246.A NH2 GLU 239.A OE2 no hydrogen 3.100 N/A TRP 247.A N VAL 243.A O no hydrogen 3.060 N/A TRP 247.A NE1 ASP 201.A OD1 no hydrogen 3.026 N/A ARG 248.A N PHE 244.A O no hydrogen 2.935 N/A ALA 249.A N ALA 245.A O no hydrogen 2.952 N/A TRP 250.A N ARG 246.A O no hydrogen 2.901 N/A ALA 251.A N TRP 247.A O no hydrogen 2.851 N/A ARG 252.A N ARG 248.A O no hydrogen 2.999 N/A GLU 253.A N ALA 249.A O no hydrogen 2.986 N/A TYR 254.A N TRP 250.A O no hydrogen 3.004 N/A GLY 255.A N ARG 252.A O no hydrogen 3.374 N/A VAL 256.A N ALA 251.A O no hydrogen 2.787 N/A PHE 257.A N PRO 223.A O no hydrogen 2.828 N/A VAL 259.A N VAL 225.A O no hydrogen 2.822 N/A ASP 260.A N GLU 268.A OE1 no hydrogen 2.938 N/A GLY 262.A N ASP 260.A OD1 no hydrogen 2.786 N/A ARG 263.A N ASP 260.A O no hydrogen 3.027 N/A ARG 263.A NE GLU 268.A OE2 no hydrogen 2.820 N/A LEU 265.A N ALA 161.A O no hydrogen 2.832 N/A GLU 267.A N PRO 264.A O no hydrogen 3.075 N/A GLU 268.A N PRO 264.A O no hydrogen 3.315 N/A VAL 269.A N LEU 265.A O no hydrogen 2.933 N/A ALA 270.A N GLU 266.A O no hydrogen 3.063 N/A SER 271.A N GLU 267.A O no hydrogen 2.986 N/A SER 271.A OG GLU 267.A O no hydrogen 3.184 N/A LEU 272.A N GLU 268.A O no hydrogen 3.321 N/A ILE 273.A N VAL 269.A O no hydrogen 3.235 N/A ILE 273.A N ALA 270.A O no hydrogen 3.225 N/A LYS 276.A NZ LEU 272.A O no hydrogen 3.125 N/A LYS 276.A NZ LYS 274.A O no hydrogen 3.260 N/A LYS 276.A NZ GLU 322.A OE1.B no hydrogen 2.990 N/A SER 278.A OG SER 342.A OG no hydrogen 3.329 N/A GLN 286.A N GLU 313.A OE2 no hydrogen 2.753 N/A GLU 287.A N GLU 313.A OE2 no hydrogen 2.980 N/A LEU 290.A N PRO 370.A O no hydrogen 2.895 N/A LEU 291.A N GLU 313.A O no hydrogen 3.008 N/A LEU 292.A N HIS 372.A O no hydrogen 2.847 N/A ALA 293.A N TYR 315.A O no hydrogen 3.056 N/A VAL 295.A N LEU 317.A O no hydrogen 3.138 N/A TYR 303.A N ALA 299.A O no hydrogen 3.057 N/A ALA 304.A N VAL 300.A O no hydrogen 2.795 N/A ALA 305.A N PRO 301.A O no hydrogen 2.919 N/A TYR 306.A N LEU 302.A O no hydrogen 2.984 N/A LEU 307.A N TYR 303.A O no hydrogen 2.960 N/A HIS 308.A N ALA 304.A O no hydrogen 2.890 N/A ALA 309.A N ALA 305.A O no hydrogen 2.851 N/A GLY 310.A N TYR 306.A O no hydrogen 3.039 N/A ARG 312.A N PRO 289.A O no hydrogen 2.824 N/A ARG 312.A NH1.A GLY 288.A O no hydrogen 2.704 N/A GLU 313.A N PRO 289.A O no hydrogen 3.389 N/A VAL 314.A N ARG 338.A O no hydrogen 2.844 N/A TYR 315.A N LEU 291.A O no hydrogen 2.838 N/A TYR 315.A OH PRO 283.A O no hydrogen 2.818 N/A LEU 316.A N HIS 340.A O no hydrogen 2.800 N/A LEU 317.A N ALA 293.A O no hydrogen 3.137 N/A THR 318.A N SER 342.A O no hydrogen 3.338 N/A THR 318.A OG1 VAL 295.A O no hydrogen 2.633 N/A THR 319.A N THR 318.A OG1 no hydrogen 2.747 N/A GLU 321.A N GLU 321.A OE2 no hydrogen 2.722 N/A ARG 324.A NH1 GLU 297.A O no hydrogen 2.770 N/A ARG 324.A NH2 GLU 297.A O no hydrogen 2.904 N/A ARG 326.A N GLU 322.A O no hydrogen 2.864 N/A TRP 327.A N SER 323.A O no hydrogen 3.027 N/A ALA 328.A N ARG 324.A O no hydrogen 2.972 N/A GLU 329.A N LEU 325.A O no hydrogen 2.854 N/A ALA 330.A N ARG 326.A O no hydrogen 2.986 N/A PHE 331.A N TRP 327.A O no hydrogen 2.939 N/A PHE 332.A N ALA 328.A O no hydrogen 2.961 N/A ARG 333.A N GLU 329.A O no hydrogen 2.876 N/A ARG 333.A NH2 GLU 329.A OE2 no hydrogen 3.040 N/A GLY 334.A N ALA 330.A O no hydrogen 2.887 N/A LYS 335.A N PHE 331.A O no hydrogen 3.214 N/A LYS 335.A N PHE 332.A O no hydrogen 3.049 N/A LYS 335.A NZ ASP 422.A OD2 no hydrogen 2.793 N/A GLY 336.A N ARG 333.A O no hydrogen 3.020 N/A VAL 337.A N PHE 332.A O no hydrogen 3.006 N/A ARG 338.A N ARG 312.A O no hydrogen 2.911 N/A HIS 340.A N VAL 314.A O no hydrogen 2.882 N/A HIS 340.A NE2 GLU 313.A OE1 no hydrogen 2.688 N/A ARG 341.A NH1 GLU 329.A OE1 no hydrogen 2.883 N/A SER 342.A N LEU 316.A O no hydrogen 3.136 N/A PHE 343.A N SER 278.A OG no hydrogen 2.841 N/A LEU 344.A N THR 318.A O no hydrogen 2.755 N/A SER 345.A N GLU 352.A OE1 no hydrogen 2.811 N/A SER 345.A OG GLU 352.A OE1 no hydrogen 3.280 N/A SER 345.A OG GLU 352.A OE2 no hydrogen 2.475 N/A ALA 349.A N GLY 346.A O no hydrogen 3.060 N/A LEU 350.A N TRP 348.A O no hydrogen 2.816 N/A VAL 353.A N ALA 349.A O no hydrogen 3.161 N/A ARG 354.A N LEU 350.A O no hydrogen 3.115 N/A ARG 354.A NE ASP 355.A OD1 no hydrogen 3.195 N/A ARG 354.A NH1 GLU 126.A OE1 no hydrogen 2.972 N/A ARG 354.A NH2 ASP 355.A OD1 no hydrogen 3.328 N/A ASP 355.A N ARG 351.A O no hydrogen 2.895 N/A LEU 356.A N GLU 352.A O no hydrogen 2.877 N/A LEU 357.A N VAL 353.A O no hydrogen 2.942 N/A ALA 358.A N ARG 354.A O no hydrogen 2.848 N/A VAL 361.A N LEU 357.A O no hydrogen 2.962 N/A GLU 362.A N ALA 358.A O no hydrogen 2.900 N/A GLU 363.A N PRO 359.A O no hydrogen 2.973 N/A ALA 364.A N VAL 360.A O no hydrogen 2.860 N/A LEU 365.A N VAL 361.A O no hydrogen 2.898 N/A ARG 366.A N GLU 362.A O no hydrogen 3.015 N/A ARG 366.A NH2 GLU 363.A OE1 no hydrogen 2.786 N/A ARG 367.A N GLU 363.A O no hydrogen 3.028 N/A ARG 367.A NE HIS 369.A NE2 no hydrogen 2.991 N/A ARG 367.A NH2 GLN 286.A O no hydrogen 2.811 N/A GLY 368.A N LEU 365.A O no hydrogen 3.455 N/A HIS 369.A N ALA 364.A O no hydrogen 2.799 N/A HIS 372.A N LEU 290.A O no hydrogen 2.850 N/A ALA 373.A N ARG 394.A O no hydrogen 2.931 N/A ASN 374.A N LEU 292.A O no hydrogen 3.009 N/A ASN 374.A ND2 ASN 376.A OD1 no hydrogen 3.056 N/A ASN 374.A ND2 HIS 396.A NE2 no hydrogen 3.027 N/A LEU 375.A N HIS 396.A O no hydrogen 2.949 N/A ASN 376.A N ASN 374.A OD1 no hydrogen 2.927 N/A ASN 376.A ND2 LEU 398.A O no hydrogen 2.905 N/A GLY 378.A N SER 296.A OG no hydrogen 2.886 N/A THR 379.A OG1 PRO 347.A O no hydrogen 2.830 N/A LEU 383.A N THR 380.A O no hydrogen 2.825 N/A GLY 384.A N ALA 381.A O no hydrogen 3.013 N/A TYR 386.A N ALA 382.A O no hydrogen 2.936 N/A LEU 387.A N LEU 383.A O no hydrogen 2.860 N/A ALA 388.A N GLY 384.A O no hydrogen 3.169 N/A ALA 388.A N LEU 385.A O no hydrogen 3.108 N/A LEU 389.A N TYR 386.A O no hydrogen 3.040 N/A ARG 390.A NE GLU 362.A OE2 no hydrogen 2.996 N/A ARG 390.A NH1 LEU 387.A O no hydrogen 3.011 N/A ARG 390.A NH1 LEU 389.A O no hydrogen 2.877 N/A ALA 393.A N ARG 390.A O no hydrogen 2.954 N/A ARG 394.A N VAL 371.A O no hydrogen 2.704 N/A HIS 396.A N ALA 373.A O no hydrogen 2.912 N/A TYR 397.A N LEU 404.A O no hydrogen 2.892 N/A LEU 398.A N ASN 376.A OD1 no hydrogen 2.759 N/A ASP 399.A N ARG 402.A O no hydrogen 2.887 N/A ARG 402.A NH1 GLU 410.A OE1 no hydrogen 3.356 N/A ARG 402.A NH2 ASP 399.A OD2 no hydrogen 2.615 N/A LEU 403.A N ALA 411.A O no hydrogen 3.084 N/A LEU 404.A N TYR 397.A O no hydrogen 2.776 N/A LEU 405.A N GLY 409.A O no hydrogen 2.930 N/A LEU 406.A N ALA 395.A O no hydrogen 3.115 N/A GLY 408.A N LEU 405.A O no hydrogen 3.009 N/A ALA 411.A N LEU 403.A O no hydrogen 2.803 N/A TRP 415.A N VAL 413.A O no hydrogen 2.787 N/A TRP 415.A NE1 ASP 401.A O no hydrogen 2.878 N/A GLU 416.A N GLU 416.A OE1 no hydrogen 2.695 N/A GLU 417.A N PRO 414.A O no hydrogen 2.987 N/A GLY 418.A N TRP 415.A O no hydrogen 2.811 N/A ARG 419.A N TYR 303.A OH no hydrogen 2.881 N/A GLU 421.A N GLU 421.A OE1 no hydrogen 2.690 N/A ASP 422.A N ARG 419.A O no hydrogen 2.991 N/A LEU 423.A N ARG 419.A O no hydrogen 3.146 N/A LEU 424.A N PRO 420.A O no hydrogen 2.994 N/A ALA 425.A N GLU 421.A O no hydrogen 3.032 N/A LEU 426.A N ASP 422.A O no hydrogen 3.006 N/A ARG 427.A N LEU 423.A O no hydrogen 2.966 N/A ARG 427.A NE SER 548.A O no hydrogen 3.265 N/A ARG 427.A NH1 ARG 427.A O no hydrogen 2.757 N/A ARG 427.A NH2 SER 548.A O no hydrogen 2.848 N/A GLY 428.A N ALA 425.A O no hydrogen 2.869 N/A TYR 429.A N LEU 424.A O no hydrogen 2.796 N/A TYR 429.A OH GLU 253.A OE1 no hydrogen 2.935 N/A ARG 430.A N VAL 509.A O no hydrogen 2.774 N/A ARG 430.A NE GLU 432.A OE2 no hydrogen 2.982 N/A ARG 430.A NH2 GLU 432.A OE2 no hydrogen 3.103 N/A GLU 432.A N HIS 507.A O no hydrogen 2.755 N/A GLU 434.A N GLY 505.A O no hydrogen 2.919 N/A ALA 438.A N TYR 435.A O no hydrogen 3.128 N/A ARG 439.A NH2 PRO 436.A O no hydrogen 2.586 N/A ARG 439.A NH2 ALA 438.A O no hydrogen 2.811 N/A LEU 444.A N ASP 441.A OD1 no hydrogen 3.016 N/A LEU 445.A N ASP 441.A O no hydrogen 2.999 N/A ALA 446.A N PRO 442.A O no hydrogen 3.097 N/A LEU 447.A N GLY 443.A O no hydrogen 3.272 N/A ALA 448.A N LEU 444.A O no hydrogen 3.038 N/A GLU 449.A N LEU 445.A O no hydrogen 2.819 N/A GLU 450.A N ALA 446.A O no hydrogen 2.647 N/A ILE 451.A N LEU 447.A O no hydrogen 2.796 N/A LEU 452.A N ALA 448.A O no hydrogen 3.072 N/A ARG 453.A N GLU 449.A O no hydrogen 3.096 N/A ARG 454.A N GLU 450.A O no hydrogen 3.365 N/A ARG 454.A N ILE 451.A O no hydrogen 3.105 N/A PHE 463.A N LEU 459.A O no hydrogen 2.671 N/A LEU 464.A N VAL 460.A O no hydrogen 3.064 N/A LYS 465.A N ARG 461.A O no hydrogen 3.129 N/A PHE 466.A N ARG 462.A O no hydrogen 3.278 N/A TRP 467.A N PHE 463.A O no hydrogen 3.006 N/A TRP 467.A NE1 GLN 473.A OE1 no hydrogen 3.086 N/A LYS 468.A N LEU 464.A O no hydrogen 3.092 N/A LYS 469.A N LYS 465.A O no hydrogen 3.061 N/A ARG 470.A N PHE 466.A O no hydrogen 2.950 N/A PHE 471.A N TRP 467.A O no hydrogen 2.962 N/A GLY 472.A N LYS 468.A O no hydrogen 2.830 N/A GLN 473.A NE2 GLU 434.A O no hydrogen 2.899 N/A LEU 482.A N LEU 479.A O no hydrogen 3.183 N/A GLU 485.A N GLY 481.A O no hydrogen 3.050 N/A TYR 486.A N LEU 482.A O no hydrogen 2.821 N/A TYR 486.A OH ARG 439.A O no hydrogen 2.554 N/A ALA 487.A N PRO 483.A O no hydrogen 3.040 N/A VAL 488.A N LEU 484.A O no hydrogen 2.824 N/A TYR 489.A N GLU 485.A O no hydrogen 2.999 N/A SER 490.A N TYR 486.A O no hydrogen 2.901 N/A SER 490.A OG TYR 486.A O no hydrogen 2.846 N/A HIS 491.A N ALA 487.A O no hydrogen 3.108 N/A HIS 491.A NE2 GLU 449.A OE2 no hydrogen 2.974 N/A LEU 492.A N VAL 488.A O no hydrogen 2.891 N/A ASN 493.A N TYR 489.A O no hydrogen 2.913 N/A ALA 494.A N SER 490.A O no hydrogen 3.045 N/A HIS 495.A N HIS 491.A O no hydrogen 3.064 N/A HIS 495.A NE2 GLU 593.A OE1 no hydrogen 3.226 N/A LEU 496.A N LEU 492.A O no hydrogen 2.784 N/A ALA 497.A N ASN 493.A O no hydrogen 2.932 N/A LYS 499.A N LEU 496.A O no hydrogen 2.742 N/A LYS 499.A NZ HIS 495.A NE2 no hydrogen 3.516 N/A LYS 499.A NZ GLU 593.A OE1 no hydrogen 3.321 N/A GLY 500.A N ALA 497.A O no hydrogen 2.943 N/A GLY 501.A N LEU 496.A O no hydrogen 3.037 N/A GLN 502.A N PHE 519.A O no hydrogen 3.097 N/A ARG 504.A N VAL 517.A O no hydrogen 2.717 N/A ARG 504.A NE GLU 421.A OE1 no hydrogen 2.985 N/A ARG 504.A NH1 GLN 502.A OE1 no hydrogen 3.055 N/A ARG 504.A NH1 ALA 503.A O no hydrogen 3.082 N/A ARG 504.A NH2 GLU 421.A OE1 no hydrogen 3.225 N/A ARG 504.A NH2 GLU 421.A OE2 no hydrogen 3.025 N/A GLY 506.A N VAL 514.A O no hydrogen 2.843 N/A HIS 507.A N GLU 432.A O no hydrogen 2.828 N/A LEU 508.A N THR 512.A O no hydrogen 2.898 N/A VAL 509.A N ARG 430.A O no hydrogen 2.941 N/A LEU 511.A N GLY 428.A O no hydrogen 3.013 N/A THR 512.A OG1 GLU 253.A OE2 no hydrogen 2.628 N/A VAL 514.A N GLY 506.A O no hydrogen 2.818 N/A ASP 515.A N VAL 527.A O no hydrogen 3.095 N/A VAL 517.A N ARG 504.A O no hydrogen 3.063 N/A PHE 518.A N TRP 525.A O no hydrogen 2.931 N/A PHE 519.A N GLN 502.A O no hydrogen 2.891 N/A HIS 520.A N ALA 523.A O no hydrogen 3.072 N/A ARG 521.A NH2 ASP 401.A OD2 no hydrogen 2.696 N/A ALA 523.A N HIS 520.A O no hydrogen 3.320 N/A TRP 525.A N PHE 518.A O no hydrogen 2.741 N/A PHE 526.A N ARG 555.A O no hydrogen 3.135 N/A VAL 527.A N GLY 516.A O no hydrogen 2.834 N/A GLU 528.A N LEU 557.A O no hydrogen 2.854 N/A CYS 529.A N ASP 515.A OD2 no hydrogen 2.800 N/A LYS 530.A N VAL 558.A O no hydrogen 2.975 N/A GLY 535.A N THR 532.A O no hydrogen 3.261 N/A ARG 537.A N ASP 533.A O no hydrogen 2.906 N/A ARG 537.A NE ASP 533.A OD2 no hydrogen 2.864 N/A ARG 537.A NH1 PRO 566.A O no hydrogen 3.260 N/A ARG 537.A NH2 ASP 533.A OD2 no hydrogen 2.710 N/A ARG 537.A NH2 ALA 565.A O no hydrogen 2.740 N/A GLU 538.A N GLU 534.A O no hydrogen 3.250 N/A ARG 539.A N GLY 535.A O no hydrogen 3.103 N/A ARG 539.A N LEU 536.A O no hydrogen 3.195 N/A ARG 539.A NH2 GLU 528.A OE1 no hydrogen 3.186 N/A ALA 540.A N LEU 536.A O no hydrogen 2.930 N/A LEU 545.A N ILE 542.A O no hydrogen 2.929 N/A ARG 547.A N ALA 543.A O no hydrogen 3.076 N/A ARG 547.A NE GLU 544.A OE1 no hydrogen 3.209 N/A ARG 547.A NH2 SER 210.A OG no hydrogen 2.876 N/A ARG 547.A NH2 GLU 544.A OE1 no hydrogen 2.869 N/A SER 548.A N GLU 544.A O no hydrogen 2.864 N/A SER 548.A OG.A GLU 544.A O no hydrogen 3.124 N/A SER 548.A OG.B GLU 253.A O no hydrogen 2.303 N/A VAL 549.A N LEU 545.A O no hydrogen 2.897 N/A GLY 551.A N VAL 546.A O no hydrogen 2.999 N/A GLY 551.A N ARG 547.A O no hydrogen 3.156 N/A VAL 552.A N GLN 298.A OE1 no hydrogen 2.785 N/A ALA 554.A N GLY 551.A O no hydrogen 3.021 N/A ARG 555.A N LEU 524.A O no hydrogen 3.016 N/A ARG 555.A NH1 ASN 599.A O no hydrogen 2.722 N/A ARG 555.A NH2 ASN 599.A O no hydrogen 3.315 N/A GLY 556.A N ASN 572.A O no hydrogen 2.862 N/A LEU 557.A N PHE 526.A O no hydrogen 2.780 N/A ARG 560.A N LYS 530.A O no hydrogen 3.013 N/A ARG 560.A NE LEU 452.A O no hydrogen 2.651 N/A ARG 560.A NH1 LEU 452.A O no hydrogen 2.888 N/A ARG 561.A N PRO 531.A O no hydrogen 2.976 N/A TRP 562.A N GLU 578.A O no hydrogen 2.957 N/A TRP 562.A NE1 ALA 565.A O no hydrogen 3.027 N/A ARG 563.A N ASP 533.A OD1 no hydrogen 3.237 N/A SER 570.A OG PRO 568.A O no hydrogen 2.759 N/A SER 570.A OG TYR 575.A OH no hydrogen 3.199 N/A ASN 572.A ND2 ALA 543.A O no hydrogen 2.874 N/A LEU 573.A N SER 570.A O no hydrogen 3.309 N/A VAL 574.A N GLY 556.A O no hydrogen 2.828 N/A TYR 575.A OH SER 570.A OG no hydrogen 3.199 N/A LEU 577.A N ALA 559.A O no hydrogen 3.037 N/A GLU 578.A N ARG 560.A O no hydrogen 3.054 N/A VAL 583.A N GLY 580.A O no hydrogen 3.187 N/A TYR 586.A N TYR 575.A O no hydrogen 3.126 N/A ARG 587.A N GLU 591.A OE1 no hydrogen 2.843 N/A ARG 587.A NH1 GLU 578.A OE1 no hydrogen 3.221 N/A ARG 587.A NH1 GLU 578.A OE2 no hydrogen 3.456 N/A ARG 587.A NH2 GLU 590.A OE2 no hydrogen 3.399 N/A PHE 588.A N ALA 576.A O no hydrogen 2.734 N/A GLU 590.A N GLU 590.A OE1 no hydrogen 2.838 N/A GLU 591.A N ARG 587.A O no hydrogen 2.796 N/A LEU 592.A N PRO 589.A O no hydrogen 3.238 N/A ALA 595.A N GLU 591.A O no hydrogen 2.805 N/A LEU 596.A N LEU 592.A O no hydrogen 2.823 N/A SER 597.A N GLU 593.A O no hydrogen 3.198 N/A SER 597.A OG GLU 593.A O no hydrogen 2.854 N/A ARG 603.A N GLU 553.A OE1 no hydrogen 2.767 N/A ARG 604.A NE ASP 401.A OD1 no hydrogen 2.733 N/A ARG 604.A NH1 GLU 607.A OE2 no hydrogen 3.012 N/A ARG 604.A NH2 ASP 401.A OD2 no hydrogen 3.194 N/A GLY 605.A N ASP 399.A OD1 no hydrogen 2.716 N/A LEU 606.A N ASP 399.A OD2 no hydrogen 3.043 N/A