Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3czk_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ALA 5.A N ASP 2.A O no hydrogen 2.767 N/A LEU 6.A N ASP 2.A O no hydrogen 2.989 N/A ARG 7.A N PRO 3.A O no hydrogen 2.780 N/A ARG 7.A NE ASP 27.A OD1 no hydrogen 2.877 N/A ARG 7.A NH2 ASP 27.A OD2 no hydrogen 2.805 N/A ALA 8.A N PRO 4.A O no hydrogen 3.137 N/A ALA 9.A N ALA 5.A O no hydrogen 3.199 N/A PHE 10.A N LEU 6.A O no hydrogen 3.161 N/A ALA 11.A N ARG 7.A O no hydrogen 2.856 N/A HIS 18.A N ASP 15.A O no hydrogen 2.951 N/A HIS 18.A ND1 ASP 15.A OD2 no hydrogen 2.870 N/A HIS 18.A NE2 GLN 67.A OE1 no hydrogen 2.609 N/A ALA 19.A N ASP 15.A O no hydrogen 2.769 N/A LEU 22.A N HIS 18.A O no hydrogen 3.385 N/A LEU 23.A N ALA 19.A O no hydrogen 2.999 N/A SER 24.A N GLU 20.A O no hydrogen 3.020 N/A ARG 25.A N VAL 21.A O no hydrogen 3.087 N/A ARG 25.A NE ILE 307.A O no hydrogen 2.819 N/A ARG 25.A NH2 ILE 307.A O no hydrogen 3.078 N/A TYR 26.A N LEU 22.A O no hydrogen 2.797 N/A ASP 27.A N LEU 23.A O no hydrogen 2.987 N/A GLN 28.A N ARG 25.A O no hydrogen 3.098 N/A HIS 29.A N ARG 25.A O no hydrogen 3.200 N/A ALA 30.A N TYR 26.A O no hydrogen 2.967 N/A ARG 32.A NH1 ASP 306.A OD2 no hydrogen 3.379 N/A ARG 32.A NH2 HIS 29.A ND1 no hydrogen 2.731 N/A LEU 33.A N HIS 29.A O no hydrogen 3.190 N/A LEU 34.A N ALA 30.A O no hydrogen 2.806 N/A ASP 35.A N SER 31.A O no hydrogen 2.822 N/A ALA 36.A N ARG 32.A O no hydrogen 2.906 N/A LEU 37.A N LEU 33.A O no hydrogen 2.914 N/A HIS 38.A N LEU 34.A O no hydrogen 2.826 N/A ALA 39.A N ASP 35.A O no hydrogen 3.078 N/A LEU 40.A N ALA 36.A O no hydrogen 3.131 N/A TYR 41.A N LEU 37.A O no hydrogen 2.733 N/A TYR 41.A OH TRP 248.A O no hydrogen 2.705 N/A GLY 42.A N HIS 38.A O no hydrogen 2.637 N/A ARG 44.A N TYR 41.A O no hydrogen 3.074 N/A ARG 44.A NE ASP 46.A OD1 no hydrogen 3.539 N/A TYR 47.A N ARG 44.A O no hydrogen 3.058 N/A TRP 50.A N ASP 46.A O no hydrogen 3.029 N/A LEU 51.A N TYR 47.A O no hydrogen 2.922 N/A ALA 52.A N ALA 48.A O no hydrogen 3.282 N/A GLN 53.A N SER 49.A O no hydrogen 3.311 N/A GLN 53.A NE2 GLU 57.A OE2 no hydrogen 2.855 N/A TRP 54.A N TRP 50.A O no hydrogen 2.748 N/A TRP 54.A NE1 GLY 255.A O no hydrogen 3.045 N/A LEU 55.A N LEU 51.A O no hydrogen 2.660 N/A GLY 56.A N ALA 52.A O no hydrogen 3.069 N/A GLY 56.A N GLN 53.A O no hydrogen 2.940 N/A GLU 57.A N GLN 53.A O no hydrogen 3.156 N/A VAL 58.A N TRP 54.A O no hydrogen 2.808 N/A GLY 59.A N LEU 55.A O no hydrogen 3.075 N/A ASP 60.A N GLY 56.A O no hydrogen 3.184 N/A ILE 61.A N GLU 57.A O no hydrogen 3.059 N/A ALA 62.A N VAL 58.A O no hydrogen 2.871 N/A ARG 63.A N GLY 59.A O no hydrogen 3.009 N/A ARG 63.A NH1 PRO 13.A O no hydrogen 2.853 N/A GLN 64.A N ASP 60.A O no hydrogen 3.267 N/A GLN 64.A N ILE 61.A O no hydrogen 3.155 N/A ARG 65.A N ALA 62.A O no hydrogen 3.455 N/A ARG 65.A NE ASP 73.A OD2 no hydrogen 2.637 N/A ARG 65.A NH1 ALA 265.A O no hydrogen 3.193 N/A ARG 65.A NH1 ASN 266.A OD1 no hydrogen 3.192 N/A ARG 65.A NH2 ASP 73.A OD1 no hydrogen 3.004 N/A GLN 67.A NE2 GLN 67.A O no hydrogen 2.788 N/A GLN 67.A NE2 THR 71.A OG1 no hydrogen 2.802 N/A LEU 69.A N PRO 66.A O no hydrogen 3.017 N/A GLN 70.A N PRO 66.A O no hydrogen 3.048 N/A THR 71.A N GLN 67.A O no hydrogen 2.901 N/A THR 71.A OG1 GLN 67.A O no hydrogen 3.084 N/A LEU 72.A N ALA 68.A O no hydrogen 3.043 N/A ASP 73.A N LEU 69.A O no hydrogen 2.814 N/A SER 74.A N GLN 70.A O no hydrogen 3.079 N/A SER 74.A N THR 71.A O no hydrogen 3.096 N/A THR 75.A N THR 71.A O no hydrogen 2.895 N/A THR 75.A OG1 THR 71.A O no hydrogen 2.964 N/A THR 75.A OG1 LEU 72.A O no hydrogen 3.521 N/A ARG 76.A N LEU 72.A O no hydrogen 2.934 N/A ARG 76.A NH1 GLU 270.A OE1 no hydrogen 2.664 N/A ARG 76.A NH1 ALA 311.A O no hydrogen 3.091 N/A ARG 76.A NH2 GLU 270.A OE1 no hydrogen 2.905 N/A HIS 77.A ND1 THR 75.A O no hydrogen 3.231 N/A TRP 80.A N HIS 77.A O no hydrogen 2.992 N/A GLY 82.A N GLY 79.A O no hydrogen 2.936 N/A GLN 83.A N TRP 80.A O no hydrogen 3.342 N/A MET 86.A N GLN 83.A O no hydrogen 3.095 N/A GLY 88.A N PRO 479.A O no hydrogen 2.715 N/A TYR 89.A N TYR 117.A O no hydrogen 2.901 N/A TYR 89.A OH GLU 486.A OE2 no hydrogen 2.694 N/A SER 90.A N ILE 481.A O no hydrogen 2.722 N/A SER 90.A OG HIS 119.A ND1 no hydrogen 3.109 N/A ALA 91.A N HIS 119.A O no hydrogen 3.063 N/A PHE 96.A N TYR 92.A O no hydrogen 2.805 N/A ALA 97.A N ALA 93.A O no hydrogen 2.937 N/A GLY 98.A N ASP 94.A O no hydrogen 2.865 N/A THR 99.A N ALA 97.A O no hydrogen 2.849 N/A LEU 100.A N LEU 147.A O no hydrogen 2.900 N/A GLY 102.A N THR 99.A OG1 no hydrogen 3.115 N/A VAL 103.A N THR 99.A O no hydrogen 2.800 N/A ALA 104.A N LEU 100.A O no hydrogen 2.987 N/A GLU 105.A N GLN 101.A O no hydrogen 3.031 N/A ARG 106.A N VAL 103.A O no hydrogen 2.895 N/A VAL 107.A N ALA 104.A O no hydrogen 3.139 N/A TYR 109.A N ARG 106.A O no hydrogen 2.812 N/A TYR 109.A OH GLU 486.A OE2 no hydrogen 2.889 N/A GLN 111.A N VAL 107.A O no hydrogen 2.921 N/A GLU 112.A N PRO 108.A O no hydrogen 3.007 N/A LEU 113.A N TYR 109.A O no hydrogen 3.134 N/A GLY 114.A N LEU 110.A O no hydrogen 3.002 N/A VAL 115.A N LEU 110.A O no hydrogen 2.988 N/A ARG 116.A N LEU 87.A O no hydrogen 3.018 N/A TYR 117.A N LEU 87.A O no hydrogen 3.138 N/A LEU 118.A N SER 166.A O no hydrogen 2.836 N/A HIS 119.A N TYR 89.A O no hydrogen 2.832 N/A HIS 119.A NE2 ASP 170.A OD2 no hydrogen 2.759 N/A LEU 120.A N CYS 168.A O no hydrogen 3.160 N/A LEU 121.A N ALA 91.A O no hydrogen 3.032 N/A ARG 125.A N GLN 142.A O no hydrogen 2.700 N/A ALA 126.A N GLU 144.A OE1 no hydrogen 3.069 N/A ARG 127.A N ALA 136.A O no hydrogen 3.059 N/A ARG 127.A NE ASP 130.A O no hydrogen 3.120 N/A ARG 127.A NH2 ASP 130.A O no hydrogen 3.265 N/A ALA 128.A N ASP 179.A OD2 no hydrogen 3.225 N/A PHE 135.A N ASP 132.A O no hydrogen 2.825 N/A ALA 136.A N ASN 131.A O no hydrogen 3.021 N/A SER 138.A N ARG 125.A O no hydrogen 2.687 N/A TYR 140.A OH VAL 172.A O no hydrogen 2.586 N/A GLY 141.A N ASP 139.A OD1 no hydrogen 2.656 N/A GLN 142.A NE2 GLY 141.A O no hydrogen 2.949 N/A VAL 143.A N ASN 150.A OD1 no hydrogen 3.009 N/A GLU 144.A N PHE 123.A O no hydrogen 2.798 N/A SER 146.A OG GLU 144.A OE2 no hydrogen 3.141 N/A LEU 147.A N GLU 144.A O no hydrogen 2.691 N/A GLY 148.A N GLU 144.A O no hydrogen 3.035 N/A GLY 148.A N PRO 145.A O no hydrogen 3.031 N/A SER 149.A N ASP 152.A OD2 no hydrogen 2.867 N/A SER 149.A OG ASP 152.A OD2 no hydrogen 3.402 N/A ASN 150.A ND2 GLY 141.A O no hydrogen 2.954 N/A ASP 151.A N SER 149.A OG no hydrogen 3.281 N/A ASP 152.A N SER 149.A OG no hydrogen 3.397 N/A LEU 153.A N SER 149.A O no hydrogen 3.239 N/A VAL 154.A N ASN 150.A O no hydrogen 3.125 N/A ALA 155.A N ASP 151.A O no hydrogen 2.914 N/A LEU 156.A N ASP 152.A O no hydrogen 2.682 N/A THR 157.A N LEU 153.A O no hydrogen 2.889 N/A THR 157.A OG1 LEU 153.A O no hydrogen 3.148 N/A THR 157.A OG1 VAL 154.A O no hydrogen 2.911 N/A THR 157.A OG1 LEU 267.A O no hydrogen 3.089 N/A SER 158.A N VAL 154.A O no hydrogen 3.045 N/A SER 158.A OG VAL 154.A O no hydrogen 3.111 N/A ARG 159.A N ALA 155.A O no hydrogen 2.997 N/A LEU 160.A N LEU 156.A O no hydrogen 2.775 N/A ARG 161.A N THR 157.A O no hydrogen 2.825 N/A GLU 162.A N SER 158.A O no hydrogen 3.166 N/A ALA 163.A N LEU 160.A O no hydrogen 2.860 N/A GLY 164.A N ARG 161.A O no hydrogen 3.083 N/A ILE 165.A N LEU 160.A O no hydrogen 2.767 N/A SER 166.A N ARG 116.A O no hydrogen 2.825 N/A SER 166.A OG GLU 270.A OE1 no hydrogen 2.441 N/A CYS 168.A N LEU 118.A O no hydrogen 2.624 N/A CYS 168.A SG TYR 117.A OH no hydrogen 3.461 N/A CYS 168.A SG ALA 271.A O no hydrogen 3.711 N/A ALA 169.A N ALA 271.A O no hydrogen 2.739 N/A PHE 171.A N ARG 273.A O no hydrogen 2.945 N/A LEU 173.A N PHE 171.A O no hydrogen 2.613 N/A ASN 174.A ND2 HIS 175.A ND1 no hydrogen 2.772 N/A ASN 174.A ND2 ASP 245.A OD2 no hydrogen 3.567 N/A THR 176.A N TRP 244.A O no hydrogen 2.958 N/A THR 176.A OG1 ALA 177.A O no hydrogen 2.832 N/A THR 176.A OG1 TYR 197.A OH no hydrogen 2.610 N/A ALA 177.A N VAL 137.A O no hydrogen 2.659 N/A ASP 178.A N TYR 242.A O no hydrogen 2.865 N/A HIS 180.A N ALA 177.A O no hydrogen 3.209 N/A TRP 182.A N HIS 180.A ND1 no hydrogen 2.916 N/A GLN 184.A N HIS 180.A O no hydrogen 2.986 N/A ALA 185.A N ALA 181.A O no hydrogen 2.958 N/A ALA 186.A N TRP 182.A O no hydrogen 2.786 N/A ARG 187.A N ALA 183.A O no hydrogen 2.621 N/A ALA 188.A N GLN 184.A O no hydrogen 2.995 N/A ALA 188.A N ALA 185.A O no hydrogen 3.190 N/A GLY 189.A N ALA 186.A O no hydrogen 2.867 N/A ASP 190.A N ALA 185.A O no hydrogen 3.023 N/A TYR 193.A N ASP 190.A O no hydrogen 3.172 N/A LEU 194.A N ASP 190.A O no hydrogen 2.970 N/A ASP 195.A N ALA 191.A O no hydrogen 2.975 N/A TYR 196.A N TYR 193.A O no hydrogen 2.980 N/A TYR 196.A OH ASP 256.A OD2 no hydrogen 2.702 N/A TYR 197.A N LEU 194.A O no hydrogen 3.350 N/A TYR 197.A OH THR 176.A OG1 no hydrogen 2.610 N/A PHE 200.A N TRP 234.A O no hydrogen 2.974 N/A ARG 203.A NH1 ASP 207.A OD1 no hydrogen 2.918 N/A ASP 207.A N ARG 203.A O no hydrogen 2.879 N/A ARG 208.A N THR 204.A O no hydrogen 3.393 N/A TYR 209.A N VAL 205.A O no hydrogen 3.082 N/A GLU 210.A N PRO 206.A O no hydrogen 2.891 N/A ALA 211.A N ARG 208.A O no hydrogen 2.610 N/A THR 212.A N TYR 209.A O no hydrogen 3.123 N/A THR 212.A OG1 TYR 209.A O no hydrogen 3.559 N/A THR 212.A OG1 THR 286.A O no hydrogen 3.080 N/A HIS 219.A N GLN 431.A OE1 no hydrogen 2.961 N/A THR 220.A N GLN 431.A OE1 no hydrogen 3.008 N/A ALA 221.A N PHE 217.A O no hydrogen 2.696 N/A THR 226.A N MET 235.A O no hydrogen 2.918 N/A THR 226.A OG1 THR 237.A OG1 no hydrogen 2.864 N/A VAL 228.A N GLN 233.A O no hydrogen 2.974 N/A THR 231.A OG1 VAL 228.A O no hydrogen 3.479 N/A ALA 232.A N VAL 228.A O no hydrogen 2.854 N/A ALA 232.A N ASP 229.A O no hydrogen 2.903 N/A GLN 233.A N VAL 228.A O no hydrogen 3.443 N/A TRP 234.A N PHE 200.A O no hydrogen 2.780 N/A MET 235.A N THR 226.A O no hydrogen 2.593 N/A TRP 236.A N HIS 198.A O no hydrogen 3.122 N/A THR 237.A N ASN 224.A O no hydrogen 3.165 N/A THR 237.A OG1 THR 226.A OG1 no hydrogen 2.864 N/A THR 237.A OG1 THR 237.A O no hydrogen 2.578 N/A THR 238.A N ASP 245.A OD1 no hydrogen 2.867 N/A THR 238.A OG1 ASP 245.A OD1 no hydrogen 3.397 N/A THR 238.A OG1 ASP 245.A OD2 no hydrogen 2.606 N/A TYR 240.A N GLN 243.A OE1 no hydrogen 3.033 N/A TYR 240.A OH GLU 504.A OE2 no hydrogen 2.575 N/A TYR 242.A OH ASP 130.A OD2 no hydrogen 2.503 N/A GLN 243.A N TYR 240.A O no hydrogen 3.236 N/A GLN 243.A NE2 ASP 132.A OD2 no hydrogen 3.253 N/A GLN 243.A NE2 PHE 135.A O no hydrogen 2.964 N/A TRP 244.A N THR 176.A O no hydrogen 2.980 N/A ASP 245.A N TRP 236.A O no hydrogen 2.963 N/A LEU 246.A N ASN 174.A O no hydrogen 2.695 N/A ASN 247.A N TYR 196.A O no hydrogen 2.730 N/A ASN 247.A ND2 ASP 195.A O no hydrogen 3.476 N/A TRP 248.A NE1 LEU 173.A O no hydrogen 2.687 N/A SER 249.A N ASN 247.A OD1 no hydrogen 3.109 N/A SER 249.A OG ASN 247.A OD1 no hydrogen 2.609 N/A ASN 250.A N ASN 247.A O no hydrogen 2.895 N/A ASN 250.A ND2 ASP 195.A O no hydrogen 3.144 N/A ALA 252.A N ASN 250.A OD1 no hydrogen 2.665 N/A PHE 254.A N ASN 250.A O no hydrogen 3.283 N/A GLY 255.A N PRO 251.A O no hydrogen 2.779 N/A ASP 256.A N ALA 252.A O no hydrogen 2.976 N/A MET 257.A N VAL 253.A O no hydrogen 2.932 N/A ALA 258.A N PHE 254.A O no hydrogen 2.882 N/A LEU 259.A N GLY 255.A O no hydrogen 3.129 N/A ALA 260.A N ASP 256.A O no hydrogen 2.956 N/A MET 261.A N MET 257.A O no hydrogen 2.917 N/A LEU 262.A N ALA 258.A O no hydrogen 3.000 N/A ARG 263.A N LEU 259.A O no hydrogen 2.874 N/A LEU 264.A N ALA 260.A O no hydrogen 3.135 N/A ALA 265.A N MET 261.A O no hydrogen 3.040 N/A ASN 266.A N LEU 262.A O no hydrogen 2.914 N/A ASN 266.A ND2 ILE 61.A O no hydrogen 3.026 N/A LEU 267.A N ARG 263.A O no hydrogen 3.006 N/A LEU 267.A N LEU 264.A O no hydrogen 2.795 N/A GLY 268.A N ALA 265.A O no hydrogen 2.763 N/A VAL 269.A N LEU 264.A O no hydrogen 3.245 N/A GLU 270.A N LEU 167.A O no hydrogen 2.977 N/A ALA 271.A N LEU 167.A O no hydrogen 3.183 N/A PHE 272.A N VAL 313.A O no hydrogen 2.717 N/A ARG 273.A N ALA 169.A O no hydrogen 2.842 N/A ARG 273.A NE TYR 343.A OH no hydrogen 3.173 N/A ARG 273.A NH1 ASP 170.A OD1 no hydrogen 2.735 N/A ARG 273.A NH1 ASP 275.A OD1 no hydrogen 2.685 N/A ARG 273.A NH2 ASP 275.A OD1 no hydrogen 3.552 N/A LEU 274.A N LYS 315.A O no hydrogen 2.813 N/A ASP 275.A N ARG 273.A O no hydrogen 2.954 N/A SER 276.A OG ASP 275.A OD2 no hydrogen 3.045 N/A THR 277.A N LEU 274.A O no hydrogen 3.288 N/A TYR 279.A N SER 276.A O no hydrogen 3.140 N/A LYS 282.A NZ ASP 245.A OD2 no hydrogen 2.681 N/A LYS 282.A NZ TYR 279.A O no hydrogen 2.948 N/A THR 286.A N ARG 283.A O no hydrogen 3.194 N/A THR 286.A OG1 ARG 283.A O no hydrogen 2.748 N/A CYS 288.A N THR 286.A OG1 no hydrogen 2.833 N/A CYS 288.A SG ARG 283.A O no hydrogen 3.527 N/A CYS 288.A SG THR 286.A O no hydrogen 3.504 N/A CYS 288.A SG THR 286.A OG1 no hydrogen 3.736 N/A MET 289.A N ASP 287.A OD1 no hydrogen 3.105 N/A ASN 290.A N ALA 278.A O no hydrogen 2.920 N/A ASN 290.A ND2 TYR 328.A OH no hydrogen 2.814 N/A GLN 291.A NE2 MET 289.A O no hydrogen 3.173 N/A ALA 294.A N GLN 291.A O no hydrogen 2.979 N/A HIS 295.A ND1 GLU 338.A OE2 no hydrogen 2.785 N/A THR 296.A N SER 292.A O no hydrogen 3.226 N/A THR 296.A OG1 SER 292.A O no hydrogen 3.314 N/A LEU 297.A N GLU 293.A O no hydrogen 2.888 N/A LEU 298.A N ALA 294.A O no hydrogen 3.156 N/A VAL 299.A N HIS 295.A O no hydrogen 2.889 N/A ALA 300.A N THR 296.A O no hydrogen 2.942 N/A LEU 301.A N LEU 297.A O no hydrogen 3.023 N/A ARG 302.A N LEU 298.A O no hydrogen 2.778 N/A ARG 302.A NE ASP 306.A OD1 no hydrogen 2.874 N/A ARG 302.A NH1 GLU 338.A O no hydrogen 2.879 N/A ALA 303.A N VAL 299.A O no hydrogen 2.825 N/A VAL 304.A N ALA 300.A O no hydrogen 2.929 N/A THR 305.A N LEU 301.A O no hydrogen 3.057 N/A THR 305.A OG1 ARG 302.A O no hydrogen 2.815 N/A ASP 306.A N ARG 302.A O no hydrogen 2.903 N/A ILE 307.A N ALA 303.A O no hydrogen 3.057 N/A VAL 308.A N VAL 304.A O no hydrogen 2.936 N/A ALA 309.A N THR 305.A O no hydrogen 2.887 N/A ALA 311.A N ASP 73.A OD1 no hydrogen 3.204 N/A VAL 312.A N ALA 309.A O no hydrogen 3.119 N/A VAL 313.A N GLU 270.A O no hydrogen 2.689 N/A LYS 315.A N PHE 272.A O no hydrogen 2.856 N/A LYS 315.A NZ TYR 117.A OH no hydrogen 2.938 N/A LYS 315.A NZ TYR 343.A OH no hydrogen 3.449 N/A ALA 316.A N LEU 341.A O no hydrogen 2.696 N/A THR 323.A OG1 GLN 324.A OE1 no hydrogen 3.320 N/A GLN 324.A N PRO 321.A O no hydrogen 2.702 N/A LEU 325.A N MET 322.A O no hydrogen 2.921 N/A TYR 328.A N LEU 325.A O no hydrogen 2.965 N/A PHE 329.A N PRO 326.A O no hydrogen 2.963 N/A GLY 330.A N PRO 327.A O no hydrogen 3.060 N/A ASP 334.A N SER 331.A O no hydrogen 2.785 N/A GLU 335.A N GLY 332.A O no hydrogen 2.741 N/A GLY 336.A N PHE 329.A O no hydrogen 2.907 N/A HIS 337.A N ASP 334.A O no hydrogen 2.977 N/A CYS 339.A N TYR 328.A O no hydrogen 2.807 N/A HIS 340.A N MET 314.A O no hydrogen 2.870 N/A LEU 341.A N MET 314.A O no hydrogen 3.096 N/A TYR 343.A N ALA 316.A O no hydrogen 3.111 N/A HIS 344.A N LEU 380.A O no hydrogen 2.897 N/A HIS 344.A NE2 SER 370.A OG no hydrogen 3.008 N/A SER 345.A N TYR 343.A O no hydrogen 2.915 N/A LEU 347.A N HIS 344.A ND1 no hydrogen 2.963 N/A MET 348.A N HIS 344.A O no hydrogen 3.156 N/A ALA 349.A N SER 345.A O no hydrogen 3.064 N/A ALA 350.A N THR 346.A O no hydrogen 2.748 N/A GLY 351.A N LEU 347.A O no hydrogen 2.857 N/A GLY 351.A N MET 348.A O no hydrogen 3.120 N/A TRP 352.A N MET 348.A O no hydrogen 3.386 N/A TRP 352.A NE1 VAL 383.A O no hydrogen 3.030 N/A SER 353.A N ALA 349.A O no hydrogen 2.991 N/A SER 353.A OG ALA 349.A O no hydrogen 2.933 N/A ALA 354.A N ALA 350.A O no hydrogen 2.778 N/A LEU 355.A N GLY 351.A O no hydrogen 2.938 N/A ALA 356.A N TRP 352.A O no hydrogen 3.044 N/A LEU 357.A N SER 353.A O no hydrogen 2.981 N/A GLN 358.A N LEU 355.A O no hydrogen 3.188 N/A GLN 358.A NE2 ASP 581.A OD2 no hydrogen 3.545 N/A ARG 359.A N ALA 354.A O no hydrogen 2.893 N/A ARG 359.A NE ASP 361.A OD1 no hydrogen 2.883 N/A ARG 359.A NH1 PRO 405.A O no hydrogen 3.389 N/A ARG 359.A NH1 PRO 406.A O no hydrogen 3.040 N/A ARG 359.A NH2 ASP 361.A OD1 no hydrogen 3.493 N/A ARG 359.A NH2 ASP 361.A OD2 no hydrogen 2.914 N/A ARG 359.A NH2 PRO 405.A O no hydrogen 2.718 N/A ASP 361.A N PRO 562.A O no hydrogen 2.949 N/A ILE 362.A N ARG 359.A O no hydrogen 3.271 N/A LEU 363.A N GLY 360.A O no hydrogen 2.942 N/A HIS 364.A N GLY 360.A O no hydrogen 3.248 N/A HIS 364.A ND1 SER 556.A OG no hydrogen 2.676 N/A ASN 365.A N ASP 361.A O no hydrogen 3.241 N/A ASN 365.A ND2 GLN 404.A OE1 no hydrogen 3.620 N/A VAL 366.A N ILE 362.A O no hydrogen 3.310 N/A ILE 367.A N LEU 363.A O no hydrogen 3.005 N/A ALA 368.A N HIS 364.A O no hydrogen 2.870 N/A HIS 369.A N ASN 365.A O no hydrogen 2.926 N/A SER 370.A N ILE 367.A O no hydrogen 2.866 N/A SER 370.A OG HIS 344.A NE2 no hydrogen 3.008 N/A SER 370.A OG VAL 366.A O no hydrogen 2.965 N/A CYS 377.A N PRO 374.A O no hydrogen 3.118 N/A CYS 377.A SG CYS 339.A O no hydrogen 3.743 N/A CYS 377.A SG ARG 375.A O no hydrogen 3.665 N/A ALA 378.A N HIS 340.A O no hydrogen 2.951 N/A TRP 379.A N PRO 476.A O no hydrogen 2.973 N/A LEU 380.A N ALA 342.A O no hydrogen 2.871 N/A SER 381.A N VAL 478.A O no hydrogen 2.845 N/A ARG 384.A NE GLY 438.A O no hydrogen 2.994 N/A ARG 384.A NH1 ASP 387.A O no hydrogen 3.119 N/A ARG 384.A NH2 ASP 387.A O no hydrogen 2.972 N/A ARG 384.A NH2 GLY 438.A O no hydrogen 3.015 N/A CYS 385.A SG ASP 387.A O no hydrogen 3.845 N/A ILE 389.A N THR 436.A O no hydrogen 2.792 N/A TRP 391.A NE1 THR 436.A OG1 no hydrogen 2.898 N/A LEU 394.A N TRP 391.A O no hydrogen 2.807 N/A GLU 397.A N GLU 397.A OE1 no hydrogen 2.466 N/A ALA 398.A N LEU 394.A O no hydrogen 2.914 N/A CYS 399.A N GLN 395.A O no hydrogen 3.248 N/A CYS 399.A N HIS 396.A O no hydrogen 2.909 N/A CYS 399.A SG GLN 395.A O no hydrogen 3.626 N/A GLY 400.A N GLU 397.A O no hydrogen 2.922 N/A ASN 401.A N GLN 404.A O no hydrogen 2.791 N/A ASN 401.A ND2 ASN 365.A OD1 no hydrogen 2.844 N/A ALA 403.A N ASN 401.A OD1 no hydrogen 3.103 N/A GLN 404.A N ASN 401.A OD1 no hydrogen 2.854 N/A GLN 404.A NE2 GLU 397.A O no hydrogen 2.929 N/A GLN 404.A NE2 GLN 404.A O no hydrogen 3.518 N/A GLN 404.A NE2 PRO 405.A O no hydrogen 3.110 N/A PHE 407.A N ALA 398.A O no hydrogen 3.065 N/A ARG 410.A NH1 ASP 411.A OD1 no hydrogen 2.683 N/A ASP 411.A N SER 408.A OG no hydrogen 3.018 N/A VAL 412.A N SER 408.A O no hydrogen 3.038 N/A ALA 413.A N LEU 409.A O no hydrogen 2.806 N/A ARG 414.A N ARG 410.A O no hydrogen 3.009 N/A PHE 415.A N ASP 411.A O no hydrogen 2.932 N/A TYR 416.A N VAL 412.A O no hydrogen 3.038 N/A TYR 416.A OH TRP 352.A O no hydrogen 2.613 N/A ALA 417.A N ALA 413.A O no hydrogen 3.029 N/A ALA 417.A N ARG 414.A O no hydrogen 3.083 N/A ASN 418.A N PHE 415.A O no hydrogen 3.175 N/A ALA 419.A N ARG 414.A O no hydrogen 3.060 N/A SER 423.A N VAL 420.A O no hydrogen 3.395 N/A SER 423.A OG PHE 415.A O no hydrogen 2.617 N/A ALA 425.A N SER 423.A OG no hydrogen 3.329 N/A ARG 426.A N ALA 442.A O no hydrogen 2.880 N/A ARG 426.A NE GLU 451.A OE1 no hydrogen 3.464 N/A ARG 426.A NH1 SER 423.A O no hydrogen 2.826 N/A ARG 426.A NH1 ALA 425.A O no hydrogen 2.692 N/A GLY 427.A N TYR 416.A O no hydrogen 2.926 N/A GLU 428.A N ASN 437.A O no hydrogen 3.167 N/A PHE 430.A N GLY 435.A O no hydrogen 3.066 N/A THR 436.A N ILE 389.A O no hydrogen 3.287 N/A ASN 437.A N GLU 428.A O no hydrogen 2.780 N/A GLY 438.A N HIS 509.A ND1 no hydrogen 2.941 N/A MET 439.A N ASN 491.A OD1 no hydrogen 2.859 N/A LEU 443.A N MET 439.A O no hydrogen 2.888 N/A ALA 444.A N ALA 440.A O no hydrogen 2.760 N/A GLN 447.A N ALA 441.A O no hydrogen 3.269 N/A ALA 449.A N GLY 445.A O no hydrogen 3.006 N/A GLN 450.A N ILE 446.A O no hydrogen 2.957 N/A GLU 451.A N GLN 447.A O no hydrogen 2.869 N/A ALA 452.A N ALA 448.A O no hydrogen 3.043 N/A ALA 452.A N ALA 449.A O no hydrogen 2.972 N/A GLY 453.A N GLN 450.A O no hydrogen 2.991 N/A ASP 454.A N ALA 449.A O no hydrogen 3.189 N/A ALA 457.A N ASP 454.A OD1 no hydrogen 3.026 N/A LEU 458.A N ASP 454.A O no hydrogen 3.045 N/A ALA 459.A N ALA 455.A O no hydrogen 3.208 N/A VAL 460.A N ALA 456.A O no hydrogen 3.329 N/A ALA 461.A N ALA 457.A O no hydrogen 2.881 N/A VAL 462.A N LEU 458.A O no hydrogen 2.874 N/A ASP 463.A N ALA 459.A O no hydrogen 3.031 N/A ARG 464.A N VAL 460.A O no hydrogen 3.042 N/A ARG 464.A NH1 ALA 444.A O no hydrogen 2.800 N/A LEU 465.A N ALA 461.A O no hydrogen 2.987 N/A VAL 466.A N VAL 462.A O no hydrogen 2.928 N/A LEU 467.A N ASP 463.A O no hydrogen 2.861 N/A LEU 468.A N ARG 464.A O no hydrogen 3.149 N/A TYR 469.A N LEU 465.A O no hydrogen 3.196 N/A TYR 469.A OH ASP 485.A OD2 no hydrogen 2.615 N/A ALA 470.A N VAL 466.A O no hydrogen 2.841 N/A ILE 471.A N LEU 467.A O no hydrogen 3.406 N/A LEU 473.A N TYR 469.A O no hydrogen 2.853 N/A ALA 474.A N ALA 470.A O no hydrogen 3.033 N/A ALA 474.A N ILE 471.A O no hydrogen 3.037 N/A MET 475.A N ALA 472.A O no hydrogen 3.235 N/A VAL 478.A N TRP 379.A O no hydrogen 2.828 N/A LEU 480.A N SER 381.A O no hydrogen 2.772 N/A ILE 481.A N GLY 88.A O no hydrogen 2.657 N/A TYR 482.A N TYR 469.A OH no hydrogen 3.312 N/A TYR 482.A OH HIS 509.A O no hydrogen 2.814 N/A MET 483.A N SER 90.A O no hydrogen 2.807 N/A GLY 484.A N GLU 486.A OE1 no hydrogen 2.936 N/A ASP 485.A N TYR 482.A O no hydrogen 3.010 N/A GLU 486.A N GLU 486.A OE1 no hydrogen 2.480 N/A LEU 487.A N GLY 484.A O no hydrogen 2.756 N/A ALA 488.A N ASP 485.A O no hydrogen 3.159 N/A MET 489.A N GLY 484.A O no hydrogen 3.232 N/A ASN 491.A ND2 ARG 426.A O no hydrogen 2.793 N/A ASP 492.A N LEU 508.A O no hydrogen 2.844 N/A GLY 494.A N ASP 492.A OD1 no hydrogen 3.195 N/A ARG 496.A N PRO 493.A O no hydrogen 2.924 N/A ARG 496.A NH2 GLU 428.A OE2 no hydrogen 2.414 N/A ASP 497.A N GLY 494.A O no hydrogen 2.998 N/A ASP 498.A N TYR 495.A O no hydrogen 2.778 N/A HIS 500.A N ASP 498.A OD1 no hydrogen 2.562 N/A ARG 501.A N ASP 498.A O no hydrogen 2.740 N/A GLN 502.A N ASP 498.A O no hydrogen 2.528 N/A GLU 504.A N ARG 501.A O no hydrogen 2.671 N/A ARG 506.A N GLU 504.A OE1 no hydrogen 3.243 N/A ARG 506.A NE GLU 504.A OE1 no hydrogen 3.111 N/A ARG 506.A NH1 ASP 387.A OD1 no hydrogen 2.899 N/A ARG 506.A NH2 ASP 132.A OD1 no hydrogen 2.803 N/A ARG 506.A NH2 GLU 504.A OE2 no hydrogen 2.800 N/A TRP 507.A N GLU 504.A O no hydrogen 3.205 N/A LEU 508.A N GLY 505.A O no hydrogen 2.998 N/A HIS 509.A N ARG 506.A O no hydrogen 3.295 N/A HIS 509.A NE2 HIS 386.A O no hydrogen 2.813 N/A ARG 510.A N TRP 507.A O no hydrogen 2.975 N/A ARG 510.A NE HIS 386.A O no hydrogen 2.889 N/A ARG 510.A NH2 HIS 386.A O no hydrogen 3.130 N/A MET 513.A N ARG 95.A O no hydrogen 2.650 N/A TRP 515.A NE1 PHE 96.A O no hydrogen 2.913 N/A LEU 517.A N ASP 514.A OD1 no hydrogen 2.820 N/A ALA 518.A N ASP 514.A O no hydrogen 2.980 N/A ALA 519.A N TRP 515.A O no hydrogen 3.293 N/A ALA 519.A N GLN 516.A O no hydrogen 3.253 N/A GLN 520.A N LEU 517.A O no hydrogen 3.151 N/A ARG 521.A N ALA 518.A O no hydrogen 3.178 N/A ARG 521.A NE ALA 518.A O no hydrogen 2.812 N/A ARG 521.A NH1 GLU 112.A OE2 no hydrogen 2.808 N/A ARG 521.A NH2 ALA 518.A O no hydrogen 3.315 N/A HIS 522.A N ALA 519.A O no hydrogen 3.483 N/A SER 526.A N ASP 523.A O no hydrogen 2.841 N/A SER 526.A OG GLN 520.A O no hydrogen 3.006 N/A SER 526.A OG ASP 523.A O no hydrogen 2.887 N/A SER 528.A OG LEU 487.A O no hydrogen 2.940 N/A GLY 529.A N SER 526.A OG no hydrogen 2.833 N/A THR 530.A N SER 526.A O no hydrogen 2.754 N/A THR 530.A OG1 ALA 524.A O no hydrogen 3.232 N/A THR 530.A OG1 SER 526.A O no hydrogen 2.667 N/A VAL 531.A N LEU 527.A O no hydrogen 2.812 N/A TYR 532.A N SER 528.A O no hydrogen 2.767 N/A ARG 533.A N GLY 529.A O no hydrogen 3.006 N/A ARG 534.A N THR 530.A O no hydrogen 3.057 N/A LEU 535.A N VAL 531.A O no hydrogen 3.120 N/A ARG 536.A N TYR 532.A O no hydrogen 2.979 N/A GLY 537.A N ARG 533.A O no hydrogen 2.928 N/A LEU 538.A N ARG 534.A O no hydrogen 3.303 N/A ILE 539.A N LEU 535.A O no hydrogen 2.976 N/A ARG 540.A N ARG 536.A O no hydrogen 3.070 N/A GLN 541.A N GLY 537.A O no hydrogen 3.048 N/A ARG 542.A N LEU 538.A O no hydrogen 2.988 N/A ARG 542.A NE LEU 473.A O no hydrogen 2.904 N/A ARG 542.A NH1 PRO 84.A O no hydrogen 3.358 N/A ARG 542.A NH2 LEU 473.A O no hydrogen 3.162 N/A ALA 543.A N ILE 539.A O no hydrogen 3.105 N/A ALA 544.A N GLN 541.A O no hydrogen 2.991 N/A LEU 545.A N ARG 542.A O no hydrogen 3.132 N/A LEU 548.A N LEU 545.A O no hydrogen 2.706 N/A ALA 549.A N GLY 546.A O no hydrogen 3.025 N/A ALA 550.A N GLY 82.A O no hydrogen 2.855 N/A GLN 552.A N ALA 549.A O no hydrogen 3.075 N/A GLN 552.A NE2 ASP 551.A OD2 no hydrogen 2.834 N/A ALA 555.A N THR 568.A O no hydrogen 3.068 N/A SER 556.A OG HIS 364.A ND1 no hydrogen 2.676 N/A SER 556.A OG ALA 566.A O no hydrogen 2.961 N/A ILE 557.A N ALA 566.A O no hydrogen 3.079 N/A ARG 563.A N ASP 561.A OD1 no hydrogen 2.971 N/A ARG 563.A NE ASP 561.A OD1 no hydrogen 3.026 N/A ARG 563.A NH2 ASP 561.A OD2 no hydrogen 3.044 N/A VAL 564.A N ASP 561.A O no hydrogen 3.103 N/A PHE 565.A N HIS 577.A O no hydrogen 2.867 N/A LEU 567.A N ALA 575.A O no hydrogen 2.783 N/A THR 568.A N ALA 555.A O no hydrogen 2.772 N/A THR 568.A OG1 ALA 555.A O no hydrogen 3.133 N/A ARG 569.A N PHE 573.A O no hydrogen 2.989 N/A ARG 569.A NH2 LEU 548.A O no hydrogen 2.658 N/A GLY 570.A N ALA 553.A O no hydrogen 2.766 N/A PHE 573.A N ARG 569.A O no hydrogen 3.332 N/A ILE 574.A N LEU 615.A O no hydrogen 2.927 N/A ALA 575.A N LEU 567.A O no hydrogen 2.717 N/A LEU 576.A N ARG 613.A O no hydrogen 2.801 N/A HIS 577.A N PHE 565.A O no hydrogen 2.805 N/A ASN 578.A N GLY 611.A O no hydrogen 2.927 N/A ASN 578.A ND2 SER 580.A OG no hydrogen 2.999 N/A PHE 579.A N ARG 563.A O no hydrogen 2.941 N/A ASP 581.A N GLN 358.A OE1 no hydrogen 2.789 N/A GLN 582.A N SER 580.A OG no hydrogen 3.045 N/A LEU 584.A N LEU 607.A O no hydrogen 3.268 N/A VAL 586.A N ILE 605.A O no hydrogen 2.790 N/A ALA 590.A N GLU 587.A O no hydrogen 2.695 N/A ILE 591.A N LEU 588.A O no hydrogen 3.178 N/A VAL 593.A N LEU 588.A O no hydrogen 3.301 N/A LEU 598.A N TRP 614.A O no hydrogen 2.791 N/A SER 604.A OG ASP 585.A OD2 no hydrogen 2.541 N/A ILE 605.A N VAL 586.A O no hydrogen 2.796 N/A LEU 607.A N LEU 584.A O no hydrogen 2.794 N/A TYR 610.A N SER 580.A O no hydrogen 2.939 N/A GLY 611.A N PRO 608.A O no hydrogen 3.112 N/A ARG 613.A N LEU 576.A O no hydrogen 2.902 N/A ARG 613.A NE VAL 612.A O no hydrogen 3.221 N/A ARG 613.A NH2 VAL 612.A O no hydrogen 3.424 N/A LEU 615.A N ILE 574.A O no hydrogen 2.811 N/A GLN 616.A N TRP 596.A O no hydrogen 3.009 N/A ARG 617.A NH2 ILE 591.A O no hydrogen 3.344 N/A