Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3upx_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ARG 7.A N PHE 4.A O no hydrogen 3.174 N/A ARG 7.A NE ASP 27.A OD2 no hydrogen 3.179 N/A TYR 8.A N PHE 4.A O no hydrogen 2.879 N/A LYS 9.A N LYS 26.A O no hydrogen 3.063 N/A GLN 11.A N LEU 24.A O no hydrogen 2.675 N/A ARG 12.A N LEU 24.A O no hydrogen 3.293 N/A LEU 14.A N VAL 22.A O no hydrogen 3.052 N/A LYS 16.A NZ GLY 17.A O no hydrogen 2.859 N/A VAL 22.A N GLY 15.A O no hydrogen 2.874 N/A ILE 23.A N VAL 36.A O no hydrogen 2.730 N/A LEU 24.A N ARG 12.A O no hydrogen 2.924 N/A CYS 25.A N CYS 34.A O no hydrogen 2.909 N/A CYS 25.A SG ILE 23.A O no hydrogen 3.512 N/A LYS 26.A N LYS 9.A O no hydrogen 2.863 N/A ASP 27.A N GLN 32.A O no hydrogen 2.975 N/A LYS 28.A N ARG 7.A O no hydrogen 2.931 N/A LYS 28.A NZ SER 5.A O no hydrogen 2.632 N/A ILE 29.A N ASP 27.A OD1 no hydrogen 2.805 N/A THR 30.A N ASP 27.A OD1 no hydrogen 2.961 N/A GLY 31.A N ASP 27.A O no hydrogen 3.003 N/A CYS 34.A N CYS 25.A O no hydrogen 2.865 N/A CYS 34.A SG.A CYS 25.A O no hydrogen 3.556 N/A CYS 34.A SG.B GLN 32.A O no hydrogen 3.961 N/A ALA 35.A N GLY 85.A O no hydrogen 2.735 N/A VAL 36.A N ILE 23.A O no hydrogen 2.889 N/A LYS 37.A N LEU 83.A O no hydrogen 2.870 N/A LYS 37.A NZ SER 18.A O no hydrogen 2.888 N/A LYS 37.A NZ ASP 152.A OD1 no hydrogen 2.880 N/A LYS 37.A NZ ASP 152.A OD2 no hydrogen 2.817 N/A VAL 38.A N GLU 21.A O no hydrogen 2.912 N/A ILE 39.A N PHE 81.A O no hydrogen 2.901 N/A LYS 41.A N GLY 79.A O no hydrogen 3.229 N/A LYS 41.A NZ GLU 76.A OE2 no hydrogen 2.698 N/A LYS 41.A NZ ASP 77.A O no hydrogen 2.784 N/A LYS 41.A NZ LYS 78.A O no hydrogen 3.406 N/A GLN 43.A N SER 40.A O no hydrogen 3.040 N/A LYS 47.A N HIS 158.A O no hydrogen 2.896 N/A LYS 47.A NZ SER 156.A O no hydrogen 3.221 N/A THR 48.A OG1 HIS 158.A ND1 no hydrogen 2.741 N/A SER 52.A N ASP 49.A OD1 no hydrogen 3.203 N/A LEU 53.A N ASP 49.A O no hydrogen 3.228 N/A LEU 54.A N LYS 50.A O no hydrogen 2.998 N/A GLU 56.A N SER 52.A O no hydrogen 3.347 N/A VAL 57.A N LEU 53.A O no hydrogen 2.996 N/A GLN 58.A N LEU 54.A O no hydrogen 3.087 N/A LEU 59.A N ARG 55.A O no hydrogen 3.026 N/A LEU 60.A N GLU 56.A O no hydrogen 2.714 N/A LYS 61.A N VAL 57.A O no hydrogen 3.070 N/A GLN 62.A N LEU 59.A O no hydrogen 2.909 N/A GLN 62.A NE2 GLN 58.A O no hydrogen 3.084 N/A LEU 63.A N LEU 59.A O no hydrogen 3.166 N/A LEU 63.A N LEU 60.A O no hydrogen 3.317 N/A ASP 64.A N TYR 121.A OH no hydrogen 2.924 N/A HIS 65.A NE2 SER 117.A OG no hydrogen 3.023 N/A ASN 67.A N HIS 65.A ND1 no hydrogen 3.015 N/A ASN 67.A ND2 GLN 114.A OE1 no hydrogen 2.987 N/A ASN 67.A ND2 ILE 148.A O no hydrogen 2.821 N/A ILE 68.A N HIS 65.A O no hydrogen 3.144 N/A MET 69.A N ILE 150.A O no hydrogen 2.973 N/A LYS 70.A N TYR 88.A OH no hydrogen 3.260 N/A LYS 70.A NZ LYS 61.A O no hydrogen 2.684 N/A LYS 70.A NZ LEU 63.A O no hydrogen 2.853 N/A TYR 72.A N VAL 84.A O no hydrogen 2.816 N/A GLU 73.A N VAL 84.A O no hydrogen 3.246 N/A PHE 75.A N TYR 82.A O no hydrogen 2.937 N/A ASP 77.A N TYR 80.A O no hydrogen 3.064 N/A GLY 79.A N ASP 77.A OD2 no hydrogen 2.974 N/A TYR 80.A N ASP 77.A OD2 no hydrogen 2.891 N/A TYR 80.A OH ASP 341.A OD1 no hydrogen 3.179 N/A PHE 81.A N ILE 39.A O no hydrogen 3.078 N/A TYR 82.A N PHE 75.A O no hydrogen 2.774 N/A TYR 82.A OH ASP 77.A OD1 no hydrogen 2.619 N/A LEU 83.A N LYS 37.A O no hydrogen 2.905 N/A VAL 84.A N GLU 73.A O no hydrogen 2.926 N/A GLY 85.A N ALA 35.A O no hydrogen 2.978 N/A GLU 86.A N LYS 70.A O no hydrogen 2.997 N/A TYR 88.A OH GLU 86.A OE1 no hydrogen 3.009 N/A THR 89.A N GLU 140.A O no hydrogen 3.177 N/A THR 89.A OG1 GLU 140.A O no hydrogen 3.381 N/A GLY 90.A N LEU 139.A O no hydrogen 2.924 N/A LEU 93.A N LEU 137.A O no hydrogen 2.808 N/A GLU 96.A N GLU 92.A O no hydrogen 3.441 N/A GLU 96.A N LEU 93.A O no hydrogen 2.998 N/A ILE 97.A N LEU 93.A O no hydrogen 3.008 N/A ILE 98.A N PHE 94.A O no hydrogen 3.056 N/A SER 99.A N GLU 96.A O no hydrogen 3.330 N/A SER 99.A OG GLU 96.A O no hydrogen 2.765 N/A ARG 100.A NE GLU 96.A OE2 no hydrogen 2.870 N/A ARG 100.A NH2 GLU 96.A OE1 no hydrogen 3.260 N/A ARG 100.A NH2 GLU 96.A OE2 no hydrogen 3.245 N/A PHE 103.A N SER 273.A OG no hydrogen 2.978 N/A SER 104.A N ASP 107.A OD2 no hydrogen 3.000 N/A VAL 106.A N SER 104.A OG no hydrogen 3.277 N/A ALA 108.A N SER 104.A O no hydrogen 3.113 N/A ALA 109.A N GLU 105.A O no hydrogen 2.682 N/A ARG 110.A N VAL 106.A O no hydrogen 3.133 N/A ILE 111.A N ASP 107.A O no hydrogen 3.041 N/A ILE 112.A N ALA 108.A O no hydrogen 2.904 N/A ARG 113.A N ALA 109.A O no hydrogen 2.797 N/A GLN 114.A N ARG 110.A O no hydrogen 3.313 N/A GLN 114.A NE2 ARG 110.A O no hydrogen 3.595 N/A VAL 115.A N ILE 111.A O no hydrogen 3.179 N/A LEU 116.A N ILE 112.A O no hydrogen 2.854 N/A SER 117.A N ARG 113.A O no hydrogen 2.935 N/A SER 117.A OG HIS 65.A NE2 no hydrogen 3.023 N/A GLY 118.A N GLN 114.A O no hydrogen 2.958 N/A ILE 119.A N VAL 115.A O no hydrogen 2.965 N/A THR 120.A N LEU 116.A O no hydrogen 2.848 N/A THR 120.A OG1 LEU 116.A O no hydrogen 2.745 N/A TYR 121.A N SER 117.A O no hydrogen 3.236 N/A MET 122.A N GLY 118.A O no hydrogen 3.106 N/A HIS 123.A N ILE 119.A O no hydrogen 2.859 N/A HIS 123.A NE2 ASP 189.A OD2 no hydrogen 2.743 N/A LYS 124.A N THR 120.A O no hydrogen 2.990 N/A ASN 125.A N MET 122.A O no hydrogen 2.938 N/A LYS 126.A N HIS 123.A O no hydrogen 2.864 N/A ILE 127.A N MET 122.A O no hydrogen 3.077 N/A HIS 129.A N ASP 189.A OD2 no hydrogen 3.012 N/A HIS 129.A NE2 ILE 151.A O no hydrogen 2.749 N/A ARG 130.A N ASP 189.A OD1 no hydrogen 2.821 N/A ARG 130.A NE ASP 131.A OD1 no hydrogen 3.211 N/A ARG 130.A NH1 TYR 184.A OH no hydrogen 3.488 N/A ARG 130.A NH2 ASP 131.A OD2 no hydrogen 3.351 N/A ASP 131.A N HIS 129.A ND1 no hydrogen 3.173 N/A LYS 133.A NZ ASP 131.A O no hydrogen 3.199 N/A ASN 136.A N LYS 133.A O no hydrogen 2.946 N/A ASN 136.A ND2 ASP 131.A O no hydrogen 2.989 N/A LEU 137.A N PRO 134.A O no hydrogen 3.014 N/A LEU 138.A N ARG 149.A O no hydrogen 3.042 N/A LEU 139.A N GLY 91.A O no hydrogen 2.826 N/A GLU 140.A N ASN 147.A O no hydrogen 2.735 N/A SER 141.A OG SER 143.A OG no hydrogen 3.283 N/A SER 143.A N SER 141.A OG no hydrogen 3.355 N/A SER 143.A OG SER 141.A OG no hydrogen 3.283 N/A ILE 148.A N GLN 114.A OE1 no hydrogen 2.855 N/A ARG 149.A N LEU 138.A O no hydrogen 2.645 N/A ARG 149.A NE GLU 140.A OE2 no hydrogen 2.993 N/A ARG 149.A NH1 ILE 68.A O no hydrogen 2.864 N/A ARG 149.A NH2 GLU 140.A OE2 no hydrogen 3.252 N/A ILE 150.A N ASN 67.A O no hydrogen 2.891 N/A ILE 151.A N ASN 136.A O no hydrogen 3.017 N/A LEU 155.A N ASP 152.A O no hydrogen 3.355 N/A SER 156.A OG HIS 129.A O no hydrogen 2.654 N/A HIS 158.A N LEU 155.A O no hydrogen 2.839 N/A HIS 158.A ND1 THR 48.A OG1 no hydrogen 2.741 N/A PHE 159.A N LEU 155.A O no hydrogen 3.027 N/A GLU 160.A N LYS 45.A O no hydrogen 2.889 N/A SER 162.A OG ASP 167.A OD2 no hydrogen 2.544 N/A LYS 164.A N SER 162.A OG no hydrogen 3.004 N/A ASP 167.A N LYS 164.A O no hydrogen 2.956 N/A LYS 168.A N MET 165.A O no hydrogen 3.058 N/A ILE 169.A N MET 165.A O no hydrogen 3.224 N/A THR 171.A N LYS 168.A O no hydrogen 2.942 N/A THR 171.A OG1 LYS 168.A O no hydrogen 2.486 N/A TYR 173.A OH GLN 288.A OE1 no hydrogen 3.109 N/A TYR 174.A N THR 171.A O no hydrogen 3.066 N/A GLU 178.A N GLU 178.A OE1 no hydrogen 2.984 N/A VAL 179.A N ALA 176.A O no hydrogen 2.955 N/A HIS 181.A NE2 GLU 220.A OE2 no hydrogen 3.090 N/A GLY 182.A N GLU 178.A O no hydrogen 3.110 N/A GLU 186.A N GLU 186.A OE1 no hydrogen 2.867 N/A LYS 187.A N ASP 185.A OD1 no hydrogen 2.948 N/A LYS 187.A NZ PRO 250.A O no hydrogen 2.834 N/A LYS 187.A NZ ARG 253.A O no hydrogen 2.580 N/A CYS 188.A N ASP 185.A O no hydrogen 3.012 N/A CYS 188.A SG ASP 185.A O no hydrogen 3.067 N/A CYS 188.A SG ASP 189.A OD1 no hydrogen 3.801 N/A ASP 189.A N GLU 186.A O no hydrogen 3.073 N/A TRP 191.A N LYS 187.A O no hydrogen 3.257 N/A SER 192.A N CYS 188.A O no hydrogen 3.060 N/A SER 192.A OG TYR 174.A O no hydrogen 2.837 N/A SER 192.A OG CYS 188.A O no hydrogen 3.205 N/A THR 193.A N ASP 189.A O no hydrogen 2.971 N/A THR 193.A OG1 ASP 189.A O no hydrogen 2.644 N/A GLY 194.A N VAL 190.A O no hydrogen 2.848 N/A VAL 195.A N TRP 191.A O no hydrogen 3.026 N/A ILE 196.A N SER 192.A O no hydrogen 3.114 N/A LEU 197.A N THR 193.A O no hydrogen 2.827 N/A TYR 198.A N GLY 194.A O no hydrogen 2.949 N/A TYR 198.A OH THR 225.A O no hydrogen 2.464 N/A ILE 199.A N VAL 195.A O no hydrogen 2.998 N/A LEU 200.A N ILE 196.A O no hydrogen 2.823 N/A LEU 201.A N LEU 197.A O no hydrogen 3.107 N/A LEU 201.A N TYR 198.A O no hydrogen 3.269 N/A SER 202.A N TYR 198.A O no hydrogen 3.105 N/A SER 202.A OG TYR 198.A O no hydrogen 3.021 N/A GLY 203.A N ILE 199.A O no hydrogen 2.586 N/A CYS 204.A N SER 202.A OG no hydrogen 3.268 N/A CYS 204.A SG SER 202.A O no hydrogen 3.985 N/A GLY 209.A N ASN 208.A OD1 no hydrogen 2.772 N/A ASP 214.A N ASN 211.A OD1 no hydrogen 2.966 N/A ILE 215.A N ASN 211.A O no hydrogen 3.177 N/A LEU 216.A N GLU 212.A O no hydrogen 3.043 N/A LYS 217.A N TYR 213.A O no hydrogen 2.837 N/A LYS 218.A N ASP 214.A O no hydrogen 3.204 N/A LYS 218.A NZ ASN 208.A O no hydrogen 2.707 N/A VAL 219.A N ILE 215.A O no hydrogen 3.073 N/A GLU 220.A N LEU 216.A O no hydrogen 2.960 N/A LYS 221.A N LYS 217.A O no hydrogen 3.210 N/A GLY 222.A N LYS 218.A O no hydrogen 2.951 N/A GLN 230.A N GLN 230.A OE1 no hydrogen 2.658 N/A GLN 230.A NE2 SER 202.A O no hydrogen 3.195 N/A TRP 231.A N LEU 228.A O no hydrogen 2.945 N/A LYS 232.A N PRO 229.A O no hydrogen 3.181 N/A LYS 233.A N GLN 230.A O no hydrogen 3.313 N/A VAL 234.A N TRP 231.A O no hydrogen 2.964 N/A SER 235.A N GLU 105.A OE1 no hydrogen 2.881 N/A SER 235.A OG GLU 105.A OE2 no hydrogen 3.011 N/A SER 235.A OG SER 237.A OG no hydrogen 3.183 N/A SER 237.A OG SER 235.A OG no hydrogen 3.183 N/A ALA 238.A N SER 235.A OG no hydrogen 3.083 N/A LYS 239.A N SER 235.A O no hydrogen 3.443 N/A LYS 239.A NZ TRP 231.A O no hydrogen 3.225 N/A ASP 240.A N GLU 236.A O no hydrogen 2.726 N/A LEU 241.A N SER 237.A O no hydrogen 2.963 N/A ILE 242.A N ALA 238.A O no hydrogen 2.980 N/A ARG 243.A N LYS 239.A O no hydrogen 2.935 N/A ARG 243.A NH1 GLU 236.A OE1 no hydrogen 2.890 N/A LYS 244.A N ASP 240.A O no hydrogen 3.265 N/A LYS 244.A N LEU 241.A O no hydrogen 2.995 N/A LYS 244.A NZ ASP 240.A OD2 no hydrogen 3.018 N/A MET 245.A N LEU 241.A O no hydrogen 3.096 N/A MET 245.A N ILE 242.A O no hydrogen 3.178 N/A LEU 246.A N ILE 242.A O no hydrogen 2.889 N/A THR 247.A OG1 ARG 243.A O no hydrogen 2.805 N/A THR 247.A OG1 LYS 244.A O no hydrogen 2.955 N/A TYR 248.A OH GLU 220.A O no hydrogen 2.602 N/A MET 252.A N VAL 249.A O no hydrogen 2.891 N/A ARG 253.A N PRO 250.A O no hydrogen 3.183 N/A ARG 253.A NE THR 247.A O no hydrogen 2.867 N/A ARG 253.A NH1 GLU 178.A OE1 no hydrogen 3.483 N/A ARG 253.A NH1 GLU 178.A OE2 no hydrogen 2.809 N/A ARG 253.A NH1 LYS 187.A O no hydrogen 2.854 N/A ARG 253.A NH2 GLU 178.A OE1 no hydrogen 2.927 N/A ARG 253.A NH2 THR 247.A O no hydrogen 3.196 N/A ARG 253.A NH2 TYR 248.A O no hydrogen 3.060 N/A ILE 254.A N LYS 244.A O no hydrogen 3.198 N/A ARG 257.A NH1 ARG 257.A O no hydrogen 3.290 N/A ARG 257.A NH1 ASP 261.A OD2 no hydrogen 2.794 N/A ASP 258.A N SER 255.A OG no hydrogen 2.911 N/A ALA 259.A N SER 255.A O no hydrogen 2.912 N/A LEU 260.A N ALA 256.A O no hydrogen 3.237 N/A ASP 261.A N ASP 258.A O no hydrogen 3.084 N/A HIS 262.A N ALA 259.A O no hydrogen 3.025 N/A HIS 262.A NE2 ASP 240.A OD2 no hydrogen 2.563 N/A TRP 264.A N HIS 262.A ND1 no hydrogen 2.990 N/A TRP 264.A NE1 GLU 105.A OE2 no hydrogen 2.646 N/A GLN 266.A N HIS 262.A O no hydrogen 2.993 N/A THR 267.A N GLU 263.A O no hydrogen 2.734 N/A THR 267.A OG1 GLU 263.A O no hydrogen 2.905 N/A TYR 268.A N TRP 264.A O no hydrogen 2.937 N/A THR 269.A OG1 ILE 265.A O no hydrogen 2.726 N/A SER 273.A OG ASP 275.A OD1 no hydrogen 2.971 N/A LEU 274.A N PHE 103.A O no hydrogen 2.721 N/A ILE 278.A N LEU 274.A O no hydrogen 3.196 N/A LEU 279.A N ASP 275.A O no hydrogen 3.220 N/A ASN 280.A N ASN 276.A O no hydrogen 2.991 N/A ASN 280.A ND2 SER 202.A O no hydrogen 3.104 N/A ASN 280.A ND2 ASN 276.A OD1 no hydrogen 2.721 N/A ILE 281.A N ALA 277.A O no hydrogen 2.922 N/A ARG 282.A N ILE 278.A O no hydrogen 2.971 N/A ARG 282.A NE ILE 98.A O no hydrogen 3.326 N/A ARG 282.A NH2 ILE 98.A O no hydrogen 2.852 N/A GLN 283.A N LEU 279.A O no hydrogen 3.175 N/A PHE 284.A N ASN 280.A O no hydrogen 2.849 N/A GLN 285.A N ILE 281.A O no hydrogen 2.807 N/A GLN 285.A NE2 ASP 95.A OD1 no hydrogen 3.023 N/A GLY 286.A N ARG 282.A O no hydrogen 3.252 N/A THR 287.A N GLN 283.A O no hydrogen 3.110 N/A THR 287.A OG1 GLN 283.A O no hydrogen 2.656 N/A GLN 288.A N PHE 284.A O no hydrogen 2.951 N/A LYS 289.A N GLN 285.A O no hydrogen 2.970 N/A LYS 289.A NZ GLU 92.A OE1 no hydrogen 2.789 N/A LYS 289.A NZ GLU 92.A OE2 no hydrogen 3.548 N/A LEU 290.A N GLY 286.A O no hydrogen 2.880 N/A ALA 291.A N THR 287.A O no hydrogen 3.059 N/A GLN 292.A N GLN 288.A O no hydrogen 2.947 N/A GLN 292.A NE2 GLU 135.A OE2 no hydrogen 2.893 N/A ALA 293.A N LYS 289.A O no hydrogen 2.894 N/A ALA 294.A N LEU 290.A O no hydrogen 2.878 N/A LEU 295.A N ALA 291.A O no hydrogen 3.038 N/A LEU 296.A N GLN 292.A O no hydrogen 2.943 N/A TYR 297.A N ALA 293.A O no hydrogen 2.907 N/A MET 298.A N ALA 294.A O no hydrogen 2.957 N/A GLY 299.A N LEU 295.A O no hydrogen 2.927 N/A SER 300.A N LEU 296.A O no hydrogen 2.852 N/A SER 300.A OG LEU 296.A O no hydrogen 2.863 N/A LYS 301.A N TYR 297.A O no hydrogen 2.952 N/A LEU 302.A N MET 298.A O no hydrogen 3.075 N/A THR 303.A N GLY 299.A O no hydrogen 2.835 N/A THR 303.A OG1 GLY 299.A O no hydrogen 3.328 N/A SER 304.A N SER 300.A O no hydrogen 2.914 N/A GLN 305.A N LYS 301.A O no hydrogen 2.957 N/A ASP 306.A N LEU 302.A O no hydrogen 2.990 N/A GLU 307.A N THR 303.A O no hydrogen 2.668 N/A THR 308.A N SER 304.A O no hydrogen 2.879 N/A THR 308.A OG1 SER 304.A O no hydrogen 3.080 N/A LYS 309.A N GLN 305.A O no hydrogen 3.475 N/A GLU 310.A N ASP 306.A O no hydrogen 3.099 N/A LEU 311.A N GLU 307.A O no hydrogen 3.072 N/A THR 312.A N THR 308.A O no hydrogen 3.187 N/A THR 312.A OG1 THR 308.A O no hydrogen 2.927 N/A ALA 313.A N LYS 309.A O no hydrogen 3.134 N/A ILE 314.A N GLU 310.A O no hydrogen 2.974 N/A PHE 315.A N LEU 311.A O no hydrogen 2.771 N/A HIS 316.A N THR 312.A O no hydrogen 2.769 N/A LYS 317.A N ALA 313.A O no hydrogen 2.938 N/A MET 318.A N ILE 314.A O no hydrogen 2.973 N/A ASP 319.A N PHE 315.A O no hydrogen 2.980 N/A ASP 319.A N HIS 316.A O no hydrogen 3.068 N/A LYS 320.A N MET 318.A O no hydrogen 2.854 N/A GLY 322.A N ASP 319.A O no hydrogen 3.307 N/A GLY 324.A N ASP 319.A OD2 no hydrogen 2.730 N/A LEU 326.A N ILE 360.A O no hydrogen 2.998 N/A ASP 327.A N GLU 330.A OE2 no hydrogen 2.697 N/A ARG 328.A N ASP 327.A OD1 no hydrogen 2.809 N/A ARG 328.A NE ASP 355.A OD1 no hydrogen 3.061 N/A ARG 328.A NH2 ASP 355.A OD2 no hydrogen 2.975 N/A LEU 331.A N ASP 327.A O no hydrogen 3.067 N/A ILE 332.A N ARG 328.A O no hydrogen 3.005 N/A GLU 333.A N ALA 329.A O no hydrogen 2.866 N/A GLY 334.A N GLU 330.A O no hydrogen 2.937 N/A TYR 335.A N LEU 331.A O no hydrogen 2.910 N/A LYS 336.A N ILE 332.A O no hydrogen 2.668 N/A GLU 337.A N GLU 333.A O no hydrogen 2.771 N/A LEU 338.A N GLY 334.A O no hydrogen 2.889 N/A MET 339.A N TYR 335.A O no hydrogen 3.316 N/A ARG 340.A N GLU 337.A O no hydrogen 2.869 N/A ARG 340.A NE LEU 338.A O no hydrogen 3.127 N/A MET 344.A N ASP 341.A O no hydrogen 3.156 N/A LEU 345.A N SER 343.A O no hydrogen 2.991 N/A ALA 349.A N ASP 346.A O no hydrogen 3.197 N/A ALA 349.A N ASP 346.A OD1 no hydrogen 2.780 N/A GLU 351.A N ALA 347.A O no hydrogen 3.336 N/A HIS 352.A N SER 348.A O no hydrogen 3.477 N/A GLU 353.A N ALA 349.A O no hydrogen 3.305 N/A VAL 354.A N VAL 350.A O no hydrogen 2.761 N/A ASP 355.A N GLU 351.A O no hydrogen 2.904 N/A GLN 356.A N HIS 352.A O no hydrogen 2.726 N/A VAL 357.A N GLU 353.A O no hydrogen 3.103 N/A LEU 358.A N VAL 354.A O no hydrogen 3.060 N/A ASP 359.A N ASP 355.A O no hydrogen 2.862 N/A ILE 360.A N LEU 326.A O no hydrogen 3.349 N/A TYR 362.A N GLY 324.A O no hydrogen 3.285 N/A GLU 364.A N GLU 361.A O no hydrogen 2.749 N/A PHE 365.A N GLU 361.A O no hydrogen 3.414 N/A VAL 366.A N TYR 362.A O no hydrogen 2.948 N/A THR 367.A N SER 363.A O no hydrogen 3.499 N/A THR 367.A OG1 SER 363.A O no hydrogen 3.045 N/A VAL 368.A N GLU 364.A O no hydrogen 3.153 N/A ALA 369.A N PHE 365.A O no hydrogen 2.885 N/A MET 370.A N VAL 366.A O no hydrogen 3.135 N/A ASP 371.A N THR 367.A O no hydrogen 2.515 N/A ARG 372.A N VAL 368.A O no hydrogen 2.861 N/A THR 374.A N MET 370.A O no hydrogen 2.724 N/A THR 374.A OG1 MET 370.A O no hydrogen 3.560 N/A LEU 375.A N ASP 371.A O no hydrogen 2.804 N/A LEU 376.A N ARG 372.A O no hydrogen 2.673 N/A SER 377.A N LYS 373.A O no hydrogen 2.926 N/A SER 377.A OG LYS 373.A O no hydrogen 2.453 N/A ARG 378.A N THR 374.A O no hydrogen 3.210 N/A GLU 379.A N LEU 375.A O no hydrogen 3.270 N/A LEU 381.A N SER 377.A O no hydrogen 3.407 N/A GLU 382.A N ARG 378.A O no hydrogen 2.901 N/A ARG 383.A N GLU 379.A O no hydrogen 2.986 N/A ALA 384.A N ARG 380.A O no hydrogen 3.173 N/A PHE 385.A N LEU 381.A O no hydrogen 2.977 N/A ARG 386.A N GLU 382.A O no hydrogen 2.868 N/A ARG 386.A NH1 GLU 382.A OE2 no hydrogen 2.874 N/A MET 387.A N ARG 383.A O no hydrogen 2.925 N/A PHE 388.A N ALA 384.A O no hydrogen 2.836 N/A ASP 389.A N PHE 385.A O no hydrogen 2.927 N/A ASN 392.A N ASP 389.A O no hydrogen 3.202 N/A SER 393.A N ASP 389.A OD1 no hydrogen 3.041 N/A SER 393.A N ASP 391.A OD1 no hydrogen 3.133 N/A SER 393.A OG ASP 389.A OD1 no hydrogen 3.169 N/A SER 393.A OG ASP 391.A OD1 no hydrogen 3.392 N/A GLY 394.A N ASP 389.A OD2 no hydrogen 2.623 N/A LYS 395.A N SER 393.A OG no hydrogen 3.195 N/A LYS 395.A NZ GLU 429.A OE2 no hydrogen 3.233 N/A ILE 396.A N VAL 430.A O no hydrogen 2.833 N/A SER 397.A N GLU 400.A OE1 no hydrogen 2.783 N/A SER 397.A OG GLU 400.A OE1 no hydrogen 3.358 N/A SER 398.A N GLY 428.A O no hydrogen 2.895 N/A SER 398.A OG GLY 428.A O no hydrogen 2.998 N/A GLU 400.A N SER 397.A OG no hydrogen 3.387 N/A LEU 401.A N SER 397.A O no hydrogen 2.890 N/A ALA 402.A N SER 398.A O no hydrogen 3.009 N/A THR 403.A N THR 399.A O no hydrogen 3.100 N/A THR 403.A OG1 THR 399.A O no hydrogen 3.185 N/A ILE 404.A N GLU 400.A O no hydrogen 2.819 N/A PHE 405.A N LEU 401.A O no hydrogen 2.663 N/A GLY 406.A N ALA 402.A O no hydrogen 2.941 N/A VAL 407.A N THR 403.A O no hydrogen 3.047 N/A SER 408.A N ILE 404.A O no hydrogen 3.116 N/A SER 408.A OG ILE 404.A O no hydrogen 2.782 N/A ASP 409.A N GLY 406.A O no hydrogen 3.186 N/A VAL 410.A N PHE 405.A O no hydrogen 2.942 N/A THR 414.A N ASP 411.A OD2 no hydrogen 2.935 N/A THR 414.A OG1 ASP 411.A OD2 no hydrogen 2.705 N/A TRP 415.A N ASP 411.A O no hydrogen 3.171 N/A LYS 416.A N SER 412.A O no hydrogen 3.179 N/A SER 417.A N GLU 413.A O no hydrogen 3.049 N/A VAL 418.A N THR 414.A O no hydrogen 3.078 N/A LEU 419.A N TRP 415.A O no hydrogen 2.778 N/A SER 420.A N LYS 416.A O no hydrogen 3.197 N/A SER 420.A OG LYS 416.A O no hydrogen 3.001 N/A GLU 421.A N SER 417.A O no hydrogen 3.403 N/A VAL 422.A N VAL 418.A O no hydrogen 3.205 N/A ASP 423.A N LEU 419.A O no hydrogen 3.121 N/A ASN 426.A ND2 ASP 423.A O no hydrogen 3.087 N/A ASP 427.A N ASN 425.A O no hydrogen 2.671 N/A GLY 428.A N ASN 426.A OD1 no hydrogen 3.040 N/A VAL 430.A N ILE 396.A O no hydrogen 2.988 N/A ASP 431.A N GLU 434.A OE1 no hydrogen 3.098 N/A GLU 434.A N ASP 431.A OD1 no hydrogen 2.983 N/A PHE 435.A N ASP 431.A O no hydrogen 2.994 N/A GLN 436.A N PHE 432.A O no hydrogen 2.921 N/A GLN 436.A NE2 ASP 433.A OD1 no hydrogen 3.316 N/A GLN 437.A N ASP 433.A O no hydrogen 2.928 N/A GLN 437.A NE2 ASP 433.A OD2 no hydrogen 2.767 N/A MET 438.A N GLU 434.A O no hydrogen 2.874 N/A LEU 439.A N PHE 435.A O no hydrogen 3.050 N/A LEU 440.A N GLN 436.A O no hydrogen 2.953 N/A LYS 441.A N GLN 437.A O no hydrogen 3.089 N/A LYS 441.A NZ GLU 421.A OE2 no hydrogen 3.025 N/A LEU 442.A N MET 438.A O no hydrogen 2.985 N/A LEU 442.A N LEU 439.A O no hydrogen 3.191 N/A CYS 443.A N LEU 440.A O no hydrogen 3.111 N/A CYS 443.A SG MET 298.A O no hydrogen 3.990 N/A CYS 443.A SG LEU 439.A O no hydrogen 3.247 N/A CYS 443.A SG LEU 440.A O no hydrogen 3.567 N/A CYS 443.A SG ASN 445.A OD1 no hydrogen 3.892 N/A ASN 445.A N LEU 440.A O no hydrogen 2.955 N/A