Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1a4s_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLN 2.A NE2 ASP 19.A OD1 no hydrogen 2.724 N/A ASP 5.A N ALA 1.A O no hydrogen 2.953 N/A SER 6.A N GLN 2.A O no hydrogen 3.027 N/A SER 6.A N LEU 3.A O no hydrogen 3.261 N/A SER 6.A OG LEU 3.A O no hydrogen 2.898 N/A MET 7.A N VAL 4.A O no hydrogen 3.157 N/A SER 9.A N SER 6.A O no hydrogen 3.378 N/A SER 9.A OG SER 6.A O no hydrogen 3.403 N/A ALA 10.A N MET 7.A O no hydrogen 2.859 N/A SER 11.A N SER 14.A OG no hydrogen 3.277 N/A SER 11.A OG THR 12.A O no hydrogen 3.491 N/A THR 12.A OG1 ASP 328.A OD1 no hydrogen 2.494 N/A GLY 13.A N GLU 42.A OE2 no hydrogen 2.840 N/A SER 14.A N SER 11.A O no hydrogen 3.006 N/A SER 14.A OG SER 11.A O no hydrogen 3.144 N/A VAL 17.A N LEU 49.A O no hydrogen 2.816 N/A ASN 22.A ND2 VAL 53.A O no hydrogen 3.034 N/A TYR 23.A N VAL 217.A O no hydrogen 2.932 N/A TRP 24.A N ARG 27.A O no hydrogen 3.203 N/A GLY 25.A N SER 66.A OG no hydrogen 2.978 N/A ARG 27.A N TRP 24.A O no hydrogen 3.222 N/A ARG 28.A NE GLU 203.A OE2 no hydrogen 2.739 N/A ARG 28.A NH1 ASP 20.A O no hydrogen 3.034 N/A ARG 28.A NH2 GLU 203.A OE1 no hydrogen 2.761 N/A ILE 29.A N ASN 22.A O no hydrogen 2.780 N/A THR 37.A OG1 GLN 51.A OE1 no hydrogen 2.877 N/A GLU 38.A N MET 52.A O no hydrogen 2.964 N/A VAL 40.A N CYS 50.A O no hydrogen 2.892 N/A GLU 42.A N ARG 47.A O no hydrogen 2.902 N/A THR 45.A N GLU 42.A O no hydrogen 3.298 N/A THR 45.A OG1 GLU 42.A OE1 no hydrogen 2.645 N/A GLY 46.A N GLU 42.A O no hydrogen 2.730 N/A ARG 47.A N THR 45.A OG1 no hydrogen 3.293 N/A ARG 47.A NH1 VAL 15.A O no hydrogen 2.918 N/A ARG 47.A NH1 GLU 42.A OE1 no hydrogen 2.867 N/A ARG 47.A NH2 VAL 15.A O no hydrogen 2.791 N/A LEU 49.A N VAL 40.A O no hydrogen 2.657 N/A MET 52.A N GLU 38.A O no hydrogen 2.579 N/A CYS 55.A N GLN 219.A O no hydrogen 2.823 N/A CYS 55.A SG ASN 22.A OD1 no hydrogen 3.007 N/A CYS 55.A SG GLN 219.A O no hydrogen 3.635 N/A GLY 56.A N GLU 59.A OE1 no hydrogen 2.766 N/A VAL 60.A N GLY 56.A O no hydrogen 3.032 N/A ASP 61.A N ALA 57.A O no hydrogen 3.036 N/A GLN 62.A N GLU 58.A O no hydrogen 3.189 N/A GLN 62.A NE2 GLU 58.A O no hydrogen 3.369 N/A ALA 63.A N GLU 59.A O no hydrogen 3.069 N/A VAL 64.A N VAL 60.A O no hydrogen 2.894 N/A GLN 65.A N ASP 61.A O no hydrogen 2.939 N/A GLN 65.A NE2 ASP 61.A O no hydrogen 3.673 N/A GLN 65.A NE2 ASP 61.A OD2 no hydrogen 2.573 N/A SER 66.A N GLN 62.A O no hydrogen 2.970 N/A SER 66.A OG ASN 216.A OD1 no hydrogen 2.912 N/A ALA 67.A N ALA 63.A O no hydrogen 3.033 N/A GLN 68.A N VAL 64.A O no hydrogen 2.794 N/A ALA 69.A N GLN 65.A O no hydrogen 3.192 N/A ALA 70.A N SER 66.A O no hydrogen 3.192 N/A TYR 71.A N ALA 67.A O no hydrogen 2.912 N/A LEU 72.A N GLN 68.A O no hydrogen 3.108 N/A LYS 73.A N ALA 70.A O no hydrogen 2.892 N/A TRP 74.A N ALA 70.A O no hydrogen 2.905 N/A TRP 74.A NE1 LEU 180.A O no hydrogen 2.850 N/A SER 75.A N TYR 71.A O no hydrogen 3.034 N/A SER 75.A OG TYR 71.A O no hydrogen 2.726 N/A LYS 76.A N LYS 73.A O no hydrogen 3.117 N/A MET 77.A N TRP 74.A O no hydrogen 2.852 N/A ALA 78.A N GLU 81.A OE1 no hydrogen 2.799 N/A GLU 81.A N ALA 78.A O no hydrogen 2.971 N/A ARG 82.A N ALA 78.A O no hydrogen 3.027 N/A ARG 82.A NH1 ALA 181.A O no hydrogen 3.231 N/A SER 83.A N GLY 79.A O no hydrogen 2.850 N/A SER 83.A OG ALA 130.A O no hydrogen 2.669 N/A ARG 84.A NH1 GLU 88.A OE2 no hydrogen 3.240 N/A MET 86.A N ARG 82.A O no hydrogen 3.077 N/A LEU 87.A N SER 83.A O no hydrogen 2.943 N/A GLU 88.A N ARG 84.A O no hydrogen 3.269 N/A ALA 89.A N VAL 85.A O no hydrogen 3.027 N/A ALA 90.A N MET 86.A O no hydrogen 3.164 N/A ARG 91.A N LEU 87.A O no hydrogen 2.981 N/A ARG 91.A NE GLU 88.A OE1 no hydrogen 2.790 N/A ARG 91.A NH1 GLU 95.A OE2 no hydrogen 3.148 N/A ARG 91.A NH2 GLU 88.A OE1 no hydrogen 2.527 N/A ILE 92.A N GLU 88.A O no hydrogen 3.014 N/A ILE 93.A N ALA 89.A O no hydrogen 3.120 N/A ARG 94.A N ALA 90.A O no hydrogen 3.028 N/A ARG 94.A NH1 GLU 127.A OE2 no hydrogen 2.754 N/A GLU 95.A N ARG 91.A O no hydrogen 3.128 N/A ARG 96.A N ILE 92.A O no hydrogen 3.218 N/A ARG 96.A N ILE 93.A O no hydrogen 3.242 N/A ARG 96.A NH1 GLU 207.A OE2 no hydrogen 2.900 N/A ARG 96.A NH2 GLU 207.A OE1 no hydrogen 2.711 N/A ARG 96.A NH2 GLU 207.A OE2 no hydrogen 3.167 N/A ARG 97.A N ARG 94.A O no hydrogen 3.273 N/A ARG 97.A NE ASP 98.A OD1 no hydrogen 2.800 N/A ARG 97.A NH1 ASP 120.A OD1 no hydrogen 3.072 N/A ARG 97.A NH2 ASP 98.A OD1 no hydrogen 2.860 N/A ILE 100.A N ARG 96.A O no hydrogen 2.912 N/A ALA 101.A N ARG 97.A O no hydrogen 2.958 N/A LYS 102.A N ASP 98.A O no hydrogen 3.151 N/A LYS 102.A NZ MET 7.A O no hydrogen 2.500 N/A LYS 102.A NZ ALA 10.A O no hydrogen 2.823 N/A LEU 103.A N ASN 99.A O no hydrogen 3.115 N/A GLU 104.A N ILE 100.A O no hydrogen 2.963 N/A VAL 105.A N ALA 101.A O no hydrogen 2.882 N/A ILE 106.A N LYS 102.A O no hydrogen 3.187 N/A ASN 107.A N LEU 103.A O no hydrogen 3.305 N/A ASN 107.A ND2 PHE 41.A O no hydrogen 3.598 N/A ASN 107.A ND2 ASN 107.A O no hydrogen 2.693 N/A ASN 107.A ND2 MET 193.A O no hydrogen 2.928 N/A ASN 108.A N GLU 104.A O no hydrogen 3.035 N/A ASN 108.A ND2 TRP 165.A O no hydrogen 2.869 N/A ASN 108.A ND2 ASN 166.A O no hydrogen 3.227 N/A GLY 109.A N VAL 105.A O no hydrogen 2.747 N/A LYS 110.A N ASN 108.A OD1 no hydrogen 2.887 N/A LYS 110.A NZ ASP 118.A OD2 no hydrogen 2.364 N/A LYS 110.A NZ ASN 166.A O no hydrogen 3.092 N/A LYS 110.A NZ THR 292.A OG1 no hydrogen 3.335 N/A ILE 112.A N PRO 329.A O no hydrogen 3.024 N/A THR 113.A OG1 THR 332.A O no hydrogen 3.278 N/A GLU 114.A N THR 111.A OG1 no hydrogen 3.362 N/A ALA 115.A N THR 111.A O no hydrogen 2.820 N/A GLU 116.A N ILE 112.A O no hydrogen 3.133 N/A ASP 118.A N GLU 114.A O no hydrogen 3.152 N/A ILE 119.A N ALA 115.A O no hydrogen 3.066 N/A ILE 119.A N GLU 116.A O no hydrogen 3.253 N/A ASP 120.A N GLU 116.A O no hydrogen 3.058 N/A ALA 121.A N TYR 117.A O no hydrogen 2.887 N/A ALA 122.A N ASP 118.A O no hydrogen 3.071 N/A TRP 123.A N ILE 119.A O no hydrogen 3.106 N/A TRP 123.A NE1 ASP 120.A OD1 no hydrogen 3.045 N/A GLN 124.A N ASP 120.A O no hydrogen 2.889 N/A CYS 125.A N ALA 121.A O no hydrogen 2.936 N/A CYS 125.A SG ASN 478.A OD1 no hydrogen 3.638 N/A ILE 126.A N ALA 122.A O no hydrogen 3.339 N/A GLU 127.A N TRP 123.A O no hydrogen 2.988 N/A TYR 128.A N GLN 124.A O no hydrogen 2.778 N/A TYR 129.A N CYS 125.A O no hydrogen 3.034 N/A TYR 129.A OH GLY 479.A O no hydrogen 2.833 N/A ALA 130.A N ILE 126.A O no hydrogen 3.147 N/A GLY 131.A N GLU 127.A O no hydrogen 3.161 N/A LEU 132.A N TYR 128.A O no hydrogen 3.183 N/A ALA 133.A N TYR 129.A O no hydrogen 2.954 N/A THR 135.A N LEU 132.A O no hydrogen 2.787 N/A LEU 136.A N LEU 132.A O no hydrogen 3.266 N/A LEU 136.A N ALA 133.A O no hydrogen 3.360 N/A GLN 139.A N THR 151.A OG1 no hydrogen 2.817 N/A ILE 141.A N ALA 149.A O no hydrogen 2.879 N/A LEU 143.A N ALA 147.A O no hydrogen 3.055 N/A PHE 148.A N VAL 494.A O no hydrogen 3.176 N/A ALA 149.A N ILE 141.A O no hydrogen 3.047 N/A TYR 150.A N VAL 492.A O no hydrogen 2.915 N/A THR 151.A N GLN 139.A O no hydrogen 3.030 N/A ARG 152.A N LYS 490.A O no hydrogen 3.034 N/A ARG 152.A NH1 GLU 154.A OE2 no hydrogen 2.596 N/A ARG 153.A NE SER 137.A O no hydrogen 3.182 N/A ARG 153.A NH1 SER 487.A OG no hydrogen 3.025 N/A GLU 154.A N GLN 488.A O no hydrogen 2.862 N/A LEU 156.A N ASN 184.A OD1 no hydrogen 2.739 N/A GLY 157.A N ASN 184.A OD1 no hydrogen 2.993 N/A CYS 159.A N ALA 185.A O no hydrogen 3.086 N/A ALA 160.A N LYS 236.A O no hydrogen 2.873 N/A GLY 161.A N VAL 187.A O no hydrogen 3.077 N/A ILE 162.A N SER 238.A O no hydrogen 2.879 N/A LEU 163.A N LYS 189.A O no hydrogen 3.265 N/A ASN 166.A ND2 GLN 295.A O no hydrogen 2.845 N/A PHE 169.A N GLU 104.A OE2 no hydrogen 2.834 N/A ILE 171.A N TYR 167.A O no hydrogen 2.863 N/A ALA 172.A N PRO 168.A O no hydrogen 3.251 N/A ALA 173.A N PHE 169.A O no hydrogen 3.298 N/A TRP 174.A N MET 170.A O no hydrogen 2.848 N/A LYS 175.A N ILE 171.A O no hydrogen 3.238 N/A LYS 175.A NZ SER 238.A OG no hydrogen 2.758 N/A LYS 175.A NZ THR 240.A OG1 no hydrogen 3.018 N/A LYS 175.A NZ GLU 477.A OE2 no hydrogen 2.931 N/A CYS 176.A N ALA 172.A O no hydrogen 2.933 N/A CYS 176.A SG ALA 172.A O no hydrogen 3.251 N/A ALA 177.A N ALA 173.A O no hydrogen 2.883 N/A LEU 180.A N CYS 176.A O no hydrogen 2.956 N/A ALA 181.A N ALA 177.A O no hydrogen 2.940 N/A CYS 182.A N PRO 178.A O no hydrogen 3.019 N/A CYS 182.A SG PRO 178.A O no hydrogen 3.578 N/A CYS 182.A SG VAL 483.A O no hydrogen 3.680 N/A GLY 183.A N LEU 180.A O no hydrogen 3.002 N/A ASN 184.A N ALA 179.A O no hydrogen 2.948 N/A ASN 184.A ND2 ALA 179.A O no hydrogen 2.852 N/A ASN 184.A ND2 TYR 486.A O no hydrogen 2.802 N/A ALA 185.A N GLY 157.A O no hydrogen 3.101 N/A VAL 186.A N LEU 214.A O no hydrogen 2.865 N/A VAL 187.A N CYS 159.A O no hydrogen 3.062 N/A PHE 188.A N ASN 216.A O no hydrogen 2.963 N/A LYS 189.A N GLY 161.A O no hydrogen 3.015 N/A LYS 189.A NZ PRO 190.A O no hydrogen 3.096 N/A LYS 189.A NZ GLY 220.A O no hydrogen 2.986 N/A THR 194.A N SER 191.A O no hydrogen 3.081 N/A THR 197.A OG1 GLU 104.A OE1 no hydrogen 2.630 N/A VAL 199.A N VAL 196.A O no hydrogen 3.410 N/A ILE 200.A N THR 197.A O no hydrogen 3.002 N/A LEU 201.A N THR 197.A O no hydrogen 3.377 N/A ALA 202.A N GLY 198.A O no hydrogen 3.320 N/A GLU 203.A N VAL 199.A O no hydrogen 2.858 N/A ILE 204.A N ILE 200.A O no hydrogen 2.866 N/A PHE 205.A N LEU 201.A O no hydrogen 3.070 N/A HIS 206.A N ALA 202.A O no hydrogen 3.478 N/A GLU 207.A N GLU 203.A O no hydrogen 2.895 N/A ALA 208.A N ILE 204.A O no hydrogen 2.764 N/A GLY 209.A N PHE 205.A O no hydrogen 3.144 N/A GLY 209.A N HIS 206.A O no hydrogen 2.972 N/A VAL 210.A N PHE 205.A O no hydrogen 3.151 N/A LEU 214.A N PRO 211.A O no hydrogen 3.011 N/A ASN 216.A N VAL 186.A O no hydrogen 2.877 N/A ASN 216.A ND2 VAL 186.A O no hydrogen 3.160 N/A ASN 216.A ND2 GLY 213.A O no hydrogen 2.647 N/A VAL 217.A N TYR 23.A O no hydrogen 2.698 N/A VAL 218.A N PHE 188.A O no hydrogen 2.935 N/A GLN 219.A N ASN 22.A OD1 no hydrogen 2.970 N/A GLN 219.A NE2 LEU 21.A O no hydrogen 2.995 N/A GLN 219.A NE2 PRO 195.A O no hydrogen 3.053 N/A THR 224.A OG1 CYS 55.A O no hydrogen 2.688 N/A GLY 225.A N GLY 221.A O no hydrogen 2.953 N/A SER 226.A N ALA 222.A O no hydrogen 2.708 N/A SER 226.A OG ALA 222.A O no hydrogen 2.971 N/A LEU 227.A N GLU 223.A O no hydrogen 2.929 N/A LEU 228.A N THR 224.A O no hydrogen 3.346 N/A CYS 229.A N GLY 225.A O no hydrogen 3.214 N/A CYS 229.A SG GLY 225.A O no hydrogen 3.567 N/A HIS 230.A N SER 226.A O no hydrogen 2.991 N/A HIS 231.A N LEU 228.A O no hydrogen 3.258 N/A VAL 234.A N HIS 231.A O no hydrogen 3.409 N/A ALA 235.A N VAL 158.A O no hydrogen 2.787 N/A LYS 236.A NZ THR 261.A OG1 no hydrogen 2.996 N/A VAL 237.A N HIS 259.A O no hydrogen 2.903 N/A SER 238.A N ALA 160.A O no hydrogen 2.776 N/A SER 238.A OG THR 261.A OG1 no hydrogen 3.278 N/A PHE 239.A N THR 261.A O no hydrogen 3.087 N/A THR 240.A N ILE 162.A O no hydrogen 3.064 N/A GLY 241.A N GLU 263.A O no hydrogen 3.199 N/A SER 242.A OG THR 245.A OG1 no hydrogen 3.332 N/A THR 245.A N SER 242.A OG no hydrogen 3.301 N/A THR 245.A OG1 SER 242.A OG no hydrogen 3.332 N/A GLY 246.A N SER 242.A O no hydrogen 2.865 N/A LYS 247.A N VAL 243.A O no hydrogen 2.956 N/A LYS 248.A N PRO 244.A O no hydrogen 3.416 N/A VAL 249.A N THR 245.A O no hydrogen 2.990 N/A MET 250.A N GLY 246.A O no hydrogen 3.023 N/A GLU 251.A N LYS 247.A O no hydrogen 3.111 N/A MET 252.A N LYS 248.A O no hydrogen 2.819 N/A SER 253.A N VAL 249.A O no hydrogen 2.997 N/A SER 253.A OG VAL 249.A O no hydrogen 2.688 N/A ALA 254.A N MET 250.A O no hydrogen 3.080 N/A ALA 254.A N GLU 251.A O no hydrogen 3.211 N/A LYS 255.A N MET 252.A O no hydrogen 3.262 N/A THR 256.A N SER 253.A O no hydrogen 3.401 N/A VAL 257.A N ALA 254.A O no hydrogen 3.089 N/A LYS 258.A N SER 253.A O no hydrogen 3.168 N/A LYS 258.A NZ CYS 229.A O no hydrogen 3.022 N/A LYS 258.A NZ HIS 231.A O no hydrogen 2.676 N/A HIS 259.A N ALA 235.A O no hydrogen 3.302 N/A THR 261.A N VAL 237.A O no hydrogen 3.118 N/A LEU 262.A N PHE 474.A O no hydrogen 2.964 N/A GLU 263.A N PHE 239.A O no hydrogen 3.056 N/A LEU 264.A N SER 472.A O no hydrogen 2.772 N/A GLY 266.A N GLU 400.A OE2 no hydrogen 2.980 N/A LYS 267.A NZ THR 301.A OG1 no hydrogen 3.221 N/A LYS 267.A NZ CYS 396.A O no hydrogen 2.939 N/A SER 268.A OG THR 298.A O no hydrogen 3.373 N/A SER 268.A OG ALA 429.A O no hydrogen 2.975 N/A LEU 270.A N ARG 302.A O no hydrogen 2.894 N/A LEU 271.A N GLY 431.A O no hydrogen 2.795 N/A ILE 272.A N PHE 304.A O no hydrogen 2.988 N/A PHE 273.A N PHE 433.A O no hydrogen 3.026 N/A LYS 274.A N GLN 306.A OE1 no hydrogen 2.611 N/A LYS 274.A NZ GLU 308.A OE2 no hydrogen 3.443 N/A CYS 276.A N PHE 273.A O no hydrogen 3.077 N/A CYS 276.A SG PHE 273.A O no hydrogen 3.249 N/A ASN 280.A ND2 GLU 277.A OE1 no hydrogen 3.050 N/A ALA 281.A N GLU 277.A O no hydrogen 2.989 N/A VAL 282.A N LEU 278.A O no hydrogen 2.804 N/A ARG 283.A N GLU 279.A O no hydrogen 2.863 N/A ARG 283.A NE GLU 279.A OE2 no hydrogen 2.868 N/A GLY 284.A N ASN 280.A O no hydrogen 2.753 N/A ALA 285.A N ALA 281.A O no hydrogen 2.866 N/A LEU 286.A N VAL 282.A O no hydrogen 3.050 N/A MET 287.A N ARG 283.A O no hydrogen 2.817 N/A ALA 288.A N GLY 284.A O no hydrogen 2.797 N/A ALA 288.A N ALA 285.A O no hydrogen 3.214 N/A ASN 289.A N LEU 286.A O no hydrogen 3.130 N/A ASN 289.A ND2 ALA 285.A O no hydrogen 2.929 N/A ASN 289.A ND2 GLY 300.A O no hydrogen 3.029 N/A PHE 290.A N LEU 286.A O no hydrogen 3.027 N/A THR 292.A N GLU 114.A OE2 no hydrogen 2.863 N/A THR 292.A OG1 GLU 114.A OE1 no hydrogen 2.517 N/A GLY 294.A N LEU 291.A O no hydrogen 2.833 N/A GLN 295.A N THR 292.A O no hydrogen 2.995 N/A GLN 295.A NE2 THR 292.A O no hydrogen 3.124 N/A ASN 299.A N VAL 296.A O no hydrogen 3.154 N/A GLY 300.A N ALA 288.A O no hydrogen 2.876 N/A ARG 302.A N SER 268.A O no hydrogen 3.329 N/A ARG 302.A NE LYS 267.A O no hydrogen 2.956 N/A ARG 302.A NH1 ARG 420.A O no hydrogen 3.024 N/A ARG 302.A NH2 LYS 267.A O no hydrogen 3.005 N/A ARG 302.A NH2 ALA 421.A O no hydrogen 2.906 N/A VAL 303.A N SER 407.A O no hydrogen 2.834 N/A PHE 304.A N LEU 270.A O no hydrogen 2.787 N/A VAL 305.A N LEU 409.A O no hydrogen 2.790 N/A GLN 306.A N ILE 272.A O no hydrogen 3.018 N/A GLN 306.A NE2 ASP 412.A O no hydrogen 3.404 N/A ARG 307.A N PHE 411.A O no hydrogen 2.998 N/A ARG 307.A NE ASP 412.A OD1 no hydrogen 2.742 N/A ARG 307.A NH2 ASP 412.A OD2 no hydrogen 3.014 N/A GLU 308.A N GLU 308.A OE1 no hydrogen 2.732 N/A ILE 309.A N GLN 306.A O no hydrogen 2.963 N/A MET 310.A N ARG 307.A O no hydrogen 3.213 N/A GLN 312.A N GLN 312.A OE1 no hydrogen 2.932 N/A PHE 313.A N ILE 309.A O no hydrogen 2.906 N/A LEU 314.A N MET 310.A O no hydrogen 2.918 N/A GLU 315.A N PRO 311.A O no hydrogen 3.000 N/A GLU 316.A N GLN 312.A O no hydrogen 3.388 N/A VAL 317.A N PHE 313.A O no hydrogen 2.817 N/A VAL 318.A N LEU 314.A O no hydrogen 2.933 N/A LYS 319.A N GLU 315.A O no hydrogen 3.339 N/A LYS 319.A NZ GLU 316.A OE1 no hydrogen 3.060 N/A ARG 320.A N GLU 316.A O no hydrogen 3.041 N/A ARG 320.A NH1 GLU 279.A OE1 no hydrogen 2.859 N/A ARG 320.A NH1 GLU 279.A OE2 no hydrogen 3.141 N/A ARG 320.A NH1 GLU 316.A OE2 no hydrogen 3.003 N/A ARG 320.A NH2 GLU 279.A OE2 no hydrogen 3.022 N/A THR 321.A N VAL 317.A O no hydrogen 2.978 N/A THR 321.A OG1 VAL 317.A O no hydrogen 2.729 N/A LYS 322.A N VAL 318.A O no hydrogen 3.104 N/A ALA 323.A N LYS 319.A O no hydrogen 3.003 N/A ALA 323.A N ARG 320.A O no hydrogen 3.136 N/A ILE 324.A N THR 321.A O no hydrogen 2.974 N/A GLY 327.A N MET 336.A O no hydrogen 3.092 N/A LEU 330.A N ASP 328.A OD1 no hydrogen 3.071 N/A LEU 331.A N ASP 328.A O no hydrogen 3.129 N/A THR 332.A OG1 GLU 333.A OE1 no hydrogen 3.277 N/A GLU 333.A N GLU 333.A OE1 no hydrogen 2.817 N/A THR 334.A N LEU 331.A O no hydrogen 3.184 N/A THR 334.A OG1 ASP 328.A O no hydrogen 2.568 N/A ARG 335.A N VAL 325.A O no hydrogen 2.751 N/A ARG 335.A NH1 THR 332.A O no hydrogen 2.821 N/A ARG 335.A NH1 THR 334.A O no hydrogen 3.091 N/A MET 336.A N VAL 325.A O no hydrogen 3.010 N/A GLY 337.A N GLN 293.A OE1 no hydrogen 2.664 N/A LEU 339.A N TYR 380.A O no hydrogen 2.801 N/A ILE 340.A N GLN 295.A OE1 no hydrogen 3.039 N/A LYS 342.A NZ ASP 346.A OD1 no hydrogen 3.178 N/A GLN 344.A N SER 341.A OG no hydrogen 3.166 N/A LEU 345.A N SER 341.A O no hydrogen 3.130 N/A ASP 346.A N LYS 342.A O no hydrogen 2.879 N/A LYS 347.A N PRO 343.A O no hydrogen 2.885 N/A VAL 348.A N GLN 344.A O no hydrogen 2.800 N/A LEU 349.A N LEU 345.A O no hydrogen 2.743 N/A GLY 350.A N ASP 346.A O no hydrogen 2.764 N/A PHE 351.A N LYS 347.A O no hydrogen 2.945 N/A VAL 352.A N VAL 348.A O no hydrogen 3.344 N/A ALA 353.A N LEU 349.A O no hydrogen 2.944 N/A GLN 354.A N GLY 350.A O no hydrogen 2.876 N/A ALA 355.A N PHE 351.A O no hydrogen 2.843 N/A LYS 356.A N VAL 352.A O no hydrogen 3.124 N/A LYS 357.A N ALA 353.A O no hydrogen 3.150 N/A GLU 358.A N GLN 354.A O no hydrogen 3.027 N/A GLU 358.A N ALA 355.A O no hydrogen 3.023 N/A GLY 359.A N ALA 355.A O no hydrogen 3.061 N/A GLY 359.A N LYS 356.A O no hydrogen 3.042 N/A ALA 360.A N ALA 355.A O no hydrogen 2.826 N/A ARG 361.A N ASP 388.A O no hydrogen 2.740 N/A LEU 363.A N VAL 386.A O no hydrogen 2.852 N/A GLY 366.A N SER 383.A O no hydrogen 2.967 N/A LEU 369.A N PHE 381.A O no hydrogen 3.103 N/A LYS 375.A N ASP 373.A OD1 no hydrogen 3.122 N/A LYS 375.A NZ ASP 373.A OD2 no hydrogen 2.790 N/A LEU 376.A N ASP 373.A O no hydrogen 3.169 N/A GLY 379.A N LEU 376.A O no hydrogen 3.118 N/A TYR 380.A N PRO 43.A O no hydrogen 2.934 N/A PHE 381.A N GLY 379.A O no hydrogen 3.147 N/A SER 383.A N GLU 367.A O no hydrogen 3.041 N/A SER 383.A OG GLU 367.A O no hydrogen 3.482 N/A CYS 385.A N PRO 404.A O no hydrogen 2.771 N/A CYS 385.A SG CYS 364.A O no hydrogen 3.285 N/A VAL 386.A N CYS 364.A O no hydrogen 3.266 N/A LEU 387.A N MET 406.A O no hydrogen 2.862 N/A ASP 388.A N ARG 361.A O no hydrogen 2.779 N/A ARG 391.A NE ASP 393.A OD1 no hydrogen 2.661 N/A ARG 391.A NH2 ASP 393.A OD1 no hydrogen 2.695 N/A ARG 391.A NH2 ASP 393.A OD2 no hydrogen 2.641 N/A MET 394.A N ARG 391.A O no hydrogen 3.008 N/A THR 395.A N GLU 358.A OE1 no hydrogen 2.826 N/A THR 395.A OG1 GLU 358.A OE1 no hydrogen 3.395 N/A THR 395.A OG1 GLU 358.A OE2 no hydrogen 2.783 N/A VAL 397.A N MET 394.A O no hydrogen 3.091 N/A LYS 398.A N MET 394.A O no hydrogen 3.120 N/A GLU 399.A N THR 395.A O no hydrogen 3.010 N/A VAL 405.A N GLY 403.A O no hydrogen 2.935 N/A MET 406.A N CYS 385.A O no hydrogen 2.856 N/A SER 407.A N THR 301.A O no hydrogen 3.134 N/A VAL 408.A N LEU 387.A O no hydrogen 3.061 N/A LEU 409.A N VAL 303.A O no hydrogen 2.968 N/A PHE 411.A N VAL 305.A O no hydrogen 3.293 N/A ASP 412.A N GLU 416.A OE1 no hydrogen 2.640 N/A THR 413.A N GLU 416.A OE1 no hydrogen 3.231 N/A GLU 416.A N THR 413.A OG1 no hydrogen 2.996 N/A VAL 417.A N THR 413.A O no hydrogen 2.971 N/A LEU 418.A N GLU 414.A O no hydrogen 2.950 N/A GLN 419.A N GLU 415.A O no hydrogen 3.370 N/A ARG 420.A N GLU 416.A O no hydrogen 3.179 N/A ARG 420.A NE ASP 392.A OD2 no hydrogen 2.662 N/A ARG 420.A NH1 PRO 410.A O no hydrogen 3.092 N/A ARG 420.A NH1 GLU 416.A OE2 no hydrogen 2.688 N/A ARG 420.A NH2 ASP 392.A OD1 no hydrogen 3.028 N/A ARG 420.A NH2 ASP 392.A OD2 no hydrogen 3.309 N/A ALA 421.A N VAL 417.A O no hydrogen 2.753 N/A ASN 422.A N LEU 418.A O no hydrogen 3.043 N/A ASN 422.A ND2 ASN 446.A O no hydrogen 2.967 N/A ASN 423.A N GLN 419.A O no hydrogen 3.091 N/A THR 424.A N ASN 422.A O no hydrogen 2.779 N/A PHE 426.A N THR 424.A OG1 no hydrogen 3.181 N/A GLY 427.A N SER 472.A OG no hydrogen 2.938 N/A ALA 429.A N SER 268.A OG no hydrogen 3.125 N/A SER 430.A OG THR 451.A O no hydrogen 2.921 N/A GLY 431.A N PRO 269.A O no hydrogen 2.841 N/A VAL 432.A N TYR 453.A O no hydrogen 2.885 N/A PHE 433.A N LEU 271.A O no hydrogen 2.709 N/A THR 434.A N ASN 455.A OD1 no hydrogen 3.188 N/A THR 434.A OG1 ASP 275.A OD1 no hydrogen 2.693 N/A THR 434.A OG1 ASP 275.A OD2 no hydrogen 2.982 N/A ARG 435.A N ASP 275.A OD2 no hydrogen 3.016 N/A ASP 436.A N ASP 275.A OD2 no hydrogen 3.177 N/A ARG 439.A N ASP 436.A OD2 no hydrogen 3.040 N/A ARG 439.A NE THR 434.A OG1 no hydrogen 3.146 N/A ARG 439.A NH2 ASP 275.A OD2 no hydrogen 3.017 N/A ALA 440.A N ASP 436.A O no hydrogen 3.029 N/A HIS 441.A N ILE 437.A O no hydrogen 3.300 N/A ARG 442.A N SER 438.A O no hydrogen 2.888 N/A ARG 442.A NE GLU 414.A OE1 no hydrogen 3.349 N/A ARG 442.A NE GLU 414.A OE2 no hydrogen 2.636 N/A ARG 442.A NH2 GLU 414.A OE1 no hydrogen 2.628 N/A ARG 442.A NH2 GLU 414.A OE2 no hydrogen 3.545 N/A VAL 443.A N ARG 439.A O no hydrogen 2.844 N/A ALA 444.A N ALA 440.A O no hydrogen 3.175 N/A ALA 445.A N HIS 441.A O no hydrogen 3.035 N/A ASN 446.A N ARG 442.A O no hydrogen 3.067 N/A ASN 446.A N VAL 443.A O no hydrogen 3.042 N/A LEU 447.A N VAL 443.A O no hydrogen 2.986 N/A GLU 448.A N ASN 422.A OD1 no hydrogen 2.803 N/A ALA 449.A N LEU 447.A O no hydrogen 3.134 N/A GLY 450.A N GLY 427.A O no hydrogen 3.163 N/A THR 451.A N LEU 428.A O no hydrogen 3.292 N/A CYS 452.A SG TYR 453.A O no hydrogen 3.830 N/A TYR 453.A N SER 430.A O no hydrogen 3.130 N/A TYR 453.A OH ILE 459.A O no hydrogen 3.396 N/A ASN 455.A N VAL 432.A O no hydrogen 2.905 N/A ASN 455.A ND2 THR 434.A O no hydrogen 2.731 N/A TYR 457.A N THR 456.A OG1 no hydrogen 2.679 N/A TYR 457.A OH THR 298.A O no hydrogen 2.682 N/A SER 458.A OG MET 287.A O no hydrogen 2.985 N/A GLU 463.A N GLU 463.A OE1 no hydrogen 2.824 N/A PHE 466.A N GLU 477.A O no hydrogen 2.782 N/A TYR 469.A N GLY 427.A O no hydrogen 2.937 N/A LYS 470.A NZ THR 424.A O no hydrogen 3.173 N/A LYS 470.A NZ GLU 448.A OE1 no hydrogen 2.693 N/A MET 471.A N THR 425.A O no hydrogen 2.865 N/A SER 472.A N TYR 469.A O no hydrogen 3.016 N/A SER 472.A OG GLY 265.A O no hydrogen 2.705 N/A GLY 473.A N LYS 470.A O no hydrogen 3.469 N/A PHE 474.A N LEU 262.A O no hydrogen 2.912 N/A ARG 476.A NH1 GLY 468.A O no hydrogen 3.032 N/A ARG 476.A NH1 GLY 475.A O no hydrogen 2.855 N/A GLU 477.A N PHE 466.A O no hydrogen 2.994 N/A GLY 479.A N VAL 462.A O no hydrogen 2.892 N/A THR 482.A OG1 ASN 478.A O no hydrogen 2.604 N/A VAL 483.A N GLN 480.A O no hydrogen 3.197 N/A ASP 484.A N ALA 481.A O no hydrogen 3.131 N/A TYR 485.A N THR 482.A O no hydrogen 3.132 N/A TYR 486.A N VAL 483.A O no hydrogen 3.221 N/A SER 487.A OG VAL 483.A O no hydrogen 2.839 N/A GLN 488.A N GLU 154.A O no hydrogen 2.846 N/A LYS 490.A N ARG 152.A O no hydrogen 2.977 N/A LYS 490.A NZ GLU 154.A OE1 no hydrogen 3.388 N/A LYS 490.A NZ GLU 154.A OE2 no hydrogen 2.771 N/A VAL 492.A N TYR 150.A O no hydrogen 2.940 N/A VAL 494.A N PHE 148.A O no hydrogen 2.756 N/A GLY 497.A N GLU 495.A OE2 no hydrogen 2.736 N/A SER 501.A OG PHE 503.A OXT no hydrogen 2.812 N/A PHE 503.A N SER 501.A OG no hydrogen 3.091 N/A