Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 5a6a_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): THR 1.A N VAL 25.A O no hydrogen 3.488 N/A SER 4.A OG GLN 7.A OE1 no hydrogen 3.097 N/A GLN 7.A N SER 4.A OG no hydrogen 3.307 N/A GLN 7.A NE2 TYR 47.A OH no hydrogen 3.011 N/A THR 8.A N SER 4.A O no hydrogen 2.971 N/A THR 8.A OG1 SER 4.A O no hydrogen 2.632 N/A GLN 9.A N LEU 5.A O no hydrogen 2.707 N/A ALA 10.A N LYS 6.A O no hydrogen 2.821 N/A ILE 11.A N GLN 7.A O no hydrogen 2.810 N/A GLU 12.A N THR 8.A O no hydrogen 3.142 N/A VAL 13.A N GLN 9.A O no hydrogen 3.271 N/A LEU 14.A N ALA 10.A O no hydrogen 2.951 N/A LYS 15.A N GLU 12.A O no hydrogen 2.904 N/A GLY 16.A N VAL 13.A O no hydrogen 3.276 N/A HIS 17.A N LEU 14.A O no hydrogen 3.111 N/A HIS 17.A NE2 GLU 103.A OE1 no hydrogen 2.586 N/A ILE 18.A N LEU 14.A O no hydrogen 2.837 N/A VAL 23.A N PRO 21.A O no hydrogen 3.267 N/A GLU 24.A N GLY 41.A O no hydrogen 3.176 N/A ALA 26.A N TYR 43.A O no hydrogen 2.730 N/A VAL 27.A N THR 1.A O no hydrogen 2.680 N/A THR 28.A N LEU 45.A O no hydrogen 3.182 N/A GLN 29.A NE2 ARG 48.A O no hydrogen 2.841 N/A SER 30.A N TYR 47.A O no hydrogen 2.902 N/A GLN 32.A N SER 30.A OG no hydrogen 2.736 N/A SER 34.A N GLU 74.A O no hydrogen 2.707 N/A ILE 35.A N GLU 74.A O no hydrogen 3.144 N/A SER 36.A N THR 46.A O no hydrogen 3.121 N/A SER 36.A OG ILE 72.A O no hydrogen 3.282 N/A ILE 37.A N ILE 72.A O no hydrogen 3.205 N/A GLU 38.A N GLN 44.A O no hydrogen 3.074 N/A GLY 39.A N VAL 70.A O no hydrogen 3.069 N/A HIS 42.A N GLU 40.A O no hydrogen 3.422 N/A TYR 43.A N GLU 24.A O no hydrogen 2.998 N/A TYR 43.A OH ASP 68.A O no hydrogen 3.013 N/A GLN 44.A N GLU 38.A O no hydrogen 2.945 N/A LEU 45.A N ALA 26.A O no hydrogen 3.013 N/A THR 46.A N SER 36.A O no hydrogen 2.659 N/A THR 46.A OG1 SER 36.A O no hydrogen 3.437 N/A ARG 48.A N SER 34.A O no hydrogen 3.046 N/A ARG 48.A NH1 GLN 75.A OE1 no hydrogen 3.565 N/A ARG 48.A NH2 ASP 31.A O no hydrogen 3.467 N/A ARG 48.A NH2 GLN 75.A OE1 no hydrogen 2.777 N/A LYS 49.A N GLN 52.A OE1 no hydrogen 2.680 N/A LYS 49.A NZ GLU 79.A O no hydrogen 2.602 N/A GLN 52.A N LYS 49.A O no hydrogen 3.026 N/A TYR 54.A N HIS 51.A O no hydrogen 2.989 N/A ARG 55.A NE GLU 74.A OE1 no hydrogen 2.738 N/A ARG 55.A NH1 MET 108.A O no hydrogen 3.226 N/A ARG 55.A NH1 GLU 389.A OE2 no hydrogen 3.181 N/A ARG 55.A NH2 GLU 74.A OE1 no hydrogen 3.207 N/A ARG 55.A NH2 GLU 74.A OE2 no hydrogen 2.809 N/A ARG 55.A NH2 GLU 389.A OE1 no hydrogen 3.512 N/A ALA 56.A N GLN 52.A O no hydrogen 3.020 N/A LEU 57.A N LEU 53.A O no hydrogen 2.970 N/A SER 58.A N TYR 54.A O no hydrogen 3.378 N/A SER 58.A OG ASN 406.A OD1 no hydrogen 2.512 N/A LEU 59.A N ARG 55.A O no hydrogen 2.987 N/A LEU 60.A N ALA 56.A O no hydrogen 2.910 N/A VAL 61.A N LEU 57.A O no hydrogen 2.898 N/A THR 62.A N SER 58.A O no hydrogen 3.102 N/A THR 62.A N LEU 59.A O no hydrogen 2.871 N/A THR 62.A OG1 SER 58.A O no hydrogen 2.549 N/A THR 62.A OG1 THR 405.A OG1 no hydrogen 2.363 N/A VAL 63.A N LEU 59.A O no hydrogen 2.939 N/A LEU 64.A N LEU 60.A O no hydrogen 3.024 N/A ALA 65.A N THR 62.A O no hydrogen 3.181 N/A ALA 67.A N VAL 63.A O no hydrogen 3.322 N/A VAL 70.A N GLY 39.A O no hydrogen 3.001 N/A ILE 72.A N ILE 37.A O no hydrogen 2.682 N/A GLU 74.A N ILE 35.A O no hydrogen 2.766 N/A GLN 75.A NE2 GLN 32.A O no hydrogen 2.866 N/A ALA 76.A N SER 34.A OG no hydrogen 3.136 N/A ALA 77.A N SER 391.A O no hydrogen 3.032 N/A TYR 78.A OH ASN 352.A OD1 no hydrogen 2.502 N/A LEU 81.A N SER 111.A OG no hydrogen 3.222 N/A ALA 82.A N VAL 363.A O no hydrogen 3.043 N/A TYR 83.A N THR 112.A O no hydrogen 3.166 N/A MET 84.A N VAL 365.A O no hydrogen 2.932 N/A VAL 85.A N GLU 114.A O no hydrogen 2.810 N/A ASP 86.A N GLY 367.A O no hydrogen 3.404 N/A CYS 87.A N TYR 116.A O no hydrogen 2.965 N/A CYS 87.A SG TYR 136.A OH no hydrogen 3.326 N/A SER 88.A N ASP 86.A OD1 no hydrogen 2.992 N/A SER 88.A OG TYR 116.A O no hydrogen 2.634 N/A SER 88.A OG THR 120.A OG1 no hydrogen 3.378 N/A ARG 89.A NH1 ASP 86.A OD2 no hydrogen 2.901 N/A ASN 90.A ND2 GLY 549.A O no hydrogen 3.651 N/A ASN 94.A N GLU 544.A O no hydrogen 2.950 N/A ASN 94.A ND2 LYS 543.A O no hydrogen 2.895 N/A ASN 94.A ND2 ASN 545.A O no hydrogen 3.109 N/A SER 97.A N ASN 94.A OD1 no hydrogen 2.861 N/A SER 97.A OG ASN 94.A OD1 no hydrogen 2.834 N/A SER 97.A OG GLU 544.A O no hydrogen 3.003 N/A ALA 98.A N ASN 94.A O no hydrogen 2.990 N/A ALA 98.A N VAL 95.A O no hydrogen 3.118 N/A LYS 99.A N VAL 95.A O no hydrogen 3.053 N/A GLN 100.A N ALA 96.A O no hydrogen 3.227 N/A GLN 100.A NE2 HIS 17.A NE2 no hydrogen 3.360 N/A MET 101.A N SER 97.A O no hydrogen 2.998 N/A ILE 102.A N ALA 98.A O no hydrogen 2.900 N/A GLU 103.A N LYS 99.A O no hydrogen 3.028 N/A ILE 104.A N GLN 100.A O no hydrogen 3.156 N/A LEU 105.A N MET 101.A O no hydrogen 2.858 N/A ALA 106.A N ILE 102.A O no hydrogen 2.857 N/A LEU 107.A N GLU 103.A O no hydrogen 3.040 N/A MET 108.A N ILE 104.A O no hydrogen 2.807 N/A GLY 109.A N LEU 105.A O no hydrogen 2.964 N/A GLY 109.A N ALA 106.A O no hydrogen 3.188 N/A TYR 110.A N LEU 105.A O no hydrogen 2.760 N/A TYR 110.A OH LEU 384.A O no hydrogen 2.581 N/A SER 111.A N LEU 81.A O no hydrogen 2.931 N/A SER 111.A OG ASP 80.A OD1 no hydrogen 2.680 N/A SER 111.A OG LEU 81.A O no hydrogen 3.118 N/A SER 111.A OG THR 112.A OG1 no hydrogen 2.845 N/A THR 112.A OG1 SER 111.A OG no hydrogen 2.845 N/A PHE 113.A N THR 154.A O no hydrogen 2.910 N/A GLU 114.A N TYR 83.A O no hydrogen 2.691 N/A TYR 116.A N VAL 85.A O no hydrogen 2.779 N/A TYR 116.A OH GLU 118.A OE2 no hydrogen 2.570 N/A MET 117.A N CYS 158.A O no hydrogen 2.569 N/A GLU 118.A N SER 88.A OG no hydrogen 2.561 N/A THR 120.A OG1 CYS 87.A O no hydrogen 2.811 N/A THR 120.A OG1 SER 88.A OG no hydrogen 3.378 N/A GLN 122.A N TYR 136.A O no hydrogen 2.902 N/A GLN 126.A N ILE 123.A O no hydrogen 3.265 N/A PHE 129.A N GLN 126.A O no hydrogen 2.881 N/A TYR 131.A N TYR 128.A O no hydrogen 3.056 N/A ARG 133.A N GLY 130.A O no hydrogen 2.880 N/A ARG 133.A NE ASP 119.A OD2 no hydrogen 3.243 N/A ARG 133.A NH2 SER 88.A O no hydrogen 2.888 N/A ARG 133.A NH2 ASP 119.A OD1 no hydrogen 2.975 N/A TYR 136.A N THR 120.A O no hydrogen 2.832 N/A TYR 136.A OH LEU 93.A O no hydrogen 2.720 N/A SER 137.A N GLU 140.A OE1 no hydrogen 2.791 N/A SER 137.A OG GLU 140.A OE1 no hydrogen 3.415 N/A GLU 140.A N SER 137.A OG no hydrogen 3.128 N/A LEU 141.A N SER 137.A O no hydrogen 3.248 N/A GLN 142.A N ALA 138.A O no hydrogen 3.005 N/A GLU 143.A N GLU 139.A O no hydrogen 2.757 N/A ILE 144.A N GLU 140.A O no hydrogen 2.870 N/A GLU 145.A N LEU 141.A O no hydrogen 2.953 N/A ALA 146.A N GLN 142.A O no hydrogen 2.893 N/A TYR 147.A N GLU 143.A O no hydrogen 3.236 N/A TYR 147.A OH GLU 103.A OE2 no hydrogen 2.282 N/A ALA 148.A N ILE 144.A O no hydrogen 2.993 N/A GLN 149.A N GLU 145.A O no hydrogen 2.748 N/A GLN 150.A N ALA 146.A O no hydrogen 2.839 N/A PHE 151.A N ALA 148.A O no hydrogen 3.232 N/A ASP 152.A N GLN 149.A O no hydrogen 3.208 N/A VAL 153.A N ALA 148.A O no hydrogen 2.798 N/A THR 154.A N SER 111.A O no hydrogen 2.867 N/A VAL 156.A N PHE 113.A O no hydrogen 3.102 N/A CYS 158.A N LEU 115.A O no hydrogen 2.950 N/A CYS 158.A SG GLU 114.A OE1 no hydrogen 2.913 N/A CYS 158.A SG VAL 156.A O no hydrogen 3.707 N/A ILE 159.A N ASN 213.A O no hydrogen 2.879 N/A GLN 160.A NE2 TYR 116.A OH no hydrogen 2.863 N/A GLN 160.A NE2 ASP 217.A OD1 no hydrogen 2.720 N/A THR 161.A N ILE 214.A O no hydrogen 3.174 N/A THR 161.A OG1 ILE 214.A O no hydrogen 3.129 N/A HIS 164.A N ASP 184.A OD2 no hydrogen 2.867 N/A HIS 164.A NE2 GLU 218.A OE1 no hydrogen 2.958 N/A VAL 169.A N LEU 165.A O no hydrogen 2.808 N/A LYS 170.A N SER 166.A O no hydrogen 2.866 N/A TRP 171.A N PHE 168.A O no hydrogen 3.521 N/A VAL 173.A N TRP 171.A O no hydrogen 2.860 N/A VAL 176.A N VAL 173.A O no hydrogen 2.994 N/A GLN 177.A N VAL 173.A O no hydrogen 2.959 N/A GLN 177.A NE2 VAL 169.A O no hydrogen 3.046 N/A GLN 177.A NE2 TRP 171.A O no hydrogen 2.807 N/A GLU 178.A N LYS 174.A O no hydrogen 2.991 N/A LEU 179.A N VAL 176.A O no hydrogen 2.825 N/A ARG 180.A N GLN 177.A O no hydrogen 3.223 N/A ARG 180.A NH1 GLN 177.A OE1 no hydrogen 2.916 N/A ARG 180.A NH2 GLU 183.A O no hydrogen 2.649 N/A ASP 181.A N ILE 185.A O no hydrogen 2.949 N/A ILE 185.A N VAL 182.A O no hydrogen 2.904 N/A LEU 186.A N LEU 162.A O no hydrogen 2.700 N/A LEU 187.A N LEU 179.A O no hydrogen 2.869 N/A GLY 189.A N TYR 194.A OH no hydrogen 2.918 N/A GLU 190.A N LEU 187.A O no hydrogen 3.343 N/A LYS 192.A NZ ASP 195.A OD2 no hydrogen 2.695 N/A TYR 194.A N GLU 190.A O no hydrogen 3.407 N/A TYR 194.A OH HIS 243.A ND1 no hydrogen 2.685 N/A ASP 195.A N GLU 191.A O no hydrogen 2.540 N/A LEU 196.A N LYS 192.A O no hydrogen 3.010 N/A ILE 197.A N VAL 193.A O no hydrogen 2.809 N/A ASP 198.A N TYR 194.A O no hydrogen 2.817 N/A GLY 199.A N ASP 195.A O no hydrogen 3.245 N/A MET 200.A N LEU 196.A O no hydrogen 3.097 N/A ALA 202.A N ASP 198.A O no hydrogen 3.172 N/A THR 203.A N GLY 199.A O no hydrogen 2.858 N/A THR 203.A OG1 GLY 199.A O no hydrogen 2.895 N/A LEU 204.A N MET 200.A O no hydrogen 3.244 N/A SER 205.A N PHE 201.A O no hydrogen 2.627 N/A SER 205.A OG ALA 202.A O no hydrogen 2.231 N/A LEU 207.A N LEU 204.A O no hydrogen 3.120 N/A LYS 208.A N GLU 145.A OE1 no hydrogen 3.086 N/A THR 209.A N GLU 145.A OE2 no hydrogen 3.021 N/A THR 209.A OG1 PHE 155.A O no hydrogen 2.855 N/A ARG 210.A NE TYR 254.A O no hydrogen 2.629 N/A ARG 210.A NH1 SER 205.A O no hydrogen 3.468 N/A ARG 210.A NH1 LEU 207.A O no hydrogen 2.896 N/A ARG 210.A NH1 THR 209.A O no hydrogen 3.017 N/A ARG 210.A NH2 SER 205.A O no hydrogen 2.916 N/A LYS 211.A N THR 209.A OG1 no hydrogen 3.253 N/A LYS 211.A NZ GLU 362.A OE1 no hydrogen 2.906 N/A VAL 212.A N HIS 257.A O no hydrogen 3.162 N/A ASN 213.A N PRO 157.A O no hydrogen 3.109 N/A ILE 214.A N GLN 259.A O no hydrogen 2.814 N/A GLY 215.A N ASN 213.A OD1 no hydrogen 2.879 N/A MET 216.A N GLN 160.A OE1 no hydrogen 3.208 N/A GLU 218.A N ASP 263.A OD2 no hydrogen 2.754 N/A VAL 222.A N ALA 219.A O no hydrogen 3.086 N/A GLY 223.A N ASP 181.A OD2 no hydrogen 2.831 N/A LEU 224.A N LEU 221.A O no hydrogen 2.904 N/A ARG 226.A N ASP 181.A O no hydrogen 2.949 N/A ARG 226.A NH1 ARG 180.A O no hydrogen 3.508 N/A TYR 227.A N ASP 181.A OD1 no hydrogen 3.239 N/A ILE 229.A N GLY 225.A O no hydrogen 3.307 N/A LEU 230.A N ARG 226.A O no hydrogen 3.310 N/A LEU 230.A N TYR 227.A O no hydrogen 3.199 N/A ASN 231.A N TYR 227.A O no hydrogen 2.742 N/A GLY 232.A N LEU 228.A O no hydrogen 2.765 N/A ARG 236.A NE VAL 222.A O no hydrogen 2.850 N/A ARG 236.A NH2 HIS 220.A O no hydrogen 2.413 N/A ARG 236.A NH2 VAL 222.A O no hydrogen 3.164 N/A SER 237.A OG ASP 235.A OD1 no hydrogen 2.925 N/A SER 237.A OG THR 285.A OG1 no hydrogen 2.847 N/A LEU 238.A N ASP 235.A OD1 no hydrogen 3.189 N/A LEU 239.A N ASP 235.A O no hydrogen 3.154 N/A MET 240.A N ARG 236.A O no hydrogen 2.983 N/A CYS 241.A N SER 237.A O no hydrogen 3.286 N/A CYS 241.A SG SER 237.A O no hydrogen 3.291 N/A GLN 242.A N LEU 238.A O no hydrogen 2.879 N/A HIS 243.A N LEU 239.A O no hydrogen 2.946 N/A HIS 243.A ND1 TYR 194.A OH no hydrogen 2.685 N/A HIS 243.A NE2 THR 161.A O no hydrogen 3.032 N/A LEU 244.A N MET 240.A O no hydrogen 2.694 N/A GLU 245.A N CYS 241.A O no hydrogen 2.758 N/A ARG 246.A N GLN 242.A O no hydrogen 3.158 N/A ARG 246.A NH1 GLU 191.A OE2 no hydrogen 2.887 N/A ARG 246.A NH2 GLU 191.A OE1 no hydrogen 2.863 N/A VAL 247.A N HIS 243.A O no hydrogen 2.989 N/A LEU 248.A N LEU 244.A O no hydrogen 2.961 N/A ASP 249.A N GLU 245.A O no hydrogen 3.018 N/A ILE 250.A N ARG 246.A O no hydrogen 3.098 N/A ALA 251.A N VAL 247.A O no hydrogen 2.916 N/A ASP 252.A N LEU 248.A O no hydrogen 2.789 N/A LYS 253.A N ASP 249.A O no hydrogen 3.246 N/A TYR 254.A N ALA 251.A O no hydrogen 3.200 N/A TYR 254.A OH ASP 198.A OD1 no hydrogen 2.863 N/A GLY 255.A N ASP 252.A O no hydrogen 2.859 N/A PHE 256.A N ALA 251.A O no hydrogen 3.015 N/A HIS 257.A N ARG 210.A O no hydrogen 2.768 N/A GLN 259.A N VAL 212.A O no hydrogen 2.616 N/A GLN 259.A NE2 GLU 362.A OE1 no hydrogen 3.287 N/A MET 260.A N THR 297.A O no hydrogen 2.876 N/A TRP 261.A N GLY 215.A O no hydrogen 2.948 N/A SER 262.A N VAL 299.A O no hydrogen 3.303 N/A SER 262.A OG TYR 275.A OH no hydrogen 2.515 N/A SER 262.A OG VAL 299.A O no hydrogen 3.512 N/A SER 262.A OG HIS 318.A NE2 no hydrogen 2.642 N/A LYS 267.A N ASP 263.A O no hydrogen 2.991 N/A LYS 267.A NZ HIS 220.A NE2 no hydrogen 3.120 N/A LYS 267.A NZ ASP 263.A OD2 no hydrogen 2.694 N/A LEU 268.A N MET 264.A O no hydrogen 2.901 N/A MET 269.A N PHE 265.A O no hydrogen 2.894 N/A SER 270.A N PHE 266.A O no hydrogen 2.591 N/A SER 270.A OG PHE 266.A O no hydrogen 2.903 N/A SER 270.A OG LYS 267.A O no hydrogen 3.367 N/A SER 270.A OG GLN 274.A O no hydrogen 2.993 N/A GLN 274.A N SER 270.A OG no hydrogen 2.824 N/A GLN 274.A NE2 ASP 272.A O no hydrogen 3.248 N/A TYR 275.A OH SER 262.A OG no hydrogen 2.515 N/A ARG 277.A N TYR 275.A O no hydrogen 2.912 N/A ARG 277.A NE ASP 272.A OD1 no hydrogen 3.247 N/A ARG 277.A NE ASP 272.A OD2 no hydrogen 3.450 N/A ARG 277.A NH1 ASP 276.A O no hydrogen 2.889 N/A ARG 277.A NH2 ASP 272.A OD2 no hydrogen 2.895 N/A THR 285.A N PRO 282.A O no hydrogen 3.002 N/A THR 285.A OG1 SER 237.A OG no hydrogen 2.847 N/A ARG 286.A N PRO 282.A O no hydrogen 3.037 N/A VAL 287.A N GLU 283.A O no hydrogen 3.322 N/A TYR 288.A N GLU 284.A O no hydrogen 3.366 N/A TYR 288.A OH GLU 245.A OE1 no hydrogen 2.647 N/A LEU 289.A N THR 285.A O no hydrogen 2.631 N/A ASP 290.A N ARG 286.A O no hydrogen 2.773 N/A ARG 291.A NE GLU 245.A OE2 no hydrogen 3.555 N/A LEU 292.A N TYR 288.A O no hydrogen 3.357 N/A LYS 293.A N LEU 289.A O no hydrogen 2.704 N/A ASP 294.A N ARG 291.A O no hydrogen 3.285 N/A ARG 295.A N LEU 292.A O no hydrogen 3.108 N/A THR 297.A N CYS 258.A O no hydrogen 3.128 N/A THR 297.A OG1 ASP 324.A OD1 no hydrogen 3.004 N/A LEU 298.A N ASP 324.A O no hydrogen 2.922 N/A VAL 299.A N MET 260.A O no hydrogen 2.726 N/A TYR 300.A N ALA 326.A O no hydrogen 2.838 N/A TYR 300.A OH ASP 302.A OD2 no hydrogen 3.092 N/A TRP 301.A N TYR 275.A OH no hydrogen 3.043 N/A TRP 301.A NE1 ASP 263.A OD1 no hydrogen 3.026 N/A ASP 302.A N ALA 328.A O no hydrogen 3.275 N/A TYR 303.A OH THR 366.A OG1 no hydrogen 2.922 N/A TYR 304.A N ASP 302.A OD1 no hydrogen 2.771 N/A GLN 305.A N TYR 311.A OH no hydrogen 3.269 N/A GLN 305.A NE2 ASP 302.A OD1 no hydrogen 3.499 N/A GLN 305.A NE2 ASP 302.A OD2 no hydrogen 2.705 N/A GLU 308.A N GLU 350.A OE1 no hydrogen 2.875 N/A LYS 310.A N SER 307.A OG no hydrogen 3.327 N/A TYR 311.A N SER 307.A O no hydrogen 3.498 N/A TYR 311.A OH GLN 305.A O no hydrogen 2.914 N/A ASN 312.A N GLU 308.A O no hydrogen 2.813 N/A ARG 313.A N GLU 309.A O no hydrogen 2.907 N/A ASN 314.A N LYS 310.A O no hydrogen 3.360 N/A ASN 314.A ND2 TYR 300.A OH no hydrogen 2.689 N/A PHE 315.A N TYR 311.A O no hydrogen 3.011 N/A ARG 316.A N ASN 312.A O no hydrogen 3.178 N/A ASN 317.A N ARG 313.A O no hydrogen 3.209 N/A HIS 318.A N ASN 314.A O no hydrogen 3.133 N/A HIS 318.A ND1 ASN 314.A O no hydrogen 2.831 N/A HIS 318.A NE2 SER 262.A OG no hydrogen 2.642 N/A HIS 319.A N PHE 315.A O no hydrogen 3.027 N/A LYS 320.A N ASN 317.A O no hydrogen 3.181 N/A SER 322.A N HIS 318.A O no hydrogen 2.819 N/A ASP 324.A N SER 322.A OG no hydrogen 2.946 N/A ALA 326.A N LEU 298.A O no hydrogen 3.032 N/A PHE 327.A N GLU 362.A O no hydrogen 3.092 N/A ALA 328.A N TYR 300.A O no hydrogen 2.844 N/A GLY 329.A N ILE 364.A O no hydrogen 2.794 N/A ALA 331.A N THR 366.A O no hydrogen 3.138 N/A TRP 332.A N SER 344.A OG no hydrogen 2.936 N/A LYS 333.A NZ LYS 333.A O no hydrogen 3.411 N/A LYS 333.A NZ GLY 367.A O no hydrogen 3.235 N/A LYS 333.A NZ TRP 368.A O no hydrogen 3.016 N/A PHE 337.A N ASN 436.A OD1 no hydrogen 2.636 N/A THR 338.A OG1 GLN 486.A OE1 no hydrogen 2.982 N/A HIS 340.A N TRP 332.A O no hydrogen 2.907 N/A ASN 341.A N ASP 418.A OD1 no hydrogen 2.911 N/A ASN 341.A ND2 SER 379.A O no hydrogen 2.942 N/A ASN 341.A ND2 ASP 418.A OD1 no hydrogen 3.238 N/A HIS 342.A N ASP 418.A OD2 no hydrogen 2.679 N/A HIS 342.A ND1 ASP 418.A OD2 no hydrogen 3.243 N/A PHE 343.A N HIS 340.A ND1 no hydrogen 3.254 N/A SER 344.A N HIS 340.A O no hydrogen 3.101 N/A SER 344.A OG HIS 340.A O no hydrogen 2.737 N/A ARG 345.A N ASN 341.A O no hydrogen 2.966 N/A LEU 346.A N HIS 342.A O no hydrogen 3.012 N/A VAL 347.A N PHE 343.A O no hydrogen 3.031 N/A ALA 348.A N SER 344.A O no hydrogen 3.072 N/A ILE 349.A N ARG 345.A O no hydrogen 3.171 N/A ALA 351.A N VAL 347.A O no hydrogen 2.983 N/A ASN 352.A N ALA 348.A O no hydrogen 2.870 N/A ASN 352.A ND2 LEU 390.A O no hydrogen 3.454 N/A ASN 352.A ND2 ASN 394.A OD1 no hydrogen 2.801 N/A LYS 353.A N ILE 349.A O no hydrogen 3.452 N/A LYS 353.A NZ GLU 308.A OE1 no hydrogen 3.548 N/A LYS 353.A NZ GLU 350.A OE1 no hydrogen 2.628 N/A LYS 353.A NZ GLU 350.A OE2 no hydrogen 3.037 N/A ALA 354.A N GLU 350.A O no hydrogen 3.127 N/A CYS 355.A N ALA 351.A O no hydrogen 2.707 N/A CYS 355.A SG ALA 351.A O no hydrogen 3.153 N/A ARG 356.A N ASN 352.A O no hydrogen 2.990 N/A ARG 356.A NE ASN 352.A OD1 no hydrogen 2.896 N/A ARG 356.A NH2 LEU 390.A O no hydrogen 2.723 N/A ALA 357.A N LYS 353.A O no hydrogen 3.091 N/A ASN 358.A N CYS 355.A O no hydrogen 3.196 N/A ASN 358.A ND2 ALA 354.A O no hydrogen 2.761 N/A GLN 359.A N ARG 356.A O no hydrogen 2.981 N/A ILE 360.A N CYS 355.A O no hydrogen 2.846 N/A VAL 363.A N ASP 80.A O no hydrogen 3.244 N/A ILE 364.A N PHE 327.A O no hydrogen 2.777 N/A VAL 365.A N ALA 82.A O no hydrogen 2.828 N/A THR 366.A N GLY 329.A O no hydrogen 2.836 N/A THR 366.A OG1 TYR 303.A OH no hydrogen 2.922 N/A THR 366.A OG1 GLY 329.A O no hydrogen 2.976 N/A GLY 367.A N MET 84.A O no hydrogen 2.918 N/A TRP 368.A NE1 TYR 303.A OH no hydrogen 2.728 N/A GLY 369.A N ASP 86.A OD2 no hydrogen 2.802 N/A GLY 373.A N GLY 369.A O no hydrogen 2.877 N/A THR 375.A OG1 GLY 336.A O no hydrogen 2.715 N/A GLN 377.A N GLU 544.A OE1 no hydrogen 2.830 N/A GLN 377.A NE2 ALA 91.A O no hydrogen 3.546 N/A GLN 377.A NE2 ASN 545.A OD1 no hydrogen 2.926 N/A PHE 378.A N GLU 544.A OE2 no hydrogen 2.627 N/A SER 379.A N ALA 376.A O no hydrogen 2.824 N/A SER 379.A OG ALA 376.A O no hydrogen 2.593 N/A SER 383.A OG ASN 341.A OD1 no hydrogen 2.461 N/A LEU 384.A N ILE 380.A O no hydrogen 3.155 N/A GLN 385.A N LEU 381.A O no hydrogen 2.624 N/A GLN 385.A NE2 GLU 389.A OE2 no hydrogen 3.001 N/A ILE 386.A N PRO 382.A O no hydrogen 2.619 N/A TRP 387.A N SER 383.A O no hydrogen 3.010 N/A ALA 388.A N LEU 384.A O no hydrogen 2.983 N/A GLU 389.A N GLN 385.A O no hydrogen 2.769 N/A LEU 390.A N ILE 386.A O no hydrogen 2.817 N/A SER 391.A N TRP 387.A O no hydrogen 2.867 N/A TYR 392.A N ALA 388.A O no hydrogen 3.174 N/A TYR 392.A OH GLY 109.A O no hydrogen 2.679 N/A ARG 393.A N GLU 389.A O no hydrogen 2.944 N/A ARG 393.A NH1 GLU 74.A OE2 no hydrogen 2.643 N/A LEU 399.A N LEU 396.A O no hydrogen 3.221 N/A SER 400.A OG GLU 412.A OE1 no hydrogen 2.988 N/A SER 400.A OG GLU 412.A OE2 no hydrogen 3.353 N/A HIS 402.A N GLY 398.A O no hydrogen 2.637 N/A HIS 402.A ND1 GLU 389.A OE2 no hydrogen 2.926 N/A PHE 403.A N LEU 399.A O no hydrogen 3.006 N/A LYS 404.A N SER 400.A O no hydrogen 2.911 N/A THR 405.A N ALA 401.A O no hydrogen 3.044 N/A THR 405.A OG1 THR 62.A OG1 no hydrogen 2.363 N/A THR 405.A OG1 ALA 401.A O no hydrogen 3.163 N/A ASN 406.A N HIS 402.A O no hydrogen 2.985 N/A ASN 406.A ND2 GLN 385.A OE1 no hydrogen 2.854 N/A THR 407.A N PHE 403.A O no hydrogen 2.926 N/A THR 407.A OG1 PHE 403.A O no hydrogen 2.778 N/A GLY 408.A N LYS 404.A O no hydrogen 3.073 N/A LEU 409.A N THR 407.A OG1 no hydrogen 3.173 N/A PHE 414.A N THR 410.A O no hydrogen 2.890 N/A MET 415.A N VAL 411.A O no hydrogen 2.807 N/A GLN 416.A N ASP 413.A O no hydrogen 2.813 N/A ILE 417.A N PHE 414.A O no hydrogen 3.135 N/A ASP 418.A N MET 415.A O no hydrogen 3.459 N/A LEU 419.A N GLN 416.A O no hydrogen 2.583 N/A ASN 421.A N ASP 418.A O no hydrogen 2.905 N/A ASN 421.A ND2 THR 338.A O no hydrogen 3.117 N/A ASN 421.A ND2 PRO 339.A O no hydrogen 2.740 N/A LEU 422.A N LEU 419.A O no hydrogen 3.321 N/A LEU 423.A N ASN 421.A O no hydrogen 2.918 N/A LEU 426.A N LEU 423.A O no hydrogen 3.115 N/A ASN 429.A N ASN 429.A OD1 no hydrogen 2.555 N/A ASN 434.A N THR 603.A O no hydrogen 3.272 N/A ASN 434.A ND2 ILE 335.A O no hydrogen 3.303 N/A ASN 434.A ND2 ALA 605.A O no hydrogen 3.109 N/A ASN 436.A ND2 ILE 335.A O no hydrogen 2.842 N/A ASN 436.A ND2 ASN 421.A OD1 no hydrogen 2.756 N/A ARG 437.A N ASN 434.A O no hydrogen 2.832 N/A ARG 437.A NE GLU 374.A OE1 no hydrogen 3.042 N/A ARG 437.A NH1 ASN 371.A OD1 no hydrogen 2.617 N/A ARG 437.A NH1 ASN 606.A OD1 no hydrogen 3.194 N/A ARG 437.A NH2 ASN 371.A OD1 no hydrogen 2.958 N/A ARG 437.A NH2 GLU 374.A OE1 no hydrogen 2.987 N/A TYR 438.A N ASN 434.A O no hydrogen 3.427 N/A TYR 438.A OH THR 603.A O no hydrogen 3.385 N/A VAL 439.A N PRO 435.A O no hydrogen 2.998 N/A TYR 441.A N ARG 437.A O no hydrogen 3.189 N/A TYR 441.A OH GLU 374.A OE2 no hydrogen 2.614 N/A GLN 442.A N TYR 438.A O no hydrogen 3.146 N/A CYS 446.A N ASP 443.A OD2 no hydrogen 2.794 N/A LEU 449.A N GLN 442.A OE1 no hydrogen 2.800 N/A HIS 452.A N LEU 449.A O no hydrogen 3.095 N/A HIS 452.A ND1 ALA 601.A O no hydrogen 2.836 N/A MET 453.A N ASP 450.A O no hydrogen 3.189 N/A THR 454.A N ASP 458.A OD2 no hydrogen 2.925 N/A GLN 457.A N THR 454.A O no hydrogen 2.805 N/A GLN 457.A NE2 ASP 425.A OD1 no hydrogen 2.976 N/A GLN 457.A NE2 ASP 458.A OD1 no hydrogen 3.533 N/A ASP 458.A N THR 454.A O no hydrogen 2.731 N/A LYS 459.A N PRO 455.A O no hydrogen 3.028 N/A LYS 459.A NZ SER 494.A O no hydrogen 3.179 N/A LYS 459.A NZ ASP 498.A OD1 no hydrogen 3.140 N/A HIS 461.A NE2 LEU 419.A O no hydrogen 2.766 N/A PHE 462.A N ASP 458.A O no hydrogen 3.097 N/A ALA 463.A N LYS 459.A O no hydrogen 2.920 N/A GLN 464.A N PRO 460.A O no hydrogen 2.758 N/A ALA 465.A N HIS 461.A O no hydrogen 3.019 N/A ALA 466.A N PHE 462.A O no hydrogen 2.913 N/A GLU 467.A N ALA 463.A O no hydrogen 3.403 N/A THR 468.A N GLN 464.A O no hydrogen 3.175 N/A THR 468.A OG1 GLN 464.A O no hydrogen 2.672 N/A LEU 469.A N ALA 465.A O no hydrogen 2.842 N/A ALA 470.A N ALA 466.A O no hydrogen 3.038 N/A ASN 471.A N GLU 467.A O no hydrogen 3.049 N/A ILE 472.A N THR 468.A O no hydrogen 2.996 N/A LYS 473.A N LEU 469.A O no hydrogen 2.498 N/A GLU 474.A N ALA 470.A O no hydrogen 3.112 N/A LYS 475.A N ILE 472.A O no hydrogen 2.800 N/A LYS 475.A NZ ASP 413.A OD2 no hydrogen 3.394 N/A LYS 475.A NZ ASN 471.A OD1 no hydrogen 3.512 N/A ALA 476.A N LYS 473.A O no hydrogen 3.043 N/A TYR 479.A N ALA 476.A O no hydrogen 3.247 N/A ALA 480.A N GLY 477.A O no hydrogen 3.341 N/A TYR 481.A OH GLU 544.A OE2 no hydrogen 3.092 N/A LEU 482.A N TYR 479.A O no hydrogen 3.131 N/A PHE 483.A N ALA 480.A O no hydrogen 2.795 N/A GLU 484.A N ALA 480.A O no hydrogen 2.673 N/A THR 485.A N TYR 481.A O no hydrogen 2.987 N/A THR 485.A OG1 TYR 481.A O no hydrogen 2.928 N/A THR 485.A OG1 GLN 540.A OE1 no hydrogen 2.723 N/A GLN 486.A N LEU 482.A O no hydrogen 3.224 N/A GLN 486.A NE2 PHE 337.A O no hydrogen 3.337 N/A ALA 487.A N PHE 483.A O no hydrogen 2.917 N/A GLN 488.A N GLU 484.A O no hydrogen 3.374 N/A GLN 488.A NE2 GLN 488.A O no hydrogen 3.485 N/A LEU 489.A N THR 485.A O no hydrogen 3.122 N/A ASN 490.A N GLN 486.A O no hydrogen 2.951 N/A ASN 490.A ND2 GLN 486.A O no hydrogen 2.561 N/A ALA 491.A N ALA 487.A O no hydrogen 2.814 N/A ILE 492.A N GLN 488.A O no hydrogen 2.930 N/A LEU 493.A N LEU 489.A O no hydrogen 2.888 N/A SER 494.A N ASN 490.A O no hydrogen 2.959 N/A SER 494.A OG ASN 490.A O no hydrogen 3.383 N/A SER 494.A OG ALA 491.A O no hydrogen 2.407 N/A SER 495.A OG ILE 492.A O no hydrogen 3.561 N/A LYS 496.A N ILE 492.A O no hydrogen 3.060 N/A LYS 496.A NZ VAL 439.A O no hydrogen 2.955 N/A LYS 496.A NZ PHE 440.A O no hydrogen 2.699 N/A LYS 496.A NZ GLN 442.A O no hydrogen 2.702 N/A VAL 497.A N LEU 493.A O no hydrogen 3.083 N/A ASP 498.A N SER 495.A O no hydrogen 3.428 N/A ARG 501.A NE ASP 450.A OD2 no hydrogen 3.198 N/A ARG 501.A NH2 ASP 450.A O no hydrogen 3.060 N/A ARG 501.A NH2 ASP 450.A OD2 no hydrogen 3.445 N/A ARG 501.A NH2 MET 453.A O no hydrogen 3.126 N/A ARG 502.A N ASP 498.A O no hydrogen 2.886 N/A ARG 502.A NE ASP 498.A OD1 no hydrogen 3.278 N/A ARG 502.A NE ASP 498.A OD2 no hydrogen 2.986 N/A ARG 502.A NH1 GLU 522.A OE1 no hydrogen 2.748 N/A ARG 502.A NH1 GLU 522.A OE2 no hydrogen 3.458 N/A ARG 502.A NH2 ASP 498.A OD1 no hydrogen 3.145 N/A ARG 502.A NH2 GLU 522.A OE2 no hydrogen 2.977 N/A ILE 503.A N VAL 499.A O no hydrogen 3.080 N/A ARG 504.A N GLY 500.A O no hydrogen 3.272 N/A ARG 504.A NH1 GLU 584.A O no hydrogen 3.187 N/A ARG 504.A NH2 GLU 584.A O no hydrogen 3.226 N/A GLN 505.A N ARG 501.A O no hydrogen 2.749 N/A ALA 506.A N ARG 502.A O no hydrogen 2.911 N/A TYR 507.A N ILE 503.A O no hydrogen 3.027 N/A TYR 507.A OH GLU 586.A OE2 no hydrogen 2.814 N/A GLN 508.A N ARG 504.A O no hydrogen 3.029 N/A ALA 509.A N GLN 505.A O no hydrogen 3.136 N/A ASP 510.A N TYR 507.A O no hydrogen 3.432 N/A ASP 511.A N ALA 506.A O no hydrogen 3.002 N/A SER 514.A N ASP 511.A O no hydrogen 2.995 N/A SER 514.A N ASP 511.A OD1 no hydrogen 2.743 N/A SER 514.A OG ASP 511.A OD1 no hydrogen 3.449 N/A SER 514.A OG ASP 511.A OD2 no hydrogen 3.062 N/A LEU 515.A N ASP 511.A O no hydrogen 3.189 N/A GLN 516.A N LYS 512.A O no hydrogen 3.101 N/A GLN 517.A N GLU 513.A O no hydrogen 3.082 N/A ILE 518.A N SER 514.A O no hydrogen 3.180 N/A ALA 519.A N LEU 515.A O no hydrogen 3.037 N/A ARG 520.A N GLN 516.A O no hydrogen 2.968 N/A GLN 521.A N GLN 517.A O no hydrogen 2.652 N/A GLU 522.A N GLN 517.A O no hydrogen 3.213 N/A LEU 523.A N ILE 518.A O no hydrogen 2.866 N/A LEU 526.A N GLU 522.A O no hydrogen 2.861 N/A ARG 527.A N LEU 523.A O no hydrogen 2.912 N/A ARG 527.A NE GLU 568.A OE2 no hydrogen 2.509 N/A ARG 527.A NH2 GLU 568.A OE1 no hydrogen 3.073 N/A ARG 527.A NH2 GLU 568.A OE2 no hydrogen 3.245 N/A SER 528.A N PRO 524.A O no hydrogen 3.290 N/A GLN 529.A N GLU 525.A O no hydrogen 2.980 N/A ILE 530.A N LEU 526.A O no hydrogen 3.001 N/A GLU 531.A N ARG 527.A O no hydrogen 2.836 N/A ASP 532.A N SER 528.A O no hydrogen 2.973 N/A PHE 533.A N GLN 529.A O no hydrogen 2.846 N/A HIS 534.A N ILE 530.A O no hydrogen 2.963 N/A HIS 534.A NE2 ASP 554.A OD1 no hydrogen 2.734 N/A ALA 535.A N GLU 531.A O no hydrogen 3.141 N/A LEU 536.A N ASP 532.A O no hydrogen 2.794 N/A PHE 537.A N PHE 533.A O no hydrogen 2.583 N/A SER 538.A N HIS 534.A O no hydrogen 2.795 N/A SER 538.A OG HIS 534.A O no hydrogen 2.559 N/A HIS 539.A N ALA 535.A O no hydrogen 2.941 N/A GLN 540.A N LEU 536.A O no hydrogen 3.032 N/A TRP 541.A N PHE 537.A O no hydrogen 2.799 N/A TRP 541.A NE1 LYS 546.A O no hydrogen 2.820 N/A LEU 542.A N SER 538.A O no hydrogen 2.822 N/A LYS 543.A N HIS 539.A O no hydrogen 2.929 N/A LYS 543.A N GLN 540.A O no hydrogen 3.151 N/A GLU 544.A N GLN 540.A O no hydrogen 3.058 N/A ASN 545.A N TRP 541.A O no hydrogen 2.605 N/A LYS 546.A N VAL 92.A O no hydrogen 2.770 N/A LYS 546.A NZ GLY 134.A O no hydrogen 3.396 N/A LYS 546.A NZ GLU 140.A OE1 no hydrogen 2.877 N/A LYS 546.A NZ GLU 140.A OE2 no hydrogen 2.983 N/A LEU 550.A N VAL 547.A O no hydrogen 3.214 N/A THR 552.A N GLY 549.A O no hydrogen 2.830 N/A VAL 553.A N LEU 550.A O no hydrogen 2.969 N/A ASP 554.A N LEU 550.A O no hydrogen 2.923 N/A ILE 555.A N ASP 551.A O no hydrogen 3.102 N/A ARG 556.A N THR 552.A O no hydrogen 3.113 N/A ARG 556.A NH1 ASN 371.A O no hydrogen 2.764 N/A MET 557.A N VAL 553.A O no hydrogen 2.915 N/A GLY 558.A N ASP 554.A O no hydrogen 2.813 N/A GLY 559.A N ILE 555.A O no hydrogen 2.995 N/A LEU 560.A N ARG 556.A O no hydrogen 3.035 N/A LEU 561.A N MET 557.A O no hydrogen 2.804 N/A GLN 562.A N GLY 558.A O no hydrogen 3.088 N/A ARG 563.A N GLY 559.A O no hydrogen 3.082 N/A ARG 563.A NE ASP 443.A OD1 no hydrogen 2.786 N/A ARG 563.A NH2 ASP 443.A OD1 no hydrogen 3.393 N/A ARG 563.A NH2 ASP 443.A OD2 no hydrogen 2.768 N/A ILE 564.A N LEU 560.A O no hydrogen 2.982 N/A ILE 564.A N LEU 561.A O no hydrogen 2.800 N/A LYS 565.A N LEU 561.A O no hydrogen 3.018 N/A ARG 566.A N GLN 562.A O no hydrogen 3.003 N/A ALA 567.A N ARG 563.A O no hydrogen 3.337 N/A GLU 568.A N ILE 564.A O no hydrogen 2.925 N/A SER 569.A N LYS 565.A O no hydrogen 2.769 N/A SER 569.A OG LYS 565.A O no hydrogen 3.359 N/A SER 569.A OG ARG 566.A O no hydrogen 2.959 N/A ARG 570.A N ARG 566.A O no hydrogen 2.676 N/A ARG 570.A NH2 ASP 583.A OD1 no hydrogen 3.487 N/A ILE 571.A N ALA 567.A O no hydrogen 3.300 N/A GLU 572.A N GLU 568.A O no hydrogen 2.906 N/A VAL 573.A N SER 569.A O no hydrogen 2.852 N/A TYR 574.A N ARG 570.A O no hydrogen 3.045 N/A LEU 575.A N ILE 571.A O no hydrogen 2.919 N/A ALA 576.A N GLU 572.A O no hydrogen 3.110 N/A GLY 577.A N TYR 574.A O no hydrogen 2.837 N/A GLN 578.A N VAL 573.A O no hydrogen 3.043 N/A LEU 579.A N VAL 573.A O no hydrogen 3.314 N/A GLU 584.A N GLU 584.A OE1 no hydrogen 2.547 N/A LEU 585.A N ILE 582.A O no hydrogen 3.097 N/A GLU 586.A N ASP 583.A O no hydrogen 2.944 N/A VAL 587.A N GLU 584.A O no hydrogen 3.364 N/A PHE 592.A N HIS 452.A NE2 no hydrogen 3.240 N/A PHE 595.A N THR 593.A OG1 no hydrogen 3.412 N/A TYR 596.A OH SER 431.A O no hydrogen 2.798 N/A ALA 597.A N ASP 594.A O no hydrogen 3.373 N/A THR 603.A N TYR 438.A OH no hydrogen 3.094 N/A THR 603.A OG1 THR 604.A O no hydrogen 3.399 N/A THR 604.A N THR 603.A OG1 no hydrogen 2.556 N/A THR 604.A OG1 GLY 432.A O no hydrogen 2.439 N/A ALA 605.A N ASN 434.A OD1 no hydrogen 2.917 N/A ASN 606.A ND2 TRP 334.A O no hydrogen 2.651 N/A TRP 608.A N ASN 371.A OD1 no hydrogen 2.782 N/A THR 610.A N GLN 607.A O no hydrogen 3.279 N/A THR 610.A OG1 GLN 607.A O no hydrogen 3.451 N/A ILE 611.A N GLN 607.A O no hydrogen 3.056 N/A ALA 612.A N TRP 608.A O no hydrogen 3.073 N/A SER 615.A N THR 613.A OG1 no hydrogen 2.977 N/A THR 619.A OG1 THR 620.A O no hydrogen 3.075 N/A