Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3mdl_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): HIS 1.A ND1 HIS 2.A O no hydrogen 2.919 N/A HIS 2.A N ASP 127.A OD1 no hydrogen 2.972 N/A CYS 4.A N HIS 2.A ND1 no hydrogen 3.125 N/A CYS 5.A N HIS 2.A O no hydrogen 3.077 N/A CYS 5.A SG HIS 1.A ND1 no hydrogen 3.570 N/A CYS 5.A SG HIS 2.A O no hydrogen 3.106 N/A ASN 7.A N CYS 4.A O no hydrogen 3.004 N/A GLN 10.A N ASN 36.A O no hydrogen 2.861 N/A GLN 10.A NE2 ASN 7.A O no hydrogen 3.228 N/A GLN 10.A NE2 PRO 8.A O no hydrogen 3.011 N/A ASN 11.A ND2 CYS 37.A O no hydrogen 2.816 N/A ARG 12.A NH2 ASP 94.A OD1 no hydrogen 3.030 N/A ARG 12.A NH2 ASP 94.A OD2 no hydrogen 3.553 N/A GLY 13.A N GLN 10.A O no hydrogen 3.115 N/A GLU 14.A N ASP 26.A O no hydrogen 3.070 N/A MET 16.A N LYS 24.A O no hydrogen 3.004 N/A THR 18.A N GLN 22.A O no hydrogen 2.835 N/A TYR 23.A OH ASN 36.A OD1 no hydrogen 2.632 N/A LYS 24.A N MET 16.A O no hydrogen 2.774 N/A CYS 25.A SG GLU 35.A O no hydrogen 3.194 N/A ASP 26.A N GLU 14.A O no hydrogen 2.790 N/A CYS 27.A SG CYS 25.A O no hydrogen 3.958 N/A CYS 27.A SG GLY 34.A O no hydrogen 3.583 N/A THR 28.A N ASP 26.A OD1 no hydrogen 3.172 N/A THR 28.A OG1 ASP 26.A OD1 no hydrogen 2.527 N/A THR 30.A N CYS 27.A O no hydrogen 3.057 N/A THR 30.A OG1 CYS 27.A O no hydrogen 2.717 N/A PHE 32.A N THR 30.A OG1 no hydrogen 3.077 N/A TYR 33.A N THR 39.A O no hydrogen 2.736 N/A CYS 37.A N GLY 34.A O no hydrogen 3.155 N/A THR 39.A N TYR 33.A O no hydrogen 2.951 N/A THR 39.A OG1 TYR 33.A O no hydrogen 3.524 N/A GLU 41.A N GLY 31.A O no hydrogen 2.962 N/A THR 44.A OG1 GLY 31.A O no hydrogen 2.754 N/A ARG 45.A N GLU 41.A O no hydrogen 2.990 N/A ILE 46.A N PHE 42.A O no hydrogen 3.321 N/A LYS 47.A N LEU 43.A O no hydrogen 3.316 N/A LEU 48.A N THR 44.A O no hydrogen 3.006 N/A LEU 49.A N ARG 45.A O no hydrogen 3.349 N/A LEU 50.A N ILE 46.A O no hydrogen 3.055 N/A LYS 51.A N LYS 47.A O no hydrogen 2.914 N/A THR 53.A OG1 THR 56.A OG1 no hydrogen 2.958 N/A THR 56.A N THR 53.A O no hydrogen 3.216 N/A THR 56.A N THR 53.A OG1 no hydrogen 3.187 N/A THR 56.A OG1 THR 53.A OG1 no hydrogen 2.958 N/A VAL 57.A N THR 53.A O no hydrogen 3.174 N/A HIS 58.A N PRO 54.A O no hydrogen 2.899 N/A TYR 59.A N ASN 55.A O no hydrogen 3.168 N/A ILE 60.A N THR 56.A O no hydrogen 3.084 N/A LEU 61.A N VAL 57.A O no hydrogen 2.945 N/A THR 62.A N HIS 58.A O no hydrogen 3.017 N/A THR 62.A N TYR 59.A O no hydrogen 3.266 N/A THR 62.A OG1 HIS 58.A O no hydrogen 2.788 N/A THR 62.A OG1 TYR 59.A O no hydrogen 3.443 N/A HIS 63.A N ILE 60.A O no hydrogen 3.451 N/A HIS 63.A ND1 TYR 59.A O no hydrogen 2.737 N/A VAL 67.A N PHE 64.A O no hydrogen 2.981 N/A TRP 68.A N PHE 64.A O no hydrogen 3.102 N/A TRP 68.A NE1 ILE 60.A O no hydrogen 2.844 N/A ASN 69.A N LYS 65.A O no hydrogen 2.724 N/A ILE 70.A N GLY 66.A O no hydrogen 3.412 N/A VAL 71.A N VAL 67.A O no hydrogen 2.953 N/A ASN 72.A N TRP 68.A O no hydrogen 2.711 N/A ASN 72.A ND2 HIS 325.A O no hydrogen 2.821 N/A ASN 73.A N ILE 70.A O no hydrogen 3.154 N/A ASN 73.A ND2 ASN 69.A O no hydrogen 2.608 N/A LEU 77.A N ILE 74A.A O no hydrogen 2.906 N/A ARG 78.A N ILE 74A.A O no hydrogen 2.999 N/A ARG 78.A NE LYS 327.A O no hydrogen 2.992 N/A ARG 78.A NH2 LEU 328.A O no hydrogen 3.026 N/A SER 79.A N PRO 75.A O no hydrogen 3.086 N/A SER 79.A OG PRO 75.A O no hydrogen 2.849 N/A LEU 80.A N PHE 76.A O no hydrogen 3.195 N/A ILE 81.A N LEU 77.A O no hydrogen 2.951 N/A MET 82.A N ARG 78.A O no hydrogen 2.959 N/A LYS 83.A N SER 79.A O no hydrogen 2.812 N/A TYR 84.A N LEU 80.A O no hydrogen 3.000 N/A VAL 85.A N ILE 81.A O no hydrogen 2.819 N/A LEU 86.A N MET 82.A O no hydrogen 2.894 N/A THR 87.A N LYS 83.A O no hydrogen 3.030 N/A THR 87.A OG1 LYS 83.A O no hydrogen 2.929 N/A THR 87.A OG1 TYR 84.A O no hydrogen 3.280 N/A SER 88.A N TYR 84.A O no hydrogen 2.814 N/A SER 88.A OG TYR 84.A O no hydrogen 2.917 N/A SER 88.A OG VAL 85.A O no hydrogen 3.028 N/A ARG 89.A NH1 GLU 493.A OE1 no hydrogen 3.003 N/A ARG 89.A NH1 GLU 493.A OE2 no hydrogen 3.312 N/A ARG 89.A NH2 GLU 493.A OE2 no hydrogen 2.789 N/A SER 90.A N THR 87.A O no hydrogen 3.402 N/A ILE 93.A N SER 90.A O no hydrogen 3.390 N/A THR 98.A OG1 ASP 94.A OD2 no hydrogen 2.834 N/A ASN 100.A N TYR 103.A O no hydrogen 3.270 N/A HIS 102.A N ASN 100.A OD1 no hydrogen 2.813 N/A HIS 102.A ND1 TYR 116.A OH no hydrogen 2.609 N/A TYR 103.A N ASN 100.A O no hydrogen 3.089 N/A LYS 106.A NZ GLU 14.A OE1 no hydrogen 2.512 N/A LYS 106.A NZ GLU 14.A OE2 no hydrogen 3.025 N/A ALA 110.A N SER 107.A OG no hydrogen 2.956 N/A PHE 111.A N SER 107.A O no hydrogen 2.886 N/A SER 112.A N TRP 108.A O no hydrogen 2.841 N/A SER 112.A OG TRP 108.A O no hydrogen 2.733 N/A ASN 113.A N GLU 109.A O no hydrogen 3.048 N/A ASN 113.A ND2 GLU 109.A OE2 no hydrogen 2.783 N/A SER 115.A N ASN 113.A OD1 no hydrogen 3.026 N/A TYR 116.A N ASN 113.A O no hydrogen 3.486 N/A TYR 116.A OH HIS 102.A ND1 no hydrogen 2.609 N/A TYR 117.A N GLY 188.A O no hydrogen 2.995 N/A TYR 117.A OH THR 181.A OG1 no hydrogen 3.020 N/A THR 118.A N ILE 346.A O no hydrogen 2.842 N/A THR 118.A OG1 TYR 99.A O no hydrogen 2.949 N/A ARG 119.A N TYR 99.A O no hydrogen 2.826 N/A ARG 119.A NE LEU 121.A O no hydrogen 3.089 N/A ARG 119.A NH1 MET 427.A O no hydrogen 2.782 N/A ARG 119.A NH2 MET 427.A O no hydrogen 3.074 N/A ARG 119.A NH2 LYS 428.A O no hydrogen 3.246 N/A ALA 120.A N GLU 349.A OE1 no hydrogen 2.981 N/A LEU 121.A N GLU 349.A OE2 no hydrogen 3.170 N/A VAL 124.A N LYS 428.A O no hydrogen 2.949 N/A CYS 128.A N ALA 125.A O no hydrogen 3.387 N/A CYS 128.A SG ALA 125.A O no hydrogen 3.458 N/A THR 130.A N GLY 133.A O no hydrogen 2.886 N/A THR 130.A OG1 LYS 135.A O no hydrogen 2.849 N/A GLY 133.A N THR 130.A O no hydrogen 3.078 N/A LYS 135.A NZ ASP 468.A OD2 no hydrogen 3.271 N/A SER 143.A OG ASP 422.A OD1 no hydrogen 2.808 N/A LYS 144.A N ASP 142.A OD2 no hydrogen 3.014 N/A LYS 144.A NZ GLU 148.A OE1 no hydrogen 3.091 N/A LYS 144.A NZ GLU 148.A OE2 no hydrogen 3.224 N/A VAL 146.A N ASP 142.A O no hydrogen 3.181 N/A LEU 147.A N SER 143.A O no hydrogen 2.914 N/A GLU 148.A N LYS 144.A O no hydrogen 2.889 N/A LYS 149.A N GLU 145.A O no hydrogen 2.924 N/A LYS 149.A NZ GLU 145.A OE2 no hydrogen 2.827 N/A VAL 150.A N VAL 146.A O no hydrogen 2.980 N/A LEU 151.A N LEU 147.A O no hydrogen 2.820 N/A LEU 152.A N LEU 147.A O no hydrogen 2.954 N/A ARG 153.A N VAL 409.A O no hydrogen 2.731 N/A ARG 153.A NE ASN 408.A OD1 no hydrogen 2.871 N/A ARG 153.A NH1 LEU 360.A O no hydrogen 2.805 N/A ARG 153.A NH1 ASP 362.A OD1 no hydrogen 3.051 N/A ARG 153.A NH2 LEU 360.A O no hydrogen 2.824 N/A ARG 153.A NH2 ASN 408.A O no hydrogen 2.925 N/A ARG 153.A NH2 ASN 408.A OD1 no hydrogen 3.452 N/A ARG 154.A NH1 GLU 148.A O no hydrogen 2.829 N/A ARG 154.A NH1 LEU 152.A O no hydrogen 2.934 N/A ARG 154.A NH2 GLU 148.A O no hydrogen 2.886 N/A ILE 157.A N ASN 408.A OD1 no hydrogen 3.027 N/A ASP 159.A N ALA 400.A O no hydrogen 2.807 N/A GLN 161.A N ASP 159.A OD1 no hydrogen 2.994 N/A GLN 161.A NE2 LEU 321.A O no hydrogen 2.915 N/A GLY 162.A N ASP 159.A O no hydrogen 2.989 N/A SER 163.A N ASP 159.A OD2 no hydrogen 2.927 N/A SER 163.A OG ASP 159.A OD2 no hydrogen 2.678 N/A SER 163.A OG HIS 320.A NE2 no hydrogen 2.663 N/A ASN 164.A N PHE 549.A O no hydrogen 3.087 N/A ASN 164.A ND2 THR 396.A O no hydrogen 2.997 N/A ASN 164.A ND2 SER 548.A O no hydrogen 2.834 N/A MET 165.A N PHE 395.A O no hydrogen 3.105 N/A MET 165.A N GLN 398.A O no hydrogen 3.043 N/A MET 166.A N PHE 395.A O no hydrogen 3.387 N/A PHE 167.A N ASN 164.A OD1 no hydrogen 2.847 N/A ALA 168.A N ASN 164.A O no hydrogen 2.975 N/A PHE 169.A N MET 165.A O no hydrogen 2.944 N/A PHE 170.A N MET 166.A O no hydrogen 3.007 N/A ALA 171.A N PHE 167.A O no hydrogen 2.805 N/A GLN 172.A N ALA 168.A O no hydrogen 3.177 N/A HIS 173.A N PHE 169.A O no hydrogen 2.917 N/A PHE 174.A N PHE 170.A O no hydrogen 2.874 N/A THR 175.A N ALA 171.A O no hydrogen 3.177 N/A THR 175.A OG1 ALA 171.A O no hydrogen 2.784 N/A THR 175.A OG1 GLN 172.A O no hydrogen 3.457 N/A HIS 176.A N GLN 172.A O no hydrogen 3.217 N/A GLN 177.A N PHE 174.A O no hydrogen 3.477 N/A GLN 177.A NE2 PHE 174.A O no hydrogen 2.826 N/A PHE 178.A N THR 175.A O no hydrogen 3.067 N/A PHE 179.A N THR 175.A O no hydrogen 2.810 N/A LYS 180.A NZ ASN 200.A OD1 no hydrogen 2.805 N/A LYS 180.A NZ GLU 205.A OE1 no hydrogen 2.774 N/A THR 181.A OG1 TYR 117.A OH no hydrogen 3.020 N/A ASP 182.A N PHE 189.A O no hydrogen 2.927 N/A ARG 185.A N ASP 182.A O no hydrogen 2.944 N/A GLY 186.A N ASP 182.A O no hydrogen 2.939 N/A PHE 189.A N GLY 186.A O no hydrogen 3.095 N/A THR 190.A N SER 115.A O no hydrogen 2.701 N/A THR 190.A OG1 LYS 180.A O no hydrogen 3.454 N/A ARG 191.A N LYS 180.A O no hydrogen 2.657 N/A ARG 191.A NE THR 181.A O no hydrogen 3.483 N/A ARG 191.A NH2 THR 181.A O no hydrogen 3.272 N/A GLY 192.A N THR 190.A OG1 no hydrogen 3.077 N/A LEU 193.A N GLU 205.A OE2 no hydrogen 3.021 N/A HIS 195.A N GLY 192.A O no hydrogen 3.119 N/A HIS 195.A NE2 LEU 114.A O no hydrogen 2.605 N/A ASP 198.A N GLY 196.A O no hydrogen 2.998 N/A LEU 199.A N GLN 177.A OE1 no hydrogen 2.796 N/A ASN 200.A N ASP 198.A OD1 no hydrogen 2.920 N/A ASN 200.A ND2 GLN 177.A O no hydrogen 2.647 N/A ASN 200.A ND2 ASP 198.A OD1 no hydrogen 2.722 N/A ILE 202.A N LEU 199.A O no hydrogen 3.034 N/A TYR 203.A N LEU 199.A O no hydrogen 2.942 N/A TYR 203.A OH HIS 278.A ND1 no hydrogen 2.647 N/A GLY 204.A N ASN 200.A O no hydrogen 2.755 N/A ARG 209.A N THR 206.A OG1 no hydrogen 3.314 N/A ARG 209.A NE GLY 257.A O no hydrogen 2.750 N/A ARG 209.A NH1 GLU 241.A O no hydrogen 2.786 N/A ARG 209.A NH2 GLU 241.A O no hydrogen 2.917 N/A ARG 209.A NH2 VAL 256.A O no hydrogen 3.009 N/A ARG 209.A NH2 GLY 257.A O no hydrogen 3.452 N/A GLN 210.A N THR 206.A O no hydrogen 2.965 N/A HIS 211.A N LEU 207.A O no hydrogen 2.937 N/A LYS 212.A N ASP 208.A O no hydrogen 3.207 N/A LYS 212.A NZ GLN 239.A O no hydrogen 2.893 N/A LEU 213.A N ARG 209.A O no hydrogen 3.104 N/A LEU 213.A N GLN 210.A O no hydrogen 2.978 N/A ARG 214.A NH1 GLN 210.A OE1 no hydrogen 3.046 N/A ARG 214.A NH1 GLU 295.A OE1 no hydrogen 3.080 N/A ARG 214.A NH2 ASP 294.A OD2 no hydrogen 2.842 N/A ARG 214.A NH2 GLU 295.A OE1 no hydrogen 2.804 N/A LEU 215.A N LYS 220.A O no hydrogen 2.939 N/A GLY 219.A N ASP 294.A OD1 no hydrogen 2.768 N/A LYS 220.A N LYS 217.A O no hydrogen 3.028 N/A LYS 220.A NZ ASP 283.A OD1 no hydrogen 2.733 N/A LEU 221.A N ASN 279.A OD1 no hydrogen 2.875 N/A LYS 222.A N LEU 213.A O no hydrogen 2.908 N/A GLN 224.A N TYR 231.A O no hydrogen 2.993 N/A GLN 224.A NE2 PRO 232.A O no hydrogen 2.962 N/A GLN 224.A NE2 ASN 251.A O no hydrogen 3.595 N/A ILE 226.A N GLU 229.A O no hydrogen 2.827 N/A GLU 229.A N ILE 226.A O no hydrogen 2.911 N/A TYR 231.A N GLN 224.A O no hydrogen 2.812 N/A VAL 235.A N GLN 253.A O no hydrogen 2.860 N/A ASP 237.A N THR 234.A OG1 no hydrogen 2.902 N/A THR 238.A N THR 234.A O no hydrogen 3.112 N/A THR 238.A OG1 THR 234.A O no hydrogen 2.734 N/A GLN 239.A N VAL 235.A O no hydrogen 2.770 N/A VAL 240.A N THR 238.A OG1 no hydrogen 3.191 N/A ILE 243.A N GLU 259.A O no hydrogen 2.886 N/A TYR 244.A OH PHE 254.A O no hydrogen 2.759 N/A ILE 248.A N PRO 245.A O no hydrogen 3.310 N/A LEU 252.A N PRO 249.A O no hydrogen 2.951 N/A GLN 253.A N GLU 250.A O no hydrogen 3.121 N/A GLN 253.A NE2 ILE 248.A O no hydrogen 2.674 N/A ALA 255.A N PRO 233.A O no hydrogen 2.695 N/A GLN 258.A NE2 HIS 176.A O no hydrogen 2.873 N/A VAL 260.A N GLN 258.A OE1 no hydrogen 3.066 N/A PHE 261.A N GLN 258.A O no hydrogen 3.308 N/A LEU 263.A N VAL 260.A O no hydrogen 2.961 N/A LEU 267.A N VAL 264.A O no hydrogen 2.893 N/A MET 268.A N VAL 264.A O no hydrogen 3.138 N/A MET 269.A N PRO 265.A O no hydrogen 2.843 N/A TYR 270.A OH MET 166.A O no hydrogen 2.740 N/A ALA 271.A N LEU 267.A O no hydrogen 2.847 N/A THR 272.A N MET 268.A O no hydrogen 2.888 N/A THR 272.A OG1 MET 268.A O no hydrogen 2.764 N/A ILE 273.A N MET 269.A O no hydrogen 2.971 N/A TRP 274.A N TYR 270.A O no hydrogen 2.817 N/A LEU 275.A N ALA 271.A O no hydrogen 2.971 N/A ARG 276.A N THR 272.A O no hydrogen 3.013 N/A ARG 276.A NE VAL 230.A O no hydrogen 3.011 N/A ARG 276.A NH1 ASN 540.A O no hydrogen 2.830 N/A ARG 276.A NH2 GLU 229.A OE1 no hydrogen 3.075 N/A ARG 276.A NH2 VAL 230.A O no hydrogen 2.805 N/A GLU 277.A N ILE 273.A O no hydrogen 2.927 N/A HIS 278.A N TRP 274.A O no hydrogen 2.942 N/A HIS 278.A ND1 TYR 203.A OH no hydrogen 2.647 N/A HIS 278.A NE2 GLY 219.A O no hydrogen 2.799 N/A ASN 279.A N LEU 275.A O no hydrogen 3.132 N/A ASN 279.A ND2 LEU 221.A O no hydrogen 3.147 N/A ARG 280.A N ARG 276.A O no hydrogen 2.831 N/A ARG 280.A NE GLU 277.A OE1 no hydrogen 2.774 N/A ARG 280.A NH2 GLU 277.A OE1 no hydrogen 3.431 N/A ARG 280.A NH2 GLU 277.A OE2 no hydrogen 2.826 N/A VAL 281.A N GLU 277.A O no hydrogen 3.009 N/A CYS 282.A N HIS 278.A O no hydrogen 2.989 N/A CYS 282.A SG HIS 278.A NE2 no hydrogen 3.372 N/A CYS 282.A SG HIS 278.A O no hydrogen 3.398 N/A CYS 282.A SG SER 301.A OG no hydrogen 3.469 N/A ASP 283.A N ASN 279.A O no hydrogen 3.081 N/A ILE 284.A N ARG 280.A O no hydrogen 3.103 N/A LEU 285.A N VAL 281.A O no hydrogen 2.895 N/A LYS 286.A N CYS 282.A O no hydrogen 2.804 N/A LYS 286.A NZ ASP 218.A OD1 no hydrogen 2.897 N/A GLN 287.A N ASP 283.A O no hydrogen 3.050 N/A GLU 288.A N ILE 284.A O no hydrogen 3.010 N/A HIS 289.A N LEU 285.A O no hydrogen 2.651 N/A HIS 289.A ND1 GLU 291.A OE2 no hydrogen 2.971 N/A HIS 289.A NE2 GLY 520.A O no hydrogen 2.707 N/A GLU 291.A N GLU 291.A OE1 no hydrogen 2.713 N/A TRP 292.A N HIS 289.A O no hydrogen 3.130 N/A LEU 297.A N GLY 293.A O no hydrogen 3.144 N/A PHE 298.A N ASP 294.A O no hydrogen 2.886 N/A GLN 299.A N GLU 295.A O no hydrogen 3.000 N/A GLN 299.A NE2 GLU 295.A OE2 no hydrogen 2.837 N/A THR 300.A N GLN 296.A O no hydrogen 2.979 N/A THR 300.A OG1 GLN 296.A O no hydrogen 2.535 N/A SER 301.A N LEU 297.A O no hydrogen 3.116 N/A SER 301.A OG LEU 297.A O no hydrogen 2.900 N/A ARG 302.A N PHE 298.A O no hydrogen 3.021 N/A ARG 302.A NE ASP 198.A O no hydrogen 3.215 N/A ARG 302.A NH2 ASP 198.A O no hydrogen 2.794 N/A LEU 303.A N GLN 299.A O no hydrogen 3.084 N/A ILE 304.A N THR 300.A O no hydrogen 3.016 N/A LEU 305.A N SER 301.A O no hydrogen 2.882 N/A ILE 306.A N ARG 302.A O no hydrogen 2.973 N/A GLY 307.A N LEU 303.A O no hydrogen 3.064 N/A GLU 308.A N ILE 304.A O no hydrogen 2.770 N/A THR 309.A N LEU 305.A O no hydrogen 2.837 N/A THR 309.A OG1 LEU 305.A O no hydrogen 2.648 N/A ILE 310.A N ILE 306.A O no hydrogen 3.033 N/A LYS 311.A N GLY 307.A O no hydrogen 2.951 N/A LYS 311.A NZ GLU 315.A OE1 no hydrogen 3.154 N/A LYS 311.A NZ GLU 315.A OE2 no hydrogen 2.951 N/A LYS 311.A NZ ASN 529.A O no hydrogen 3.007 N/A ILE 312.A N GLU 308.A O no hydrogen 2.958 N/A VAL 313.A N THR 309.A O no hydrogen 2.873 N/A ILE 314.A N ILE 310.A O no hydrogen 3.035 N/A GLU 315.A N LYS 311.A O no hydrogen 2.958 N/A ASP 316.A N ILE 312.A O no hydrogen 2.988 N/A TYR 317.A N ILE 312.A O no hydrogen 3.038 N/A TYR 317.A OH TYR 354.A OH no hydrogen 2.645 N/A VAL 318.A N VAL 313.A O no hydrogen 2.683 N/A GLN 319.A N ILE 314.A O no hydrogen 3.217 N/A GLN 319.A NE2 PHE 326.A O no hydrogen 2.897 N/A HIS 320.A N ASP 316.A O no hydrogen 2.933 N/A HIS 320.A NE2 SER 163.A OG no hydrogen 2.663 N/A LEU 321.A N TYR 317.A O no hydrogen 3.063 N/A SER 322.A N VAL 318.A O no hydrogen 2.890 N/A SER 322.A OG VAL 318.A O no hydrogen 3.486 N/A SER 322.A OG GLN 319.A O no hydrogen 2.785 N/A GLY 323.A N HIS 320.A O no hydrogen 3.300 N/A TYR 324.A N SER 322.A OG no hydrogen 3.000 N/A HIS 325.A N LEU 61.A O no hydrogen 2.966 N/A LYS 327.A N ASN 72.A OD1 no hydrogen 2.902 N/A LEU 328.A N GLN 319.A OE1 no hydrogen 2.603 N/A LYS 329.A NZ ASP 331.A OD2 no hydrogen 3.098 N/A PHE 330.A N GLU 315.A OE2 no hydrogen 2.803 N/A GLU 333.A N ASP 331.A OD1 no hydrogen 3.121 N/A LEU 334.A N ASP 331.A O no hydrogen 2.963 N/A LEU 335.A N PRO 332.A O no hydrogen 3.015 N/A PHE 336.A N GLU 333.A O no hydrogen 3.152 N/A GLN 338.A N LEU 335.A O no hydrogen 2.877 N/A GLN 338.A NE2 ASN 337.A OD1 no hydrogen 3.119 N/A GLN 343.A N GLN 341.A O no hydrogen 2.948 N/A ASN 344.A ND2 HIS 195.A O no hydrogen 3.072 N/A ARG 345.A NH1 PHE 111.A O no hydrogen 2.853 N/A ARG 345.A NH2 PHE 111.A O no hydrogen 2.725 N/A ILE 346.A N HIS 195.A ND1 no hydrogen 2.913 N/A SER 348.A N THR 118.A O no hydrogen 2.776 N/A SER 348.A OG TYR 429.A OH no hydrogen 2.620 N/A GLU 349.A N GLU 349.A OE1 no hydrogen 2.849 N/A ASN 351.A N ALA 347.A O no hydrogen 3.127 N/A ASN 351.A ND2 THR 181.A OG1 no hydrogen 3.326 N/A THR 352.A N SER 348.A O no hydrogen 2.932 N/A THR 352.A OG1 SER 348.A O no hydrogen 3.279 N/A THR 352.A OG1 TYR 429.A OH no hydrogen 2.716 N/A LEU 353.A N GLU 349.A O no hydrogen 2.906 N/A TYR 354.A N PHE 350.A O no hydrogen 3.248 N/A TYR 354.A N ASN 351.A O no hydrogen 3.113 N/A TYR 354.A OH TYR 317.A OH no hydrogen 2.645 N/A HIS 355.A N THR 352.A O no hydrogen 3.252 N/A HIS 355.A NE2 ASN 351.A OD1 no hydrogen 2.959 N/A TRP 356.A N TYR 354.A O no hydrogen 2.818 N/A LEU 359.A N TRP 356.A O no hydrogen 3.098 N/A LEU 360.A N HIS 357.A O no hydrogen 3.015 N/A THR 363.A OG1 ASN 365.A OD1 no hydrogen 2.716 N/A PHE 364.A N TYR 371.A O no hydrogen 2.727 N/A ASN 365.A N GLN 398.A OE1 no hydrogen 2.973 N/A ILE 366.A N GLN 369.A O no hydrogen 3.081 N/A GLU 367.A N SER 394.A OG no hydrogen 2.859 N/A ASP 368.A N ASP 368.A OD1 no hydrogen 2.564 N/A GLN 369.A N ILE 366.A O no hydrogen 2.891 N/A TYR 371.A N PHE 364.A O no hydrogen 2.961 N/A TYR 371.A OH HIS 386.A NE2 no hydrogen 2.622 N/A SER 372.A N GLN 375.A OE1 no hydrogen 3.025 N/A GLN 375.A N SER 372.A OG no hydrogen 3.317 N/A PHE 376.A N SER 372.A O no hydrogen 2.927 N/A PHE 376.A N PHE 373.A O no hydrogen 3.190 N/A LEU 377.A N PHE 373.A O no hydrogen 2.886 N/A TYR 378.A N LEU 263.A O no hydrogen 2.750 N/A ASN 379.A N PHE 376.A O no hydrogen 3.246 N/A ASN 379.A ND2 GLN 375.A O no hydrogen 2.922 N/A ASN 380.A ND2 LEU 252.A O no hydrogen 3.002 N/A SER 381.A OG ASN 379.A OD1 no hydrogen 2.638 N/A LEU 384.A N ASN 380.A O no hydrogen 3.151 N/A GLU 385.A N SER 381.A O no hydrogen 2.715 N/A HIS 386.A N ILE 382.A O no hydrogen 3.085 N/A HIS 386.A ND1 GLU 367.A OE1 no hydrogen 3.092 N/A HIS 386.A NE2 TYR 371.A OH no hydrogen 2.622 N/A GLY 387.A N LEU 383.A O no hydrogen 2.728 N/A THR 389.A OG1 LYS 542.A O no hydrogen 2.675 N/A PHE 391.A N GLY 387.A O no hydrogen 3.112 N/A VAL 392.A N LEU 388.A O no hydrogen 2.943 N/A GLU 393.A N THR 389.A O no hydrogen 2.963 N/A SER 394.A N GLN 390.A O no hydrogen 2.867 N/A SER 394.A OG GLN 390.A O no hydrogen 3.073 N/A SER 394.A OG GLN 390.A OE1 no hydrogen 3.570 N/A PHE 395.A N PHE 391.A O no hydrogen 2.899 N/A THR 396.A N VAL 392.A O no hydrogen 2.925 N/A THR 396.A OG1 VAL 392.A O no hydrogen 2.580 N/A THR 396.A OG1 THR 547.A OG1 no hydrogen 2.837 N/A ARG 397.A N SER 394.A O no hydrogen 3.157 N/A GLN 398.A N SER 394.A O no hydrogen 3.036 N/A GLN 398.A NE2 THR 363.A O no hydrogen 2.687 N/A ALA 400.A N SER 163.A O no hydrogen 2.715 N/A GLY 401.A N LEU 359.A O no hydrogen 2.895 N/A ARG 402.A N ILE 157.A O no hydrogen 2.881 N/A ARG 402.A NE ALA 485.A O no hydrogen 2.847 N/A ARG 402.A NH2 ALA 485.A O no hydrogen 3.097 N/A ALA 404.A N ILE 486.A O no hydrogen 2.956 N/A GLY 405.A N GLU 479.A O no hydrogen 2.967 N/A GLY 406.A N LEU 477.A O no hydrogen 2.652 N/A ARG 407.A N VAL 150.A O no hydrogen 2.835 N/A ARG 407.A NE LYS 149.A O no hydrogen 2.925 N/A ARG 407.A NH1 GLU 455.A OE1 no hydrogen 2.759 N/A ARG 407.A NH2 LYS 149.A O no hydrogen 3.043 N/A ASN 408.A ND2 ILE 157.A O no hydrogen 2.963 N/A ASN 408.A ND2 ARG 402.A O no hydrogen 2.779 N/A VAL 409.A N LEU 151.A O no hydrogen 2.840 N/A VAL 413.A N PRO 410.A O no hydrogen 3.051 N/A GLN 414.A N ILE 411.A O no hydrogen 3.115 N/A ALA 417.A N VAL 413.A O no hydrogen 3.123 N/A LYS 418.A N GLN 414.A O no hydrogen 2.813 N/A LYS 418.A NZ SER 143.A OG no hydrogen 3.400 N/A LYS 418.A NZ ASP 422.A OD2 no hydrogen 2.754 N/A ALA 419.A N ALA 415.A O no hydrogen 3.008 N/A SER 420.A N VAL 416.A O no hydrogen 3.072 N/A SER 420.A OG HIS 355.A ND1 no hydrogen 2.957 N/A SER 420.A OG VAL 416.A O no hydrogen 3.402 N/A ASP 422.A N LYS 418.A O no hydrogen 2.931 N/A GLN 423.A N ALA 419.A O no hydrogen 2.764 N/A SER 424.A N SER 420.A O no hydrogen 3.118 N/A SER 424.A OG SER 420.A O no hydrogen 2.870 N/A ARG 425.A N ILE 421.A O no hydrogen 3.143 N/A ARG 425.A NE GLU 471.A OE1 no hydrogen 2.858 N/A ARG 425.A NE GLU 471.A OE2 no hydrogen 3.303 N/A ARG 425.A NH1 PRO 141.A O no hydrogen 2.890 N/A ARG 425.A NH2 PRO 141.A O no hydrogen 2.771 N/A ARG 425.A NH2 GLU 471.A OE2 no hydrogen 2.708 N/A GLU 426.A N ASP 422.A O no hydrogen 2.974 N/A MET 427.A N GLN 423.A O no hydrogen 2.826 N/A LYS 428.A N ARG 425.A O no hydrogen 3.050 N/A LYS 428.A NZ.B PRO 131.A O no hydrogen 2.628 N/A TYR 429.A N SER 424.A O no hydrogen 3.068 N/A TYR 429.A OH SER 348.A OG no hydrogen 2.620 N/A TYR 429.A OH THR 352.A OG1 no hydrogen 2.716 N/A GLN 430.A NE2 PRO 122.A O no hydrogen 2.903 N/A SER 431.A OG ASP 468.A O no hydrogen 3.155 N/A LEU 432.A N MET 470.A O no hydrogen 2.901 N/A ASN 433.A ND2 TYR 444.A O no hydrogen 3.024 N/A ASN 433.A ND2 ASP 468.A OD1 no hydrogen 2.894 N/A GLU 434.A N SER 431.A OG no hydrogen 3.193 N/A TYR 435.A N SER 431.A O no hydrogen 3.119 N/A TYR 435.A OH GLU 349.A OE2 no hydrogen 2.487 N/A ARG 436.A N LEU 432.A O no hydrogen 2.796 N/A ARG 436.A NE LYS 442.A O no hydrogen 2.708 N/A ARG 436.A NH1 GLU 489.A OE1 no hydrogen 3.046 N/A ARG 436.A NH1 THR 490.A OG1 no hydrogen 2.843 N/A ARG 436.A NH2 LYS 442.A O no hydrogen 2.784 N/A ARG 436.A NH2 GLU 489.A OE1 no hydrogen 2.740 N/A LYS 437.A N ASN 433.A O no hydrogen 3.023 N/A LYS 437.A NZ GLN 10.A OE1 no hydrogen 3.045 N/A LYS 437.A NZ GLU 434.A OE2 no hydrogen 3.531 N/A ARG 438.A N GLU 434.A O no hydrogen 3.042 N/A ARG 438.A NE ALA 120.A O no hydrogen 3.137 N/A ARG 438.A NH1 LEU 92.A O no hydrogen 2.836 N/A ARG 438.A NH1 ARG 438.A O no hydrogen 2.978 N/A ARG 438.A NH2 LEU 92.A O no hydrogen 2.756 N/A PHE 439.A N TYR 435.A O no hydrogen 3.137 N/A PHE 439.A N ARG 436.A O no hydrogen 3.169 N/A SER 440.A N LYS 437.A O no hydrogen 3.163 N/A LEU 441.A N ARG 436.A O no hydrogen 2.710 N/A TYR 444.A N ASN 433.A OD1 no hydrogen 2.931 N/A TYR 444.A OH GLU 479.A OE2 no hydrogen 2.554 N/A THR 445.A N GLU 449.A OE1 no hydrogen 2.677 N/A THR 445.A OG1 GLU 449.A OE1 no hydrogen 3.005 N/A GLU 449.A N SER 446.A OG no hydrogen 3.003 N/A LEU 450.A N SER 446.A O no hydrogen 3.352 N/A THR 451.A N PHE 447.A O no hydrogen 3.013 N/A THR 451.A OG1 GLU 453.A OE1 no hydrogen 2.762 N/A GLY 452.A N GLU 448.A O no hydrogen 2.703 N/A MET 456.A N GLU 453.A OE2 no hydrogen 2.586 N/A ALA 457.A N GLU 453.A OE1 no hydrogen 3.224 N/A ALA 458.A N LYS 454.A O no hydrogen 3.033 N/A GLU 459.A N GLU 455.A O no hydrogen 3.120 N/A LEU 460.A N MET 456.A O no hydrogen 2.841 N/A LYS 461.A N ALA 457.A O no hydrogen 2.851 N/A LYS 461.A NZ SER 465.A O no hydrogen 2.783 N/A ALA 462.A N ALA 458.A O no hydrogen 3.059 N/A LEU 463.A N GLU 459.A O no hydrogen 2.991 N/A TYR 464.A N LEU 460.A O no hydrogen 2.813 N/A TYR 464.A OH GLU 471.A OE2 no hydrogen 2.665 N/A SER 465.A N LYS 461.A O no hydrogen 2.878 N/A ASP 466.A N TYR 464.A O no hydrogen 2.816 N/A ASP 468.A N ASP 466.A OD1 no hydrogen 3.022 N/A VAL 469.A N ASP 466.A O no hydrogen 2.951 N/A MET 470.A N ILE 467.A O no hydrogen 3.060 N/A TYR 473.A OH HIS 355.A O no hydrogen 3.143 N/A ALA 475.A N GLU 471.A O no hydrogen 3.256 N/A LEU 476.A N LEU 472.A O no hydrogen 3.027 N/A LEU 477.A N PRO 474.A O no hydrogen 3.171 N/A VAL 478.A N PRO 474.A O no hydrogen 3.050 N/A LYS 480.A N LEU 450.A O no hydrogen 2.803 N/A ARG 482.A N PHE 487.A O no hydrogen 3.023 N/A ARG 482.A NE ASN 55.A OD1 no hydrogen 2.873 N/A ARG 482.A NH2 ASN 55.A OD1 no hydrogen 2.826 N/A ALA 485.A N ARG 482.A O no hydrogen 2.892 N/A ILE 486.A N GLN 161.A OE1 no hydrogen 2.808 N/A THR 490.A N GLU 479.A OE1 no hydrogen 3.090 N/A THR 490.A N GLU 479.A OE2 no hydrogen 3.150 N/A THR 490.A OG1 GLU 479.A OE1 no hydrogen 3.546 N/A THR 490.A OG1 GLU 479.A OE2 no hydrogen 2.627 N/A GLU 493.A N GLU 489.A O no hydrogen 2.950 N/A LEU 494.A N THR 490.A O no hydrogen 2.985 N/A GLY 495.A N MET 491.A O no hydrogen 2.895 N/A ALA 496.A N VAL 492.A O no hydrogen 2.934 N/A SER 499.A N GLY 495.A O no hydrogen 2.889 N/A LEU 500.A N ALA 496.A O no hydrogen 2.872 N/A LYS 501.A N PRO 497.A O no hydrogen 3.155 N/A LYS 501.A NZ SER 95.A OG no hydrogen 2.956 N/A LYS 501.A NZ GLN 341.A O no hydrogen 2.787 N/A LYS 501.A NZ GLN 343.A O no hydrogen 2.964 N/A GLY 502.A N PHE 498.A O no hydrogen 3.087 N/A LEU 503.A N SER 499.A O no hydrogen 2.986 N/A LEU 503.A N LEU 500.A O no hydrogen 3.104 N/A MET 504.A N LEU 500.A O no hydrogen 2.759 N/A GLY 505.A N.A LYS 501.A O no hydrogen 3.008 N/A GLY 505.A N.B LYS 501.A O no hydrogen 2.998 N/A ASN 506.A ND2 VAL 197.A O no hydrogen 2.814 N/A ILE 508.A N ASN 506.A OD1 no hydrogen 3.139 N/A CYS 509.A N ASN 506.A O no hydrogen 3.010 N/A CYS 509.A SG LEU 503.A O no hydrogen 3.645 N/A SER 510.A N PRO 507.A O no hydrogen 3.003 N/A SER 510.A OG PRO 507.A O no hydrogen 2.608 N/A TYR 513.A N SER 510.A O no hydrogen 2.961 N/A TRP 514.A N SER 510.A O no hydrogen 2.775 N/A LYS 515.A N TYR 513.A O no hydrogen 2.674 N/A LYS 515.A NZ GLN 512.A OE1 no hydrogen 3.212 N/A THR 518.A N LYS 515.A O no hydrogen 3.184 N/A THR 518.A OG1 TYR 513.A O no hydrogen 2.609 N/A PHE 519.A N PRO 516.A O no hydrogen 2.984 N/A GLY 520.A N SER 517.A O no hydrogen 3.394 N/A GLY 521.A N PRO 516.A O no hydrogen 2.852 N/A PHE 525.A N GLY 521.A O no hydrogen 3.101 N/A LYS 526.A N GLU 522.A O no hydrogen 2.789 N/A ILE 527.A N VAL 523.A O no hydrogen 3.181 N/A ILE 528.A N GLY 524.A O no hydrogen 3.398 N/A ASN 529.A N PHE 525.A O no hydrogen 3.068 N/A THR 530.A OG1 LYS 526.A O no hydrogen 2.753 N/A ALA 531.A N ILE 528.A O no hydrogen 3.271 N/A SER 532.A N SER 535.A OG no hydrogen 3.108 N/A SER 532.A OG GLN 534.A OE1.B no hydrogen 3.394 N/A SER 532.A OG SER 535.A OG no hydrogen 3.385 N/A ILE 533.A N ASP 316.A OD2 no hydrogen 2.775 N/A GLN 534.A N GLN 534.A OE1.B no hydrogen 2.903 N/A GLN 534.A NE2.A GLN 534.A O no hydrogen 2.966 N/A GLN 534.A NE2.A PRO 545.A O no hydrogen 3.142 N/A GLN 534.A NE2.B THR 547.A O no hydrogen 3.609 N/A SER 535.A N SER 532.A OG no hydrogen 2.963 N/A SER 535.A OG SER 532.A O no hydrogen 3.246 N/A SER 535.A OG SER 532.A OG no hydrogen 3.385 N/A LEU 536.A N SER 532.A O no hydrogen 2.924 N/A ILE 537.A N ILE 533.A O no hydrogen 3.200 N/A CYS 538.A N GLN 534.A O no hydrogen 2.758 N/A ASN 539.A N SER 535.A O no hydrogen 2.939 N/A ASN 540.A N ILE 537.A O no hydrogen 3.147 N/A ASN 540.A ND2 GLU 277.A OE1 no hydrogen 2.719 N/A ASN 540.A ND2 LEU 536.A O no hydrogen 2.798 N/A VAL 541.A N ILE 537.A O no hydrogen 2.824 N/A CYS 544.A N VAL 541.A O no hydrogen 3.051 N/A THR 547.A N GLN 534.A OE1.A no hydrogen 3.102 N/A THR 547.A OG1 THR 396.A OG1 no hydrogen 2.837 N/A SER 548.A OG ASN 550.A O no hydrogen 2.970 N/A SER 548.A OG ASN 550.A OD1 no hydrogen 2.986 N/A ASN 550.A N SER 548.A OG no hydrogen 3.150 N/A VAL 551.A N GLY 162.A O no hydrogen 2.814 N/A ILE 74A.A N VAL 71.A O no hydrogen 3.237 N/A