Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4h1s_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): TRP 1.A N PHE 268.A O no hydrogen 3.243 N/A LEU 3.A N ILE 266.A O no hydrogen 2.901 N/A THR 4.A N ASN 51.A O no hydrogen 2.706 N/A ILE 5.A N LEU 264.A O no hydrogen 2.803 N/A LEU 6.A N LEU 53.A O no hydrogen 2.730 N/A HIS 7.A N GLY 262.A O no hydrogen 3.027 N/A HIS 7.A NE2 TYR 237.A OH no hydrogen 2.720 N/A THR 8.A N LEU 55.A O no hydrogen 2.991 N/A THR 8.A OG1 ASP 56.A OD1 no hydrogen 2.711 N/A THR 8.A OG1 TYR 84.A OH no hydrogen 2.651 N/A ASN 9.A ND2 ASP 10.A OD1 no hydrogen 2.812 N/A ASN 9.A ND2 TYR 255.A O no hydrogen 2.797 N/A ASP 10.A N GLY 58.A O no hydrogen 2.936 N/A HIS 12.A N ASP 59.A O no hydrogen 2.916 N/A HIS 12.A ND1 TYR 61.A O no hydrogen 3.062 N/A HIS 12.A ND1 GLN 62.A O no hydrogen 3.006 N/A SER 13.A OG SER 13.A O no hydrogen 2.551 N/A SER 13.A OG THR 64.A OG1 no hydrogen 2.580 N/A ARG 14.A N VAL 11.A O no hydrogen 3.167 N/A ARG 14.A NE SER 22.A O no hydrogen 2.857 N/A ARG 14.A NH1 HIS 12.A O no hydrogen 2.917 N/A ARG 14.A NH2 SER 22.A O no hydrogen 3.525 N/A ARG 14.A NH2 SER 22.A OG no hydrogen 3.019 N/A THR 18.A N MET 32.A O no hydrogen 2.701 N/A THR 18.A OG1 SER 19.A O no hydrogen 2.768 N/A THR 18.A OG1 MET 32.A O no hydrogen 3.567 N/A SER 19.A N SER 23.A O no hydrogen 2.884 N/A SER 22.A N SER 19.A O no hydrogen 2.853 N/A SER 22.A OG ASP 21.A O no hydrogen 2.569 N/A SER 23.A N ASP 21.A OD1 no hydrogen 3.043 N/A SER 23.A OG ASP 21.A OD1 no hydrogen 2.617 N/A LYS 24.A NZ GLU 381.A OE1 no hydrogen 3.546 N/A LYS 24.A NZ GLU 381.A OE2 no hydrogen 3.014 N/A SER 29.A N ASN 27.A O no hydrogen 2.452 N/A ARG 30.A N ASN 27.A O no hydrogen 2.927 N/A CYS 31.A SG ASN 27.A O no hydrogen 3.573 N/A MET 32.A N THR 18.A O no hydrogen 2.732 N/A GLY 33.A N LEU 284.A O no hydrogen 2.890 N/A VAL 35.A N LEU 15.A O no hydrogen 2.754 N/A ARG 37.A NE ILE 288.A O no hydrogen 2.918 N/A ARG 37.A NH1 GLN 17.A OE1 no hydrogen 3.072 N/A ARG 37.A NH1 GLY 33.A O no hydrogen 2.845 N/A ARG 37.A NH2 GLN 17.A OE1 no hydrogen 3.062 N/A LEU 38.A N GLY 34.A O no hydrogen 3.124 N/A PHE 39.A N VAL 35.A O no hydrogen 2.910 N/A THR 40.A N ALA 36.A O no hydrogen 3.497 N/A THR 40.A OG1 ALA 36.A O no hydrogen 3.361 N/A THR 40.A OG1 PRO 289.A O no hydrogen 2.707 N/A LYS 41.A N ARG 37.A O no hydrogen 3.192 N/A LYS 41.A NZ GLN 44.A OE1 no hydrogen 2.791 N/A VAL 42.A N LEU 38.A O no hydrogen 2.963 N/A GLN 43.A N PHE 39.A O no hydrogen 2.780 N/A GLN 44.A N THR 40.A O no hydrogen 2.892 N/A ILE 45.A N LYS 41.A O no hydrogen 3.151 N/A ARG 46.A N VAL 42.A O no hydrogen 2.862 N/A ARG 46.A NH1 LEU 82.A O no hydrogen 3.190 N/A ARG 46.A NH2 LEU 82.A O no hydrogen 3.492 N/A ARG 46.A NH2 ARG 83.A O no hydrogen 2.870 N/A ARG 47.A N GLN 43.A O no hydrogen 2.947 N/A ALA 48.A N GLN 44.A O no hydrogen 3.241 N/A ALA 48.A N ILE 45.A O no hydrogen 2.886 N/A GLU 49.A N ILE 45.A O no hydrogen 2.822 N/A ASN 51.A ND2 GLU 2.A O no hydrogen 2.801 N/A LEU 53.A N THR 4.A O no hydrogen 2.895 N/A LEU 54.A N ASP 85.A OD2 no hydrogen 2.860 N/A LEU 55.A N LEU 6.A O no hydrogen 2.774 N/A ASP 56.A N ALA 86.A O no hydrogen 3.126 N/A ALA 57.A N THR 8.A O no hydrogen 2.847 N/A GLY 58.A N ASP 56.A OD2 no hydrogen 2.805 N/A ASP 59.A N GLU 93.A OE1 no hydrogen 2.800 N/A GLN 60.A NE2 ASP 56.A OD1 no hydrogen 3.042 N/A TYR 61.A N GLU 93.A OE2 no hydrogen 2.872 N/A TYR 61.A OH GLY 100.A O no hydrogen 2.863 N/A GLN 62.A NE2 ASP 95.A OD2 no hydrogen 3.045 N/A THR 64.A OG1 SER 13.A O no hydrogen 2.915 N/A THR 64.A OG1 SER 13.A OG no hydrogen 2.580 N/A TRP 66.A N THR 64.A OG1 no hydrogen 3.231 N/A TRP 66.A NE1 GLU 16.A OE2 no hydrogen 2.814 N/A PHE 67.A N THR 64.A O no hydrogen 3.001 N/A THR 68.A N THR 64.A O no hydrogen 3.243 N/A THR 68.A OG1 THR 64.A O no hydrogen 3.501 N/A VAL 69.A N ILE 65.A O no hydrogen 2.906 N/A TYR 70.A N TRP 66.A O no hydrogen 2.942 N/A TYR 70.A OH TRP 301.A O no hydrogen 2.537 N/A LYS 71.A N PHE 67.A O no hydrogen 2.942 N/A LYS 71.A NZ THR 68.A O no hydrogen 3.244 N/A GLY 72.A N GLU 74.A OE1 no hydrogen 2.709 N/A ALA 73.A N TYR 70.A O no hydrogen 2.939 N/A GLU 74.A N GLU 74.A OE1 no hydrogen 2.542 N/A ALA 76.A N GLY 72.A O no hydrogen 3.095 N/A HIS 77.A N ALA 73.A O no hydrogen 3.050 N/A HIS 77.A NE2 ASP 297.A OD2 no hydrogen 2.474 N/A PHE 78.A N GLU 74.A O no hydrogen 3.025 N/A MET 79.A N VAL 75.A O no hydrogen 2.855 N/A ASN 80.A N ALA 76.A O no hydrogen 2.918 N/A ASN 80.A ND2 GLU 108.A O no hydrogen 3.086 N/A ALA 81.A N HIS 77.A O no hydrogen 3.000 N/A LEU 82.A N PHE 78.A O no hydrogen 2.972 N/A ARG 83.A N ASN 80.A O no hydrogen 2.974 N/A TYR 84.A N MET 79.A O no hydrogen 3.240 N/A TYR 84.A OH THR 8.A OG1 no hydrogen 2.651 N/A ASP 85.A N LEU 54.A O no hydrogen 2.787 N/A MET 87.A N PRO 112.A O no hydrogen 3.059 N/A ALA 88.A N ASP 56.A O no hydrogen 2.951 N/A LEU 89.A N LEU 114.A O no hydrogen 3.055 N/A GLY 90.A N GLU 93.A OE1 no hydrogen 2.747 N/A HIS 92.A N ASP 59.A OD1 no hydrogen 2.936 N/A HIS 92.A ND1 ASP 95.A OD2 no hydrogen 2.690 N/A GLU 93.A N GLY 90.A O no hydrogen 3.282 N/A PHE 94.A N ASN 91.A O no hydrogen 3.074 N/A ASP 95.A N HIS 92.A O no hydrogen 3.093 N/A GLY 97.A N PHE 94.A O no hydrogen 3.092 N/A GLU 99.A N GLU 99.A OE1 no hydrogen 2.977 N/A GLY 100.A N ASN 96.A O no hydrogen 3.102 N/A LEU 101.A N VAL 98.A O no hydrogen 2.978 N/A ILE 102.A N VAL 98.A O no hydrogen 2.801 N/A GLU 103.A N GLU 99.A O no hydrogen 3.378 N/A LEU 105.A N LEU 101.A O no hydrogen 3.213 N/A LEU 106.A N LEU 101.A O no hydrogen 2.946 N/A LYS 107.A N ILE 102.A O no hydrogen 2.962 N/A LYS 107.A NZ GLU 103.A OE1 no hydrogen 3.513 N/A LYS 107.A NZ GLU 103.A OE2 no hydrogen 2.550 N/A GLU 108.A N LEU 105.A O no hydrogen 3.253 N/A ALA 109.A N LEU 105.A O no hydrogen 2.980 N/A LYS 110.A N ASN 80.A OD1 no hydrogen 2.785 N/A LEU 114.A N MET 87.A O no hydrogen 2.666 N/A SER 115.A N LEU 133.A O no hydrogen 2.824 N/A SER 115.A OG ASN 117.A OD1 no hydrogen 3.195 N/A SER 115.A OG THR 151.A OG1 no hydrogen 2.755 N/A ALA 116.A N GLY 149.A O no hydrogen 2.701 N/A ASN 117.A ND2 THR 151.A O no hydrogen 2.657 N/A ASN 117.A ND2 GLU 168.A O no hydrogen 2.954 N/A LYS 119.A N VAL 166.A O no hydrogen 2.772 N/A LYS 119.A NZ ALA 116.A O no hydrogen 2.963 N/A LYS 121.A N ASN 164.A O no hydrogen 2.848 N/A ALA 125.A N GLY 122.A O no hydrogen 3.331 N/A SER 126.A OG PRO 123.A O no hydrogen 3.429 N/A ILE 128.A N LEU 124.A O no hydrogen 2.968 N/A LEU 131.A N ILE 128.A O no hydrogen 3.088 N/A TYR 132.A OH ILE 118.A O no hydrogen 2.792 N/A LEU 133.A N ILE 113.A O no hydrogen 2.958 N/A LYS 136.A N ILE 147.A O no hydrogen 2.855 N/A LEU 138.A N VAL 145.A O no hydrogen 2.865 N/A VAL 140.A N GLU 143.A O no hydrogen 2.954 N/A GLU 143.A N VAL 140.A O no hydrogen 2.953 N/A VAL 145.A N LEU 138.A O no hydrogen 2.826 N/A GLY 146.A N LYS 188.A O no hydrogen 2.814 N/A ILE 147.A N LYS 136.A O no hydrogen 2.853 N/A VAL 148.A N ILE 190.A O no hydrogen 2.911 N/A GLY 149.A N PRO 134.A O no hydrogen 3.036 N/A TYR 150.A N LEU 192.A O no hydrogen 3.139 N/A TYR 150.A OH ASP 200.A OD1 no hydrogen 2.564 N/A THR 151.A N ASN 117.A OD1 no hydrogen 2.833 N/A THR 151.A OG1 LEU 89.A O no hydrogen 2.855 N/A THR 151.A OG1 SER 115.A OG no hydrogen 2.755 N/A SER 152.A N HIS 194.A O no hydrogen 2.894 N/A LYS 153.A N GLU 170.A OE2 no hydrogen 3.123 N/A GLU 154.A N SER 152.A OG no hydrogen 3.135 N/A THR 155.A N SER 152.A O no hydrogen 3.161 N/A THR 155.A OG1 SER 152.A O no hydrogen 2.759 N/A PHE 157.A N GLU 154.A O no hydrogen 2.740 N/A LEU 158.A N THR 155.A O no hydrogen 2.922 N/A SER 159.A N THR 155.A O no hydrogen 2.828 N/A SER 159.A OG ASN 91.A O no hydrogen 3.002 N/A SER 159.A OG ASP 95.A OD1 no hydrogen 2.522 N/A ASN 160.A N PHE 94.A O no hydrogen 3.291 N/A ASN 160.A ND2 ASP 95.A O no hydrogen 2.889 N/A ASN 164.A ND2 LYS 121.A O no hydrogen 3.688 N/A VAL 166.A N LYS 119.A O no hydrogen 2.745 N/A GLU 168.A N ASN 117.A O no hydrogen 2.808 N/A GLU 170.A N GLU 170.A OE1 no hydrogen 2.594 N/A THR 172.A N ASP 169.A OD2 no hydrogen 3.366 N/A THR 172.A OG1 ASP 169.A OD2 no hydrogen 3.115 N/A ALA 173.A N ASP 169.A O no hydrogen 3.049 N/A LEU 174.A N GLU 170.A O no hydrogen 2.831 N/A LEU 174.A N ILE 171.A O no hydrogen 3.236 N/A GLN 175.A N ILE 171.A O no hydrogen 3.084 N/A GLN 175.A NE2 GLN 175.A O no hydrogen 3.458 N/A GLN 175.A NE2 ASP 179.A OD1 no hydrogen 3.556 N/A GLN 175.A NE2 ARG 208.A O no hydrogen 2.993 N/A VAL 178.A N LEU 174.A O no hydrogen 2.941 N/A ASP 179.A N GLN 175.A O no hydrogen 2.935 N/A LYS 180.A N PRO 176.A O no hydrogen 2.912 N/A LEU 181.A N GLU 177.A O no hydrogen 3.045 N/A LYS 182.A N VAL 178.A O no hydrogen 3.046 N/A LYS 182.A NZ ARG 208.A O no hydrogen 3.350 N/A THR 183.A N ASP 179.A O no hydrogen 2.929 N/A THR 183.A OG1 LYS 180.A O no hydrogen 2.706 N/A LEU 184.A N LYS 180.A O no hydrogen 2.999 N/A ASN 185.A N LYS 182.A O no hydrogen 2.930 N/A VAL 186.A N LEU 181.A O no hydrogen 2.967 N/A LYS 188.A NZ GLU 143.A OE1 no hydrogen 3.059 N/A LYS 188.A NZ ASN 187.A OD1 no hydrogen 2.690 N/A ILE 189.A N ASP 211.A OD2 no hydrogen 2.744 N/A ILE 190.A N GLY 146.A O no hydrogen 2.841 N/A ALA 191.A N VAL 212.A O no hydrogen 2.989 N/A LEU 192.A N VAL 148.A O no hydrogen 2.824 N/A GLY 193.A N VAL 214.A O no hydrogen 3.092 N/A HIS 194.A N TYR 150.A O no hydrogen 2.923 N/A HIS 194.A ND1 ALA 57.A O no hydrogen 2.820 N/A SER 195.A OG GLU 170.A OE2 no hydrogen 2.740 N/A PHE 197.A N SER 218.A OG no hydrogen 2.867 N/A ASP 200.A N GLY 196.A O no hydrogen 2.875 N/A LYS 201.A N PHE 197.A O no hydrogen 3.061 N/A LYS 201.A NZ GLU 198.A OE2 no hydrogen 2.789 N/A LEU 202.A N GLU 198.A O no hydrogen 3.156 N/A ILE 203.A N MET 199.A O no hydrogen 2.893 N/A ALA 204.A N ASP 200.A O no hydrogen 3.031 N/A GLN 205.A N LYS 201.A O no hydrogen 3.002 N/A GLN 205.A N LEU 202.A O no hydrogen 3.174 N/A GLN 205.A NE2 ASP 244.A OD1 no hydrogen 3.059 N/A LYS 206.A N LEU 202.A O no hydrogen 2.829 N/A VAL 207.A N ILE 203.A O no hydrogen 2.995 N/A ARG 208.A N GLN 175.A OE1 no hydrogen 2.896 N/A VAL 210.A N VAL 207.A O no hydrogen 3.303 N/A ASP 211.A N ILE 189.A O no hydrogen 2.862 N/A VAL 213.A N PRO 250.A O no hydrogen 3.038 N/A VAL 214.A N ALA 191.A O no hydrogen 2.808 N/A GLY 215.A N VAL 252.A O no hydrogen 2.908 N/A HIS 217.A N ASP 10.A OD1 no hydrogen 2.786 N/A HIS 217.A ND1 HIS 194.A NE2 no hydrogen 3.048 N/A SER 218.A N GLY 216.A O no hydrogen 2.859 N/A SER 218.A OG GLY 216.A O no hydrogen 3.516 N/A SER 218.A OG THR 220.A OG1 no hydrogen 2.721 N/A SER 218.A OG GLN 253.A OE1 no hydrogen 3.172 N/A THR 220.A N GLN 253.A OE1 no hydrogen 2.849 N/A THR 220.A OG1 SER 218.A OG no hydrogen 2.721 N/A TYR 223.A N GLY 235.A O no hydrogen 2.983 N/A THR 224.A N ASN 280.A OD1 no hydrogen 2.924 N/A THR 224.A OG1 TYR 237.A O no hydrogen 2.594 N/A SER 229.A OG GLU 20.A OE2 no hydrogen 3.494 N/A LYS 230.A NZ GLU 20.A OE1 no hydrogen 3.547 N/A ALA 234.A N PHE 221.A O no hydrogen 2.897 N/A TYR 237.A N THR 224.A OG1 no hydrogen 3.048 N/A TYR 237.A OH HIS 7.A NE2 no hydrogen 2.720 N/A PHE 239.A N VAL 251.A O no hydrogen 2.895 N/A VAL 241.A N VAL 249.A O no hydrogen 2.890 N/A SER 243.A N ARG 247.A O no hydrogen 2.825 N/A SER 243.A OG ASP 245.A OD1 no hydrogen 2.592 N/A SER 243.A OG ARG 247.A O no hydrogen 3.347 N/A ASP 244.A N GLN 205.A O no hydrogen 2.792 N/A GLY 246.A N SER 243.A O no hydrogen 2.846 N/A ARG 247.A N SER 243.A OG no hydrogen 2.820 N/A ARG 247.A NE ASP 245.A OD1 no hydrogen 2.832 N/A ARG 247.A NE ASP 245.A OD2 no hydrogen 3.512 N/A ARG 247.A NH1 VAL 210.A O no hydrogen 2.781 N/A ARG 247.A NH2 VAL 210.A O no hydrogen 3.232 N/A ARG 247.A NH2 ASP 245.A OD1 no hydrogen 3.315 N/A LYS 248.A NZ THR 242.A OG1 no hydrogen 2.862 N/A VAL 249.A N VAL 241.A O no hydrogen 2.764 N/A VAL 251.A N PHE 239.A O no hydrogen 2.708 N/A VAL 252.A N VAL 213.A O no hydrogen 2.946 N/A GLN 253.A NE2 SER 218.A OG no hydrogen 3.406 N/A ALA 254.A N ASN 9.A OD1 no hydrogen 2.955 N/A TYR 255.A N THR 220.A O no hydrogen 2.820 N/A PHE 257.A N ASP 10.A O no hydrogen 2.748 N/A LYS 259.A N ALA 256.A O no hydrogen 3.390 N/A LYS 259.A NZ GLU 20.A O no hydrogen 2.981 N/A LYS 259.A NZ SER 229.A OG no hydrogen 3.125 N/A LYS 259.A NZ GLU 231.A OE1 no hydrogen 3.121 N/A LYS 259.A NZ GLU 231.A OE2 no hydrogen 2.999 N/A TYR 260.A OH GLU 231.A OE1 no hydrogen 2.708 N/A LEU 261.A N ILE 282.A O no hydrogen 2.939 N/A GLY 262.A N HIS 7.A O no hydrogen 2.785 N/A TYR 263.A OH GLU 49.A OE2 no hydrogen 3.011 N/A LEU 264.A N ILE 5.A O no hydrogen 2.938 N/A LYS 265.A N HIS 278.A O no hydrogen 2.892 N/A LYS 265.A NZ GLU 2.A OE1 no hydrogen 3.106 N/A LYS 265.A NZ THR 4.A OG1 no hydrogen 3.097 N/A LYS 265.A NZ GLU 49.A OE1 no hydrogen 3.136 N/A ILE 266.A N LEU 3.A O no hydrogen 2.841 N/A GLU 267.A N SER 276.A O no hydrogen 2.723 N/A PHE 268.A N TRP 1.A O no hydrogen 2.909 N/A ASP 269.A N ASN 273.A O no hydrogen 2.999 N/A GLY 272.A N ASP 269.A O no hydrogen 2.981 N/A ASN 273.A N ASP 269.A OD1 no hydrogen 2.909 N/A ASN 273.A ND2 ASP 269.A OD2 no hydrogen 3.122 N/A ILE 275.A N GLU 267.A O no hydrogen 2.633 N/A SER 276.A N GLU 267.A O no hydrogen 3.410 N/A HIS 278.A N LYS 265.A O no hydrogen 3.080 N/A ASN 280.A N TYR 263.A O no hydrogen 3.090 N/A ASN 280.A ND2 THR 224.A O no hydrogen 2.976 N/A ILE 282.A N LEU 261.A O no hydrogen 2.797 N/A LEU 284.A N LYS 259.A O no hydrogen 2.851 N/A SER 286.A OG SER 29.A O no hydrogen 3.049 N/A SER 287.A N ASN 285.A OD1 no hydrogen 3.212 N/A ILE 288.A N ASN 285.A O no hydrogen 3.124 N/A ASP 291.A N ALA 36.A O no hydrogen 2.898 N/A ILE 294.A N ASP 291.A OD2 no hydrogen 2.935 N/A LYS 295.A N ASP 291.A O no hydrogen 2.825 N/A ALA 296.A N PRO 292.A O no hydrogen 2.893 N/A ASP 297.A N SER 293.A O no hydrogen 3.064 N/A ILE 298.A N ILE 294.A O no hydrogen 2.781 N/A ASN 299.A N LYS 295.A O no hydrogen 2.798 N/A LYS 300.A N ALA 296.A O no hydrogen 2.919 N/A TRP 301.A N ASP 297.A O no hydrogen 3.043 N/A ARG 302.A NE ASP 306.A OD1 no hydrogen 2.840 N/A ARG 302.A NH1 GLU 16.A OE2 no hydrogen 2.831 N/A ARG 302.A NH1 GLU 381.A OE2 no hydrogen 2.861 N/A ARG 302.A NH2 ASP 306.A OD1 no hydrogen 3.173 N/A ARG 302.A NH2 GLU 381.A OE1 no hydrogen 2.977 N/A ARG 302.A NH2 GLU 381.A OE2 no hydrogen 3.550 N/A LEU 305.A N ARG 302.A O no hydrogen 3.123 N/A ASP 306.A N ILE 303.A O no hydrogen 3.164 N/A TYR 308.A N LEU 305.A O no hydrogen 3.280 N/A GLN 309.A NE2 GLU 310.A O no hydrogen 3.260 N/A LEU 311.A N ILE 378.A O no hydrogen 2.744 N/A LYS 313.A N LYS 508.A O no hydrogen 2.962 N/A THR 314.A N GLY 376.A O no hydrogen 2.744 N/A THR 314.A OG1 VAL 316.A O no hydrogen 2.702 N/A ILE 315.A N ILE 510.A O no hydrogen 3.198 N/A VAL 316.A N THR 314.A OG1 no hydrogen 3.154 N/A TYR 317.A OH ASP 21.A OD2 no hydrogen 2.447 N/A LEU 318.A N ILE 370.A O no hydrogen 3.057 N/A ASP 319.A N ASN 331.A OD1 no hydrogen 2.797 N/A SER 321.A N ASP 319.A OD1 no hydrogen 3.234 N/A SER 321.A OG ASP 319.A OD1 no hydrogen 2.761 N/A GLN 323.A N GLN 323.A OE1 no hydrogen 2.894 N/A GLN 323.A NE2 TYR 255.A OH no hydrogen 2.944 N/A SER 324.A N SER 321.A O no hydrogen 3.159 N/A SER 324.A N SER 321.A OG no hydrogen 3.375 N/A SER 324.A OG ASP 319.A OD1 no hydrogen 3.333 N/A SER 324.A OG ASP 319.A OD2 no hydrogen 2.546 N/A SER 324.A OG SER 321.A OG no hydrogen 3.272 N/A CYS 325.A N SER 321.A O no hydrogen 2.833 N/A CYS 325.A SG ASP 319.A O no hydrogen 3.373 N/A CYS 325.A SG SER 321.A O no hydrogen 3.621 N/A ARG 326.A N SER 322.A O no hydrogen 3.002 N/A ARG 326.A NH1 SER 417.A O no hydrogen 2.978 N/A PHE 327.A N SER 324.A O no hydrogen 2.938 N/A ARG 328.A N SER 324.A O no hydrogen 2.884 N/A CYS 330.A N GLN 423.A OE1 no hydrogen 3.047 N/A CYS 330.A SG ASP 319.A O no hydrogen 3.704 N/A ASN 331.A ND2 TYR 317.A O no hydrogen 2.785 N/A ASN 331.A ND2 PRO 512.A O no hydrogen 3.028 N/A ASN 334.A N CYS 330.A O no hydrogen 3.214 N/A ASN 334.A ND2 GLU 329.A OE2 no hydrogen 2.796 N/A ASN 334.A ND2 ALA 513.A O no hydrogen 2.910 N/A LEU 335.A N ASN 331.A O no hydrogen 2.997 N/A ILE 336.A N MET 332.A O no hydrogen 3.084 N/A CYS 337.A N GLY 333.A O no hydrogen 3.018 N/A ASP 338.A N ASN 334.A O no hydrogen 2.787 N/A ALA 339.A N LEU 335.A O no hydrogen 2.865 N/A MET 340.A N ILE 336.A O no hydrogen 2.855 N/A ILE 341.A N CYS 337.A O no hydrogen 2.964 N/A ASN 342.A N ASP 338.A O no hydrogen 2.845 N/A ASN 343.A N ALA 339.A O no hydrogen 2.903 N/A ASN 343.A ND2 ASP 494.A OD2 no hydrogen 2.880 N/A ASN 344.A N MET 340.A O no hydrogen 3.301 N/A ASN 344.A ND2 TRP 353.A O no hydrogen 2.901 N/A LEU 345.A N ILE 341.A O no hydrogen 3.138 N/A ARG 346.A N ASN 342.A O no hydrogen 3.263 N/A ARG 346.A NE ASN 342.A OD1 no hydrogen 2.988 N/A ARG 346.A NH2 ASN 342.A OD1 no hydrogen 3.334 N/A HIS 347.A N ASN 344.A O no hydrogen 2.866 N/A HIS 347.A NE2 ASP 494.A OD2 no hydrogen 3.033 N/A PHE 352.A N GLU 350.A OE2 no hydrogen 3.163 N/A TRP 353.A NE1 ASP 491.A OD2 no hydrogen 2.714 N/A ASN 354.A ND2 THR 348.A O no hydrogen 3.645 N/A HIS 355.A ND1 ASN 354.A OD1 no hydrogen 3.070 N/A VAL 356.A N TRP 353.A O no hydrogen 3.303 N/A CYS 359.A N GLY 425.A O no hydrogen 2.890 N/A CYS 359.A SG ILE 468.A O no hydrogen 3.807 N/A ILE 360.A N ILE 468.A O no hydrogen 3.135 N/A LEU 361.A N GLN 423.A O no hydrogen 2.878 N/A ASN 362.A ND2 ASP 478.A OD2 no hydrogen 2.906 N/A GLY 363.A N PHE 421.A O no hydrogen 2.667 N/A GLY 364.A N GLY 419.A O no hydrogen 2.912 N/A GLY 365.A N ASN 362.A O no hydrogen 2.768 N/A ILE 366.A N GLY 363.A O no hydrogen 2.900 N/A ARG 367.A N VAL 386.A O no hydrogen 2.898 N/A ARG 367.A NH1 GLY 364.A O no hydrogen 3.036 N/A SER 368.A OG PRO 369.A O no hydrogen 2.950 N/A ILE 370.A N LEU 318.A O no hydrogen 2.906 N/A GLU 372.A N GLU 372.A OE1 no hydrogen 2.508 N/A ARG 373.A N ASP 371.A OD2 no hydrogen 2.731 N/A ARG 373.A NH1 ASP 371.A OD1 no hydrogen 2.716 N/A THR 377.A N ASN 374.A O no hydrogen 3.285 N/A THR 377.A OG1 GLU 310.A OE1 no hydrogen 3.330 N/A ILE 378.A N GLY 312.A O no hydrogen 2.990 N/A THR 379.A N ASN 382.A OD1 no hydrogen 3.032 N/A ASN 382.A N THR 379.A OG1 no hydrogen 3.349 N/A LEU 383.A N THR 379.A O no hydrogen 3.209 N/A ALA 384.A N TRP 380.A O no hydrogen 2.858 N/A ALA 385.A N GLU 381.A O no hydrogen 3.354 N/A VAL 386.A N LEU 383.A O no hydrogen 2.862 N/A LEU 387.A N LEU 383.A O no hydrogen 2.977 N/A THR 392.A N ASN 471.A OD1 no hydrogen 2.986 N/A THR 392.A OG1 ASP 394.A OD1 no hydrogen 2.696 N/A PHE 393.A N ASP 494.A O no hydrogen 2.950 N/A ASP 394.A N LEU 469.A O no hydrogen 2.651 N/A LEU 395.A N ASP 491.A O no hydrogen 3.043 N/A VAL 396.A N VAL 467.A O no hydrogen 2.942 N/A GLN 397.A N ARG 489.A O no hydrogen 3.025 N/A LEU 398.A N TYR 465.A O no hydrogen 2.748 N/A GLY 400.A N GLU 463.A O no hydrogen 2.690 N/A SER 401.A N MET 461.A O no hydrogen 3.020 N/A THR 402.A OG1 GLU 486.A OE1 no hydrogen 2.735 N/A LEU 403.A N LYS 399.A O no hydrogen 3.237 N/A LYS 404.A N GLY 400.A O no hydrogen 2.969 N/A LYS 404.A NZ GLU 408.A OE2 no hydrogen 2.940 N/A LYS 405.A N SER 401.A O no hydrogen 3.050 N/A LYS 405.A NZ GLU 486.A OE1 no hydrogen 3.487 N/A LYS 405.A NZ GLU 486.A OE2 no hydrogen 2.470 N/A ALA 406.A N THR 402.A O no hydrogen 2.838 N/A PHE 407.A N LEU 403.A O no hydrogen 2.934 N/A GLU 408.A N LYS 404.A O no hydrogen 3.000 N/A HIS 409.A N LYS 405.A O no hydrogen 2.905 N/A HIS 409.A NE2 ASP 478.A O no hydrogen 2.831 N/A SER 410.A N ALA 406.A O no hydrogen 2.891 N/A SER 410.A OG TYR 431.A OH no hydrogen 3.168 N/A VAL 411.A N GLU 408.A O no hydrogen 3.200 N/A HIS 412.A N HIS 409.A O no hydrogen 3.366 N/A HIS 412.A ND1 HIS 409.A O no hydrogen 2.732 N/A ARG 413.A NE GLU 420.A OE2 no hydrogen 2.850 N/A ARG 413.A NH1 GLU 154.A OE2 no hydrogen 2.749 N/A ARG 413.A NH2 GLU 154.A OE1 no hydrogen 2.951 N/A ARG 413.A NH2 GLU 420.A OE1 no hydrogen 3.298 N/A TYR 414.A N VAL 411.A O no hydrogen 3.134 N/A TYR 414.A OH PHE 327.A O no hydrogen 2.547 N/A THR 418.A OG1 GLU 420.A OE1 no hydrogen 2.986 N/A THR 418.A OG1 GLU 420.A OE2 no hydrogen 2.765 N/A GLU 420.A N GLU 420.A OE1 no hydrogen 2.792 N/A LEU 422.A N SER 410.A OG no hydrogen 3.115 N/A GLN 423.A N LEU 361.A O no hydrogen 2.637 N/A GLN 423.A NE2 CYS 325.A O no hydrogen 3.073 N/A GLN 423.A NE2 ARG 328.A O no hydrogen 2.854 N/A GLY 425.A N CYS 359.A O no hydrogen 3.013 N/A HIS 428.A N ASP 445.A O no hydrogen 2.825 N/A VAL 429.A N ARG 517.A O no hydrogen 2.931 N/A VAL 430.A N LYS 443.A O no hydrogen 2.814 N/A TYR 431.A N LYS 519.A O no hydrogen 2.951 N/A ASP 432.A N ARG 440.A O no hydrogen 2.801 N/A SER 434.A N ASP 432.A OD1 no hydrogen 3.112 N/A SER 434.A OG ASP 432.A OD1 no hydrogen 2.563 N/A ARG 435.A N ASP 432.A O no hydrogen 3.216 N/A ARG 435.A NE ASP 439.A O no hydrogen 2.853 N/A ARG 435.A NE ASP 439.A OD2 no hydrogen 3.356 N/A ARG 435.A NH2 ASP 439.A OD1 no hydrogen 3.569 N/A ARG 435.A NH2 ASP 439.A OD2 no hydrogen 2.794 N/A ASP 439.A N LYS 436.A O no hydrogen 2.861 N/A ARG 440.A N GLU 408.A OE1 no hydrogen 2.851 N/A ARG 440.A NE ARG 435.A O no hydrogen 2.977 N/A ARG 440.A NH1 VAL 411.A O no hydrogen 2.857 N/A VAL 441.A N GLU 408.A OE2 no hydrogen 2.843 N/A VAL 442.A N VAL 430.A O no hydrogen 2.918 N/A LYS 443.A N VAL 430.A O no hydrogen 3.319 N/A LYS 443.A NZ ASP 445.A OD2 no hydrogen 3.027 N/A ASP 445.A N HIS 428.A O no hydrogen 2.871 N/A VAL 446.A N ASP 457.A O no hydrogen 2.884 N/A LEU 447.A N GLY 426.A O no hydrogen 3.107 N/A CYS 448.A N SER 455.A O no hydrogen 2.981 N/A CYS 448.A SG VAL 453.A O no hydrogen 3.790 N/A CYS 448.A SG SER 455.A O no hydrogen 3.606 N/A CYS 451.A SG VAL 453.A O no hydrogen 3.563 N/A ASP 457.A N VAL 446.A O no hydrogen 3.026 N/A LEU 459.A N LEU 444.A O no hydrogen 2.899 N/A LYS 460.A N TYR 465.A OH no hydrogen 2.658 N/A GLU 463.A N LYS 460.A O no hydrogen 3.219 N/A TYR 465.A N LEU 398.A O no hydrogen 2.613 N/A LYS 466.A NZ PHE 352.A O no hydrogen 3.029 N/A VAL 467.A N VAL 396.A O no hydrogen 2.910 N/A ILE 468.A N MET 358.A O no hydrogen 2.866 N/A LEU 469.A N ASP 394.A O no hydrogen 2.946 N/A ASN 471.A N THR 392.A O no hydrogen 2.916 N/A LEU 473.A N PRO 470.A O no hydrogen 2.939 N/A ALA 474.A N PRO 470.A O no hydrogen 3.207 N/A ASN 475.A N ASN 471.A O no hydrogen 2.786 N/A GLY 476.A N LEU 473.A O no hydrogen 3.022 N/A GLY 477.A N PHE 472.A O no hydrogen 2.729 N/A ASP 478.A N PHE 157.A O no hydrogen 2.820 N/A GLY 479.A N GLY 476.A O no hydrogen 3.198 N/A PHE 480.A N GLY 477.A O no hydrogen 3.120 N/A ILE 483.A N PHE 480.A O no hydrogen 3.201 N/A LYS 484.A NZ GLN 481.A OE1 no hydrogen 3.183 N/A ASP 485.A N GLN 481.A O no hydrogen 2.923 N/A GLU 486.A N MET 482.A O no hydrogen 2.951 N/A LEU 487.A N ILE 483.A O no hydrogen 3.019 N/A LEU 488.A N GLN 397.A O no hydrogen 2.826 N/A ARG 489.A NE ASP 491.A OD1 no hydrogen 2.962 N/A ARG 489.A NH2 ASP 491.A OD2 no hydrogen 2.810 N/A HIS 490.A NE2 ASP 394.A OD2 no hydrogen 2.654 N/A ASP 491.A N LEU 395.A O no hydrogen 2.990 N/A GLY 493.A N ASP 394.A OD1 no hydrogen 2.904 N/A GLN 495.A NE2 GLY 390.A O no hydrogen 2.917 N/A ASP 496.A N GLY 391.A O no hydrogen 2.825 N/A VAL 499.A N GLN 495.A O no hydrogen 2.960 N/A VAL 500.A N ASP 496.A O no hydrogen 3.301 N/A SER 501.A N ILE 497.A O no hydrogen 3.033 N/A SER 501.A OG ILE 497.A O no hydrogen 3.074 N/A SER 501.A OG ASN 498.A O no hydrogen 3.129 N/A THR 502.A N ASN 498.A O no hydrogen 2.855 N/A THR 502.A OG1 ASN 498.A O no hydrogen 2.885 N/A TYR 503.A N VAL 499.A O no hydrogen 3.087 N/A ILE 504.A N VAL 500.A O no hydrogen 3.001 N/A SER 505.A N SER 501.A O no hydrogen 2.942 N/A SER 505.A OG LEU 311.A O no hydrogen 3.099 N/A SER 505.A OG SER 501.A O no hydrogen 3.194 N/A LYS 506.A N THR 502.A O no hydrogen 2.745 N/A MET 507.A N TYR 503.A O no hydrogen 2.819 N/A LYS 508.A N ILE 504.A O no hydrogen 2.902 N/A LYS 508.A NZ SER 505.A O no hydrogen 3.215 N/A VAL 509.A N MET 507.A O no hydrogen 2.735 N/A ILE 510.A N LYS 313.A O no hydrogen 2.852 N/A GLU 515.A N GLU 329.A OE2 no hydrogen 2.757 N/A GLY 516.A N GLU 329.A OE1 no hydrogen 2.853 N/A ARG 517.A N GLU 329.A OE2 no hydrogen 3.490 N/A ARG 517.A NE GLU 515.A OE1 no hydrogen 2.764 N/A ARG 517.A NH1 ASP 338.A OD1 no hydrogen 3.148 N/A ARG 517.A NH1 VAL 424.A O no hydrogen 2.892 N/A ARG 517.A NH2 ASP 338.A OD1 no hydrogen 3.183 N/A ARG 517.A NH2 ASP 338.A OD2 no hydrogen 2.780 N/A ARG 517.A NH2 GLU 515.A OE1 no hydrogen 2.987 N/A ILE 518.A N GLU 329.A OE1 no hydrogen 3.293 N/A LYS 519.A N VAL 429.A O no hydrogen 3.012 N/A SER 521.A N TYR 431.A O no hydrogen 2.935 N/A SER 521.A OG TYR 431.A O no hydrogen 3.334 N/A