Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4d8m_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLN 3.A NE2 ASN 7.A OD1 no hydrogen 3.660 N/A LEU 5.A N LYS 1.A O no hydrogen 2.877 N/A ASN 7.A N GLN 3.A O no hydrogen 3.163 N/A ASN 7.A N LEU 5.A O no hydrogen 2.628 N/A ALA 8.A N GLN 4.A O no hydrogen 3.052 N/A MET 10.A N PHE 6.A O no hydrogen 2.896 N/A ASP 11.A N ASN 7.A O no hydrogen 2.995 N/A ALA 12.A N ALA 8.A O no hydrogen 3.053 N/A VAL 13.A N ILE 9.A O no hydrogen 2.748 N/A ASN 14.A N MET 10.A O no hydrogen 2.881 N/A LYS 15.A N ASP 11.A O no hydrogen 3.208 N/A MET 16.A N ALA 12.A O no hydrogen 2.945 N/A VAL 17.A N VAL 13.A O no hydrogen 2.755 N/A ASP 18.A N ASN 14.A O no hydrogen 3.134 N/A ASN 19.A N LYS 15.A O no hydrogen 3.232 N/A LYS 20.A N MET 16.A O no hydrogen 3.181 N/A PHE 21.A N VAL 17.A O no hydrogen 3.036 N/A LEU 22.A N ASP 18.A O no hydrogen 3.012 N/A SER 23.A N ASN 19.A O no hydrogen 2.914 N/A TYR 24.A N LYS 20.A O no hydrogen 2.747 N/A ASN 25.A N PHE 21.A O no hydrogen 2.798 N/A LEU 26.A N LEU 22.A O no hydrogen 2.947 N/A SER 27.A N SER 23.A O no hydrogen 3.098 N/A THR 28.A N TYR 24.A O no hydrogen 3.009 N/A THR 28.A OG1 ASN 25.A O no hydrogen 2.726 N/A LEU 29.A N ASN 25.A O no hydrogen 2.769 N/A ASN 30.A N LEU 26.A O no hydrogen 2.946 N/A ASN 30.A ND2 LEU 26.A O no hydrogen 3.055 N/A LYS 31.A N SER 27.A O no hydrogen 3.223 N/A THR 32.A N THR 28.A O no hydrogen 2.992 N/A THR 32.A OG1 THR 28.A O no hydrogen 3.365 N/A THR 32.A OG1 GLU 97.A OE1 no hydrogen 2.748 N/A ILE 33.A N LEU 29.A O no hydrogen 3.011 N/A GLU 34.A N ASN 30.A O no hydrogen 3.097 N/A GLY 35.A N LYS 31.A O no hydrogen 2.970 N/A LEU 36.A N THR 32.A O no hydrogen 2.824 N/A GLN 37.A N ILE 33.A O no hydrogen 2.885 N/A GLY 38.A N GLU 34.A O no hydrogen 2.952 N/A ASN 39.A N GLY 35.A O no hydrogen 3.097 N/A LEU 40.A N LEU 36.A O no hydrogen 2.919 N/A GLY 41.A N GLN 37.A O no hydrogen 2.838 N/A LEU 42.A N GLY 38.A O no hydrogen 3.046 N/A PHE 43.A N ASN 39.A O no hydrogen 3.171 N/A GLN 44.A N LEU 40.A O no hydrogen 2.901 N/A ASN 45.A N GLY 41.A O no hydrogen 2.847 N/A ALA 46.A N LEU 42.A O no hydrogen 3.180 N/A ILE 47.A N PHE 43.A O no hydrogen 3.097 N/A GLN 48.A N GLN 44.A O no hydrogen 2.867 N/A GLN 48.A NE2 GLN 44.A OE1 no hydrogen 3.096 N/A VAL 49.A N ASN 45.A O no hydrogen 2.915 N/A ALA 50.A N ALA 46.A O no hydrogen 2.921 N/A ILE 51.A N ILE 47.A O no hydrogen 3.040 N/A CYS 52.A N VAL 49.A O no hydrogen 2.843 N/A GLN 53.A N GLN 48.A O no hydrogen 2.794 N/A CYS 64.A SG ASN 63.A O no hydrogen 3.202 N/A CYS 64.A SG ASP 75.A OD1 no hydrogen 3.436 N/A CYS 67.A SG VAL 49.A O no hydrogen 3.870 N/A CYS 67.A SG ALA 50.A O no hydrogen 3.949 N/A ASN 70.A N ASN 68.A OD1 no hydrogen 2.797 N/A GLN 71.A N ASN 68.A O no hydrogen 2.916 N/A LYS 74.A NZ ASP 78.A OD1 no hydrogen 2.772 N/A LYS 74.A NZ ASP 78.A OD2 no hydrogen 3.499 N/A LEU 77.A N CYS 73.A O no hydrogen 3.106 N/A ASP 78.A N LYS 74.A O no hydrogen 2.741 N/A ARG 79.A N ASP 75.A O no hydrogen 3.373 N/A VAL 80.A N ASP 76.A O no hydrogen 3.062 N/A ALA 81.A N LEU 77.A O no hydrogen 2.842 N/A SER 82.A N ASP 78.A O no hydrogen 2.792 N/A ARG 83.A N ARG 79.A O no hydrogen 2.788 N/A ARG 83.A NH1 LEU 42.A O no hydrogen 3.045 N/A PHE 84.A N VAL 80.A O no hydrogen 2.917 N/A ASP 85.A N ALA 81.A O no hydrogen 2.991 N/A THR 86.A N SER 82.A O no hydrogen 3.050 N/A THR 86.A OG1 ARG 83.A O no hydrogen 3.182 N/A ALA 87.A N ARG 83.A O no hydrogen 3.095 N/A ASN 88.A N PHE 84.A O no hydrogen 2.733 N/A ASN 88.A ND2 TYR 134.A OH no hydrogen 2.863 N/A SER 89.A N ASP 85.A O no hydrogen 2.968 N/A SER 89.A OG THR 86.A O no hydrogen 2.732 N/A GLN 90.A N THR 86.A O no hydrogen 3.052 N/A PHE 91.A N ALA 87.A O no hydrogen 2.995 N/A THR 92.A N ASN 88.A O no hydrogen 2.910 N/A THR 92.A OG1 ASN 88.A O no hydrogen 2.702 N/A THR 92.A OG1 ASN 88.A OD1 no hydrogen 3.249 N/A GLN 93.A N SER 89.A O no hydrogen 2.772 N/A HIS 94.A N GLN 90.A O no hydrogen 2.880 N/A HIS 94.A N PHE 91.A O no hydrogen 3.271 N/A HIS 94.A ND1 GLN 90.A O no hydrogen 3.096 N/A LEU 95.A N PHE 91.A O no hydrogen 2.895 N/A GLU 97.A N HIS 94.A O no hydrogen 2.941 N/A PHE 98.A N LEU 95.A O no hydrogen 2.957 N/A LYS 99.A N PRO 96.A O no hydrogen 3.339 N/A ASP 104.A N SER 107.A OG no hydrogen 2.944 N/A GLU 105.A N GLU 105.A OE1 no hydrogen 2.663 N/A ASN 106.A N ASP 104.A OD1 no hydrogen 2.834 N/A SER 107.A N ASP 104.A O no hydrogen 3.084 N/A SER 107.A OG ASP 18.A OD2 no hydrogen 2.652 N/A SER 107.A OG ASP 104.A O no hydrogen 3.414 N/A SER 107.A OG ASP 104.A OD1 no hydrogen 3.273 N/A PHE 111.A N THR 108.A OG1 no hydrogen 3.041 N/A LYS 112.A N THR 108.A O no hydrogen 3.167 N/A ARG 113.A N GLN 109.A O no hydrogen 2.938 N/A ARG 113.A NE PHE 177.A O no hydrogen 2.812 N/A ARG 113.A NH2 PHE 177.A O no hydrogen 3.365 N/A THR 114.A N GLU 110.A O no hydrogen 2.838 N/A THR 114.A OG1 GLU 110.A O no hydrogen 2.970 N/A THR 114.A OG1 GLU 110.A OE2 no hydrogen 2.820 N/A SER 115.A N PHE 111.A O no hydrogen 2.911 N/A SER 115.A OG PHE 111.A O no hydrogen 2.918 N/A VAL 116.A N LYS 112.A O no hydrogen 3.314 N/A GLU 117.A N ARG 113.A O no hydrogen 2.881 N/A LEU 118.A N THR 114.A O no hydrogen 2.949 N/A THR 119.A N SER 115.A O no hydrogen 2.991 N/A THR 119.A OG1 SER 115.A O no hydrogen 2.720 N/A LEU 120.A N VAL 116.A O no hydrogen 2.932 N/A MET 122.A N THR 119.A O no hydrogen 2.862 N/A TYR 123.A N THR 119.A O no hydrogen 2.845 N/A THR 124.A N LEU 120.A O no hydrogen 2.797 N/A THR 124.A OG1 LEU 120.A O no hydrogen 2.856 N/A THR 125.A N PRO 121.A O no hydrogen 3.014 N/A THR 125.A OG1 PRO 121.A O no hydrogen 3.029 N/A VAL 126.A N MET 122.A O no hydrogen 2.942 N/A ALA 127.A N TYR 123.A O no hydrogen 2.860 N/A THR 128.A N THR 124.A O no hydrogen 3.079 N/A THR 128.A OG1 THR 124.A O no hydrogen 2.832 N/A LEU 129.A N THR 125.A O no hydrogen 3.153 N/A HIS 130.A N VAL 126.A O no hydrogen 2.933 N/A HIS 130.A ND1 TYR 166.A OH no hydrogen 2.666 N/A HIS 130.A NE2 ASN 88.A OD1 no hydrogen 2.650 N/A LEU 131.A N ALA 127.A O no hydrogen 2.898 N/A LEU 132.A N THR 128.A O no hydrogen 2.871 N/A LEU 133.A N LEU 129.A O no hydrogen 2.909 N/A TYR 134.A N HIS 130.A O no hydrogen 3.061 N/A TYR 134.A OH GLU 158.A OE1 no hydrogen 2.586 N/A GLU 135.A N LEU 131.A O no hydrogen 2.858 N/A GLY 136.A N LEU 132.A O no hydrogen 2.896 N/A TYR 137.A N LEU 133.A O no hydrogen 3.026 N/A ILE 138.A N TYR 134.A O no hydrogen 2.897 N/A GLU 139.A N GLU 135.A O no hydrogen 2.946 N/A PHE 140.A N GLY 136.A O no hydrogen 2.947 N/A MET 141.A N TYR 137.A O no hydrogen 2.905 N/A THR 142.A N ILE 138.A O no hydrogen 2.910 N/A THR 142.A OG1 ILE 138.A O no hydrogen 2.567 N/A LYS 143.A N GLU 139.A O no hydrogen 2.967 N/A TRP 144.A N PHE 140.A O no hydrogen 3.224 N/A ASN 145.A N THR 142.A O no hydrogen 3.116 N/A PHE 146.A N MET 141.A O no hydrogen 3.072 N/A TYR 151.A N ASN 148.A OD1 no hydrogen 2.832 N/A LEU 152.A N ASN 148.A O no hydrogen 3.028 N/A ASN 153.A N GLU 149.A O no hydrogen 2.780 N/A ASN 154.A N GLN 150.A O no hydrogen 3.049 N/A ASN 154.A ND2 GLU 158.A OE2 no hydrogen 2.959 N/A LEU 155.A N TYR 151.A O no hydrogen 3.088 N/A LYS 156.A N LEU 152.A O no hydrogen 3.040 N/A LYS 156.A NZ HIS 216.A ND1 no hydrogen 3.457 N/A VAL 157.A N ASN 153.A O no hydrogen 2.906 N/A GLU 158.A N ASN 154.A O no hydrogen 2.878 N/A LEU 159.A N LEU 155.A O no hydrogen 2.986 N/A GLN 160.A N LYS 156.A O no hydrogen 3.013 N/A GLN 161.A N VAL 157.A O no hydrogen 2.859 N/A LEU 162.A N GLU 158.A O no hydrogen 2.965 N/A ILE 163.A N LEU 159.A O no hydrogen 2.941 N/A HIS 164.A N GLN 160.A O no hydrogen 3.002 N/A HIS 164.A ND1 GLY 538.A O no hydrogen 2.770 N/A SER 165.A N GLN 161.A O no hydrogen 2.807 N/A TYR 166.A N LEU 162.A O no hydrogen 2.743 N/A TYR 166.A OH HIS 130.A ND1 no hydrogen 2.666 N/A SER 167.A N ILE 163.A O no hydrogen 3.076 N/A SER 167.A OG ILE 163.A O no hydrogen 2.782 N/A GLU 168.A N HIS 164.A O no hydrogen 3.216 N/A THR 169.A N SER 165.A O no hydrogen 3.147 N/A VAL 170.A N TYR 166.A O no hydrogen 3.071 N/A ARG 171.A N SER 167.A O no hydrogen 2.807 N/A ARG 171.A NE GLU 168.A OE1 no hydrogen 2.778 N/A ARG 171.A NH1 GLU 542.A OE2 no hydrogen 2.893 N/A ARG 171.A NH2 GLU 168.A OE1 no hydrogen 3.502 N/A ARG 171.A NH2 GLU 168.A OE2 no hydrogen 2.990 N/A THR 172.A N GLU 168.A O no hydrogen 2.843 N/A THR 172.A OG1 GLU 168.A O no hydrogen 2.762 N/A THR 172.A OG1 THR 169.A O no hydrogen 3.479 N/A SER 173.A N THR 169.A O no hydrogen 2.981 N/A SER 173.A OG THR 169.A O no hydrogen 2.804 N/A PHE 174.A N VAL 170.A O no hydrogen 3.043 N/A LEU 175.A N ARG 171.A O no hydrogen 3.040 N/A GLN 176.A N THR 172.A O no hydrogen 2.882 N/A PHE 177.A N PHE 174.A O no hydrogen 3.349 N/A LEU 178.A N LEU 175.A O no hydrogen 3.260 N/A ASN 182.A N SER 188.A OG no hydrogen 2.858 N/A ASN 183.A ND2 SER 274.A OG no hydrogen 2.835 N/A ARG 184.A N ASN 182.A OD1 no hydrogen 2.988 N/A SER 185.A N ASN 182.A O no hydrogen 3.107 N/A LYS 186.A N SER 253.A O no hydrogen 3.055 N/A LYS 186.A NZ ILE 238.A O no hydrogen 2.966 N/A LYS 186.A NZ TYR 241.A OH no hydrogen 2.656 N/A LYS 186.A NZ GLU 407.A OE1 no hydrogen 2.810 N/A LYS 186.A NZ GLU 407.A OE2 no hydrogen 3.366 N/A SER 187.A OG SER 185.A OG no hydrogen 3.130 N/A SER 188.A N SER 185.A OG no hydrogen 3.014 N/A VAL 189.A N SER 185.A O no hydrogen 2.862 N/A ASN 190.A N LYS 186.A O no hydrogen 2.986 N/A ASN 190.A ND2 THR 234.A OG1 no hydrogen 3.076 N/A ALA 191.A N SER 187.A O no hydrogen 2.945 N/A TYR 192.A N SER 188.A O no hydrogen 2.964 N/A ASN 193.A N VAL 189.A O no hydrogen 3.047 N/A ARG 194.A N ASN 190.A O no hydrogen 2.825 N/A ARG 194.A NH1 GLU 117.A OE2 no hydrogen 3.089 N/A TYR 195.A N ALA 191.A O no hydrogen 3.178 N/A TYR 195.A OH PHE 174.A O no hydrogen 2.647 N/A VAL 196.A N TYR 192.A O no hydrogen 3.043 N/A ARG 197.A N ASN 193.A O no hydrogen 2.794 N/A ARG 197.A NH1 LEU 231.A O no hydrogen 2.682 N/A ARG 197.A NH1 ASP 233.A OD1 no hydrogen 3.519 N/A ARG 197.A NH2 ASP 233.A OD1 no hydrogen 2.766 N/A ASN 198.A N ARG 194.A O no hydrogen 2.932 N/A MET 199.A N TYR 195.A O no hydrogen 2.955 N/A THR 200.A N VAL 196.A O no hydrogen 2.878 N/A THR 200.A OG1 VAL 196.A O no hydrogen 2.606 N/A VAL 201.A N ARG 197.A O no hydrogen 3.156 N/A ASN 202.A N ASN 198.A O no hydrogen 2.846 N/A CYS 203.A N MET 199.A O no hydrogen 2.895 N/A LEU 204.A N MET 199.A O no hydrogen 2.939 N/A ASP 205.A N THR 200.A O no hydrogen 2.756 N/A ALA 207.A N CYS 203.A O no hydrogen 2.837 N/A ALA 208.A N LEU 204.A O no hydrogen 2.850 N/A THR 209.A N ILE 206.A O no hydrogen 2.861 N/A THR 209.A OG1 ILE 206.A O no hydrogen 2.575 N/A TRP 210.A N ALA 207.A O no hydrogen 2.946 N/A TRP 210.A NE1 THR 128.A OG1 no hydrogen 2.984 N/A THR 212.A N THR 209.A O no hydrogen 2.903 N/A THR 212.A OG1 THR 209.A O no hydrogen 2.650 N/A PHE 213.A N TRP 210.A O no hydrogen 2.866 N/A ASP 214.A N PRO 211.A O no hydrogen 3.143 N/A THR 215.A OG1 GLU 139.A OE2 no hydrogen 2.899 N/A ASN 217.A N ASP 214.A O no hydrogen 2.969 N/A ASN 217.A N ASP 214.A OD1 no hydrogen 3.439 N/A ASN 217.A ND2 ASP 214.A OD2 no hydrogen 2.807 N/A TYR 218.A N ASP 214.A O no hydrogen 2.870 N/A TYR 218.A OH GLU 579.A OE2 no hydrogen 2.625 N/A GLY 221.A N TYR 218.A O no hydrogen 2.948 N/A LYS 223.A N LEU 448.A O no hydrogen 3.033 N/A ASP 225.A N GLY 450.A O no hydrogen 2.985 N/A THR 227.A N GLY 474.A O no hydrogen 3.138 N/A THR 227.A OG1 GLU 454.A OE1 no hydrogen 2.733 N/A ARG 228.A N GLY 474.A O no hydrogen 3.100 N/A ARG 228.A NE ASP 205.A OD1 no hydrogen 2.839 N/A ARG 228.A NH1 ARG 228.A O no hydrogen 2.758 N/A ARG 228.A NH2 ASP 205.A OD2 no hydrogen 2.799 N/A SER 232.A N SER 421.A O no hydrogen 2.880 N/A SER 232.A OG ASP 233.A O no hydrogen 2.818 N/A ASP 233.A N ASN 391.A OD1 no hydrogen 2.854 N/A THR 234.A N ASN 190.A OD1 no hydrogen 2.911 N/A ALA 235.A N VAL 419.A O no hydrogen 2.865 N/A GLY 236.A N GLU 239.A OE2 no hydrogen 3.017 N/A ILE 238.A N GLU 407.A OE1 no hydrogen 3.371 N/A TYR 241.A OH GLU 407.A OE2 no hydrogen 2.682 N/A THR 243.A OG1 THR 242.A O no hydrogen 2.583 N/A GLY 244.A N TYR 241.A O no hydrogen 2.841 N/A ASP 245.A N ASP 245.A OD1 no hydrogen 2.646 N/A LYS 246.A N ASN 410.A OD1 no hydrogen 2.869 N/A THR 247.A N ASN 410.A OD1 no hydrogen 2.883 N/A THR 247.A OG1 SER 253.A OG no hydrogen 2.947 N/A GLY 249.A N THR 247.A OG1 no hydrogen 3.376 N/A GLU 251.A N GLU 251.A OE1 no hydrogen 2.750 N/A HIS 252.A N GLY 249.A O no hydrogen 2.585 N/A SER 253.A N PRO 250.A O no hydrogen 3.207 N/A SER 253.A OG THR 247.A OG1 no hydrogen 2.947 N/A SER 253.A OG GLU 407.A OE2 no hydrogen 2.512 N/A ASN 254.A N THR 408.A OG1 no hydrogen 2.918 N/A ILE 255.A N ARG 184.A O no hydrogen 2.706 N/A THR 256.A N THR 406.A O no hydrogen 2.876 N/A ASN 258.A N PRO 404.A O no hydrogen 2.657 N/A ASN 258.A ND2 THR 256.A O no hydrogen 2.924 N/A ASN 259.A N SER 271.A O no hydrogen 2.918 N/A ILE 260.A N ASN 258.A O no hydrogen 2.966 N/A ASP 262.A N ASN 259.A O no hydrogen 2.988 N/A THR 263.A OG1 ASP 262.A OD1 no hydrogen 3.274 N/A SER 265.A OG ASP 317.A OD2 no hydrogen 2.565 N/A HIS 270.A ND1 ASP 262.A OD1 no hydrogen 2.716 N/A HIS 270.A NE2 ASP 317.A O no hydrogen 2.683 N/A SER 271.A N ASP 262.A OD2 no hydrogen 3.221 N/A SER 271.A OG ASP 262.A OD2 no hydrogen 3.432 N/A VAL 273.A N PRO 257.A O no hydrogen 3.080 N/A SER 274.A OG ASP 276.A OD1 no hydrogen 2.635 N/A SER 277.A N SER 274.A O no hydrogen 2.732 N/A SER 277.A OG SER 274.A O no hydrogen 2.732 N/A ILE 278.A N VAL 275.A O no hydrogen 3.407 N/A SER 281.A OG ASN 400.A OD1 no hydrogen 2.683 N/A ARG 282.A NE TYR 456.A O no hydrogen 3.145 N/A ARG 282.A NH1 ASN 461.A OD1 no hydrogen 3.269 N/A ARG 282.A NH2 TYR 456.A O no hydrogen 2.958 N/A ARG 282.A NH2 ASN 461.A OD1 no hydrogen 2.551 N/A LYS 283.A N SER 281.A OG no hydrogen 2.956 N/A LYS 283.A NZ ASP 312.A OD2 no hydrogen 2.785 N/A LYS 283.A NZ SER 314.A OG no hydrogen 3.422 N/A GLN 286.A N SER 309.A O no hydrogen 2.754 N/A GLN 287.A N SER 309.A O no hydrogen 3.277 N/A GLN 287.A NE2 ASP 289.A OD1 no hydrogen 3.103 N/A GLN 287.A NE2 ASP 289.A OD2 no hydrogen 3.520 N/A LEU 288.A N TYR 337.A O no hydrogen 2.819 N/A ASP 289.A N ARG 307.A O no hydrogen 3.031 N/A ILE 290.A N ASN 335.A O no hydrogen 3.044 N/A ALA 291.A N GLY 305.A O no hydrogen 2.773 N/A THR 292.A N CYS 333.A O no hydrogen 2.932 N/A TYR 293.A N HIS 302.A O no hydrogen 2.809 N/A SER 294.A N ASN 331.A O no hydrogen 2.694 N/A SER 294.A OG THR 295.A O no hydrogen 3.088 N/A ASN 297.A ND2 SER 298.A O no hydrogen 3.111 N/A ASN 297.A ND2 ASN 299.A OD1 no hydrogen 3.197 N/A ASN 299.A N SER 298.A OG no hydrogen 2.702 N/A ASN 300.A N SER 298.A O no hydrogen 2.740 N/A CYS 301.A SG SER 294.A OG no hydrogen 3.751 N/A HIS 302.A N TYR 293.A O no hydrogen 2.921 N/A HIS 302.A ND1 PRO 303.A O no hydrogen 2.846 N/A TYR 304.A N ALA 291.A O no hydrogen 2.796 N/A GLY 305.A N ALA 291.A O no hydrogen 3.509 N/A LEU 306.A N TYR 318.A O no hydrogen 2.902 N/A ARG 307.A N ASP 289.A O no hydrogen 2.806 N/A ARG 307.A NE ASP 317.A OD1 no hydrogen 2.694 N/A ARG 307.A NH2 ASP 317.A OD2 no hydrogen 2.999 N/A LEU 308.A N TYR 316.A O no hydrogen 2.827 N/A SER 309.A N GLN 287.A O no hydrogen 3.026 N/A TYR 310.A N SER 314.A O no hydrogen 2.881 N/A TYR 310.A OH ASN 400.A O no hydrogen 2.775 N/A THR 311.A N GLU 284.A O no hydrogen 2.987 N/A GLY 313.A N TYR 310.A O no hydrogen 2.860 N/A SER 314.A N ASP 312.A OD1 no hydrogen 2.909 N/A SER 314.A OG ASP 312.A OD1 no hydrogen 2.664 N/A SER 314.A OG ASP 312.A OD2 no hydrogen 3.453 N/A TYR 316.A N LEU 308.A O no hydrogen 2.944 N/A TYR 318.A N LEU 306.A O no hydrogen 2.979 N/A GLY 319.A N TYR 268.A O no hydrogen 3.238 N/A ASP 320.A N TYR 304.A O no hydrogen 3.150 N/A ASP 324.A N TYR 304.A OH no hydrogen 3.090 N/A THR 326.A N ASP 324.A OD1 no hydrogen 3.281 N/A THR 326.A OG1 ASP 324.A OD1 no hydrogen 3.551 N/A THR 327.A OG1 ASP 324.A OD1 no hydrogen 3.273 N/A THR 327.A OG1 ASP 324.A OD2 no hydrogen 2.987 N/A THR 327.A OG1 THR 326.A O no hydrogen 2.676 N/A ASN 331.A N ASN 329.A OD1 no hydrogen 2.494 N/A TYR 332.A N ASN 329.A OD1 no hydrogen 2.682 N/A CYS 333.A N THR 292.A O no hydrogen 3.177 N/A CYS 333.A SG CYS 374.A O no hydrogen 3.257 N/A ASN 335.A N ILE 290.A O no hydrogen 3.065 N/A SER 336.A OG ASP 289.A OD2 no hydrogen 2.418 N/A TYR 337.A N LEU 288.A O no hydrogen 2.842 N/A TYR 337.A OH SER 371.A OG no hydrogen 2.851 N/A ALA 339.A N GLN 286.A O no hydrogen 2.930 N/A THR 342.A N SER 365.A O no hydrogen 2.881 N/A THR 342.A OG1 SER 365.A O no hydrogen 3.236 N/A THR 342.A OG1 THR 366.A O no hydrogen 3.311 N/A ASN 345.A N VAL 363.A O no hydrogen 3.040 N/A ASN 345.A ND2 ASN 391.A O no hydrogen 2.953 N/A ALA 346.A N SER 389.A OG no hydrogen 2.846 N/A ARG 347.A N SER 361.A O no hydrogen 2.933 N/A ARG 347.A NH1 ASP 377.A OD1 no hydrogen 2.863 N/A ARG 347.A NH1 ASN 381.A OD1 no hydrogen 3.159 N/A ARG 347.A NH2 ASN 381.A OD1 no hydrogen 2.962 N/A HIS 348.A N GLN 387.A O no hydrogen 2.925 N/A HIS 348.A ND1 VAL 359.A O no hydrogen 3.248 N/A LEU 349.A N VAL 359.A O no hydrogen 2.594 N/A TYR 350.A N GLU 240.A OE1 no hydrogen 2.683 N/A TYR 350.A OH LYS 411.A O no hydrogen 2.734 N/A ASN 351.A N GLN 357.A O no hydrogen 2.799 N/A ALA 352.A N THR 243.A OG1 no hydrogen 2.736 N/A GLN 357.A N ASN 351.A O no hydrogen 2.645 N/A ASN 358.A N ASN 299.A O no hydrogen 3.210 N/A ASN 358.A ND2 ASN 416.A OD1 no hydrogen 3.061 N/A VAL 359.A N LEU 349.A O no hydrogen 2.668 N/A GLU 360.A N CYS 301.A O no hydrogen 3.053 N/A SER 361.A N ARG 347.A O no hydrogen 2.855 N/A SER 361.A OG ASP 377.A OD1 no hydrogen 2.694 N/A LEU 362.A N SER 373.A OG no hydrogen 2.632 N/A VAL 363.A N ASN 345.A O no hydrogen 2.720 N/A VAL 364.A N SER 371.A O no hydrogen 2.481 N/A SER 365.A N LEU 343.A O no hydrogen 2.798 N/A THR 366.A N GLY 369.A O no hydrogen 2.982 N/A SER 371.A OG TYR 337.A OH no hydrogen 2.851 N/A SER 371.A OG GLY 372.A O no hydrogen 2.886 N/A GLY 372.A N LEU 362.A O no hydrogen 3.321 N/A SER 373.A N SER 361.A OG no hydrogen 3.104 N/A SER 373.A OG LEU 362.A O no hydrogen 3.415 N/A CYS 376.A N CYS 374.A O no hydrogen 2.957 N/A CYS 376.A SG CYS 374.A O no hydrogen 3.933 N/A ASP 377.A N SER 373.A O no hydrogen 3.120 N/A TRP 379.A N ILE 375.A O no hydrogen 3.391 N/A ILE 380.A N CYS 376.A O no hydrogen 2.975 N/A ASN 381.A N ASP 377.A O no hydrogen 3.076 N/A TYR 382.A N ALA 378.A O no hydrogen 3.014 N/A LEU 383.A N TRP 379.A O no hydrogen 2.827 N/A ARG 384.A NH1 GLN 357.A OE1 no hydrogen 2.851 N/A ARG 384.A NH2 GLU 240.A OE1 no hydrogen 3.017 N/A GLN 387.A N HIS 348.A O no hydrogen 3.173 N/A SER 389.A N ALA 346.A O no hydrogen 2.934 N/A SER 389.A OG ASN 345.A OD1 no hydrogen 2.548 N/A LYS 390.A NZ THR 388.A OG1 no hydrogen 2.697 N/A ASN 391.A N ASN 345.A OD1 no hydrogen 2.771 N/A ASN 391.A ND2 ASP 233.A O no hydrogen 3.217 N/A ASN 391.A ND2 VAL 344.A O no hydrogen 2.989 N/A ARG 394.A NE ASP 396.A OD1 no hydrogen 3.271 N/A ARG 394.A NH2 ASP 396.A OD1 no hydrogen 3.474 N/A ARG 394.A NH2 ASP 396.A OD2 no hydrogen 3.260 N/A GLN 397.A N ARG 394.A O no hydrogen 2.997 N/A LYS 398.A N VAL 424.A O no hydrogen 2.903 N/A LYS 398.A NZ GLU 284.A OE1 no hydrogen 3.199 N/A LYS 398.A NZ GLU 284.A OE2 no hydrogen 2.825 N/A LYS 398.A NZ MET 426.A O no hydrogen 2.855 N/A LYS 398.A NZ LEU 428.A O no hydrogen 2.783 N/A ILE 399.A N ILE 341.A O no hydrogen 2.769 N/A ASN 400.A N ALA 422.A O no hydrogen 2.828 N/A ASN 400.A ND2 LYS 283.A O no hydrogen 2.833 N/A TYR 403.A N ILE 420.A O no hydrogen 2.857 N/A ILE 405.A N GLY 418.A O no hydrogen 2.819 N/A THR 406.A N THR 256.A O no hydrogen 3.231 N/A THR 408.A N ASN 254.A O no hydrogen 3.028 N/A ASN 410.A ND2 THR 247.A O no hydrogen 3.029 N/A LYS 411.A N ASP 245.A OD1 no hydrogen 2.722 N/A THR 413.A N ASN 410.A O no hydrogen 2.772 N/A THR 413.A OG1 ASN 410.A O no hydrogen 2.700 N/A ASN 416.A N THR 413.A O no hydrogen 2.826 N/A ASN 416.A ND2 PRO 237.A O no hydrogen 3.069 N/A ASN 416.A ND2 ASN 358.A OD1 no hydrogen 3.055 N/A LEU 417.A N PRO 303.A O no hydrogen 3.006 N/A VAL 419.A N ALA 235.A O no hydrogen 2.805 N/A ILE 420.A N TYR 403.A O no hydrogen 2.783 N/A SER 421.A N SER 232.A OG no hydrogen 2.803 N/A ALA 422.A N VAL 401.A O no hydrogen 2.892 N/A TYR 423.A N ILE 230.A O no hydrogen 2.821 N/A VAL 424.A N LYS 398.A O no hydrogen 2.949 N/A MET 426.A N ASP 396.A O no hydrogen 2.868 N/A GLU 427.A N GLU 427.A OE2 no hydrogen 2.760 N/A LEU 428.A N PRO 425.A O no hydrogen 2.962 N/A ASN 432.A ND2 LYS 455.A O no hydrogen 3.568 N/A ASN 432.A ND2 GLN 489.A O no hydrogen 3.071 N/A ILE 434.A N THR 491.A O no hydrogen 2.891 N/A ASN 438.A N LEU 443.A O no hydrogen 2.580 N/A THR 441.A OG1 ASN 438.A OD1 no hydrogen 3.478 N/A LYS 442.A N ASP 440.A O no hydrogen 2.398 N/A LYS 442.A NZ ALA 439.A O no hydrogen 2.684 N/A LEU 445.A N ASP 436.A O no hydrogen 2.751 N/A THR 446.A OG1 GLN 220.A OE1 no hydrogen 3.071 N/A GLN 447.A NE2 GLN 220.A O no hydrogen 3.136 N/A LYS 449.A N PHE 580.A O no hydrogen 3.086 N/A LYS 449.A NZ VAL 433.A O no hydrogen 3.196 N/A LYS 449.A NZ ASP 436.A OD2 no hydrogen 3.351 N/A GLY 450.A N LYS 223.A O no hydrogen 3.076 N/A PHE 451.A N ILE 578.A O no hydrogen 2.834 N/A PHE 453.A N ASP 576.A O no hydrogen 3.051 N/A LYS 455.A N PRO 452.A O no hydrogen 3.019 N/A LYS 455.A NZ ASP 225.A OD2 no hydrogen 2.707 N/A LYS 455.A NZ VAL 429.A O no hydrogen 2.774 N/A LYS 455.A NZ GLU 431.A O no hydrogen 2.972 N/A LYS 455.A NZ ASN 432.A OD1 no hydrogen 2.712 N/A GLY 457.A N GLY 487.A O no hydrogen 2.857 N/A GLU 459.A N TYR 562.A OH no hydrogen 3.054 N/A TYR 460.A N GLY 457.A O no hydrogen 3.073 N/A TYR 460.A OH HIS 564.A ND1 no hydrogen 2.612 N/A ASN 461.A N SER 458.A O no hydrogen 2.886 N/A ARG 463.A N TYR 460.A O no hydrogen 3.147 N/A VAL 468.A N ALA 477.A O no hydrogen 2.867 N/A GLU 470.A N ASN 475.A O no hydrogen 2.924 N/A ASN 473.A N GLU 470.A O no hydrogen 2.955 N/A GLY 474.A N TRP 471.A O no hydrogen 3.345 N/A ASN 475.A ND2 ASP 576.A OD1 no hydrogen 2.969 N/A ASN 476.A N GLU 454.A OE1 no hydrogen 2.948 N/A ASN 476.A ND2 GLU 454.A OE2 no hydrogen 3.050 N/A ALA 477.A N VAL 468.A O no hydrogen 2.686 N/A VAL 478.A N LEU 575.A O no hydrogen 2.832 N/A LYS 479.A N SER 466.A O no hydrogen 2.988 N/A LEU 480.A N LEU 573.A O no hydrogen 2.832 N/A SER 481.A N GLN 484.A OE1 no hydrogen 2.781 N/A SER 481.A OG ASP 572.A OD1 no hydrogen 2.781 N/A SER 483.A N ASN 567.A O no hydrogen 2.645 N/A GLN 484.A N SER 481.A O no hydrogen 2.982 N/A SER 485.A OG ILE 565.A O no hydrogen 3.534 N/A SER 485.A OG THR 566.A OG1 no hydrogen 2.511 N/A VAL 486.A N ILE 565.A O no hydrogen 2.917 N/A ILE 488.A N VAL 563.A O no hydrogen 3.020 N/A ILE 490.A N PHE 561.A O no hydrogen 2.763 N/A THR 491.A N ASN 432.A O no hydrogen 2.934 N/A ASN 492.A N GLY 559.A O no hydrogen 2.622 N/A ASN 492.A ND2 THR 494.A O no hydrogen 3.103 N/A ASN 492.A ND2 PRO 557.A O no hydrogen 2.923 N/A GLN 493.A N ILE 434.A O no hydrogen 2.771 N/A THR 494.A N ASN 492.A OD1 no hydrogen 3.073 N/A THR 494.A OG1 GLY 435.A O no hydrogen 2.716 N/A LYS 495.A NZ GLU 555.A OE2 no hydrogen 3.122 N/A GLN 496.A N ILE 556.A O no hydrogen 3.178 N/A GLN 496.A NE2 TYR 498.A OH no hydrogen 2.862 N/A TYR 498.A N VAL 554.A O no hydrogen 2.798 N/A TYR 498.A OH ASN 492.A OD1 no hydrogen 2.763 N/A TYR 498.A OH THR 494.A O no hydrogen 3.415 N/A GLU 499.A N VAL 581.A O no hydrogen 2.798 N/A ILE 500.A N THR 552.A O no hydrogen 2.718 N/A ARG 501.A N GLU 579.A O no hydrogen 2.913 N/A ARG 501.A NH1 ASN 217.A O no hydrogen 2.996 N/A ARG 501.A NH1 GLU 579.A OE1 no hydrogen 2.945 N/A ARG 501.A NH2 ASN 217.A O no hydrogen 2.342 N/A CYS 502.A N LYS 549.A O no hydrogen 2.827 N/A ARG 503.A N ARG 577.A O no hydrogen 2.882 N/A ARG 503.A NH1 ASN 473.A OD1 no hydrogen 2.859 N/A ARG 503.A NH1 ASP 576.A OD2 no hydrogen 2.797 N/A TYR 504.A N ILE 547.A O no hydrogen 3.070 N/A TYR 504.A OH GLY 530.A O no hydrogen 2.601 N/A ALA 505.A N PHE 574.A O no hydrogen 2.741 N/A ASN 510.A N PHE 529.A O no hydrogen 2.963 N/A ASN 510.A ND2 SER 571.A O no hydrogen 3.033 N/A VAL 512.A N ILE 527.A O no hydrogen 2.732 N/A TYR 513.A N THR 566.A O no hydrogen 2.841 N/A PHE 514.A N ASN 525.A O no hydrogen 2.968 N/A ASN 515.A N HIS 564.A O no hydrogen 2.810 N/A VAL 516.A N PHE 523.A O no hydrogen 2.639 N/A ASP 517.A N TYR 562.A O no hydrogen 2.944 N/A LEU 518.A N VAL 516.A O no hydrogen 2.751 N/A PHE 523.A N VAL 516.A O no hydrogen 3.146 N/A ASN 525.A N PHE 514.A O no hydrogen 3.231 N/A SER 526.A OG GLN 568.A OE1 no hydrogen 2.727 N/A ILE 527.A N VAL 512.A O no hydrogen 2.793 N/A PHE 529.A N ASN 510.A O no hydrogen 2.707 N/A SER 531.A N ASP 509.A OD2 no hydrogen 2.795 N/A SER 531.A OG SER 506.A O no hydrogen 3.552 N/A THR 532.A N SER 506.A O no hydrogen 2.905 N/A THR 532.A OG1 LYS 545.A O no hydrogen 3.278 N/A SER 535.A N THR 532.A O no hydrogen 3.041 N/A GLY 538.A N SER 535.A OG no hydrogen 2.820 N/A VAL 539.A N TYR 546.A O no hydrogen 3.121 N/A GLY 541.A N GLY 544.A O no hydrogen 2.811 N/A GLU 542.A N GLU 470.A OE1 no hydrogen 2.820 N/A ASN 543.A N GLU 470.A OE2 no hydrogen 3.049 N/A ASN 543.A ND2 GLU 470.A OE2 no hydrogen 2.855 N/A LYS 545.A NZ GLU 533.A O no hydrogen 3.069 N/A LYS 545.A NZ SER 535.A O no hydrogen 2.932 N/A TYR 546.A N VAL 539.A O no hydrogen 2.730 N/A TYR 546.A OH GLU 470.A OE2 no hydrogen 2.691 N/A ILE 547.A N TYR 504.A O no hydrogen 3.156 N/A LYS 549.A N CYS 502.A O no hydrogen 2.710 N/A LYS 549.A NZ SER 528.A O no hydrogen 3.440 N/A SER 550.A OG GLU 499.A OE2 no hydrogen 2.511 N/A ILE 551.A N ILE 500.A O no hydrogen 2.746 N/A THR 552.A N ILE 500.A O no hydrogen 3.368 N/A VAL 554.A N TYR 498.A O no hydrogen 2.897 N/A ILE 556.A N GLN 496.A O no hydrogen 2.721 N/A GLY 559.A N ASN 492.A O no hydrogen 2.718 N/A PHE 561.A N ILE 490.A O no hydrogen 2.878 N/A VAL 563.A N ILE 488.A O no hydrogen 2.954 N/A HIS 564.A N ASN 515.A O no hydrogen 2.780 N/A HIS 564.A ND1 TYR 460.A OH no hydrogen 2.612 N/A ILE 565.A N VAL 486.A O no hydrogen 2.856 N/A THR 566.A N TYR 513.A O no hydrogen 2.965 N/A THR 566.A OG1 SER 485.A OG no hydrogen 2.511 N/A ASN 567.A N GLN 484.A O no hydrogen 2.961 N/A ASN 567.A ND2 LEU 480.A O no hydrogen 2.937 N/A ASN 567.A ND2 SER 571.A O no hydrogen 2.902 N/A GLN 568.A N ASN 511.A O no hydrogen 2.795 N/A GLY 569.A N ASN 567.A OD1 no hydrogen 2.888 N/A SER 571.A N ASN 510.A OD1 no hydrogen 2.944 N/A LEU 573.A N LEU 480.A O no hydrogen 2.859 N/A PHE 574.A N ALA 505.A O no hydrogen 2.891 N/A LEU 575.A N VAL 478.A O no hydrogen 2.779 N/A ASP 576.A N ARG 503.A O no hydrogen 2.937 N/A ARG 577.A NE GLU 579.A OE2 no hydrogen 2.696 N/A ARG 577.A NH2 TYR 218.A OH no hydrogen 3.390 N/A ARG 577.A NH2 GLU 579.A OE2 no hydrogen 3.533 N/A ILE 578.A N PHE 451.A O no hydrogen 2.982 N/A GLU 579.A N ARG 501.A O no hydrogen 2.885 N/A PHE 580.A N LYS 449.A O no hydrogen 3.017 N/A VAL 581.A N GLU 499.A O no hydrogen 2.903 N/A LYS 583.A N LYS 497.A O no hydrogen 3.062 N/A