Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4v2r_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): SER 1.A OG GLU 242.A OE1 no hydrogen 3.568 N/A HIS 2.A N GLU 242.A OE1 no hydrogen 2.700 N/A HIS 2.A ND1 GLU 242.A OE1 no hydrogen 2.678 N/A HIS 2.A NE2 GLU 210.A OE2 no hydrogen 2.551 N/A VAL 3.A N SER 1.A OG no hydrogen 3.128 N/A LYS 4.A N SER 1.A O no hydrogen 2.990 N/A ASP 5.A N SER 1.A O no hydrogen 3.356 N/A ILE 6.A N HIS 2.A O no hydrogen 2.934 N/A LEU 7.A N VAL 3.A O no hydrogen 3.040 N/A GLY 8.A N LYS 4.A O no hydrogen 2.839 N/A LEU 9.A N ASP 5.A O no hydrogen 2.967 N/A ILE 10.A N ILE 6.A O no hydrogen 2.848 N/A ASN 11.A N LEU 7.A O no hydrogen 2.905 N/A ALA 12.A N GLY 8.A O no hydrogen 2.953 N/A PHE 13.A N LEU 9.A O no hydrogen 2.880 N/A ASN 14.A N ILE 10.A O no hydrogen 2.971 N/A GLU 15.A N ASN 11.A O no hydrogen 2.841 N/A VAL 16.A N ALA 12.A O no hydrogen 3.044 N/A ILE 19.A N LYS 42.A O no hydrogen 2.734 N/A VAL 21.A N ALA 44.A O no hydrogen 2.778 N/A THR 24.A N ASP 22.A OD1 no hydrogen 2.774 N/A THR 25.A N ASP 22.A OD1 no hydrogen 2.770 N/A THR 25.A OG1 ASP 22.A OD1 no hydrogen 3.398 N/A THR 25.A OG1 ASP 22.A OD2 no hydrogen 2.559 N/A ILE 27.A N ASN 303.A OD1 no hydrogen 2.891 N/A THR 28.A N HIS 31.A ND1 no hydrogen 3.061 N/A VAL 29.A N GLU 299.A OE2 no hydrogen 2.945 N/A HIS 31.A N THR 28.A OG1 no hydrogen 3.242 N/A VAL 32.A N THR 28.A O no hydrogen 3.036 N/A ALA 33.A N VAL 29.A O no hydrogen 2.870 N/A ALA 34.A N ALA 30.A O no hydrogen 2.776 N/A LEU 35.A N HIS 31.A O no hydrogen 3.076 N/A ALA 36.A N VAL 32.A O no hydrogen 3.074 N/A ARG 37.A N ALA 33.A O no hydrogen 3.049 N/A ARG 37.A N ALA 34.A O no hydrogen 3.312 N/A ARG 37.A NH1 ASP 201.A OD1 no hydrogen 2.718 N/A ARG 37.A NH2 ASP 201.A OD1 no hydrogen 3.532 N/A ARG 37.A NH2 ASP 201.A OD2 no hydrogen 2.893 N/A ARG 38.A N ALA 34.A O no hydrogen 2.878 N/A ARG 38.A NH1 PHE 13.A O no hydrogen 2.767 N/A ARG 38.A NH1 VAL 16.A O no hydrogen 2.995 N/A ARG 38.A NH2 VAL 16.A O no hydrogen 3.242 N/A ARG 38.A NH2 ASP 40.A OD2 no hydrogen 3.205 N/A VAL 41.A N ARG 38.A O no hydrogen 3.222 N/A LYS 42.A N LYS 17.A O no hydrogen 3.101 N/A LYS 42.A NZ ASN 122.A O no hydrogen 2.985 N/A VAL 43.A N ASN 122.A OD1 no hydrogen 2.695 N/A ALA 44.A N ILE 19.A O no hydrogen 2.661 N/A LEU 45.A N GLU 118.A OE2 no hydrogen 2.782 N/A GLU 46.A N VAL 21.A O no hydrogen 2.950 N/A GLN 49.A N GLU 46.A O no hydrogen 3.107 N/A CYS 50.A N ALA 47.A O no hydrogen 3.011 N/A CYS 50.A SG GLU 46.A O no hydrogen 3.514 N/A ARG 51.A N ALA 47.A O no hydrogen 2.915 N/A ARG 51.A NH1 GLU 55.A OE1 no hydrogen 3.270 N/A ARG 51.A NH1 GLU 55.A OE2 no hydrogen 3.052 N/A VAL 54.A N CYS 50.A O no hydrogen 3.357 N/A GLU 55.A N ARG 51.A O no hydrogen 2.833 N/A THR 56.A N ALA 52.A O no hydrogen 3.156 N/A THR 56.A OG1 ALA 52.A O no hydrogen 2.917 N/A CYS 57.A N ARG 53.A O no hydrogen 3.039 N/A CYS 57.A SG GLY 105.A O no hydrogen 3.164 N/A SER 58.A N VAL 54.A O no hydrogen 2.940 N/A SER 59.A N GLU 55.A O no hydrogen 2.870 N/A SER 59.A OG GLU 55.A O no hydrogen 3.235 N/A TRP 60.A N THR 56.A O no hydrogen 2.715 N/A TRP 60.A NE1 ASP 316.A OD1 no hydrogen 2.823 N/A VAL 61.A N CYS 57.A O no hydrogen 2.935 N/A GLN 62.A N SER 58.A O no hydrogen 3.072 N/A ARG 63.A N SER 59.A O no hydrogen 2.853 N/A ARG 63.A NE GLU 66.A OE1 no hydrogen 3.265 N/A ARG 63.A NH2 GLU 66.A OE1 no hydrogen 3.189 N/A ARG 63.A NH2 GLU 66.A OE2 no hydrogen 2.516 N/A LYS 64.A N TRP 60.A O no hydrogen 3.155 N/A LYS 64.A NZ ASP 316.A OD1 no hydrogen 2.632 N/A LYS 64.A NZ ASP 316.A OD2 no hydrogen 3.521 N/A ALA 65.A N VAL 61.A O no hydrogen 3.032 N/A GLU 66.A N GLN 62.A O no hydrogen 3.134 N/A ASP 67.A N ARG 63.A O no hydrogen 3.132 N/A SER 72.A N GLU 68.A O no hydrogen 3.153 N/A SER 72.A OG LEU 69.A O no hydrogen 3.281 N/A LEU 73.A N GLN 70.A O no hydrogen 3.155 N/A ILE 74.A N GLN 70.A O no hydrogen 3.182 N/A ARG 75.A N GLU 71.A O no hydrogen 2.863 N/A CYS 76.A N SER 72.A O no hydrogen 3.278 N/A LEU 77.A N LEU 73.A O no hydrogen 3.259 N/A LEU 77.A N ILE 74.A O no hydrogen 2.991 N/A LEU 78.A N ILE 74.A O no hydrogen 3.110 N/A LEU 78.A N ARG 75.A O no hydrogen 3.228 N/A GLY 80.A N TYR 143.A OH no hydrogen 3.072 N/A LEU 86.A N VAL 129.A O no hydrogen 2.767 N/A THR 91.A N PRO 87.A O no hydrogen 3.034 N/A THR 91.A OG1 PRO 87.A O no hydrogen 3.199 N/A ARG 92.A N ALA 88.A O no hydrogen 2.887 N/A ARG 92.A NH1 LEU 35.A O no hydrogen 2.980 N/A ARG 92.A NH2 LEU 121.A O no hydrogen 3.046 N/A SER 93.A N THR 89.A O no hydrogen 3.108 N/A SER 93.A OG THR 89.A O no hydrogen 2.981 N/A ALA 94.A N ALA 90.A O no hydrogen 2.805 N/A MET 95.A N THR 91.A O no hydrogen 2.958 N/A LEU 96.A N ARG 92.A O no hydrogen 2.943 N/A LEU 97.A N SER 93.A O no hydrogen 2.983 N/A ARG 98.A N ALA 94.A O no hydrogen 2.871 N/A ARG 98.A NE ALA 183.A O no hydrogen 2.895 N/A ARG 98.A NH1 ASN 306.A O no hydrogen 3.023 N/A ARG 98.A NH2 ALA 183.A O no hydrogen 2.776 N/A ARG 98.A NH2 ASN 306.A O no hydrogen 2.907 N/A LEU 99.A N MET 95.A O no hydrogen 3.068 N/A ASN 100.A N LEU 96.A O no hydrogen 2.811 N/A ASN 100.A ND2 VAL 302.A O no hydrogen 2.943 N/A ASN 100.A ND2 ASN 303.A OD1 no hydrogen 3.472 N/A SER 101.A N LEU 97.A O no hydrogen 2.994 N/A SER 101.A OG LEU 97.A O no hydrogen 3.423 N/A SER 101.A OG SER 304.A O no hydrogen 2.970 N/A PHE 102.A N ARG 98.A O no hydrogen 3.240 N/A PHE 102.A N LEU 99.A O no hydrogen 3.079 N/A THR 103.A N ASN 100.A O no hydrogen 2.973 N/A THR 103.A OG1 ASN 100.A O no hydrogen 2.649 N/A GLY 105.A N PHE 102.A O no hydrogen 3.295 N/A CYS 106.A SG TYR 104.A O no hydrogen 3.741 N/A SER 107.A OG ASP 307.A OD2 no hydrogen 2.827 N/A ARG 110.A N GLU 180.A OE2 no hydrogen 2.891 N/A ARG 110.A NE GLU 180.A OE1 no hydrogen 3.014 N/A ARG 110.A NE GLU 180.A OE2 no hydrogen 2.872 N/A ARG 110.A NH2 GLU 180.A OE1 no hydrogen 2.663 N/A GLU 112.A N GLU 112.A OE1 no hydrogen 2.714 N/A VAL 113.A N ARG 110.A O no hydrogen 3.044 N/A MET 114.A N ARG 110.A O no hydrogen 3.367 N/A GLU 115.A N TRP 111.A O no hydrogen 2.903 N/A ALA 116.A N GLU 112.A O no hydrogen 2.981 N/A LEU 117.A N VAL 113.A O no hydrogen 3.016 N/A GLU 118.A N MET 114.A O no hydrogen 2.940 N/A LYS 119.A N GLU 115.A O no hydrogen 2.842 N/A LEU 120.A N ALA 116.A O no hydrogen 2.784 N/A LEU 121.A N LEU 117.A O no hydrogen 3.058 N/A ASN 122.A N GLU 118.A O no hydrogen 3.009 N/A ASN 122.A ND2 VAL 43.A O no hydrogen 3.009 N/A SER 123.A N LYS 119.A O no hydrogen 2.923 N/A SER 123.A OG LYS 119.A O no hydrogen 2.846 N/A ASN 124.A N LEU 121.A O no hydrogen 3.119 N/A VAL 125.A N LEU 120.A O no hydrogen 2.831 N/A SER 126.A N ARG 157.A O no hydrogen 3.204 N/A LYS 128.A N ILE 155.A O no hydrogen 2.874 N/A LYS 128.A NZ GLU 85.A OE2 no hydrogen 2.754 N/A SER 134.A OG ASP 137.A OD1 no hydrogen 2.515 N/A SER 136.A N SER 134.A OG no hydrogen 2.917 N/A SER 136.A OG ASP 137.A OD1 no hydrogen 2.670 N/A LEU 141.A N ASP 137.A O no hydrogen 2.903 N/A ALA 142.A N LEU 138.A O no hydrogen 2.812 N/A TYR 143.A N PRO 140.A O no hydrogen 3.231 N/A ILE 144.A N LEU 141.A O no hydrogen 2.981 N/A ALA 145.A N LEU 141.A O no hydrogen 3.004 N/A GLY 146.A N ALA 142.A O no hydrogen 2.676 N/A LEU 147.A N TYR 143.A O no hydrogen 3.108 N/A LEU 148.A N ILE 144.A O no hydrogen 2.998 N/A ILE 149.A N ALA 145.A O no hydrogen 3.061 N/A GLY 150.A N LEU 147.A O no hydrogen 3.053 N/A LYS 151.A N GLY 146.A O no hydrogen 2.913 N/A VAL 154.A N LYS 151.A O no hydrogen 3.055 N/A ALA 156.A N VAL 160.A O no hydrogen 2.790 N/A ARG 157.A N SER 126.A O no hydrogen 2.798 N/A GLY 159.A N ASN 124.A O no hydrogen 3.358 N/A ALA 162.A N VAL 154.A O no hydrogen 2.828 N/A ALA 165.A N PRO 161.A O no hydrogen 3.077 N/A LEU 166.A N ALA 162.A O no hydrogen 2.932 N/A SER 167.A N PRO 163.A O no hydrogen 3.024 N/A SER 167.A OG PRO 163.A O no hydrogen 3.279 N/A ARG 168.A N GLU 164.A O no hydrogen 3.154 N/A VAL 169.A N LEU 166.A O no hydrogen 3.199 N/A GLY 170.A N SER 167.A O no hydrogen 2.710 N/A LEU 171.A N LEU 166.A O no hydrogen 2.930 N/A PHE 174.A N LEU 148.A O no hydrogen 3.022 N/A LYS 175.A NZ GLU 71.A OE2 no hydrogen 3.106 N/A GLN 177.A N GLU 180.A OE1 no hydrogen 2.878 N/A GLN 177.A NE2 LYS 175.A O no hydrogen 2.797 N/A LYS 179.A NZ SER 107.A O no hydrogen 2.961 N/A LYS 179.A NZ PRO 309.A O no hydrogen 2.993 N/A GLU 180.A N GLN 177.A O no hydrogen 3.026 N/A LEU 182.A N GLN 70.A OE1 no hydrogen 3.368 N/A ALA 183.A N LYS 179.A O no hydrogen 2.785 N/A LEU 184.A N GLU 180.A O no hydrogen 2.992 N/A VAL 185.A N GLY 181.A O no hydrogen 3.300 N/A VAL 185.A N LEU 182.A O no hydrogen 3.143 N/A THR 188.A N ASN 306.A OD1 no hydrogen 3.244 N/A THR 188.A OG1 THR 192.A OG1 no hydrogen 3.326 N/A THR 188.A OG1 GLU 301.A OE2 no hydrogen 2.583 N/A ALA 191.A N ASP 137.A OD2 no hydrogen 2.875 N/A THR 192.A N THR 188.A O no hydrogen 2.969 N/A THR 192.A OG1 THR 188.A O no hydrogen 2.704 N/A THR 192.A OG1 THR 188.A OG1 no hydrogen 3.326 N/A ALA 193.A N SER 189.A O no hydrogen 2.902 N/A VAL 194.A N PHE 190.A O no hydrogen 3.080 N/A ALA 195.A N ALA 191.A O no hydrogen 2.891 N/A SER 196.A N THR 192.A O no hydrogen 2.762 N/A SER 196.A OG THR 192.A O no hydrogen 2.877 N/A THR 197.A N ALA 193.A O no hydrogen 3.270 N/A THR 197.A OG1 VAL 194.A O no hydrogen 3.261 N/A VAL 198.A N VAL 194.A O no hydrogen 2.914 N/A MET 199.A N ALA 195.A O no hydrogen 2.790 N/A TYR 200.A N SER 196.A O no hydrogen 2.881 N/A ASP 201.A N THR 197.A O no hydrogen 2.951 N/A ALA 202.A N VAL 198.A O no hydrogen 2.792 N/A ASN 203.A N MET 199.A O no hydrogen 3.015 N/A ASN 203.A ND2 MET 199.A O no hydrogen 2.804 N/A ASN 203.A ND2 THR 295.A OG1 no hydrogen 2.782 N/A VAL 204.A N TYR 200.A O no hydrogen 3.208 N/A LEU 205.A N ASP 201.A O no hydrogen 2.806 N/A LEU 206.A N ALA 202.A O no hydrogen 2.810 N/A LEU 207.A N ASN 203.A O no hydrogen 3.147 N/A LEU 208.A N VAL 204.A O no hydrogen 2.883 N/A VAL 209.A N LEU 205.A O no hydrogen 2.879 N/A GLU 210.A N LEU 206.A O no hydrogen 2.927 N/A THR 211.A N LEU 207.A O no hydrogen 2.946 N/A THR 211.A OG1 LEU 207.A O no hydrogen 2.914 N/A LEU 212.A N LEU 208.A O no hydrogen 2.996 N/A CYS 213.A N VAL 209.A O no hydrogen 3.071 N/A CYS 213.A N GLU 210.A O no hydrogen 3.239 N/A CYS 213.A SG VAL 209.A O no hydrogen 3.434 N/A GLY 214.A N THR 211.A O no hydrogen 2.990 N/A PHE 216.A N LEU 212.A O no hydrogen 2.786 N/A CYS 217.A N CYS 213.A O no hydrogen 3.004 N/A CYS 217.A SG GLN 257.A OE1 no hydrogen 3.440 N/A GLU 218.A N GLY 214.A O no hydrogen 3.142 N/A VAL 219.A N MET 215.A O no hydrogen 3.106 N/A ILE 220.A N PHE 216.A O no hydrogen 2.871 N/A GLY 222.A N CYS 217.A O no hydrogen 2.938 N/A ARG 223.A N ASP 273.A OD2 no hydrogen 2.602 N/A ARG 223.A NE ASP 273.A OD1 no hydrogen 3.051 N/A ARG 223.A NH1 PRO 270.A O no hydrogen 3.182 N/A ARG 223.A NH2 PRO 270.A O no hydrogen 3.161 N/A ARG 223.A NH2 ASP 273.A OD1 no hydrogen 3.119 N/A GLU 224.A N GLU 224.A OE1 no hydrogen 2.760 N/A PHE 226.A N ARG 223.A O no hydrogen 3.409 N/A ALA 227.A N GLU 224.A O no hydrogen 2.961 N/A HIS 228.A N GLU 225.A O no hydrogen 3.027 N/A LEU 230.A N HIS 228.A ND1 no hydrogen 2.959 N/A HIS 232.A N PRO 229.A O no hydrogen 3.210 N/A HIS 232.A NE2 PHE 226.A O no hydrogen 2.982 N/A LYS 233.A N PRO 229.A O no hydrogen 2.965 N/A VAL 234.A N LEU 230.A O no hydrogen 3.330 N/A LYS 235.A N HIS 232.A O no hydrogen 2.983 N/A HIS 237.A N LYS 235.A O no hydrogen 2.891 N/A GLY 239.A N GLN 289.A OE1 no hydrogen 2.957 N/A GLN 240.A NE2 HIS 232.A ND1 no hydrogen 3.003 N/A ILE 241.A N HIS 237.A O no hydrogen 3.000 N/A GLU 242.A N PRO 238.A O no hydrogen 2.903 N/A SER 243.A N GLY 239.A O no hydrogen 2.993 N/A SER 243.A OG GLY 239.A O no hydrogen 2.867 N/A SER 243.A OG GLN 240.A O no hydrogen 3.480 N/A ALA 244.A N GLN 240.A O no hydrogen 3.139 N/A GLU 245.A N ILE 241.A O no hydrogen 2.866 N/A LEU 246.A N GLU 242.A O no hydrogen 3.157 N/A LEU 247.A N SER 243.A O no hydrogen 2.986 N/A GLU 248.A N ALA 244.A O no hydrogen 2.881 N/A TRP 249.A N GLU 245.A O no hydrogen 3.267 N/A LEU 250.A N LEU 246.A O no hydrogen 2.885 N/A LEU 251.A N LEU 247.A O no hydrogen 2.959 N/A ARG 252.A N GLU 248.A O no hydrogen 2.941 N/A ARG 252.A NE GLU 248.A OE2 no hydrogen 2.918 N/A ARG 252.A NH2 GLU 248.A OE1 no hydrogen 2.825 N/A ARG 252.A NH2 GLU 248.A OE2 no hydrogen 3.527 N/A SER 254.A N LEU 251.A O no hydrogen 3.198 N/A SER 254.A OG GLU 218.A OE2 no hydrogen 2.387 N/A PHE 256.A N SER 254.A OG no hydrogen 3.195 N/A GLN 257.A N SER 254.A OG no hydrogen 3.111 N/A GLN 257.A NE2 GLY 222.A O no hydrogen 2.746 N/A GLN 257.A NE2 GLU 224.A OE1 no hydrogen 2.936 N/A GLU 258.A N SER 254.A O no hydrogen 3.317 N/A LEU 259.A N PRO 255.A O no hydrogen 3.371 N/A SER 260.A N PHE 256.A O no hydrogen 2.839 N/A SER 260.A OG GLY 222.A O no hydrogen 2.854 N/A ARG 261.A N GLN 257.A O no hydrogen 3.075 N/A ARG 261.A NH1 GLU 224.A OE2 no hydrogen 2.972 N/A GLU 262.A N GLU 258.A O no hydrogen 3.106 N/A TYR 263.A N LEU 259.A O no hydrogen 2.853 N/A TYR 264.A N SER 260.A O no hydrogen 3.011 N/A TYR 264.A OH PHE 221.A O no hydrogen 2.709 N/A SER 265.A N ARG 261.A O no hydrogen 3.172 N/A SER 265.A N GLU 262.A O no hydrogen 3.070 N/A SER 265.A OG GLU 262.A O no hydrogen 2.604 N/A SER 265.A OG GLU 262.A OE1 no hydrogen 3.409 N/A LYS 269.A NZ TYR 263.A O no hydrogen 2.800 N/A LYS 269.A NZ ILE 266.A O no hydrogen 2.681 N/A ARG 278.A N ARG 274.A O no hydrogen 3.131 N/A ARG 278.A NE ASP 273.A O no hydrogen 2.807 N/A ARG 278.A NH2 ASP 273.A O no hydrogen 3.166 N/A SER 279.A N TYR 275.A O no hydrogen 2.905 N/A SER 280.A N LEU 277.A O no hydrogen 2.898 N/A SER 280.A OG LEU 277.A O no hydrogen 2.847 N/A GLN 282.A N GLN 282.A OE1 no hydrogen 2.791 N/A TRP 283.A N SER 279.A O no hydrogen 2.954 N/A TRP 283.A NE1 GLY 342.A O no hydrogen 2.841 N/A LEU 284.A N SER 280.A O no hydrogen 2.782 N/A ALA 285.A N PRO 281.A O no hydrogen 3.014 N/A VAL 288.A N LEU 284.A O no hydrogen 2.782 N/A GLN 289.A N ALA 285.A O no hydrogen 3.219 N/A THR 290.A N PRO 286.A O no hydrogen 2.876 N/A THR 290.A OG1 PRO 286.A O no hydrogen 2.776 N/A ILE 291.A N LEU 287.A O no hydrogen 3.014 N/A ARG 292.A N VAL 288.A O no hydrogen 2.989 N/A ARG 292.A NH1 ASN 203.A OD1 no hydrogen 2.615 N/A ASP 293.A N GLN 289.A O no hydrogen 2.896 N/A ALA 294.A N THR 290.A O no hydrogen 2.885 N/A THR 295.A N ILE 291.A O no hydrogen 3.042 N/A THR 295.A OG1 ILE 291.A O no hydrogen 2.753 N/A THR 296.A N ARG 292.A O no hydrogen 3.228 N/A THR 296.A OG1 ARG 292.A O no hydrogen 3.455 N/A THR 297.A N ASP 293.A O no hydrogen 3.065 N/A THR 297.A OG1 ASP 293.A O no hydrogen 3.402 N/A VAL 298.A N ALA 294.A O no hydrogen 2.944 N/A GLU 299.A N THR 295.A O no hydrogen 3.038 N/A THR 300.A N THR 296.A O no hydrogen 2.988 N/A THR 300.A OG1 THR 296.A O no hydrogen 3.046 N/A GLU 301.A N THR 297.A O no hydrogen 3.153 N/A VAL 302.A N VAL 298.A O no hydrogen 2.821 N/A ASN 303.A N GLU 299.A O no hydrogen 2.890 N/A ASN 303.A ND2 ILE 27.A O no hydrogen 2.912 N/A ASN 303.A ND2 GLU 299.A O no hydrogen 2.839 N/A SER 304.A OG GLU 301.A O no hydrogen 2.755 N/A ASN 306.A ND2 SER 304.A OG no hydrogen 2.784 N/A ILE 310.A N LEU 319.A O no hydrogen 2.908 N/A ILE 311.A N CYS 106.A O no hydrogen 3.023 N/A ASP 312.A N ARG 317.A O no hydrogen 2.817 N/A HIS 313.A NE2 GLY 105.A O no hydrogen 2.896 N/A ASN 315.A N ASP 312.A O no hydrogen 3.015 N/A ASN 315.A ND2 ASP 312.A OD2 no hydrogen 2.795 N/A ASP 316.A N HIS 313.A O no hydrogen 3.025 N/A ARG 317.A N ASP 312.A O no hydrogen 3.207 N/A LEU 319.A N ILE 310.A O no hydrogen 2.752 N/A GLY 321.A N ASN 308.A OD1 no hydrogen 2.664 N/A ASN 323.A ND2 ALA 305.A O no hydrogen 3.253 N/A GLN 325.A N ALA 322.A O no hydrogen 3.017 N/A GLN 325.A NE2 ILE 414.A O no hydrogen 3.356 N/A GLY 326.A N SER 136.A O no hydrogen 3.254 N/A GLY 330.A N GLY 326.A O no hydrogen 2.914 N/A PHE 331.A N SER 327.A O no hydrogen 3.024 N/A TYR 332.A N ALA 328.A O no hydrogen 3.377 N/A MET 333.A N VAL 329.A O no hydrogen 2.883 N/A ASP 334.A N GLY 330.A O no hydrogen 3.229 N/A TYR 335.A N PHE 331.A O no hydrogen 3.068 N/A VAL 336.A N TYR 332.A O no hydrogen 2.864 N/A ARG 337.A N MET 333.A O no hydrogen 2.974 N/A ARG 337.A NE LEU 396.A O no hydrogen 2.759 N/A ARG 337.A NH1 SER 421.A OG no hydrogen 2.875 N/A ARG 337.A NH1 THR 425.A OG1 no hydrogen 2.907 N/A ARG 337.A NH2 ASP 334.A OD1 no hydrogen 2.785 N/A ARG 337.A NH2 ASN 398.A O no hydrogen 2.883 N/A ILE 338.A N ASP 334.A O no hydrogen 3.240 N/A ALA 339.A N TYR 335.A O no hydrogen 2.964 N/A VAL 340.A N VAL 336.A O no hydrogen 2.731 N/A ALA 341.A N ARG 337.A O no hydrogen 2.933 N/A GLY 342.A N ILE 338.A O no hydrogen 2.976 N/A LEU 343.A N ALA 339.A O no hydrogen 2.914 N/A GLY 344.A N VAL 340.A O no hydrogen 2.892 N/A LYS 345.A N ALA 341.A O no hydrogen 3.034 N/A LEU 346.A N GLY 342.A O no hydrogen 3.227 N/A LEU 347.A N LEU 343.A O no hydrogen 3.154 N/A PHE 348.A N GLY 344.A O no hydrogen 2.747 N/A ALA 349.A N LYS 345.A O no hydrogen 2.998 N/A GLN 350.A N LEU 346.A O no hydrogen 3.090 N/A GLN 350.A NE2 ALA 276.A O no hydrogen 2.960 N/A PHE 351.A N LEU 347.A O no hydrogen 2.769 N/A THR 352.A N PHE 348.A O no hydrogen 2.882 N/A THR 352.A OG1 PHE 348.A O no hydrogen 2.822 N/A GLU 353.A N ALA 349.A O no hydrogen 3.085 N/A LEU 354.A N GLN 350.A O no hydrogen 3.139 N/A MET 355.A N PHE 351.A O no hydrogen 3.152 N/A MET 355.A N THR 352.A O no hydrogen 3.179 N/A ILE 356.A N GLU 353.A O no hydrogen 3.244 N/A GLU 357.A N GLU 357.A OE1 no hydrogen 2.730 N/A TYR 359.A N ILE 356.A O no hydrogen 2.911 N/A SER 360.A N GLU 357.A O no hydrogen 3.451 N/A SER 360.A OG ILE 356.A O no hydrogen 3.186 N/A SER 360.A OG LEU 363.A O no hydrogen 3.193 N/A ASN 361.A ND2 ILE 220.A O no hydrogen 2.805 N/A ASN 366.A N MET 355.A O no hydrogen 2.794 N/A LEU 367.A N PRO 364.A O no hydrogen 2.879 N/A SER 368.A N GLY 365.A O no hydrogen 3.072 N/A SER 368.A OG GLY 365.A O no hydrogen 3.214 N/A SER 368.A OG ASP 376.A O no hydrogen 3.300 N/A GLY 370.A N ASP 376.A OD2 no hydrogen 2.942 N/A LEU 373.A N GLU 495.A OE2 no hydrogen 2.966 N/A SER 374.A N ASP 372.A OD1 no hydrogen 3.172 N/A SER 374.A OG ASP 372.A OD1 no hydrogen 2.789 N/A ASP 376.A N LEU 373.A O no hydrogen 3.261 N/A GLY 378.A N ASP 376.A OD1 no hydrogen 2.978 N/A LEU 379.A N ASN 366.A O no hydrogen 2.815 N/A LYS 380.A N TYR 377.A O no hydrogen 3.317 N/A LYS 380.A NZ ASN 366.A OD1 no hydrogen 3.236 N/A ASP 383.A N LEU 379.A O no hydrogen 2.896 N/A ILE 384.A N LYS 380.A O no hydrogen 2.927 N/A ALA 385.A N GLY 381.A O no hydrogen 3.013 N/A MET 386.A N LEU 382.A O no hydrogen 2.979 N/A ALA 387.A N ILE 384.A O no hydrogen 3.094 N/A ALA 388.A N ILE 384.A O no hydrogen 3.207 N/A TYR 389.A N ALA 385.A O no hydrogen 2.725 N/A SER 390.A N MET 386.A O no hydrogen 2.973 N/A SER 391.A N ALA 387.A O no hydrogen 2.883 N/A SER 391.A OG ALA 387.A O no hydrogen 2.784 N/A GLU 392.A N ALA 388.A O no hydrogen 3.260 N/A LEU 393.A N TYR 389.A O no hydrogen 3.009 N/A GLN 394.A N SER 390.A O no hydrogen 2.832 N/A GLN 394.A NE2 ALA 341.A O no hydrogen 3.071 N/A GLN 394.A NE2 SER 390.A O no hydrogen 3.490 N/A TYR 395.A N SER 391.A O no hydrogen 3.271 N/A LEU 396.A N GLU 392.A O no hydrogen 2.853 N/A ALA 397.A N GLN 394.A O no hydrogen 3.224 N/A ASN 398.A N TYR 395.A O no hydrogen 3.516 N/A VAL 400.A N ASP 334.A OD1 no hydrogen 3.166 N/A VAL 400.A N ASP 334.A OD2 no hydrogen 3.243 N/A THR 401.A N ASP 334.A OD2 no hydrogen 3.031 N/A THR 401.A OG1 ASP 334.A OD2 no hydrogen 2.861 N/A THR 402.A OG1 PRO 399.A O no hydrogen 3.509 N/A HIS 403.A N VAL 400.A O no hydrogen 2.843 N/A HIS 405.A ND1 HIS 403.A O no hydrogen 2.729 N/A SER 406.A OG HIS 410.A ND1 no hydrogen 2.711 N/A ALA 407.A N GLN 412.A O no hydrogen 3.003 N/A HIS 410.A ND1 SER 406.A OG no hydrogen 2.711 N/A ASN 411.A N GLU 408.A O no hydrogen 3.020 N/A ASN 411.A ND2 GLU 408.A OE1 no hydrogen 3.057 N/A GLN 412.A N ALA 407.A O no hydrogen 2.824 N/A GLN 412.A NE2 GLU 408.A OE1 no hydrogen 2.897 N/A ASN 415.A ND2 HIS 405.A O no hydrogen 2.942 N/A ASN 415.A ND2 GLN 412.A O no hydrogen 3.181 N/A SER 416.A OG SER 136.A O no hydrogen 2.615 N/A LEU 417.A N VAL 135.A O no hydrogen 2.799 N/A ALA 418.A N SER 416.A OG no hydrogen 3.111 N/A LEU 419.A N SER 136.A OG no hydrogen 3.017 N/A SER 421.A N LEU 417.A O no hydrogen 2.984 N/A SER 421.A OG ASP 334.A OD1 no hydrogen 2.550 N/A ALA 422.A N ALA 418.A O no hydrogen 2.746 N/A ARG 423.A N LEU 419.A O no hydrogen 2.958 N/A LYS 424.A N ILE 420.A O no hydrogen 3.160 N/A THR 425.A N SER 421.A O no hydrogen 2.995 N/A THR 425.A OG1 MET 333.A O no hydrogen 2.901 N/A THR 425.A OG1 SER 421.A O no hydrogen 3.136 N/A GLU 426.A N ALA 422.A O no hydrogen 2.782 N/A GLU 427.A N ARG 423.A O no hydrogen 2.944 N/A ALA 428.A N LYS 424.A O no hydrogen 2.874 N/A LEU 429.A N THR 425.A O no hydrogen 2.879 N/A ASP 430.A N GLU 426.A O no hydrogen 3.045 N/A ILE 431.A N GLU 427.A O no hydrogen 3.221 N/A LEU 432.A N ALA 428.A O no hydrogen 2.923 N/A LYS 433.A N LEU 429.A O no hydrogen 2.831 N/A LYS 433.A NZ ASP 201.A OD2 no hydrogen 3.523 N/A LEU 434.A N ASP 430.A O no hydrogen 3.223 N/A MET 435.A N ILE 431.A O no hydrogen 2.962 N/A ILE 436.A N LEU 432.A O no hydrogen 2.793 N/A ALA 437.A N LYS 433.A O no hydrogen 2.831 N/A SER 438.A N LEU 434.A O no hydrogen 3.158 N/A SER 438.A OG LEU 434.A O no hydrogen 3.486 N/A HIS 439.A N MET 435.A O no hydrogen 2.946 N/A HIS 439.A NE2 GLN 350.A OE1 no hydrogen 2.901 N/A LEU 440.A N ILE 436.A O no hydrogen 2.937 N/A THR 441.A N ALA 437.A O no hydrogen 3.131 N/A THR 441.A OG1 ALA 437.A O no hydrogen 2.822 N/A ALA 442.A N SER 438.A O no hydrogen 2.900 N/A MET 443.A N HIS 439.A O no hydrogen 2.938 N/A CYS 444.A N LEU 440.A O no hydrogen 2.968 N/A CYS 444.A SG LEU 440.A O no hydrogen 3.442 N/A GLN 445.A N THR 441.A O no hydrogen 3.023 N/A GLN 445.A NE2 LEU 367.A O no hydrogen 2.983 N/A GLN 445.A NE2 MET 577.A O no hydrogen 3.151 N/A ALA 446.A N ALA 442.A O no hydrogen 2.831 N/A VAL 447.A N MET 443.A O no hydrogen 2.718 N/A ASP 448.A N CYS 444.A O no hydrogen 3.069 N/A LEU 449.A N GLN 445.A O no hydrogen 2.946 N/A ARG 450.A N ALA 446.A O no hydrogen 2.861 N/A ARG 450.A NE VAL 219.A O no hydrogen 2.901 N/A ARG 450.A NH1 ASN 361.A O no hydrogen 2.955 N/A ARG 450.A NH1 GLU 453.A OE1 no hydrogen 3.000 N/A ARG 450.A NH2 VAL 219.A O no hydrogen 2.982 N/A ARG 450.A NH2 ASN 361.A O no hydrogen 3.189 N/A GLN 451.A N VAL 447.A O no hydrogen 3.032 N/A GLN 451.A NE2 TYR 551.A OH no hydrogen 2.921 N/A LEU 452.A N ASP 448.A O no hydrogen 2.848 N/A GLU 453.A N LEU 449.A O no hydrogen 2.827 N/A GLU 454.A N ARG 450.A O no hydrogen 3.059 N/A ALA 455.A N GLN 451.A O no hydrogen 3.228 N/A LEU 456.A N LEU 452.A O no hydrogen 2.909 N/A VAL 457.A N GLU 453.A O no hydrogen 3.036 N/A LYS 458.A N GLU 454.A O no hydrogen 3.295 N/A LYS 458.A NZ GLU 454.A OE2 no hydrogen 3.466 N/A VAL 459.A N ALA 455.A O no hydrogen 3.078 N/A VAL 460.A N LEU 456.A O no hydrogen 2.913 N/A GLU 461.A N VAL 457.A O no hydrogen 2.987 N/A ASN 462.A N LYS 458.A O no hydrogen 2.835 N/A VAL 463.A N VAL 459.A O no hydrogen 2.782 N/A VAL 464.A N VAL 460.A O no hydrogen 2.818 N/A SER 465.A N GLU 461.A O no hydrogen 2.784 N/A THR 466.A N ASN 462.A O no hydrogen 3.004 N/A THR 466.A OG1 ASN 462.A O no hydrogen 2.857 N/A THR 466.A OG1 VAL 463.A O no hydrogen 3.513 N/A LEU 467.A N VAL 463.A O no hydrogen 3.081 N/A ALA 468.A N VAL 464.A O no hydrogen 2.978 N/A ASP 469.A N SER 465.A O no hydrogen 3.241 N/A GLU 470.A N THR 466.A O no hydrogen 2.969 N/A CYS 471.A N LEU 467.A O no hydrogen 2.953 N/A CYS 471.A SG LEU 467.A O no hydrogen 3.372 N/A GLY 472.A N ASP 469.A O no hydrogen 2.910 N/A LEU 473.A N ALA 468.A O no hydrogen 2.971 N/A THR 477.A OG1 THR 515.A OG1 no hydrogen 2.646 N/A LYS 478.A N PRO 474.A O no hydrogen 3.022 N/A LYS 478.A NZ ASP 469.A OD1 no hydrogen 2.859 N/A LYS 478.A NZ ASP 469.A OD2 no hydrogen 3.433 N/A ALA 479.A N ASN 475.A O no hydrogen 3.006 N/A ARG 480.A N ASP 476.A O no hydrogen 3.258 N/A ARG 480.A NE ASP 476.A OD1 no hydrogen 3.018 N/A ARG 480.A NE ASP 476.A OD2 no hydrogen 3.078 N/A ARG 480.A NH2 ASP 476.A OD1 no hydrogen 3.366 N/A LEU 481.A N THR 477.A O no hydrogen 2.930 N/A LEU 482.A N LYS 478.A O no hydrogen 2.782 N/A TYR 483.A N ALA 479.A O no hydrogen 3.016 N/A TYR 483.A OH ASP 267.A OD1 no hydrogen 3.092 N/A VAL 484.A N ARG 480.A O no hydrogen 3.334 N/A ALA 485.A N LEU 481.A O no hydrogen 3.109 N/A LYS 486.A N LEU 482.A O no hydrogen 2.876 N/A ALA 487.A N TYR 483.A O no hydrogen 2.809 N/A VAL 488.A N VAL 484.A O no hydrogen 3.148 N/A TYR 491.A OH LEU 449.A O no hydrogen 2.789 N/A THR 492.A N PRO 489.A O no hydrogen 3.011 N/A THR 492.A OG1 PRO 489.A O no hydrogen 2.575 N/A TYR 493.A N VAL 490.A O no hydrogen 3.056 N/A SER 496.A N TYR 493.A O no hydrogen 3.135 N/A CYS 498.A SG LEU 536.A O no hydrogen 3.505 N/A ASP 499.A N SER 496.A O no hydrogen 2.929 N/A THR 501.A N ASP 499.A OD1 no hydrogen 2.855 N/A THR 501.A OG1 ASP 499.A OD1 no hydrogen 2.671 N/A LEU 502.A N ASP 499.A O no hydrogen 3.125 N/A LEU 506.A N LEU 502.A O no hydrogen 3.229 N/A GLY 507.A N PRO 503.A O no hydrogen 3.225 N/A LEU 508.A N LEU 504.A O no hydrogen 2.978 N/A LYS 509.A N LEU 505.A O no hydrogen 2.793 N/A GLN 510.A N LEU 506.A O no hydrogen 3.092 N/A SER 511.A N GLY 507.A O no hydrogen 3.063 N/A SER 511.A OG GLY 507.A O no hydrogen 3.326 N/A CYS 512.A N LEU 508.A O no hydrogen 2.832 N/A CYS 512.A SG LEU 508.A O no hydrogen 3.268 N/A PHE 513.A N LYS 509.A O no hydrogen 3.075 N/A ASP 514.A N GLN 510.A O no hydrogen 3.044 N/A THR 515.A N SER 511.A O no hydrogen 2.699 N/A THR 515.A OG1 ASP 476.A OD2 no hydrogen 2.735 N/A THR 515.A OG1 THR 477.A OG1 no hydrogen 2.646 N/A ILE 516.A N CYS 512.A O no hydrogen 3.080 N/A LEU 517.A N PHE 513.A O no hydrogen 3.063 N/A ALA 518.A N ASP 514.A O no hydrogen 3.160 N/A ALA 518.A N THR 515.A O no hydrogen 3.218 N/A LEU 519.A N THR 515.A O no hydrogen 2.986 N/A HIS 520.A N ILE 516.A O no hydrogen 3.202 N/A THR 524.A N GLU 521.A O no hydrogen 2.964 N/A THR 524.A OG1 GLU 521.A O no hydrogen 2.465 N/A LEU 525.A N GLU 521.A O no hydrogen 3.462 N/A VAL 526.A N THR 522.A O no hydrogen 3.327 N/A ASP 527.A N ASP 523.A O no hydrogen 3.216 N/A ARG 528.A N THR 524.A O no hydrogen 2.954 N/A ARG 528.A NH1 GLY 472.A O no hydrogen 2.933 N/A LEU 529.A N LEU 525.A O no hydrogen 2.927 N/A ALA 530.A N VAL 526.A O no hydrogen 2.903 N/A GLU 531.A N ASP 527.A O no hydrogen 3.004 N/A PHE 532.A N ARG 528.A O no hydrogen 2.834 N/A GLU 533.A N LEU 529.A O no hydrogen 2.998 N/A LYS 534.A N ALA 530.A O no hydrogen 3.036 N/A ARG 535.A N GLU 531.A O no hydrogen 2.838 N/A ARG 535.A NE GLU 470.A OE1 no hydrogen 2.797 N/A ARG 535.A NH2 GLU 470.A OE1 no hydrogen 2.950 N/A LEU 536.A N PHE 532.A O no hydrogen 2.824 N/A SER 537.A N GLU 533.A O no hydrogen 3.299 N/A ASP 538.A N LYS 534.A O no hydrogen 3.173 N/A ASP 538.A N ARG 535.A O no hydrogen 3.157 N/A ARG 539.A N LEU 536.A O no hydrogen 3.387 N/A LEU 540.A N LEU 536.A O no hydrogen 2.949 N/A GLU 543.A N ARG 539.A O no hydrogen 3.246 N/A MET 544.A N LEU 540.A O no hydrogen 2.931 N/A THR 545.A N GLU 541.A O no hydrogen 2.735 N/A THR 545.A OG1 GLU 541.A O no hydrogen 3.160 N/A ALA 546.A N ASN 542.A O no hydrogen 2.954 N/A VAL 547.A N GLU 543.A O no hydrogen 3.289 N/A ARG 548.A N MET 544.A O no hydrogen 3.103 N/A ARG 548.A NH1 GLU 552.A OE2 no hydrogen 3.086 N/A VAL 549.A N THR 545.A O no hydrogen 2.853 N/A LEU 550.A N ALA 546.A O no hydrogen 2.951 N/A TYR 551.A N VAL 547.A O no hydrogen 2.930 N/A TYR 551.A OH ASP 448.A OD1 no hydrogen 2.702 N/A GLU 552.A N ARG 548.A O no hydrogen 2.811 N/A LYS 553.A N VAL 549.A O no hydrogen 2.899 N/A ARG 555.A NE PRO 255.A O no hydrogen 3.245 N/A ARG 555.A NH1 GLU 454.A OE1 no hydrogen 3.404 N/A ARG 555.A NH1 GLU 454.A OE2 no hydrogen 2.949 N/A ARG 555.A NH2 PRO 255.A O no hydrogen 2.773 N/A ILE 556.A N GLN 451.A OE1 no hydrogen 2.837 N/A GLY 558.A N ARG 555.A O no hydrogen 3.198 N/A SER 559.A N ILE 556.A O no hydrogen 2.897 N/A SER 559.A OG GLU 218.A OE1 no hydrogen 2.671 N/A SER 559.A OG GLU 218.A OE2 no hydrogen 3.430 N/A PHE 561.A N SER 559.A OG no hydrogen 3.006 N/A LEU 562.A N SER 559.A O no hydrogen 2.998 N/A PHE 564.A N PHE 561.A O no hydrogen 2.968 N/A TYR 565.A N PHE 561.A O no hydrogen 3.194 N/A TYR 565.A OH ASP 448.A OD1 no hydrogen 2.437 N/A ARG 566.A N LEU 562.A O no hydrogen 2.797 N/A ARG 566.A NH2 HIS 607.A ND1 no hydrogen 3.281 N/A PHE 567.A N PRO 563.A O no hydrogen 2.856 N/A VAL 568.A N PHE 564.A O no hydrogen 3.025 N/A ARG 569.A N TYR 565.A O no hydrogen 2.803 N/A ARG 569.A NE ASP 448.A OD2 no hydrogen 2.788 N/A ARG 569.A NH1 THR 574.A OG1 no hydrogen 2.971 N/A ARG 569.A NH2 ASP 448.A OD2 no hydrogen 2.793 N/A GLU 570.A N ARG 566.A O no hydrogen 2.733 N/A GLU 571.A N ARG 566.A O no hydrogen 3.286 N/A LEU 572.A N PHE 567.A O no hydrogen 2.816 N/A THR 574.A N ARG 569.A O no hydrogen 2.954 N/A THR 574.A OG1 VAL 568.A O no hydrogen 2.718 N/A MET 577.A N GLN 445.A OE1 no hydrogen 2.713 N/A ARG 580.A N SER 578.A OG no hydrogen 2.749 N/A ARG 580.A NE GLU 552.A OE1 no hydrogen 2.863 N/A ARG 580.A NE GLU 552.A OE2 no hydrogen 3.249 N/A ARG 580.A NH1 GLY 370.A O no hydrogen 3.304 N/A ARG 580.A NH2 GLY 370.A O no hydrogen 2.843 N/A ARG 580.A NH2 GLU 552.A OE2 no hydrogen 2.697 N/A ARG 581.A N SER 578.A O no hydrogen 3.266 N/A ARG 581.A NE ASP 588.A OD2 no hydrogen 2.851 N/A ARG 581.A NH2 ASP 588.A OD1 no hydrogen 2.725 N/A ARG 581.A NH2 ASP 588.A OD2 no hydrogen 3.230 N/A THR 584.A N GLU 587.A OE2 no hydrogen 3.041 N/A THR 584.A OG1 GLU 587.A OE2 no hydrogen 3.160 N/A GLU 587.A N THR 584.A OG1 no hydrogen 3.283 N/A ASP 588.A N THR 584.A O no hydrogen 3.329 N/A VAL 589.A N PRO 585.A O no hydrogen 2.831 N/A GLN 590.A N GLN 586.A O no hydrogen 2.739 N/A GLN 590.A NE2 ASP 594.A OD1 no hydrogen 3.059 N/A LYS 591.A NZ LEU 572.A O no hydrogen 2.958 N/A LYS 591.A NZ ASP 573.A O no hydrogen 3.052 N/A VAL 592.A N ASP 588.A O no hydrogen 3.426 N/A PHE 593.A N VAL 589.A O no hydrogen 2.736 N/A ASP 594.A N GLN 590.A O no hydrogen 2.856 N/A ALA 595.A N LYS 591.A O no hydrogen 3.166 N/A ILE 596.A N VAL 592.A O no hydrogen 2.952 N/A ALA 597.A N PHE 593.A O no hydrogen 2.732 N/A ASP 598.A N ASP 594.A O no hydrogen 3.004 N/A GLY 599.A N ILE 596.A O no hydrogen 3.344 N/A ARG 600.A N ASP 598.A OD1 no hydrogen 3.086 N/A ARG 600.A NH1 ASP 598.A OD2 no hydrogen 2.696 N/A ILE 601.A N ALA 595.A O no hydrogen 2.902 N/A THR 602.A N GLY 599.A O no hydrogen 3.026 N/A THR 602.A OG1 GLY 599.A O no hydrogen 2.642 N/A VAL 603.A N ARG 600.A O no hydrogen 3.073 N/A LEU 605.A N ILE 601.A O no hydrogen 3.243 N/A LEU 606.A N THR 602.A O no hydrogen 2.869 N/A HIS 607.A N VAL 603.A O no hydrogen 2.991 N/A CYS 608.A N PRO 604.A O no hydrogen 2.929 N/A CYS 608.A SG LYS 560.A O no hydrogen 3.478 N/A LEU 609.A N LEU 605.A O no hydrogen 3.236 N/A LEU 609.A N LEU 606.A O no hydrogen 3.248 N/A GLN 610.A N HIS 607.A O no hydrogen 3.242 N/A PHE 612.A N LEU 609.A O no hydrogen 2.961 N/A