Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4gfj_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ASP 4.A N ILE 79.A O no hydrogen 2.994 N/A GLU 6.A N GLN 76.A O no hydrogen 3.174 N/A VAL 8.A N ARG 74.A O no hydrogen 2.697 N/A SER 10.A N GLU 13.A OE1 no hydrogen 2.598 N/A SER 10.A OG GLU 13.A OE1 no hydrogen 2.814 N/A PHE 14.A N SER 10.A O no hydrogen 2.970 N/A GLU 15.A N GLU 11.A O no hydrogen 3.205 N/A GLU 16.A N ARG 12.A O no hydrogen 2.934 N/A GLU 17.A N GLU 13.A O no hydrogen 2.876 N/A ARG 18.A N PHE 14.A O no hydrogen 2.961 N/A ARG 18.A NH1 LEU 116.A O no hydrogen 2.520 N/A GLU 19.A N GLU 15.A O no hydrogen 3.105 N/A THR 20.A N GLU 16.A O no hydrogen 3.117 N/A THR 20.A OG1 GLU 16.A O no hydrogen 3.122 N/A PHE 21.A N GLU 17.A O no hydrogen 2.872 N/A LEU 22.A N ARG 18.A O no hydrogen 3.053 N/A LYS 23.A N GLU 19.A O no hydrogen 2.977 N/A LYS 23.A NZ ASP 249.A OD2 no hydrogen 3.082 N/A GLY 24.A N THR 20.A O no hydrogen 2.770 N/A VAL 25.A N PHE 21.A O no hydrogen 2.755 N/A LYS 26.A N LEU 22.A O no hydrogen 3.003 N/A ALA 27.A N LYS 23.A O no hydrogen 2.895 N/A TYR 28.A N GLY 24.A O no hydrogen 2.764 N/A ASP 29.A N VAL 25.A O no hydrogen 2.723 N/A GLY 30.A N LYS 26.A O no hydrogen 3.379 N/A VAL 31.A N ALA 27.A O no hydrogen 3.370 N/A LEU 32.A N TYR 28.A O no hydrogen 3.073 N/A ALA 33.A N ASP 29.A O no hydrogen 3.004 N/A THR 34.A N GLY 30.A O no hydrogen 2.919 N/A THR 34.A OG1 GLY 30.A O no hydrogen 2.594 N/A THR 34.A OG1 VAL 31.A O no hydrogen 2.874 N/A THR 34.A OG1 HIS 54.A ND1 no hydrogen 2.672 N/A ARG 35.A N VAL 31.A O no hydrogen 3.017 N/A TYR 36.A N LEU 32.A O no hydrogen 2.931 N/A LEU 37.A N ALA 33.A O no hydrogen 3.040 N/A MET 38.A N THR 34.A O no hydrogen 3.147 N/A GLU 39.A N TYR 36.A O no hydrogen 3.304 N/A ARG 40.A N LEU 37.A O no hydrogen 3.158 N/A ALA 44.A N SER 41.A OG no hydrogen 3.093 N/A LYS 45.A N SER 41.A O no hydrogen 2.769 N/A ASN 46.A N SER 42.A O no hydrogen 3.220 N/A ASP 47.A N ALA 44.A O no hydrogen 3.266 N/A LEU 50.A N ASP 47.A OD1 no hydrogen 2.951 N/A LEU 51.A N ASP 47.A O no hydrogen 3.072 N/A GLU 52.A N GLU 48.A O no hydrogen 2.845 N/A LEU 53.A N GLU 49.A O no hydrogen 3.224 N/A HIS 54.A N LEU 50.A O no hydrogen 2.816 N/A HIS 54.A ND1 THR 34.A OG1 no hydrogen 2.672 N/A GLN 55.A N LEU 51.A O no hydrogen 2.924 N/A GLN 55.A NE2 ARG 133.A O no hydrogen 2.824 N/A ASN 56.A N GLU 52.A O no hydrogen 3.012 N/A ASN 56.A ND2 GLU 52.A O no hydrogen 2.699 N/A PHE 57.A N LEU 53.A O no hydrogen 3.102 N/A ILE 58.A N HIS 54.A O no hydrogen 3.163 N/A LEU 59.A N GLN 55.A O no hydrogen 2.896 N/A LEU 60.A N ASN 56.A O no hydrogen 2.979 N/A THR 61.A N PHE 57.A O no hydrogen 2.896 N/A THR 61.A OG1 PHE 57.A O no hydrogen 2.928 N/A GLY 62.A N ILE 58.A O no hydrogen 3.025 N/A SER 63.A N LEU 59.A O no hydrogen 2.972 N/A TYR 64.A N LEU 60.A O no hydrogen 3.063 N/A TYR 64.A OH ASP 249.A OD1 no hydrogen 2.425 N/A ALA 65.A N THR 61.A O no hydrogen 2.941 N/A CYS 66.A N GLY 62.A O no hydrogen 2.755 N/A CYS 66.A SG GLY 62.A O no hydrogen 3.194 N/A CYS 66.A SG LEU 144.A O no hydrogen 3.847 N/A SER 67.A N SER 63.A O no hydrogen 3.337 N/A SER 67.A N TYR 64.A O no hydrogen 3.134 N/A ILE 68.A N ALA 65.A O no hydrogen 2.976 N/A ASP 69.A N GLU 17.A OE1 no hydrogen 2.759 N/A ASP 69.A N GLU 17.A OE2 no hydrogen 3.143 N/A THR 71.A OG1 ASP 73.A OD2 no hydrogen 2.309 N/A GLU 72.A N ASP 69.A O no hydrogen 2.935 N/A ARG 74.A N ASP 69.A OD1 no hydrogen 2.998 N/A ARG 74.A NE THR 71.A OG1 no hydrogen 2.926 N/A TYR 75.A OH GLU 17.A OE1 no hydrogen 2.589 N/A GLN 76.A N GLU 6.A O no hydrogen 2.882 N/A ASN 77.A N ASP 86.A OD1 no hydrogen 2.747 N/A ASN 77.A ND2 GLU 6.A OE2 no hydrogen 2.903 N/A VAL 78.A N ASP 86.A OD2 no hydrogen 3.396 N/A ILE 79.A N ASP 4.A O no hydrogen 2.716 N/A VAL 80.A N VAL 83.A O no hydrogen 2.969 N/A ARG 81.A NH1 TYR 3.A OH no hydrogen 2.888 N/A ARG 81.A NH1 ARG 106.A O no hydrogen 2.946 N/A ARG 81.A NH2 ARG 106.A O no hydrogen 3.325 N/A GLY 82.A N VAL 2.A O no hydrogen 2.917 N/A VAL 83.A N VAL 80.A O no hydrogen 2.819 N/A ASN 84.A ND2 ASN 77.A OD1 no hydrogen 3.477 N/A PHE 85.A N VAL 78.A O no hydrogen 2.904 N/A GLU 87.A N ASN 84.A OD1 no hydrogen 3.452 N/A ARG 88.A NE HIS 371.A O no hydrogen 3.039 N/A ARG 88.A NH1 GLU 373.A OE1 no hydrogen 2.912 N/A ARG 88.A NH2 GLU 370.A O no hydrogen 3.098 N/A VAL 89.A N PHE 85.A O no hydrogen 2.842 N/A GLN 90.A N ASP 86.A O no hydrogen 3.175 N/A ARG 91.A N ARG 88.A O no hydrogen 2.998 N/A ARG 91.A NH1 HIS 371.A O no hydrogen 3.493 N/A LEU 92.A N VAL 89.A O no hydrogen 3.299 N/A SER 93.A OG ASP 217.A OD1 no hydrogen 3.133 N/A SER 93.A OG ASP 217.A OD2 no hydrogen 2.887 N/A THR 94.A N ASP 217.A OD1 no hydrogen 3.017 N/A THR 94.A OG1 TYR 147.A OH no hydrogen 2.650 N/A THR 94.A OG1 ASP 217.A OD1 no hydrogen 2.917 N/A GLY 95.A N LEU 92.A O no hydrogen 3.266 N/A SER 97.A OG ASP 69.A OD2 no hydrogen 2.613 N/A ARG 100.A N SER 97.A OG no hydrogen 3.131 N/A ARG 100.A NE ILE 68.A O no hydrogen 2.970 N/A ARG 100.A NH1 GLU 72.A OE2 no hydrogen 3.394 N/A ARG 100.A NH1 ARG 146.A O no hydrogen 2.669 N/A ARG 100.A NH2 ASP 69.A O no hydrogen 3.172 N/A ARG 100.A NH2 GLU 72.A OE2 no hydrogen 2.998 N/A TYR 101.A N SER 97.A O no hydrogen 3.109 N/A TYR 101.A OH GLU 215.A OE2 no hydrogen 2.372 N/A ALA 102.A N PRO 98.A O no hydrogen 3.009 N/A ILE 103.A N ALA 99.A O no hydrogen 3.093 N/A VAL 104.A N ARG 100.A O no hydrogen 3.351 N/A TYR 105.A N ALA 102.A O no hydrogen 2.965 N/A TYR 105.A OH GLU 373.A OE1 no hydrogen 2.728 N/A TYR 105.A OH GLU 373.A OE2 no hydrogen 3.251 N/A ARG 106.A NE ASP 318.A OD2 no hydrogen 2.907 N/A ARG 107.A N GLU 127.A OE2 no hydrogen 2.854 N/A GLY 108.A N TYR 105.A O no hydrogen 2.952 N/A ARG 110.A N ARG 107.A O no hydrogen 3.326 N/A ALA 111.A N GLY 108.A O no hydrogen 2.903 N/A ILE 112.A N GLY 108.A O no hydrogen 3.448 N/A ALA 113.A N TRP 109.A O no hydrogen 2.719 N/A LYS 114.A N ARG 110.A O no hydrogen 3.398 N/A LYS 114.A NZ TYR 3.A O no hydrogen 2.753 N/A LEU 116.A N ILE 112.A O no hydrogen 3.212 N/A ASP 117.A N LYS 114.A O no hydrogen 3.286 N/A GLU 121.A N ASP 119.A OD2 no hydrogen 2.908 N/A ASP 122.A N ASP 119.A O no hydrogen 3.230 N/A VAL 123.A N GLU 120.A O no hydrogen 2.900 N/A ALA 125.A N VAL 123.A O no hydrogen 2.735 N/A ARG 129.A NH1 VAL 104.A O no hydrogen 2.764 N/A ASN 134.A N VAL 131.A O no hydrogen 3.006 N/A ASN 134.A ND2 ALA 130.A O no hydrogen 2.983 N/A LEU 136.A N ASN 134.A OD1 no hydrogen 2.845 N/A GLN 137.A N MET 164.A O no hydrogen 3.080 N/A GLN 137.A NE2 PRO 194.A O no hydrogen 3.133 N/A LEU 140.A N GLN 137.A OE1 no hydrogen 3.093 N/A TYR 141.A N GLN 137.A O no hydrogen 3.055 N/A TYR 141.A OH ILE 58.A O no hydrogen 2.606 N/A ARG 142.A N PRO 138.A O no hydrogen 3.184 N/A ARG 142.A NH1 TYR 224.A OH no hydrogen 2.692 N/A ARG 142.A NH2 ARG 129.A O no hydrogen 3.010 N/A ILE 143.A N ALA 139.A O no hydrogen 2.980 N/A LEU 144.A N LEU 140.A O no hydrogen 2.834 N/A VAL 145.A N TYR 141.A O no hydrogen 3.116 N/A ARG 146.A N ARG 142.A O no hydrogen 2.947 N/A ARG 146.A NH1 LYS 216.A O no hydrogen 2.315 N/A ARG 146.A NH2 GLY 95.A O no hydrogen 2.234 N/A TYR 147.A N ILE 143.A O no hydrogen 2.874 N/A TYR 147.A OH THR 94.A OG1 no hydrogen 2.650 N/A GLY 148.A N VAL 145.A O no hydrogen 2.923 N/A ARG 149.A N LEU 144.A O no hydrogen 3.062 N/A ARG 149.A NH1 ASP 151.A OD1 no hydrogen 2.756 N/A ARG 149.A NH1 ASP 151.A OD2 no hydrogen 2.683 N/A ARG 149.A NH2 VAL 231.A O no hydrogen 3.331 N/A MET 153.A N ARG 149.A O no hydrogen 2.898 N/A VAL 157.A N ASN 56.A OD1 no hydrogen 3.098 N/A MET 164.A N PRO 161.A O no hydrogen 2.930 N/A ALA 165.A N PRO 162.A O no hydrogen 2.681 N/A GLU 167.A N PRO 162.A O no hydrogen 2.960 N/A ARG 170.A N GLU 167.A O no hydrogen 3.164 N/A ARG 170.A NE GLU 167.A OE2 no hydrogen 3.152 N/A ARG 170.A NH2 GLU 167.A OE2 no hydrogen 2.730 N/A LEU 171.A N PHE 168.A O no hydrogen 2.898 N/A GLU 173.A N GLU 169.A O no hydrogen 3.020 N/A ARG 174.A N ARG 170.A O no hydrogen 3.153 N/A ARG 174.A NH1 GLU 163.A OE1 no hydrogen 2.636 N/A TYR 175.A N ILE 172.A O no hydrogen 3.352 N/A ASP 180.A N GLU 183.A OE1 no hydrogen 3.103 N/A LYS 182.A NZ GLU 211.A O no hydrogen 2.450 N/A LYS 182.A NZ SER 221.A O no hydrogen 2.833 N/A LYS 182.A NZ SER 221.A OG no hydrogen 2.928 N/A GLU 183.A N ASP 180.A OD2 no hydrogen 2.946 N/A GLU 184.A N ASP 180.A O no hydrogen 2.977 N/A ARG 185.A N GLU 181.A O no hydrogen 3.211 N/A ARG 185.A NH1 LEU 205.A O no hydrogen 3.150 N/A ARG 185.A NH2 LEU 205.A O no hydrogen 3.406 N/A ILE 186.A N LYS 182.A O no hydrogen 2.970 N/A LEU 187.A N GLU 183.A O no hydrogen 2.729 N/A GLU 188.A N GLU 184.A O no hydrogen 3.239 N/A ILE 189.A N ILE 186.A O no hydrogen 3.077 N/A LEU 190.A N ILE 186.A O no hydrogen 3.159 N/A ARG 191.A N LEU 187.A O no hydrogen 2.648 N/A ARG 191.A NE GLU 169.A OE1 no hydrogen 2.716 N/A ARG 191.A NE GLU 169.A OE2 no hydrogen 2.883 N/A ARG 191.A NH1 GLU 184.A OE2 no hydrogen 2.984 N/A ARG 191.A NH2 GLU 169.A OE2 no hydrogen 2.447 N/A ARG 191.A NH2 GLU 184.A OE1 no hydrogen 3.364 N/A ARG 191.A NH2 GLU 184.A OE2 no hydrogen 3.340 N/A ASN 193.A N ILE 189.A O no hydrogen 2.999 N/A TRP 195.A N ASN 193.A OD1 no hydrogen 3.151 N/A TRP 195.A NE1 ASN 134.A O no hydrogen 2.648 N/A THR 196.A N ASN 193.A O no hydrogen 3.054 N/A THR 196.A OG1 ASN 193.A O no hydrogen 2.720 N/A HIS 198.A ND1 GLU 213.A OE1 no hydrogen 2.682 N/A ILE 201.A N PRO 197.A O no hydrogen 3.049 N/A ALA 202.A N HIS 198.A O no hydrogen 2.839 N/A ARG 203.A N ASP 199.A O no hydrogen 2.897 N/A ARG 204.A N GLU 200.A O no hydrogen 3.083 N/A LEU 205.A N ILE 201.A O no hydrogen 3.184 N/A LEU 207.A N ALA 202.A O no hydrogen 2.708 N/A SER 208.A N GLU 211.A OE1 no hydrogen 3.410 N/A SER 208.A OG GLU 211.A OE1 no hydrogen 3.043 N/A GLU 211.A N SER 208.A OG no hydrogen 3.232 N/A VAL 212.A N SER 208.A O no hydrogen 3.076 N/A GLU 213.A N VAL 209.A O no hydrogen 2.862 N/A GLY 214.A N SER 210.A O no hydrogen 2.889 N/A GLU 215.A N SER 220.A OG no hydrogen 2.852 N/A LYS 216.A N GLU 215.A OE2 no hydrogen 3.100 N/A LYS 216.A NZ TYR 101.A OH no hydrogen 3.510 N/A LYS 216.A NZ TYR 105.A OH no hydrogen 3.168 N/A ASP 217.A N GLU 215.A O no hydrogen 2.848 N/A GLU 219.A N ASP 217.A OD2 no hydrogen 2.750 N/A SER 220.A N SER 225.A OG no hydrogen 3.090 N/A SER 221.A N SER 220.A OG no hydrogen 2.592 N/A SER 221.A OG ASP 180.A OD1 no hydrogen 2.974 N/A GLY 222.A N GLU 183.A OE2 no hydrogen 2.885 N/A ILE 223.A N VAL 212.A O no hydrogen 2.884 N/A TYR 224.A N GLU 213.A O no hydrogen 2.948 N/A SER 225.A OG ASP 217.A O no hydrogen 2.823 N/A LEU 226.A N GLY 222.A O no hydrogen 2.763 N/A TRP 227.A N ILE 223.A O no hydrogen 3.102 N/A TRP 227.A NE1 GLN 137.A OE1 no hydrogen 2.723 N/A SER 228.A N TYR 224.A O no hydrogen 2.877 N/A SER 228.A OG TYR 224.A O no hydrogen 2.561 N/A ARG 229.A N SER 225.A O no hydrogen 2.871 N/A ARG 229.A NE PRO 218.A O no hydrogen 3.042 N/A ARG 229.A NH1 PRO 178.A O no hydrogen 2.720 N/A ARG 229.A NH1 GLU 183.A OE1 no hydrogen 2.758 N/A ARG 229.A NH2 GLU 183.A OE1 no hydrogen 3.490 N/A ARG 229.A NH2 GLU 183.A OE2 no hydrogen 2.540 N/A ARG 229.A NH2 SER 225.A OG no hydrogen 2.715 N/A VAL 230.A N LEU 226.A O no hydrogen 3.043 N/A VAL 231.A N TRP 227.A O no hydrogen 2.733 N/A VAL 232.A N SER 228.A O no hydrogen 2.972 N/A ASN 233.A N VAL 230.A O no hydrogen 2.904 N/A ASN 233.A ND2 ARG 229.A O no hydrogen 2.745 N/A ILE 234.A N VAL 231.A O no hydrogen 2.948 N/A ASP 237.A N ASP 151.A OD2 no hydrogen 2.906 N/A THR 240.A N ASP 237.A OD1 no hydrogen 3.080 N/A THR 240.A OG1 ASP 237.A OD2 no hydrogen 3.017 N/A ALA 241.A N ASP 237.A O no hydrogen 3.137 N/A LYS 242.A N GLU 238.A O no hydrogen 3.302 N/A ARG 243.A N ARG 239.A O no hydrogen 3.253 N/A HIS 244.A N THR 240.A O no hydrogen 3.005 N/A HIS 244.A ND1 VAL 150.A O no hydrogen 3.019 N/A VAL 245.A N ALA 241.A O no hydrogen 3.139 N/A LYS 246.A N LYS 242.A O no hydrogen 2.949 N/A ARG 247.A N ARG 243.A O no hydrogen 2.959 N/A ARG 248.A N HIS 244.A O no hydrogen 3.210 N/A ARG 248.A NH1 SER 63.A OG no hydrogen 2.904 N/A ARG 248.A NH1 SER 67.A OG no hydrogen 3.259 N/A ARG 248.A NH2 SER 67.A OG no hydrogen 3.067 N/A ARG 250.A NE GLU 254.A OE2 no hydrogen 3.254 N/A ARG 250.A NH2 GLU 254.A OE2 no hydrogen 3.156 N/A LEU 251.A N ARG 247.A O no hydrogen 3.108 N/A LEU 252.A N ARG 248.A O no hydrogen 2.942 N/A LEU 252.A N ASP 249.A O no hydrogen 3.134 N/A GLU 253.A N ASP 249.A O no hydrogen 3.272 N/A GLU 254.A N ARG 250.A O no hydrogen 2.955 N/A LEU 255.A N LEU 251.A O no hydrogen 2.839 N/A TYR 256.A N LEU 252.A O no hydrogen 2.912 N/A TYR 256.A OH LYS 26.A O no hydrogen 2.705 N/A GLU 257.A N GLU 253.A O no hydrogen 2.824 N/A HIS 258.A N GLU 254.A O no hydrogen 2.910 N/A LEU 259.A N LEU 255.A O no hydrogen 2.871 N/A GLU 260.A N TYR 256.A O no hydrogen 3.319 N/A GLU 261.A N GLU 257.A O no hydrogen 3.374 N/A LEU 262.A N HIS 258.A O no hydrogen 2.969 N/A SER 263.A N LEU 259.A O no hydrogen 2.962 N/A SER 263.A OG LEU 259.A O no hydrogen 2.811 N/A SER 263.A OG GLU 260.A O no hydrogen 2.591 N/A ARG 265.A N LEU 262.A O no hydrogen 2.667 N/A ARG 265.A NH1 ASP 47.A OD2 no hydrogen 2.754 N/A ARG 265.A NH2 GLU 49.A OE1 no hydrogen 3.194 N/A TYR 266.A N SER 263.A O no hydrogen 3.011 N/A TYR 266.A OH ASP 47.A OD2 no hydrogen 2.571 N/A LEU 267.A N SER 263.A O no hydrogen 2.945 N/A LEU 271.A N SER 263.A OG no hydrogen 2.898 N/A ARG 273.A NH1 ASP 29.A OD2 no hydrogen 2.918 N/A ARG 273.A NH2 ASP 29.A OD2 no hydrogen 3.337 N/A ILE 276.A N THR 272.A O no hydrogen 3.052 N/A VAL 277.A N ARG 273.A O no hydrogen 2.982 N/A GLU 278.A N ARG 274.A O no hydrogen 3.010 N/A GLU 278.A N TRP 275.A O no hydrogen 3.092 N/A HIS 279.A N TRP 275.A O no hydrogen 2.927 N/A LYS 280.A N ILE 276.A O no hydrogen 2.783 N/A LYS 280.A NZ ASP 122.A O no hydrogen 3.262 N/A LYS 280.A NZ VAL 123.A O no hydrogen 3.018 N/A ARG 281.A NH2 GLU 121.A O no hydrogen 2.788 N/A ILE 283.A N HIS 279.A O no hydrogen 2.657 N/A MET 284.A N LYS 280.A O no hydrogen 2.901 N/A ARG 285.A N ARG 281.A O no hydrogen 2.870 N/A ARG 286.A N ASP 282.A O no hydrogen 3.083 N/A TYR 287.A N ILE 283.A O no hydrogen 3.148 N/A LEU 288.A N MET 284.A O no hydrogen 3.015 N/A GLU 289.A N ARG 285.A O no hydrogen 3.234 N/A GLN 290.A N ARG 286.A O no hydrogen 3.230 N/A ARG 291.A N TYR 287.A O no hydrogen 3.029 N/A ARG 291.A NE GLY 319.A O no hydrogen 3.549 N/A ILE 292.A N LEU 288.A O no hydrogen 2.972 N/A ILE 292.A N GLU 289.A O no hydrogen 3.107 N/A VAL 293.A N GLU 289.A O no hydrogen 3.235 N/A GLU 294.A N GLN 290.A O no hydrogen 3.107 N/A CYS 295.A N ARG 291.A O no hydrogen 2.999 N/A ALA 296.A N ILE 292.A O no hydrogen 2.792 N/A LEU 297.A N VAL 293.A O no hydrogen 2.868 N/A LYS 298.A N GLU 294.A O no hydrogen 3.213 N/A LEU 299.A N CYS 295.A O no hydrogen 2.874 N/A ASP 301.A N LEU 297.A O no hydrogen 3.219 N/A ARG 302.A N LYS 298.A O no hydrogen 2.936 N/A ILE 305.A N LEU 299.A O no hydrogen 3.004 N/A ARG 306.A N GLU 343.A OE2 no hydrogen 3.300 N/A ARG 306.A NH2 ASP 338.A O no hydrogen 3.081 N/A ALA 310.A N ARG 306.A O no hydrogen 3.025 N/A LEU 311.A N GLU 307.A O no hydrogen 3.221 N/A CYS 312.A N ASP 308.A O no hydrogen 3.314 N/A CYS 312.A SG VAL 335.A O no hydrogen 3.148 N/A LEU 313.A N VAL 309.A O no hydrogen 3.090 N/A ALA 314.A N ALA 310.A O no hydrogen 3.123 N/A ARG 315.A N LEU 311.A O no hydrogen 2.909 N/A ARG 315.A NH1 GLU 289.A OE2 no hydrogen 2.698 N/A ARG 315.A NH2 GLU 289.A OE1 no hydrogen 3.466 N/A ARG 315.A NH2 GLU 289.A OE2 no hydrogen 3.122 N/A ALA 316.A N CYS 312.A O no hydrogen 2.916 N/A PHE 317.A N LEU 313.A O no hydrogen 2.850 N/A ASP 318.A N ARG 315.A O no hydrogen 3.383 N/A GLY 319.A N ALA 314.A O no hydrogen 2.976 N/A SER 320.A N PHE 317.A O no hydrogen 3.028 N/A MET 323.A N SER 320.A OG no hydrogen 3.034 N/A ILE 324.A N SER 320.A O no hydrogen 2.896 N/A ALA 325.A N ILE 321.A O no hydrogen 2.595 N/A THR 326.A N SER 322.A O no hydrogen 3.152 N/A THR 326.A N MET 323.A O no hydrogen 3.145 N/A THR 326.A OG1 SER 322.A O no hydrogen 2.933 N/A THR 326.A OG1 MET 323.A O no hydrogen 3.030 N/A THR 327.A N ILE 324.A O no hydrogen 2.871 N/A THR 327.A OG1 MET 323.A O no hydrogen 2.742 N/A THR 327.A OG1 ILE 324.A O no hydrogen 3.391 N/A TYR 329.A N ASP 366.A OD1 no hydrogen 2.804 N/A ARG 330.A N ASP 366.A OD2 no hydrogen 3.029 N/A ARG 330.A NH2 GLU 370.A OE2 no hydrogen 3.121 N/A LEU 332.A N PRO 328.A O no hydrogen 2.903 N/A LYS 333.A N TYR 329.A O no hydrogen 2.862 N/A LYS 333.A NZ PRO 337.A O no hydrogen 3.523 N/A LYS 333.A NZ LEU 339.A O no hydrogen 3.327 N/A ASP 334.A N ARG 330.A O no hydrogen 3.012 N/A CYS 336.A N LEU 332.A O no hydrogen 3.043 N/A LEU 339.A N CYS 336.A O no hydrogen 3.115 N/A THR 340.A N GLU 343.A OE1 no hydrogen 3.171 N/A ALA 344.A N THR 340.A O no hydrogen 2.946 N/A LYS 345.A N LEU 341.A O no hydrogen 2.836 N/A LYS 345.A NZ GLU 342.A OE1 no hydrogen 3.217 N/A LYS 345.A NZ ASP 356.A OD1 no hydrogen 2.660 N/A SER 346.A N GLU 343.A O no hydrogen 3.082 N/A SER 346.A OG TYR 303.A O no hydrogen 3.372 N/A VAL 347.A N GLU 343.A O no hydrogen 3.456 N/A ASN 348.A N ALA 344.A O no hydrogen 2.829 N/A ASN 348.A ND2 THR 327.A O no hydrogen 2.771 N/A ARG 349.A NH1 SER 346.A O no hydrogen 3.440 N/A LEU 351.A N ASN 348.A OD1 no hydrogen 2.763 N/A ALA 352.A N ASN 348.A O no hydrogen 3.006 N/A THR 353.A N ARG 349.A O no hydrogen 2.818 N/A THR 353.A OG1 ARG 349.A O no hydrogen 3.000 N/A LEU 354.A N THR 350.A O no hydrogen 2.969 N/A ILE 355.A N LEU 351.A O no hydrogen 3.051 N/A ASP 356.A N ALA 352.A O no hydrogen 2.870 N/A GLU 357.A N THR 353.A O no hydrogen 2.795 N/A LEU 360.A N LEU 354.A O no hydrogen 2.967 N/A SER 361.A N GLU 398.A OE2.B no hydrogen 3.175 N/A SER 361.A OG GLU 398.A OE1.B no hydrogen 2.550 N/A SER 361.A OG GLU 398.A OE2.A no hydrogen 2.485 N/A SER 361.A OG GLU 398.A OE2.B no hydrogen 3.050 N/A ALA 365.A N SER 361.A O no hydrogen 2.755 N/A ASP 366.A N PRO 362.A O no hydrogen 2.799 N/A GLU 367.A N ASP 363.A O no hydrogen 2.922 N/A LEU 368.A N ALA 364.A O no hydrogen 3.132 N/A ILE 369.A N ALA 365.A O no hydrogen 2.798 N/A GLU 370.A N ASP 366.A O no hydrogen 2.757 N/A HIS 371.A N GLU 367.A O no hydrogen 3.101 N/A PHE 372.A N LEU 368.A O no hydrogen 2.813 N/A GLU 373.A N ILE 369.A O no hydrogen 2.472 N/A SER 374.A N PHE 372.A O no hydrogen 2.742 N/A GLY 377.A N SER 374.A OG no hydrogen 3.065 N/A ILE 378.A N SER 374.A O no hydrogen 3.075 N/A LEU 379.A N ILE 375.A O no hydrogen 2.912 N/A ALA 380.A N ALA 376.A O no hydrogen 2.830 N/A THR 381.A N ILE 378.A O no hydrogen 3.111 N/A THR 381.A OG1 GLY 377.A O no hydrogen 2.927 N/A LEU 383.A N GLY 430.A O no hydrogen 2.834 N/A GLU 385.A N ASP 382.A O no hydrogen 2.887 N/A ILE 386.A N ASP 382.A O no hydrogen 3.293 N/A GLU 387.A N LEU 383.A O no hydrogen 2.989 N/A ARG 388.A N.A GLU 384.A O no hydrogen 2.944 N/A ARG 388.A N.B GLU 384.A O no hydrogen 2.953 N/A ARG 388.A NE.A GLU 385.A OE1 no hydrogen 3.554 N/A ARG 388.A NE.A GLU 385.A OE2 no hydrogen 2.809 N/A ARG 388.A NH1.B GLU 385.A OE1 no hydrogen 2.932 N/A ARG 388.A NH2.A GLU 385.A OE2 no hydrogen 2.955 N/A MET 389.A N GLU 385.A O no hydrogen 2.903 N/A TYR 390.A N ILE 386.A O no hydrogen 3.024 N/A TYR 390.A OH GLU 397.A OE2 no hydrogen 3.324 N/A GLU 391.A N GLU 387.A O no hydrogen 2.832 N/A GLU 392.A N ARG 388.A O.A no hydrogen 2.792 N/A GLU 392.A N ARG 388.A O.B no hydrogen 2.771 N/A GLY 393.A N TYR 390.A O no hydrogen 3.158 N/A ARG 394.A N MET 389.A O no hydrogen 2.922 N/A ARG 394.A NE GLU 392.A OE1 no hydrogen 3.084 N/A ARG 394.A NH2 GLU 392.A OE1 no hydrogen 2.992 N/A SER 396.A N GLU 367.A OE2 no hydrogen 2.739 N/A SER 396.A OG GLU 367.A OE1 no hydrogen 2.540 N/A SER 396.A OG GLU 367.A OE2 no hydrogen 3.194 N/A TYR 400.A N SER 396.A O no hydrogen 2.856 N/A ARG 401.A N GLU 397.A O no hydrogen 2.721 N/A ALA 402.A N GLU 398.A O.A no hydrogen 3.099 N/A ALA 402.A N GLU 398.A O.B no hydrogen 3.054 N/A ALA 403.A N ALA 399.A O no hydrogen 2.852 N/A VAL 404.A N TYR 400.A O no hydrogen 2.989 N/A GLU 405.A N ARG 401.A O no hydrogen 3.028 N/A ILE 406.A N ALA 402.A O no hydrogen 2.938 N/A GLN 407.A N ALA 403.A O no hydrogen 3.139 N/A GLN 407.A NE2 ILE 378.A O no hydrogen 2.938 N/A GLN 407.A NE2 THR 381.A O no hydrogen 2.634 N/A LEU 408.A N VAL 404.A O no hydrogen 2.867 N/A ALA 409.A N GLU 405.A O no hydrogen 3.003 N/A GLU 410.A N ILE 406.A O no hydrogen 3.370 N/A LEU 411.A N LEU 408.A O no hydrogen 3.011 N/A THR 412.A N LEU 408.A O no hydrogen 2.881 N/A THR 412.A OG1 LEU 408.A O no hydrogen 3.276 N/A LYS 413.A N ALA 409.A O no hydrogen 3.319 N/A LYS 413.A NZ GLU 410.A OE1 no hydrogen 3.158 N/A LYS 414.A N LEU 411.A O no hydrogen 3.217 N/A VAL 417.A N LYS 414.A O no hydrogen 3.088 N/A ARG 419.A NH2 GLU 405.A OE1 no hydrogen 3.076 N/A ALA 422.A N GLY 418.A O no hydrogen 2.965 N/A GLU 423.A N ARG 419.A O no hydrogen 2.729 N/A ARG 424.A N LYS 420.A O no hydrogen 2.943 N/A ARG 424.A NE GLU 451.A O no hydrogen 2.777 N/A ARG 424.A NH2 GLU 451.A O no hydrogen 3.035 N/A LEU 425.A N THR 421.A O no hydrogen 3.073 N/A LEU 426.A N ALA 422.A O no hydrogen 3.074 N/A ARG 427.A N GLU 423.A O no hydrogen 3.236 N/A ARG 427.A NE GLU 384.A OE1 no hydrogen 3.134 N/A ARG 427.A NH1 GLU 423.A OE1 no hydrogen 2.761 N/A ARG 427.A NH2 GLU 387.A OE1 no hydrogen 2.634 N/A ALA 428.A N ARG 424.A O no hydrogen 2.912 N/A PHE 429.A N LEU 425.A O no hydrogen 3.018 N/A GLY 430.A N LEU 426.A O no hydrogen 2.769 N/A ASN 431.A ND2 GLU 219.A OE1 no hydrogen 3.084 N/A ASN 431.A ND2 ASP 382.A OD1 no hydrogen 3.169 N/A ARG 434.A N ASN 431.A OD1 no hydrogen 2.720 N/A VAL 435.A N ASN 431.A O no hydrogen 3.159 N/A LYS 436.A N PRO 432.A O no hydrogen 2.996 N/A LYS 436.A NZ GLU 410.A O no hydrogen 3.528 N/A LYS 436.A NZ GLU 410.A OE2 no hydrogen 2.625 N/A GLN 437.A N GLU 433.A O no hydrogen 3.126 N/A GLN 437.A NE2 PRO 218.A O no hydrogen 2.693 N/A LEU 438.A N ARG 434.A O no hydrogen 3.271 N/A ALA 439.A N VAL 435.A O no hydrogen 3.247 N/A ARG 440.A N LYS 436.A O no hydrogen 3.022 N/A GLU 441.A N GLN 437.A O no hydrogen 3.071 N/A PHE 442.A N ALA 439.A O no hydrogen 3.071 N/A GLU 443.A N LEU 438.A O no hydrogen 3.022 N/A ILE 444.A N PHE 442.A O no hydrogen 2.768 N/A GLU 445.A N GLU 480.A OE1 no hydrogen 3.194 N/A LEU 447.A N GLU 443.A O no hydrogen 3.155 N/A ALA 448.A N ILE 444.A O no hydrogen 2.945 N/A SER 449.A N GLU 445.A O no hydrogen 3.198 N/A SER 449.A OG LYS 446.A O no hydrogen 2.805 N/A VAL 450.A N LEU 447.A O no hydrogen 3.054 N/A VAL 453.A N VAL 450.A O no hydrogen 3.138 N/A ARG 456.A NE GLU 415.A OE2 no hydrogen 3.394 N/A LEU 458.A N GLY 454.A O no hydrogen 2.907 N/A ARG 459.A N GLU 455.A O no hydrogen 2.792 N/A SER 460.A N ARG 456.A O no hydrogen 3.339 N/A SER 460.A OG GLU 415.A O no hydrogen 2.657 N/A SER 460.A OG ARG 456.A O no hydrogen 3.106 N/A SER 460.A OG VAL 457.A O no hydrogen 2.946 N/A LEU 461.A N VAL 457.A O no hydrogen 2.875 N/A VAL 462.A N LEU 458.A O no hydrogen 2.988 N/A TYR 465.A N VAL 462.A O no hydrogen 3.232 N/A TYR 465.A OH GLU 455.A OE1 no hydrogen 2.896 N/A LEU 468.A N GLY 464.A O no hydrogen 3.287 N/A ILE 469.A N TYR 465.A O no hydrogen 2.969 N/A SER 470.A N ALA 466.A O no hydrogen 3.356 N/A SER 470.A OG ALA 466.A O no hydrogen 2.819 N/A SER 470.A OG SER 467.A O no hydrogen 2.822 N/A ILE 471.A N LEU 468.A O no hydrogen 3.263 N/A ILE 474.A N ILE 471.A O no hydrogen 3.370 N/A ARG 476.A NE GLU 455.A OE1 no hydrogen 3.393 N/A ARG 476.A NE TYR 465.A OH no hydrogen 3.455 N/A ARG 476.A NH2 GLU 455.A OE1 no hydrogen 2.772 N/A ARG 478.A N ASP 475.A OD1 no hydrogen 2.800 N/A ALA 479.A N ASP 475.A O no hydrogen 2.953 N/A GLU 480.A N ARG 476.A O no hydrogen 3.043 N/A ARG 481.A N GLU 477.A O no hydrogen 2.984 N/A LEU 482.A N ARG 478.A O no hydrogen 2.745 N/A LEU 483.A N ALA 479.A O no hydrogen 2.970 N/A LYS 484.A N GLU 480.A O no hydrogen 2.870 N/A LYS 484.A NZ GLU 443.A OE1 no hydrogen 2.703 N/A LYS 484.A NZ GLU 480.A OE2 no hydrogen 3.071 N/A LYS 485.A N ARG 481.A O no hydrogen 2.934 N/A LYS 485.A NZ TYR 486.A OH no hydrogen 3.194 N/A LYS 485.A NZ ASP 503.A OD1 no hydrogen 3.256 N/A LYS 485.A NZ ASP 503.A OD2 no hydrogen 2.653 N/A TYR 486.A N LEU 482.A O no hydrogen 3.206 N/A TYR 486.A OH ASP 503.A OD1 no hydrogen 2.603 N/A GLY 487.A N LEU 483.A O no hydrogen 2.986 N/A GLY 488.A N LEU 483.A O no hydrogen 3.095 N/A VAL 492.A N GLY 488.A O no hydrogen 2.902 N/A ARG 493.A N TYR 489.A O no hydrogen 2.688 N/A ARG 493.A NE LEU 513.A O no hydrogen 3.035 N/A GLU 494.A N SER 490.A O no hydrogen 3.037 N/A ALA 495.A N VAL 492.A O no hydrogen 3.059 N/A GLY 496.A N GLU 499.A OE2 no hydrogen 2.990 N/A GLU 498.A N GLU 498.A OE2 no hydrogen 2.761 N/A LEU 500.A N GLY 496.A O no hydrogen 3.193 N/A ARG 501.A N VAL 497.A O no hydrogen 3.107 N/A ARG 501.A NE ASP 507.A OD2 no hydrogen 2.865 N/A ARG 501.A NH2 ASP 507.A OD2 no hydrogen 3.334 N/A GLU 502.A N GLU 498.A O no hydrogen 3.255 N/A ASP 503.A N GLU 499.A O no hydrogen 3.049 N/A GLY 504.A N ARG 501.A O no hydrogen 2.751 N/A LEU 505.A N LEU 500.A O no hydrogen 3.154 N/A THR 506.A N GLN 509.A OE1 no hydrogen 2.866 N/A GLN 509.A N THR 506.A OG1 no hydrogen 3.251 N/A GLN 509.A NE2 ARG 472.A O no hydrogen 3.076 N/A ILE 510.A N THR 506.A O no hydrogen 3.126 N/A ARG 511.A N ASP 507.A O no hydrogen 2.882 N/A ARG 511.A NH1 GLU 520.A OE1 no hydrogen 2.910 N/A GLU 512.A N ALA 508.A O no hydrogen 3.069 N/A LEU 513.A N GLN 509.A O no hydrogen 3.052 N/A LYS 514.A N ILE 510.A O no hydrogen 3.156 N/A LYS 514.A NZ ARG 493.A O no hydrogen 3.428 N/A LYS 514.A NZ ALA 495.A O no hydrogen 2.878 N/A LYS 514.A NZ ASP 530.A OD1 no hydrogen 2.952 N/A LYS 514.A NZ ASP 530.A OD2 no hydrogen 2.754 N/A GLY 515.A N ARG 511.A O no hydrogen 2.840 N/A LEU 516.A N ARG 511.A O no hydrogen 3.372 N/A GLU 520.A N LEU 516.A O no hydrogen 3.290 N/A SER 521.A N LYS 517.A O no hydrogen 3.176 N/A SER 521.A OG LYS 517.A O no hydrogen 3.275 N/A ILE 522.A N THR 518.A O no hydrogen 3.331 N/A VAL 523.A N LEU 519.A O no hydrogen 2.875 N/A GLU 527.A N ASP 525.A OD1 no hydrogen 2.624 N/A ASP 530.A N LEU 526.A O no hydrogen 3.020 N/A GLU 531.A N GLU 527.A O no hydrogen 2.865 N/A LEU 532.A N LYS 528.A O no hydrogen 2.849 N/A LYS 533.A N ALA 529.A O no hydrogen 2.666 N/A LYS 533.A NZ LYS 514.A O no hydrogen 2.834 N/A ARG 534.A N ASP 530.A O no hydrogen 2.877 N/A ARG 534.A NE ASP 530.A OD1 no hydrogen 3.160 N/A ARG 534.A NH2 ASP 530.A OD1 no hydrogen 3.162 N/A TYR 536.A N LEU 532.A O no hydrogen 3.269 N/A TYR 536.A OH GLU 549.A OE2 no hydrogen 3.212 N/A ALA 541.A N SER 538.A O no hydrogen 3.202 N/A VAL 542.A N SER 538.A O no hydrogen 3.267 N/A ARG 543.A N ALA 539.A O no hydrogen 3.123 N/A ARG 543.A NH1 ILE 563.A O no hydrogen 3.089 N/A ARG 544.A N ALA 541.A O no hydrogen 3.242 N/A LEU 545.A N VAL 542.A O no hydrogen 3.307 N/A LEU 550.A N PRO 546.A O no hydrogen 3.021 N/A ARG 551.A N VAL 547.A O no hydrogen 3.015 N/A ARG 551.A NH1 ASP 557.A OD2 no hydrogen 2.763 N/A GLU 552.A N GLU 548.A O no hydrogen 2.745 N/A GLU 559.A N SER 556.A OG no hydrogen 2.946 N/A ILE 560.A N SER 556.A O no hydrogen 3.091 N/A ALA 561.A N ASP 557.A O no hydrogen 2.891 N/A GLU 562.A N ASP 558.A O no hydrogen 2.884 N/A ILE 563.A N GLU 559.A O no hydrogen 2.872 N/A LYS 564.A N ILE 560.A O no hydrogen 3.235 N/A LYS 564.A NZ ARG 543.A O no hydrogen 2.444 N/A LYS 564.A NZ LEU 545.A O no hydrogen 2.734 N/A GLY 565.A N GLU 562.A O no hydrogen 3.262 N/A ILE 566.A N ALA 561.A O no hydrogen 2.979 N/A LYS 568.A NZ GLU 572.A OE2 no hydrogen 2.675 N/A ARG 571.A N PRO 567.A O no hydrogen 3.033 N/A GLU 572.A N LYS 568.A O no hydrogen 2.845 N/A THR 578.A OG1 ASP 575.A O no hydrogen 3.471 N/A THR 578.A OG1 ASP 575.A OD1 no hydrogen 2.687 N/A ALA 579.A N ASP 575.A O no hydrogen 3.076 N/A ALA 580.A N LEU 576.A O no hydrogen 2.919 N/A LEU 582.A N THR 578.A O no hydrogen 3.093 N/A TYR 583.A N ALA 579.A O no hydrogen 3.088 N/A GLU 584.A N ALA 580.A O no hydrogen 3.188 N/A ARG 585.A N GLU 581.A O no hydrogen 2.954 N/A TYR 586.A N LEU 582.A O no hydrogen 3.039 N/A GLY 587.A N TYR 583.A O no hydrogen 2.668 N/A SER 588.A N TYR 586.A O no hydrogen 2.960 N/A GLU 591.A N SER 588.A OG no hydrogen 2.747 N/A GLY 593.A N LYS 590.A O no hydrogen 3.053 N/A ARG 594.A N GLU 591.A O no hydrogen 2.585 N/A ARG 595.A NE TYR 586.A OH no hydrogen 3.299 N/A ARG 595.A NH2 TYR 586.A OH no hydrogen 2.886 N/A ASP 599.A N LEU 596.A O no hydrogen 3.238 N/A ALA 606.A N LEU 604.A O no hydrogen 2.740 N/A ALA 610.A N THR 607.A O no hydrogen 3.021 N/A