Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 2d7d_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): PHE 3.A N ASN 55.A OD1 no hydrogen 3.021 N/A GLU 4.A N ASN 82.A OD1 no hydrogen 2.931 N/A VAL 6.A N PHE 78.A O no hydrogen 2.623 N/A TYR 9.A N SER 7.A OG no hydrogen 2.796 N/A GLN 10.A NE2 GLN 12.A OE1 no hydrogen 3.640 N/A GLN 12.A N GLN 15.A OE1 no hydrogen 3.084 N/A GLN 15.A N GLN 12.A O no hydrogen 3.076 N/A GLN 15.A NE2 THR 41.A O no hydrogen 3.078 N/A GLN 15.A NE2 GLY 42.A O no hydrogen 3.441 N/A ALA 18.A N ASP 14.A O no hydrogen 3.097 N/A ILE 19.A N GLN 15.A O no hydrogen 2.843 N/A GLU 20.A N PRO 16.A O no hydrogen 2.906 N/A LYS 21.A N LYS 17.A O no hydrogen 2.967 N/A LEU 22.A N ALA 18.A O no hydrogen 3.140 N/A VAL 23.A N ILE 19.A O no hydrogen 2.987 N/A LYS 24.A N GLU 20.A O no hydrogen 2.969 N/A LYS 24.A NZ GLU 20.A OE2 no hydrogen 2.887 N/A GLY 25.A N LYS 21.A O no hydrogen 2.788 N/A ILE 26.A N LEU 22.A O no hydrogen 3.065 N/A GLN 27.A N VAL 23.A O no hydrogen 2.930 N/A GLU 28.A N LYS 24.A O no hydrogen 2.772 N/A GLY 29.A N ILE 26.A O no hydrogen 2.782 N/A LYS 30.A N GLY 25.A O no hydrogen 3.058 N/A HIS 32.A ND1 TYR 389.A OH no hydrogen 2.789 N/A GLN 33.A N ILE 387.A O no hydrogen 2.979 N/A GLN 33.A NE2 LEU 22.A O no hydrogen 3.093 N/A THR 34.A OG1 THR 402.A OG1 no hydrogen 2.650 N/A LEU 35.A N TYR 389.A O no hydrogen 2.765 N/A LEU 36.A N VAL 406.A O no hydrogen 2.560 N/A ALA 38.A N GLN 408.A O no hydrogen 3.087 N/A THR 41.A OG1 ALA 38.A O no hydrogen 2.941 N/A LYS 43.A NZ GLY 37.A O no hydrogen 2.933 N/A THR 44.A OG1 GLU 74.A OE2 no hydrogen 2.641 N/A THR 46.A N GLY 42.A O no hydrogen 2.997 N/A THR 46.A OG1 GLY 42.A O no hydrogen 3.404 N/A THR 46.A OG1 GLN 408.A OE1 no hydrogen 2.550 N/A VAL 47.A N LYS 43.A O no hydrogen 2.943 N/A SER 48.A N THR 44.A O no hydrogen 3.003 N/A ASN 49.A N PHE 45.A O no hydrogen 3.005 N/A ASN 49.A ND2 PHE 45.A O no hydrogen 2.908 N/A LEU 50.A N THR 46.A O no hydrogen 2.983 N/A ILE 51.A N VAL 47.A O no hydrogen 2.770 N/A LYS 52.A N SER 48.A O no hydrogen 3.054 N/A GLU 53.A N ASN 49.A O no hydrogen 3.126 N/A VAL 54.A N LEU 50.A O no hydrogen 3.031 N/A ASN 55.A N ILE 51.A O no hydrogen 3.020 N/A LYS 56.A NZ ASP 330.A OD2 no hydrogen 2.829 N/A THR 58.A N VAL 134.A O no hydrogen 2.940 N/A LEU 59.A N MET 332.A O no hydrogen 2.825 N/A VAL 60.A N ILE 136.A O no hydrogen 2.657 N/A ILE 61.A N VAL 334.A O no hydrogen 2.850 N/A ALA 62.A N ALA 138.A O no hydrogen 2.893 N/A ASN 64.A ND2 GLU 505.A OE2 no hydrogen 2.882 N/A LEU 67.A N ASN 64.A OD1 no hydrogen 2.808 N/A ALA 68.A N ASN 64.A O no hydrogen 2.975 N/A GLY 69.A N LYS 65.A O no hydrogen 2.873 N/A GLN 70.A N THR 66.A O no hydrogen 3.022 N/A LEU 71.A N LEU 67.A O no hydrogen 2.772 N/A TYR 72.A N ALA 68.A O no hydrogen 2.947 N/A SER 73.A N GLY 69.A O no hydrogen 2.923 N/A SER 73.A OG GLY 69.A O no hydrogen 2.947 N/A PHE 75.A N LEU 71.A O no hydrogen 2.845 N/A LYS 76.A N TYR 72.A O no hydrogen 3.030 N/A PHE 78.A N GLU 74.A O no hydrogen 2.977 N/A PHE 79.A N PHE 75.A O no hydrogen 2.839 N/A ASN 81.A ND2 GLU 4.A OE1 no hydrogen 3.318 N/A ASN 81.A ND2 GLU 4.A OE2 no hydrogen 2.727 N/A ASN 82.A N PHE 79.A O no hydrogen 3.243 N/A ASN 82.A ND2 ARG 2.A O no hydrogen 2.932 N/A ASN 82.A ND2 ASP 133.A OD2 no hydrogen 2.806 N/A ALA 83.A N ASP 133.A O no hydrogen 2.901 N/A GLU 85.A N ILE 135.A O no hydrogen 2.702 N/A TYR 86.A OH LYS 65.A O no hydrogen 3.214 N/A PHE 87.A N ILE 137.A O no hydrogen 2.867 N/A TYR 91.A N SER 89.A OG no hydrogen 3.394 N/A ASP 92.A N SER 112.A O no hydrogen 2.587 N/A GLN 95.A N ASP 110.A O no hydrogen 2.525 N/A ALA 98.A N ILE 107.A O no hydrogen 3.078 N/A TYR 99.A OH ASP 104.A OD2 no hydrogen 2.491 N/A VAL 100.A N THR 105.A O no hydrogen 2.684 N/A THR 103.A N VAL 100.A O no hydrogen 2.951 N/A THR 103.A OG1 VAL 100.A O no hydrogen 3.565 N/A THR 103.A OG1 THR 105.A OG1 no hydrogen 3.122 N/A ASP 104.A N PRO 101.A O no hydrogen 3.167 N/A THR 105.A N VAL 100.A O no hydrogen 3.358 N/A THR 105.A OG1 THR 103.A OG1 no hydrogen 3.122 N/A ILE 107.A N ALA 98.A O no hydrogen 2.603 N/A LYS 109.A NZ TYR 91.A OH no hydrogen 3.469 N/A LYS 109.A NZ GLU 305.A OE1 no hydrogen 2.937 N/A ASP 110.A N GLN 95.A O no hydrogen 2.855 N/A SER 112.A N TYR 93.A O no hydrogen 3.379 N/A ASN 114.A N TYR 90.A O no hydrogen 2.683 N/A ASN 114.A ND2 ASP 92.A OD1 no hydrogen 2.707 N/A ASN 114.A ND2 ASP 92.A OD2 no hydrogen 3.460 N/A ILE 117.A N ASN 114.A OD1 no hydrogen 2.870 N/A ASP 118.A N ASN 114.A O no hydrogen 3.177 N/A LYS 119.A N ASP 115.A O no hydrogen 3.068 N/A LYS 119.A NZ ASP 206.A OD1 no hydrogen 3.271 N/A LYS 119.A NZ ASP 206.A OD2 no hydrogen 3.330 N/A LEU 120.A N GLU 116.A O no hydrogen 2.953 N/A ARG 121.A N ILE 117.A O no hydrogen 2.991 N/A ARG 121.A NH2 VAL 88.A O no hydrogen 2.956 N/A ARG 121.A NH2 SER 141.A OG no hydrogen 2.930 N/A HIS 122.A N ASP 118.A O no hydrogen 2.985 N/A HIS 122.A ND1 ASP 118.A O no hydrogen 3.226 N/A SER 123.A N LYS 119.A O no hydrogen 2.848 N/A SER 123.A OG GLU 85.A OE1 no hydrogen 2.553 N/A ALA 124.A N LEU 120.A O no hydrogen 2.882 N/A THR 125.A N ARG 121.A O no hydrogen 3.158 N/A THR 125.A OG1 HIS 122.A O no hydrogen 3.528 N/A THR 125.A OG1 TYR 152.A OH no hydrogen 2.762 N/A THR 125.A OG1 HIS 246.A NE2 no hydrogen 2.696 N/A SER 126.A N HIS 122.A O no hydrogen 3.129 N/A SER 126.A OG HIS 122.A O no hydrogen 2.831 N/A SER 126.A OG SER 123.A O no hydrogen 3.199 N/A ALA 127.A N SER 123.A O no hydrogen 3.087 N/A PHE 129.A N SER 126.A O no hydrogen 2.986 N/A GLU 130.A N ALA 127.A O no hydrogen 2.994 N/A ARG 131.A N ALA 127.A O no hydrogen 3.046 N/A ARG 131.A NH1 ASN 81.A O no hydrogen 3.468 N/A ARG 131.A NH1 ASP 133.A OD1 no hydrogen 3.525 N/A ARG 131.A NH1 ASP 133.A OD2 no hydrogen 2.805 N/A ARG 132.A N ASP 1.A OD2 no hydrogen 2.997 N/A ARG 132.A NH2 ASP 330.A OD1 no hydrogen 3.264 N/A ASP 133.A N ASP 133.A OD1 no hydrogen 2.631 N/A VAL 134.A N ARG 132.A O no hydrogen 2.972 N/A ILE 135.A N ALA 83.A O no hydrogen 2.897 N/A ILE 136.A N THR 58.A O no hydrogen 2.955 N/A ILE 137.A N GLU 85.A O no hydrogen 2.928 N/A ALA 138.A N VAL 60.A O no hydrogen 2.878 N/A SER 139.A N PHE 87.A O no hydrogen 3.095 N/A SER 141.A N SER 139.A OG no hydrogen 3.199 N/A CYS 142.A N SER 139.A O no hydrogen 2.942 N/A CYS 142.A SG SER 139.A O no hydrogen 3.327 N/A ILE 143.A N VAL 140.A O no hydrogen 2.972 N/A TYR 144.A N SER 141.A O no hydrogen 3.106 N/A LEU 146.A N TYR 321.A O no hydrogen 2.541 N/A GLY 147.A N HIS 246.A O no hydrogen 2.781 N/A GLU 151.A N SER 148.A OG no hydrogen 3.419 N/A TYR 152.A N SER 148.A O no hydrogen 2.926 N/A ARG 153.A N PRO 149.A O no hydrogen 2.752 N/A GLU 154.A N GLU 150.A O no hydrogen 2.801 N/A MET 155.A N GLU 151.A O no hydrogen 2.635 N/A MET 155.A N TYR 152.A O no hydrogen 3.141 N/A VAL 156.A N ARG 153.A O no hydrogen 3.395 N/A VAL 157.A N ILE 241.A O no hydrogen 2.979 N/A LEU 159.A N VAL 239.A O no hydrogen 2.843 N/A THR 161.A N ASP 237.A O no hydrogen 2.996 N/A GLU 162.A N ILE 219.A O no hydrogen 2.892 N/A MET 163.A N ARG 160.A O no hydrogen 3.143 N/A ILE 165.A N ASP 217.A O no hydrogen 3.124 N/A GLU 166.A N GLU 169.A OE1 no hydrogen 3.092 N/A ARG 167.A NE ASN 168.A OD1 no hydrogen 3.097 N/A ARG 167.A NH1 GLY 195.A O no hydrogen 2.745 N/A ARG 167.A NH2 ASN 168.A OD1 no hydrogen 2.919 N/A LEU 170.A N GLU 166.A O no hydrogen 3.149 N/A LEU 171.A N ARG 167.A O no hydrogen 3.107 N/A ARG 172.A N ASN 168.A O no hydrogen 3.049 N/A LYS 173.A N GLU 169.A O no hydrogen 3.062 N/A LEU 174.A N LEU 170.A O no hydrogen 2.978 N/A VAL 175.A N LEU 171.A O no hydrogen 3.017 N/A ASP 176.A N ARG 172.A O no hydrogen 3.002 N/A ILE 177.A N LYS 173.A O no hydrogen 3.171 N/A ILE 177.A N LEU 174.A O no hydrogen 3.170 N/A GLN 178.A N VAL 175.A O no hydrogen 2.867 N/A TYR 179.A N LEU 174.A O no hydrogen 2.966 N/A TYR 179.A OH PHE 242.A O no hydrogen 2.940 N/A ALA 180.A N GLY 189.A O no hydrogen 3.211 N/A ARG 181.A NE ASP 183.A OD1 no hydrogen 2.947 N/A ARG 181.A NE ASP 183.A OD2 no hydrogen 3.184 N/A ARG 181.A NH2 ASP 183.A OD2 no hydrogen 3.016 N/A ASN 182.A N PHE 191.A O no hydrogen 2.938 N/A ILE 184.A N ASN 182.A OD1 no hydrogen 3.205 N/A ASP 185.A N ASN 182.A OD1 no hydrogen 2.759 N/A GLN 187.A NE2 ASP 185.A O no hydrogen 3.104 N/A ARG 188.A NE ASP 115.A OD1 no hydrogen 3.248 N/A ARG 188.A NH1 ASP 118.A OD1 no hydrogen 3.408 N/A ARG 188.A NH1 ALA 203.A O no hydrogen 2.743 N/A ARG 188.A NH2 ASP 115.A OD2 no hydrogen 3.190 N/A ARG 188.A NH2 ASP 118.A OD1 no hydrogen 2.726 N/A GLY 189.A N PHE 201.A O no hydrogen 2.902 N/A THR 190.A OG1 ALA 180.A O no hydrogen 3.496 N/A PHE 191.A N ALA 180.A O no hydrogen 2.995 N/A ARG 192.A N GLU 199.A O no hydrogen 2.835 N/A ARG 192.A NE GLU 199.A OE1 no hydrogen 2.956 N/A ARG 192.A NH2 GLU 199.A OE1 no hydrogen 3.056 N/A ARG 192.A NH2 ALA 227.A O no hydrogen 3.271 N/A VAL 193.A N ASP 183.A OD1 no hydrogen 3.100 N/A ARG 194.A N VAL 197.A O no hydrogen 2.808 N/A ARG 194.A NH1 GLU 199.A OE2 no hydrogen 3.191 N/A ARG 194.A NH2 GLU 199.A OE1 no hydrogen 2.802 N/A ARG 194.A NH2 GLU 199.A OE2 no hydrogen 3.285 N/A VAL 197.A N ARG 194.A O no hydrogen 2.936 N/A VAL 198.A N VAL 212.A O no hydrogen 2.991 N/A GLU 199.A N ARG 192.A O no hydrogen 2.779 N/A ILE 200.A N VAL 210.A O no hydrogen 2.799 N/A PHE 201.A N THR 190.A O no hydrogen 2.868 N/A ALA 203.A N TYR 179.A OH no hydrogen 3.358 N/A ARG 205.A N PRO 202.A O no hydrogen 3.154 N/A ARG 205.A NH1 GLU 207.A OE2 no hydrogen 3.567 N/A ASP 206.A N GLU 207.A OE1 no hydrogen 2.793 N/A CYS 209.A N VAL 225.A O no hydrogen 2.870 N/A CYS 209.A SG VAL 225.A O no hydrogen 3.874 N/A VAL 210.A N ILE 200.A O no hydrogen 2.886 N/A ARG 211.A N ARG 223.A O no hydrogen 2.923 N/A ARG 211.A NH1 GLU 199.A OE2 no hydrogen 2.668 N/A ARG 211.A NH2 GLY 230.A O no hydrogen 2.929 N/A VAL 212.A N VAL 198.A O no hydrogen 2.732 N/A GLU 213.A N ARG 221.A O no hydrogen 2.954 N/A PHE 214.A N ASP 196.A O no hydrogen 2.759 N/A PHE 215.A N GLU 218.A O no hydrogen 2.847 N/A ILE 219.A N MET 163.A O no hydrogen 2.964 N/A GLU 220.A N GLU 213.A O no hydrogen 2.697 N/A ARG 221.A NE GLU 213.A OE2 no hydrogen 3.038 N/A ARG 223.A N ARG 211.A O no hydrogen 2.993 N/A ARG 223.A NE ASP 235.A OD2 no hydrogen 3.111 N/A ARG 223.A NH2 ASP 235.A OD2 no hydrogen 3.211 N/A GLU 224.A N GLY 234.A O no hydrogen 2.896 N/A VAL 225.A N CYS 209.A O no hydrogen 3.019 N/A ASP 226.A N GLU 231.A O no hydrogen 3.001 N/A THR 229.A N ASP 226.A OD2 no hydrogen 3.345 N/A THR 229.A OG1 ASP 226.A OD2 no hydrogen 3.147 N/A GLY 230.A N ASP 226.A O no hydrogen 2.845 N/A LEU 233.A N GLU 224.A O no hydrogen 2.710 N/A GLY 234.A N GLU 224.A O no hydrogen 3.372 N/A ARG 236.A N ILE 222.A O no hydrogen 2.939 N/A ARG 236.A NH1 GLU 224.A OE2 no hydrogen 3.258 N/A ASP 237.A N ASP 237.A OD1 no hydrogen 2.514 N/A VAL 239.A N LEU 159.A O no hydrogen 2.739 N/A ILE 241.A N VAL 157.A O no hydrogen 3.057 N/A ALA 244.A N ILE 177.A O no hydrogen 3.006 N/A SER 245.A OG PHE 247.A O no hydrogen 3.087 N/A HIS 246.A NE2 THR 125.A OG1 no hydrogen 2.696 N/A PHE 247.A N SER 245.A OG no hydrogen 3.052 N/A ARG 250.A NE ASP 176.A OD1 no hydrogen 3.289 N/A ARG 250.A NE ASP 176.A OD2 no hydrogen 3.469 N/A ARG 250.A NH2 ASP 176.A OD2 no hydrogen 3.217 N/A MET 254.A N ARG 250.A O no hydrogen 3.251 N/A GLU 255.A N ALA 251.A O no hydrogen 3.280 N/A LYS 256.A N GLU 252.A O no hydrogen 3.450 N/A ALA 257.A N LYS 253.A O no hydrogen 2.817 N/A ILE 258.A N MET 254.A O no hydrogen 2.947 N/A GLN 259.A N GLU 255.A O no hydrogen 3.139 N/A ASN 260.A N LYS 256.A O no hydrogen 2.976 N/A ILE 261.A N ALA 257.A O no hydrogen 2.828 N/A GLU 262.A N ILE 258.A O no hydrogen 3.087 N/A LYS 263.A N GLN 259.A O no hydrogen 3.226 N/A LYS 263.A NZ GLU 267.A OE2 no hydrogen 3.318 N/A GLU 264.A N ASN 260.A O no hydrogen 3.001 N/A LEU 265.A N ILE 261.A O no hydrogen 2.881 N/A GLU 266.A N GLU 262.A O no hydrogen 2.797 N/A GLU 267.A N LYS 263.A O no hydrogen 2.993 N/A GLN 268.A N GLU 264.A O no hydrogen 3.026 N/A LEU 269.A N LEU 265.A O no hydrogen 2.915 N/A LYS 270.A N GLU 266.A O no hydrogen 3.443 N/A LYS 270.A NZ GLU 267.A OE2 no hydrogen 3.206 N/A VAL 271.A N GLU 267.A O no hydrogen 3.336 N/A MET 272.A N GLN 268.A O no hydrogen 3.051 N/A HIS 273.A N LEU 269.A O no hydrogen 3.010 N/A GLU 274.A N LYS 270.A O no hydrogen 3.226 N/A ASN 275.A N VAL 271.A O no hydrogen 3.246 N/A GLY 276.A N HIS 273.A O no hydrogen 2.861 N/A LYS 277.A N MET 272.A O no hydrogen 2.702 N/A GLU 280.A N GLU 280.A OE1 no hydrogen 2.705 N/A ALA 281.A N LYS 277.A O no hydrogen 2.930 N/A GLN 282.A N LEU 278.A O no hydrogen 3.047 N/A ARG 283.A N LEU 279.A O no hydrogen 3.000 N/A ARG 283.A NH1 HIS 362.A O no hydrogen 3.086 N/A LEU 284.A N GLU 280.A O no hydrogen 3.022 N/A GLU 285.A N ALA 281.A O no hydrogen 3.076 N/A GLN 286.A N GLN 282.A O no hydrogen 3.024 N/A ARG 287.A N ARG 283.A O no hydrogen 3.061 N/A ARG 287.A NH1 PHE 364.A O no hydrogen 3.225 N/A THR 288.A N LEU 284.A O no hydrogen 2.898 N/A THR 288.A OG1 LEU 284.A O no hydrogen 2.703 N/A ARG 289.A N GLU 285.A O no hydrogen 3.084 N/A ARG 289.A NE GLU 285.A OE2 no hydrogen 3.364 N/A TYR 290.A N GLN 286.A O no hydrogen 3.055 N/A ASP 291.A N ARG 287.A O no hydrogen 2.969 N/A LEU 292.A N THR 288.A O no hydrogen 2.895 N/A GLU 293.A N ARG 289.A O no hydrogen 3.066 N/A MET 294.A N TYR 290.A O no hydrogen 3.138 N/A MET 295.A N ASP 291.A O no hydrogen 3.168 N/A ARG 296.A N LEU 292.A O no hydrogen 3.191 N/A ARG 296.A NH1 GLU 262.A OE1 no hydrogen 2.679 N/A ARG 296.A NH2 GLU 262.A OE1 no hydrogen 2.878 N/A ARG 296.A NH2 GLU 262.A OE2 no hydrogen 2.981 N/A GLU 297.A N GLU 293.A O no hydrogen 2.883 N/A MET 298.A N MET 294.A O no hydrogen 2.659 N/A GLY 299.A N MET 295.A O no hydrogen 2.767 N/A CYS 301.A SG ASP 291.A O no hydrogen 3.964 N/A CYS 301.A SG SER 302.A O no hydrogen 3.709 N/A GLU 305.A N GLU 305.A OE2 no hydrogen 2.798 N/A ASN 306.A N GLY 303.A O no hydrogen 3.159 N/A TYR 307.A N ILE 304.A O no hydrogen 2.875 N/A TYR 307.A OH ASP 291.A OD2 no hydrogen 2.740 N/A SER 308.A N GLU 305.A O no hydrogen 2.990 N/A SER 308.A OG GLU 305.A O no hydrogen 3.405 N/A ARG 309.A NE ASP 371.A OD2 no hydrogen 2.610 N/A ARG 309.A NH2 ASP 371.A OD2 no hydrogen 2.749 N/A HIS 310.A NE2 GLU 264.A OE2 no hydrogen 2.486 N/A LEU 311.A N TYR 307.A O no hydrogen 2.931 N/A THR 312.A N SER 308.A O no hydrogen 3.055 N/A THR 312.A OG1 SER 308.A O no hydrogen 2.955 N/A LEU 313.A N HIS 310.A O no hydrogen 2.862 N/A ARG 314.A NH1 THR 319.A O no hydrogen 3.487 N/A ARG 314.A NH2 THR 319.A O no hydrogen 2.506 N/A GLY 317.A N ASP 371.A OD1 no hydrogen 2.807 N/A SER 318.A N PRO 315.A O no hydrogen 3.375 N/A SER 318.A OG PRO 315.A O no hydrogen 2.545 N/A THR 319.A OG1 GLU 379.A OE2 no hydrogen 2.399 N/A THR 322.A N ASP 325.A OD2 no hydrogen 2.815 N/A THR 322.A OG1 CYS 142.A O no hydrogen 3.431 N/A LEU 324.A N THR 322.A OG1 no hydrogen 3.119 N/A ASP 325.A N THR 322.A O no hydrogen 2.857 N/A TYR 326.A N LEU 323.A O no hydrogen 2.773 N/A TYR 326.A OH GLY 147.A O no hydrogen 2.703 N/A MET 332.A N PRO 57.A O no hydrogen 3.120 N/A ILE 333.A N ASN 386.A O no hydrogen 2.952 N/A VAL 334.A N LEU 59.A O no hydrogen 2.806 N/A VAL 335.A N VAL 388.A O no hydrogen 2.799 N/A ASP 336.A N ILE 61.A O no hydrogen 2.969 N/A SER 338.A N VAL 390.A O no hydrogen 3.099 N/A SER 338.A OG GLU 398.A OE1 no hydrogen 2.771 N/A VAL 340.A N GLU 337.A O no hydrogen 2.876 N/A THR 341.A N GLU 337.A O no hydrogen 2.917 N/A THR 341.A OG1 ASP 336.A O no hydrogen 2.613 N/A THR 341.A OG1 GLU 337.A O no hydrogen 3.072 N/A ILE 342.A N SER 338.A O no hydrogen 2.882 N/A GLN 344.A N VAL 340.A O no hydrogen 3.207 N/A GLN 344.A NE2 HIS 63.A O no hydrogen 2.931 N/A VAL 345.A N THR 341.A O no hydrogen 2.879 N/A ARG 346.A N ILE 342.A O no hydrogen 3.136 N/A GLY 347.A N PRO 343.A O no hydrogen 2.849 N/A MET 348.A N GLN 344.A O no hydrogen 3.196 N/A ASN 350.A ND2 ARG 346.A O no hydrogen 3.176 N/A GLY 351.A N GLY 347.A O no hydrogen 3.070 N/A ASP 352.A N MET 348.A O no hydrogen 2.982 N/A GLN 353.A N PHE 349.A O no hydrogen 2.740 N/A ALA 354.A N ASN 350.A O no hydrogen 3.055 N/A ARG 355.A N GLY 351.A O no hydrogen 3.180 N/A ARG 355.A NE GLU 97.A O no hydrogen 2.861 N/A ARG 355.A NH2 GLU 97.A O no hydrogen 3.526 N/A LYS 356.A N ASP 352.A O no hydrogen 3.019 N/A LYS 356.A NZ ALA 369.A O no hydrogen 2.947 N/A GLN 357.A N GLN 353.A O no hydrogen 2.939 N/A VAL 358.A N ALA 354.A O no hydrogen 3.410 N/A VAL 360.A N LYS 356.A O no hydrogen 3.025 N/A ASP 361.A N GLN 357.A O no hydrogen 2.828 N/A HIS 362.A N VAL 358.A O no hydrogen 3.312 N/A GLY 363.A N VAL 360.A O no hydrogen 3.246 N/A PHE 364.A N LEU 359.A O no hydrogen 2.718 N/A ARG 365.A N LEU 359.A O no hydrogen 3.184 N/A ARG 365.A NE GLU 97.A OE2 no hydrogen 2.806 N/A ARG 365.A NH1 ASP 291.A OD2 no hydrogen 3.549 N/A ARG 365.A NH2 GLU 97.A OE1 no hydrogen 3.103 N/A SER 368.A N GLU 264.A OE1 no hydrogen 2.947 N/A SER 368.A OG GLU 264.A OE1 no hydrogen 3.395 N/A SER 368.A OG GLU 264.A OE2 no hydrogen 2.768 N/A SER 368.A OG HIS 310.A NE2 no hydrogen 3.199 N/A ALA 369.A N LEU 366.A O no hydrogen 3.005 N/A LEU 370.A N PRO 367.A O no hydrogen 3.005 N/A ASP 371.A N SER 368.A O no hydrogen 3.054 N/A ASN 372.A N ALA 369.A O no hydrogen 3.056 N/A ASN 372.A ND2 SER 308.A OG no hydrogen 2.744 N/A ARG 373.A NH1 PRO 374.A O no hydrogen 2.936 N/A ARG 373.A NH1 GLU 379.A OE1 no hydrogen 2.826 N/A ARG 373.A NH1 GLU 379.A OE2 no hydrogen 3.550 N/A ARG 373.A NH2 GLY 317.A O no hydrogen 3.499 N/A ARG 373.A NH2 GLU 379.A OE2 no hydrogen 2.834 N/A LEU 375.A N ILE 143.A O no hydrogen 2.939 N/A ARG 376.A N GLU 379.A OE1 no hydrogen 2.557 N/A ARG 376.A NH1 GLU 379.A OE2 no hydrogen 2.851 N/A PHE 380.A N ARG 376.A O no hydrogen 2.975 N/A GLU 381.A N PHE 377.A O no hydrogen 2.892 N/A HIS 383.A N PHE 380.A O no hydrogen 3.070 N/A MET 384.A N GLU 381.A O no hydrogen 3.034 N/A ILE 387.A N LYS 31.A O no hydrogen 2.744 N/A VAL 388.A N ILE 333.A O no hydrogen 2.905 N/A TYR 389.A N GLN 33.A O no hydrogen 2.825 N/A TYR 389.A OH HIS 32.A ND1 no hydrogen 2.789 N/A VAL 390.A N VAL 335.A O no hydrogen 2.824 N/A SER 391.A N LEU 35.A O no hydrogen 3.266 N/A SER 391.A OG HIS 339.A ND1 no hydrogen 2.928 N/A THR 393.A N SER 391.A OG no hydrogen 2.895 N/A THR 393.A OG1 THR 393.A O no hydrogen 2.484 N/A THR 393.A OG1 GLN 534.A OE1 no hydrogen 2.864 N/A GLY 395.A N GLU 398.A OE1 no hydrogen 2.768 N/A TYR 397.A OH GLU 381.A OE1 no hydrogen 2.671 N/A GLU 398.A N GLU 398.A OE2 no hydrogen 2.708 N/A ILE 399.A N GLY 395.A O no hydrogen 3.132 N/A GLU 400.A N PRO 396.A O no hydrogen 2.988 N/A HIS 401.A N TYR 397.A O no hydrogen 3.080 N/A HIS 401.A ND1 TYR 397.A O no hydrogen 3.101 N/A THR 402.A OG1 THR 34.A OG1 no hydrogen 2.650 N/A THR 402.A OG1 GLU 398.A O no hydrogen 2.606 N/A VAL 406.A N THR 34.A O no hydrogen 3.068 N/A GLN 408.A N LEU 36.A O no hydrogen 3.090 N/A GLN 408.A NE2 THR 41.A O no hydrogen 2.957 N/A GLN 408.A NE2 THR 41.A OG1 no hydrogen 3.182 N/A ILE 409.A N ASP 14.A OD1 no hydrogen 2.695 N/A ILE 409.A N ASP 14.A OD2 no hydrogen 3.213 N/A ILE 410.A N ASP 14.A OD2 no hydrogen 3.040 N/A ARG 411.A NE THR 39.A O no hydrogen 2.750 N/A ARG 411.A NH1 LEU 415.A O no hydrogen 3.112 N/A ARG 411.A NH1 ASP 417.A OD1 no hydrogen 3.050 N/A ARG 411.A NH2 THR 39.A O no hydrogen 2.887 N/A ARG 411.A NH2 ASP 417.A OD1 no hydrogen 2.964 N/A THR 413.A OG1 LYS 584.A O no hydrogen 2.850 N/A GLY 414.A N ARG 411.A O no hydrogen 2.703 N/A ASP 417.A N GLN 572.A OE1 no hydrogen 2.856 N/A ASP 421.A N VAL 547.A O no hydrogen 2.909 N/A ARG 423.A N MET 549.A O no hydrogen 3.044 N/A ARG 423.A NE ASP 421.A OD1 no hydrogen 2.490 N/A ARG 423.A NH1 ASP 431.A OD1 no hydrogen 3.019 N/A ARG 423.A NH1 ASP 431.A OD2 no hydrogen 2.563 N/A ARG 423.A NH1 GLU 435.A OE1 no hydrogen 2.833 N/A ARG 423.A NH2 GLU 435.A OE1 no hydrogen 2.900 N/A ILE 425.A N ASP 552.A OD1 no hydrogen 3.281 N/A GLN 428.A N ILE 425.A O no hydrogen 3.202 N/A ASP 431.A N GLY 427.A O no hydrogen 2.799 N/A LEU 432.A N GLN 428.A O no hydrogen 2.915 N/A ILE 433.A N ILE 429.A O no hydrogen 2.835 N/A GLY 434.A N ASP 430.A O no hydrogen 3.300 N/A GLU 435.A N ASP 431.A O no hydrogen 3.244 N/A ILE 436.A N LEU 432.A O no hydrogen 2.816 N/A GLN 437.A N ILE 433.A O no hydrogen 2.702 N/A ALA 438.A N GLY 434.A O no hydrogen 3.201 N/A ARG 439.A N GLU 435.A O no hydrogen 3.116 N/A ARG 439.A NH1 GLU 435.A O no hydrogen 2.982 N/A ARG 439.A NH1 GLU 435.A OE2 no hydrogen 2.938 N/A ILE 440.A N ILE 436.A O no hydrogen 2.870 N/A GLU 441.A N GLN 437.A O no hydrogen 3.182 N/A ARG 442.A N ARG 439.A O no hydrogen 3.124 N/A ASN 443.A N ILE 440.A O no hydrogen 3.327 N/A GLU 444.A N ARG 439.A O no hydrogen 3.017 N/A ARG 445.A N GLU 511.A O no hydrogen 2.958 N/A ARG 445.A NE LEU 489.A O no hydrogen 2.645 N/A ARG 445.A NH1 ASN 443.A OD1 no hydrogen 3.250 N/A ARG 445.A NH2 ARG 490.A O no hydrogen 2.663 N/A VAL 446.A N ASP 495.A O no hydrogen 3.028 N/A LEU 447.A N LEU 514.A O no hydrogen 3.037 N/A VAL 448.A N LEU 497.A O no hydrogen 2.775 N/A THR 449.A N ALA 516.A O no hydrogen 2.945 N/A THR 449.A OG1 THR 450.A O no hydrogen 3.225 N/A THR 449.A OG1 ILE 500.A O no hydrogen 2.773 N/A THR 450.A N GLY 499.A O no hydrogen 2.994 N/A MET 455.A N THR 452.A OG1 no hydrogen 3.126 N/A SER 456.A N THR 452.A O no hydrogen 3.155 N/A SER 456.A OG THR 452.A O no hydrogen 2.618 N/A GLU 457.A N LYS 453.A O no hydrogen 2.963 N/A ASP 458.A N LYS 454.A O no hydrogen 3.034 N/A LEU 459.A N MET 455.A O no hydrogen 2.833 N/A THR 460.A N SER 456.A O no hydrogen 2.936 N/A THR 460.A OG1 SER 456.A O no hydrogen 2.783 N/A ASP 461.A N GLU 457.A O no hydrogen 2.916 N/A TYR 462.A N ASP 458.A O no hydrogen 2.938 N/A LEU 463.A N LEU 459.A O no hydrogen 2.928 N/A LYS 464.A N THR 460.A O no hydrogen 2.923 N/A GLU 465.A N ASP 461.A O no hydrogen 2.954 N/A ILE 466.A N LEU 463.A O no hydrogen 3.078 N/A GLY 467.A N LYS 464.A O no hydrogen 3.038 N/A ILE 468.A N LEU 463.A O no hydrogen 3.117 N/A LYS 469.A NZ GLY 492.A O no hydrogen 2.594 N/A ASN 471.A N VAL 496.A O no hydrogen 3.172 N/A LEU 473.A N VAL 498.A O no hydrogen 2.776 N/A HIS 474.A N TYR 472.A O no hydrogen 3.031 N/A ILE 477.A N HIS 474.A O no hydrogen 3.077 N/A ARG 482.A N LYS 478.A O no hydrogen 2.767 N/A ILE 483.A N THR 479.A O no hydrogen 2.860 N/A ILE 485.A N GLU 481.A O no hydrogen 3.021 N/A ILE 486.A N ARG 482.A O no hydrogen 2.945 N/A ARG 487.A N ILE 483.A O no hydrogen 2.833 N/A ASP 488.A N GLU 484.A O no hydrogen 2.932 N/A LEU 489.A N ILE 485.A O no hydrogen 2.859 N/A ARG 490.A N ILE 486.A O no hydrogen 2.855 N/A ARG 490.A NE GLU 511.A OE1 no hydrogen 2.890 N/A ARG 490.A NE GLU 511.A OE2 no hydrogen 3.259 N/A ARG 490.A NH2 GLU 511.A OE2 no hydrogen 2.996 N/A LEU 491.A N ARG 487.A O no hydrogen 2.894 N/A GLY 492.A N LEU 489.A O no hydrogen 2.833 N/A LYS 493.A N ASP 488.A O no hydrogen 2.852 N/A LYS 493.A NZ TYR 494.A OH no hydrogen 3.299 N/A LYS 493.A NZ GLU 599.A OE1 no hydrogen 3.280 N/A TYR 494.A N ASP 488.A O no hydrogen 3.320 N/A ASP 495.A N LYS 469.A O no hydrogen 2.764 N/A VAL 496.A N LYS 469.A O no hydrogen 3.202 N/A LEU 497.A N VAL 446.A O no hydrogen 3.101 N/A VAL 498.A N ASN 471.A O no hydrogen 3.130 N/A GLY 499.A N VAL 448.A O no hydrogen 2.995 N/A LEU 503.A N ASN 501.A OD1 no hydrogen 2.787 N/A VAL 512.A N ILE 509.A O no hydrogen 3.382 N/A SER 513.A N ARG 445.A O no hydrogen 2.954 N/A SER 513.A OG GLU 444.A OE1 no hydrogen 2.694 N/A VAL 515.A N ARG 546.A O no hydrogen 3.012 N/A ALA 516.A N LEU 447.A O no hydrogen 2.896 N/A ILE 517.A N ILE 548.A O no hydrogen 2.779 N/A LEU 518.A N THR 449.A O no hydrogen 3.084 N/A ALA 520.A N TYR 550.A O no hydrogen 2.871 N/A LYS 522.A N ASP 519.A O no hydrogen 3.163 N/A LYS 522.A NZ ASP 519.A OD1 no hydrogen 2.686 N/A LYS 522.A NZ ASP 521.A OD2 no hydrogen 2.777 N/A ARG 527.A N GLU 523.A O no hydrogen 2.921 N/A ARG 527.A NE LEU 518.A O no hydrogen 2.992 N/A ARG 527.A NE ASP 519.A O no hydrogen 3.454 N/A ARG 527.A NH1 THR 449.A OG1 no hydrogen 3.068 N/A ARG 527.A NH1 LEU 526.A O no hydrogen 3.139 N/A ARG 527.A NH2 THR 449.A OG1 no hydrogen 2.978 N/A ARG 527.A NH2 LEU 518.A O no hydrogen 2.661 N/A SER 528.A N PHE 525.A O no hydrogen 3.279 N/A SER 528.A OG PHE 525.A O no hydrogen 2.907 N/A ARG 530.A NH2 GLU 529.A OE1 no hydrogen 2.728 N/A SER 531.A N SER 528.A OG no hydrogen 3.223 N/A SER 531.A OG PHE 525.A O no hydrogen 2.841 N/A LEU 532.A N SER 528.A O no hydrogen 2.852 N/A ILE 533.A N GLU 529.A O no hydrogen 3.074 N/A GLN 534.A N ARG 530.A O no hydrogen 3.128 N/A THR 535.A N SER 531.A O no hydrogen 2.934 N/A THR 535.A OG1 SER 531.A O no hydrogen 2.642 N/A ILE 536.A N LEU 532.A O no hydrogen 2.748 N/A GLY 537.A N ILE 533.A O no hydrogen 2.909 N/A ARG 538.A N THR 535.A O no hydrogen 3.131 N/A ARG 538.A NE LEU 502.A O no hydrogen 3.152 N/A ARG 538.A NH2 LEU 502.A O no hydrogen 3.049 N/A ALA 539.A N ILE 536.A O no hydrogen 3.021 N/A ALA 540.A N GLY 537.A O no hydrogen 3.048 N/A ARG 541.A NH2 THR 39.A OG1 no hydrogen 3.230 N/A ASN 542.A ND2 PRO 510.A O no hydrogen 2.857 N/A ALA 543.A N THR 585.A OG1 no hydrogen 2.911 N/A GLU 544.A N ASN 542.A OD1 no hydrogen 2.905 N/A GLY 545.A N ASN 542.A O no hydrogen 3.072 N/A VAL 547.A N LEU 419.A O no hydrogen 2.824 N/A ILE 548.A N VAL 515.A O no hydrogen 3.063 N/A MET 549.A N ASP 421.A O no hydrogen 2.859 N/A TYR 550.A N ILE 517.A O no hydrogen 2.909 N/A TYR 550.A OH ASP 431.A OD2 no hydrogen 2.542 N/A ALA 551.A N ARG 423.A O no hydrogen 2.995 N/A ASP 552.A N ASP 521.A OD1 no hydrogen 2.776 N/A LYS 553.A N ASP 521.A OD1 no hydrogen 3.371 N/A THR 555.A OG1 GLU 523.A OE2 no hydrogen 3.348 N/A SER 557.A N GLU 523.A OE2 no hydrogen 3.044 N/A SER 557.A OG GLU 523.A OE1 no hydrogen 2.430 N/A SER 557.A OG GLU 523.A OE2 no hydrogen 3.148 N/A MET 558.A N THR 555.A OG1 no hydrogen 3.297 N/A GLU 559.A N THR 555.A O no hydrogen 3.002 N/A ILE 560.A N LYS 556.A O no hydrogen 3.211 N/A ALA 561.A N SER 557.A O no hydrogen 3.055 N/A ILE 562.A N MET 558.A O no hydrogen 2.739 N/A ASN 563.A N GLU 559.A O no hydrogen 2.880 N/A GLU 564.A N ILE 560.A O no hydrogen 3.014 N/A THR 565.A N ALA 561.A O no hydrogen 3.117 N/A THR 565.A OG1 ALA 561.A O no hydrogen 2.812 N/A LYS 566.A N ILE 562.A O no hydrogen 3.001 N/A ARG 567.A N ASN 563.A O no hydrogen 2.883 N/A ARG 567.A NE GLU 564.A OE1 no hydrogen 3.388 N/A ARG 567.A NH1 GLU 407.A OE2 no hydrogen 2.822 N/A ARG 567.A NH2 GLU 407.A OE2 no hydrogen 3.546 N/A ARG 567.A NH2 GLU 564.A OE1 no hydrogen 2.460 N/A ARG 568.A N GLU 564.A O no hydrogen 3.084 N/A ARG 568.A NH1 ASP 417.A OD2 no hydrogen 3.403 N/A ARG 569.A N THR 565.A O no hydrogen 3.041 N/A ARG 569.A NH1 ASP 417.A O no hydrogen 2.625 N/A GLU 570.A N LYS 566.A O no hydrogen 3.232 N/A GLU 570.A N ARG 567.A O no hydrogen 3.264 N/A GLN 571.A N ARG 567.A O no hydrogen 3.294 N/A GLN 571.A NE2 ARG 567.A O no hydrogen 3.658 N/A GLN 572.A N ARG 568.A O no hydrogen 2.862 N/A GLN 572.A NE2 ILE 409.A O no hydrogen 2.653 N/A GLN 572.A NE2 ASP 417.A OD1 no hydrogen 3.188 N/A GLU 573.A N ARG 569.A O no hydrogen 2.980 N/A ARG 574.A N GLU 570.A O no hydrogen 3.027 N/A PHE 575.A N GLN 571.A O no hydrogen 2.985 N/A ASN 576.A N GLN 572.A O no hydrogen 2.980 N/A ASN 576.A ND2 GLY 414.A O no hydrogen 2.773 N/A GLU 577.A N GLU 573.A O no hydrogen 2.908 N/A GLU 578.A N ARG 574.A O no hydrogen 2.819 N/A HIS 579.A N PHE 575.A O no hydrogen 2.836 N/A HIS 579.A N ASN 576.A O no hydrogen 3.209 N/A HIS 579.A ND1 PHE 575.A O no hydrogen 3.018 N/A GLY 580.A N GLU 577.A O no hydrogen 3.239 N/A ILE 581.A N ASN 576.A O no hydrogen 2.902 N/A LYS 584.A N THR 413.A O no hydrogen 3.383 N/A GLN 592.A N LYS 588.A O no hydrogen 3.254 N/A LYS 593.A N LYS 589.A O no hydrogen 3.167 N/A VAL 594.A N GLU 590.A O no hydrogen 3.163 N/A VAL 595.A N ARG 591.A O no hydrogen 2.991 N/A GLU 596.A N GLN 592.A O no hydrogen 3.152 N/A GLN 597.A N LYS 593.A O no hydrogen 3.170 N/A MET 598.A N VAL 594.A O no hydrogen 3.064 N/A GLU 599.A N VAL 595.A O no hydrogen 2.974 N/A HIS 600.A N GLU 596.A O no hydrogen 3.296 N/A GLU 601.A N GLN 597.A O no hydrogen 3.026 N/A MET 602.A N MET 598.A O no hydrogen 2.776 N/A LYS 603.A N GLU 599.A O no hydrogen 2.865 N/A GLU 604.A N HIS 600.A O no hydrogen 2.868 N/A ALA 605.A N GLU 601.A O no hydrogen 2.895 N/A ALA 606.A N MET 602.A O no hydrogen 2.950 N/A LYS 607.A N LYS 603.A O no hydrogen 3.050 N/A LYS 607.A NZ LYS 603.A O no hydrogen 3.260 N/A ALA 608.A N GLU 604.A O no hydrogen 3.120 N/A LEU 609.A N ALA 606.A O no hydrogen 2.885 N/A ASP 610.A N ALA 605.A O no hydrogen 2.864 N/A GLU 612.A N GLU 612.A OE1 no hydrogen 2.770 N/A ARG 613.A N ASP 610.A OD1 no hydrogen 2.905 N/A ARG 613.A NH1 GLU 616.A OE1 no hydrogen 3.234 N/A ALA 614.A N ASP 610.A O no hydrogen 3.112 N/A ALA 615.A N PHE 611.A O no hydrogen 2.861 N/A GLU 616.A N GLU 612.A O no hydrogen 2.981 N/A LEU 617.A N ARG 613.A O no hydrogen 3.024 N/A ARG 618.A N ALA 614.A O no hydrogen 2.976 N/A ARG 618.A NE ASP 619.A OD1 no hydrogen 3.182 N/A ARG 618.A NH2 ASP 619.A OD1 no hydrogen 3.476 N/A ASP 619.A N ALA 615.A O no hydrogen 2.910 N/A LEU 620.A N GLU 616.A O no hydrogen 2.849 N/A LEU 621.A N LEU 617.A O no hydrogen 2.704 N/A