Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4mwb_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LYS 3.A NZ VAL 4.A O no hydrogen 2.832 N/A LYS 3.A NZ ARG 268.A O no hydrogen 2.766 N/A LYS 3.A NZ PRO 270.A O no hydrogen 3.512 N/A LYS 3.A NZ ASP 272.A OD2 no hydrogen 2.862 N/A VAL 4.A N GLU 267.A O no hydrogen 2.885 N/A PHE 5.A N ARG 42.A O no hydrogen 2.797 N/A PHE 6.A N ASP 272.A OD2 no hydrogen 2.856 N/A VAL 7.A N PHE 44.A O no hydrogen 3.138 N/A THR 8.A N VAL 273.A O no hydrogen 3.040 N/A THR 8.A OG1 HIS 274.A ND1 no hydrogen 2.721 N/A SER 9.A N LEU 46.A O no hydrogen 2.986 N/A SER 9.A OG PRO 10.A O no hydrogen 2.665 N/A SER 9.A OG TYR 12.A OH no hydrogen 3.357 N/A SER 9.A OG THR 47.A OG1 no hydrogen 2.653 N/A TYR 12.A N GLY 48.A O no hydrogen 2.944 N/A TYR 12.A OH SER 9.A OG no hydrogen 3.357 N/A TYR 12.A OH THR 26.A OG1 no hydrogen 2.617 N/A HIS 19.A N HIS 22.A ND1 no hydrogen 3.077 N/A GLY 21.A N HIS 19.A ND1 no hydrogen 3.231 N/A HIS 22.A N HIS 19.A O no hydrogen 3.029 N/A VAL 23.A N HIS 19.A O no hydrogen 3.193 N/A TYR 24.A N ILE 20.A O no hydrogen 2.842 N/A SER 25.A N GLY 21.A O no hydrogen 3.086 N/A SER 25.A OG GLY 21.A O no hydrogen 3.552 N/A SER 25.A OG HIS 306.A NE2 no hydrogen 2.657 N/A THR 26.A N HIS 22.A O no hydrogen 3.046 N/A THR 26.A OG1 TYR 12.A OH no hydrogen 2.617 N/A THR 26.A OG1 HIS 22.A O no hydrogen 3.160 N/A THR 26.A OG1 THR 47.A OG1 no hydrogen 3.411 N/A LEU 27.A N VAL 23.A O no hydrogen 2.875 N/A ILE 28.A N TYR 24.A O no hydrogen 3.109 N/A THR 29.A N SER 25.A O no hydrogen 3.202 N/A THR 29.A OG1 THR 8.A O no hydrogen 3.085 N/A THR 29.A OG1 SER 25.A O no hydrogen 3.220 N/A ASP 30.A N THR 26.A O no hydrogen 2.875 N/A VAL 31.A N LEU 27.A O no hydrogen 2.818 N/A ILE 32.A N ILE 28.A O no hydrogen 3.120 N/A GLY 33.A N THR 29.A O no hydrogen 3.086 N/A ARG 34.A N ASP 30.A O no hydrogen 2.879 N/A ARG 34.A NE ASP 30.A OD2 no hydrogen 2.811 N/A TYR 35.A N VAL 31.A O no hydrogen 2.927 N/A TYR 35.A OH ASP 414.A OD1 no hydrogen 2.635 N/A HIS 36.A N ILE 32.A O no hydrogen 3.174 N/A HIS 36.A ND1 GLU 41.A OE1 no hydrogen 2.698 N/A ARG 37.A N GLY 33.A O no hydrogen 3.033 N/A ARG 37.A NH2 SER 87.A O no hydrogen 2.881 N/A ARG 37.A NH2 ASP 89.A OD2 no hydrogen 3.002 N/A VAL 38.A N ARG 34.A O no hydrogen 2.917 N/A LYS 39.A N TYR 35.A O no hydrogen 3.086 N/A LYS 39.A NZ ASP 414.A OD1 no hydrogen 2.797 N/A GLY 40.A N ARG 37.A O no hydrogen 2.936 N/A GLU 41.A N HIS 36.A O no hydrogen 3.019 N/A ARG 42.A NE GLU 2.A OE2 no hydrogen 3.229 N/A ARG 42.A NH1 GLU 267.A OE2 no hydrogen 2.886 N/A ARG 42.A NH2 GLU 2.A OE2 no hydrogen 2.856 N/A PHE 44.A N PHE 5.A O no hydrogen 2.904 N/A ALA 45.A N ASP 89.A OD2 no hydrogen 2.765 N/A LEU 46.A N VAL 7.A O no hydrogen 2.954 N/A THR 47.A N TYR 90.A O no hydrogen 3.103 N/A THR 47.A OG1 SER 9.A OG no hydrogen 2.653 N/A THR 47.A OG1 THR 26.A OG1 no hydrogen 3.411 N/A THR 49.A N ILE 92.A O no hydrogen 2.913 N/A THR 49.A OG1 GLU 51.A OE2 no hydrogen 2.773 N/A ASP 50.A N TYR 12.A O no hydrogen 2.724 N/A GLU 51.A N THR 94.A OG1 no hydrogen 2.862 N/A HIS 52.A ND1 ASP 237.A OD2 no hydrogen 2.651 N/A GLY 53.A N TRP 221.A O no hydrogen 2.929 N/A GLN 54.A NE2 GLU 58.A OE2 no hydrogen 2.913 N/A LYS 55.A N GLU 130.A OE2 no hydrogen 2.976 N/A LYS 55.A NZ SER 128.A O no hydrogen 2.780 N/A ALA 57.A N GLY 53.A O no hydrogen 2.934 N/A GLU 58.A N GLN 54.A O no hydrogen 2.818 N/A ALA 59.A N LYS 55.A O no hydrogen 3.056 N/A ALA 60.A N VAL 56.A O no hydrogen 3.018 N/A LYS 61.A N ALA 57.A O no hydrogen 3.123 N/A GLN 62.A N GLU 58.A O no hydrogen 3.027 N/A LYS 63.A N ALA 59.A O no hydrogen 3.290 N/A GLN 64.A N LYS 61.A O no hydrogen 2.755 N/A VAL 65.A N ALA 60.A O no hydrogen 3.181 N/A ASP 69.A N SER 66.A OG no hydrogen 3.208 N/A PHE 70.A N SER 66.A O no hydrogen 2.811 N/A THR 71.A N PRO 67.A O no hydrogen 2.891 N/A THR 71.A OG1 PRO 67.A O no hydrogen 2.734 N/A THR 71.A OG1 TYR 68.A O no hydrogen 3.228 N/A THR 72.A N TYR 68.A O no hydrogen 3.174 N/A THR 72.A OG1 TYR 68.A O no hydrogen 2.853 N/A ALA 73.A N ASP 69.A O no hydrogen 3.098 N/A VAL 74.A N PHE 70.A O no hydrogen 2.957 N/A ALA 75.A N THR 71.A O no hydrogen 2.818 N/A GLY 76.A N THR 72.A O no hydrogen 3.046 N/A GLU 77.A N ALA 73.A O no hydrogen 3.101 N/A PHE 78.A N VAL 74.A O no hydrogen 3.052 N/A LYS 79.A N ALA 75.A O no hydrogen 2.956 N/A LYS 80.A N GLY 76.A O no hydrogen 2.980 N/A GLU 82.A N LYS 79.A O no hydrogen 2.867 N/A GLN 83.A N LYS 80.A O no hydrogen 2.919 N/A GLN 83.A NE2 TYR 335.A OH no hydrogen 2.876 N/A ASP 85.A N GLU 82.A O no hydrogen 3.060 N/A SER 87.A N ASP 30.A OD1 no hydrogen 2.721 N/A ASP 89.A N ALA 45.A O no hydrogen 2.918 N/A TYR 90.A N ALA 45.A O no hydrogen 3.337 N/A ILE 92.A N THR 47.A O no hydrogen 2.834 N/A ARG 93.A NE GLU 51.A OE2 no hydrogen 2.758 N/A ARG 93.A NH2 GLU 51.A OE1 no hydrogen 3.026 N/A ARG 93.A NH2 GLU 51.A OE2 no hydrogen 3.509 N/A THR 94.A N THR 49.A O no hydrogen 3.317 N/A THR 95.A OG1 GLU 51.A OE1 no hydrogen 2.741 N/A ASN 96.A N ARG 93.A O no hydrogen 2.920 N/A ASN 96.A ND2 GLU 256.A OE1 no hydrogen 3.154 N/A GLN 98.A N ASN 96.A OD1 no hydrogen 2.776 N/A HIS 99.A N ASN 96.A OD1 no hydrogen 3.264 N/A HIS 99.A ND1 THR 244.A OG1 no hydrogen 2.885 N/A HIS 99.A NE2 ASP 237.A OD1 no hydrogen 2.818 N/A LYS 100.A N ASN 96.A O no hydrogen 3.225 N/A ALA 101.A N GLU 97.A O no hydrogen 3.308 N/A VAL 102.A N GLN 98.A O no hydrogen 3.214 N/A VAL 103.A N HIS 99.A O no hydrogen 2.938 N/A LYS 104.A N LYS 100.A O no hydrogen 3.026 N/A GLU 105.A N ALA 101.A O no hydrogen 3.010 N/A LEU 106.A N VAL 102.A O no hydrogen 2.905 N/A TRP 107.A N VAL 103.A O no hydrogen 2.933 N/A THR 108.A N LYS 104.A O no hydrogen 3.037 N/A THR 108.A OG1 LYS 104.A O no hydrogen 2.912 N/A LYS 109.A N GLU 105.A O no hydrogen 2.989 N/A LEU 110.A N LEU 106.A O no hydrogen 2.920 N/A GLU 111.A N TRP 107.A O no hydrogen 2.852 N/A GLN 112.A N THR 108.A O no hydrogen 2.782 N/A LYS 113.A N LYS 109.A O no hydrogen 2.958 N/A GLY 114.A N GLU 111.A O no hydrogen 2.846 N/A ASP 115.A N LEU 110.A O no hydrogen 3.187 N/A TYR 117.A N MET 168.A O no hydrogen 2.938 N/A TYR 117.A OH ASP 208.A OD2 no hydrogen 2.534 N/A GLY 119.A N ASN 166.A O no hydrogen 2.782 N/A ARG 120.A NE GLU 122.A OE2 no hydrogen 2.740 N/A ARG 120.A NH2 SER 163.A OG no hydrogen 2.905 N/A TYR 121.A N GLU 164.A O no hydrogen 3.048 N/A TYR 121.A OH TRP 124.A O no hydrogen 2.660 N/A GLY 123.A N VAL 162.A O no hydrogen 2.941 N/A TYR 125.A N THR 160.A O no hydrogen 2.855 N/A TYR 125.A OH GLU 130.A OE1 no hydrogen 2.660 N/A SER 126.A N SER 131.A O no hydrogen 2.886 N/A SER 126.A OG ASP 129.A OD2 no hydrogen 2.694 N/A ASP 129.A N SER 126.A OG no hydrogen 3.182 N/A GLU 130.A N ILE 127.A O no hydrogen 3.100 N/A SER 131.A N SER 126.A O no hydrogen 3.034 N/A SER 131.A OG PHE 132.A O no hydrogen 3.499 N/A LEU 133.A N TRP 124.A O no hydrogen 3.153 N/A THR 134.A OG1 GLN 136.A OE1 no hydrogen 3.377 N/A THR 134.A OG1 ASN 137.A OD1 no hydrogen 3.229 N/A ASN 137.A N THR 134.A O no hydrogen 2.841 N/A ILE 138.A N PRO 135.A O no hydrogen 3.384 N/A THR 139.A N VAL 151.A O no hydrogen 2.941 N/A GLY 141.A N CYS 149.A O no hydrogen 3.037 N/A ASP 143.A N ASN 147.A O no hydrogen 3.069 N/A GLY 146.A N ASP 143.A O no hydrogen 2.710 N/A ASN 147.A N ASP 143.A OD1 no hydrogen 2.671 N/A CYS 149.A N GLY 141.A O no hydrogen 3.002 N/A CYS 149.A SG LYS 150.A O no hydrogen 3.541 N/A LYS 150.A NZ ASP 140.A OD1 no hydrogen 2.802 N/A VAL 151.A N THR 139.A O no hydrogen 2.844 N/A SER 152.A N HIS 157.A O no hydrogen 2.896 N/A LEU 153.A N ASN 137.A O no hydrogen 2.941 N/A SER 155.A N SER 152.A OG no hydrogen 2.999 N/A SER 155.A OG ASP 129.A OD1 no hydrogen 3.413 N/A SER 155.A OG ASP 129.A OD2 no hydrogen 2.545 N/A SER 155.A OG HIS 157.A ND1 no hydrogen 3.251 N/A GLY 156.A N SER 152.A O no hydrogen 2.825 N/A VAL 159.A N LYS 150.A O no hydrogen 3.056 N/A THR 160.A N TYR 125.A O no hydrogen 2.906 N/A THR 160.A OG1 TYR 125.A O no hydrogen 3.405 N/A VAL 162.A N GLY 123.A O no hydrogen 2.805 N/A GLU 164.A N TYR 121.A O no hydrogen 3.048 N/A ASN 166.A N GLY 119.A O no hydrogen 2.876 N/A ASN 166.A ND2 GLU 164.A OE1 no hydrogen 3.123 N/A ASN 166.A ND2 GLU 165.A O no hydrogen 2.860 N/A TYR 167.A N SER 212.A OG no hydrogen 2.772 N/A MET 168.A N TYR 117.A O no hydrogen 2.680 N/A PHE 169.A N LEU 209.A O no hydrogen 2.700 N/A ARG 170.A N ASP 115.A O no hydrogen 2.962 N/A ARG 170.A NE GLY 114.A O no hydrogen 2.934 N/A LEU 171.A N PHE 169.A O no hydrogen 2.778 N/A SER 172.A N ASP 208.A OD1 no hydrogen 3.069 N/A SER 172.A OG ASP 208.A OD1 no hydrogen 2.781 N/A ALA 173.A N ARG 170.A O no hydrogen 3.031 N/A PHE 174.A N LEU 171.A O no hydrogen 2.942 N/A ARG 175.A NE VAL 202.A O no hydrogen 3.045 N/A ARG 175.A NE GLU 203.A O no hydrogen 3.134 N/A ARG 175.A NH2 GLU 203.A O no hydrogen 2.811 N/A ARG 177.A NH2 ALA 173.A O no hydrogen 3.229 N/A LEU 178.A N PHE 174.A O no hydrogen 2.916 N/A LEU 179.A N ARG 175.A O no hydrogen 2.990 N/A GLU 180.A N GLU 176.A O no hydrogen 2.965 N/A TRP 181.A N ARG 177.A O no hydrogen 3.011 N/A TYR 182.A N LEU 178.A O no hydrogen 2.956 N/A TYR 182.A OH ALA 285.A O no hydrogen 2.679 N/A HIS 183.A N LEU 179.A O no hydrogen 3.041 N/A HIS 183.A ND1 LEU 179.A O no hydrogen 2.907 N/A ALA 184.A N GLU 180.A O no hydrogen 2.873 N/A ASN 185.A N TRP 181.A O no hydrogen 3.053 N/A ASN 185.A ND2 TRP 181.A O no hydrogen 3.051 N/A CYS 188.A N ASN 185.A O no hydrogen 2.959 N/A CYS 188.A SG ASN 185.A O no hydrogen 3.182 N/A VAL 190.A N ILE 303.A O no hydrogen 2.878 N/A ARG 194.A N PRO 191.A O no hydrogen 3.107 N/A ARG 194.A NH1 ALA 305.A O no hydrogen 2.881 N/A ARG 194.A NH1 PHE 348.A O no hydrogen 2.851 N/A ARG 195.A N PRO 191.A O no hydrogen 3.301 N/A ARG 195.A NH1 GLU 192.A OE1 no hydrogen 3.507 N/A ARG 195.A NH2 TYR 182.A O no hydrogen 3.230 N/A ARG 196.A N GLU 192.A O no hydrogen 2.986 N/A GLU 197.A N PHE 193.A O no hydrogen 3.012 N/A VAL 198.A N ARG 194.A O no hydrogen 3.047 N/A ILE 199.A N ARG 195.A O no hydrogen 3.076 N/A ARG 200.A N ARG 196.A O no hydrogen 3.005 N/A ALA 201.A N GLU 197.A O no hydrogen 3.104 N/A VAL 202.A N VAL 198.A O no hydrogen 3.090 N/A GLU 203.A N ILE 199.A O no hydrogen 2.857 N/A LYS 204.A N ARG 200.A O no hydrogen 3.312 N/A GLY 205.A N VAL 202.A O no hydrogen 3.126 N/A LEU 209.A N PHE 169.A O no hydrogen 3.057 N/A SER 210.A OG ASN 166.A OD1 no hydrogen 2.652 N/A VAL 211.A N TYR 167.A O no hydrogen 2.827 N/A SER 212.A OG HIS 231.A ND1 no hydrogen 2.820 N/A ARG 213.A NE GLU 164.A OE1 no hydrogen 2.920 N/A ARG 213.A NH2 GLU 164.A OE2 no hydrogen 3.094 N/A ALA 214.A N GLU 164.A OE1 no hydrogen 3.236 N/A ARG 215.A N ASP 230.A O no hydrogen 3.083 N/A ARG 215.A NH1 ASN 220.A OD1 no hydrogen 2.768 N/A THR 217.A N ALA 214.A O no hydrogen 3.287 N/A THR 217.A OG1 GLU 164.A OE2 no hydrogen 2.830 N/A THR 217.A OG1 ALA 214.A O no hydrogen 3.521 N/A LEU 218.A N ARG 215.A O no hydrogen 3.292 N/A HIS 219.A N ALA 216.A O no hydrogen 2.929 N/A HIS 219.A NE2 GLU 58.A OE2 no hydrogen 2.891 N/A ASN 220.A N ARG 215.A O no hydrogen 3.044 N/A TRP 221.A N LEU 218.A O no hydrogen 3.065 N/A TRP 221.A NE1 GLU 51.A O no hydrogen 2.764 N/A VAL 225.A N HIS 231.A O no hydrogen 2.992 N/A ASN 228.A N VAL 225.A O no hydrogen 2.871 N/A ASN 228.A ND2 TYR 167.A OH no hydrogen 2.705 N/A ASP 230.A N ASN 228.A OD1 no hydrogen 3.165 N/A HIS 231.A N ASN 228.A O no hydrogen 3.209 N/A HIS 231.A ND1 SER 212.A OG no hydrogen 2.820 N/A TYR 233.A N VAL 211.A O no hydrogen 2.801 N/A TYR 233.A OH GLU 130.A O no hydrogen 2.732 N/A TRP 235.A NE1 ASP 129.A O no hydrogen 3.371 N/A LEU 236.A N TYR 233.A O no hydrogen 2.985 N/A ASP 237.A N TYR 233.A O no hydrogen 3.111 N/A ALA 238.A N VAL 234.A O no hydrogen 2.713 N/A LEU 239.A N TRP 235.A O no hydrogen 3.034 N/A THR 240.A N LEU 236.A O no hydrogen 3.196 N/A THR 240.A OG1 LEU 236.A O no hydrogen 2.740 N/A ASN 241.A N ALA 238.A O no hydrogen 2.966 N/A ASN 241.A ND2 ALA 238.A O no hydrogen 2.860 N/A TYR 242.A N LEU 239.A O no hydrogen 3.187 N/A TYR 242.A OH HIS 284.A NE2 no hydrogen 2.606 N/A THR 244.A N THR 240.A O no hydrogen 2.985 N/A THR 244.A OG1 HIS 99.A ND1 no hydrogen 2.885 N/A THR 244.A OG1 THR 240.A O no hydrogen 3.287 N/A GLY 245.A N ASN 241.A O no hydrogen 2.829 N/A SER 246.A N TYR 242.A O no hydrogen 3.258 N/A SER 246.A OG LEU 243.A O no hydrogen 2.670 N/A ARG 247.A N THR 244.A O no hydrogen 2.824 N/A ARG 247.A NE VAL 260.A O no hydrogen 2.898 N/A ARG 247.A NH1 GLU 105.A OE2 no hydrogen 2.981 N/A ARG 247.A NH2 GLU 105.A OE1 no hydrogen 3.217 N/A ARG 247.A NH2 VAL 260.A O no hydrogen 3.037 N/A LEU 248.A N GLY 245.A O no hydrogen 3.350 N/A ARG 249.A N SER 258.A O no hydrogen 2.903 N/A ARG 249.A NH2 GLU 265.A OE2 no hydrogen 3.177 N/A ASP 251.A N LYS 255.A O no hydrogen 3.069 N/A SER 253.A N ASP 251.A OD1 no hydrogen 2.867 N/A GLY 254.A N ASP 251.A O no hydrogen 3.071 N/A LYS 255.A N ASP 251.A OD1 no hydrogen 3.140 N/A VAL 257.A N ARG 249.A O no hydrogen 2.928 N/A VAL 260.A N ARG 247.A O no hydrogen 2.927 N/A ASN 264.A N ASP 262.A OD1 no hydrogen 3.166 N/A ASN 264.A ND2 ASP 262.A OD1 no hydrogen 2.803 N/A ASN 264.A ND2 ASP 262.A OD2 no hydrogen 3.537 N/A GLU 265.A N ASP 262.A O no hydrogen 2.961 N/A LEU 266.A N PHE 263.A O no hydrogen 3.089 N/A GLU 267.A N PHE 263.A O no hydrogen 3.298 N/A ARG 268.A NH1 GLY 245.A O no hydrogen 2.882 N/A ARG 268.A NH1 LEU 248.A O no hydrogen 2.861 N/A ARG 268.A NH2 LEU 248.A O no hydrogen 3.398 N/A ASP 272.A N PHE 6.A O no hydrogen 2.796 N/A VAL 273.A N PHE 6.A O no hydrogen 3.298 N/A HIS 274.A N LYS 302.A O no hydrogen 2.924 N/A HIS 274.A ND1 THR 8.A OG1 no hydrogen 2.721 N/A VAL 275.A N THR 8.A O no hydrogen 2.919 N/A ILE 276.A N VAL 304.A O no hydrogen 2.909 N/A LYS 278.A N HIS 306.A O no hydrogen 2.931 N/A LYS 278.A NZ ASP 351.A OD1 no hydrogen 2.918 N/A LYS 278.A NZ ASP 351.A OD2 no hydrogen 3.102 N/A ILE 280.A N GLY 277.A O no hydrogen 3.209 N/A LEU 281.A N LYS 278.A O no hydrogen 3.403 N/A LYS 282.A NZ SER 131.A OG no hydrogen 2.874 N/A LYS 282.A NZ TYR 287.A OH no hydrogen 3.469 N/A HIS 284.A ND1 ILE 280.A O no hydrogen 2.983 N/A HIS 284.A NE2 TYR 242.A OH no hydrogen 2.606 N/A ALA 285.A N LEU 281.A O no hydrogen 2.802 N/A ILE 286.A N LYS 282.A O no hydrogen 2.997 N/A TYR 287.A N LYS 282.A O no hydrogen 3.118 N/A TRP 288.A N PHE 283.A O no hydrogen 2.896 N/A TRP 288.A NE1 HIS 274.A NE2 no hydrogen 3.133 N/A ALA 290.A N ILE 286.A O no hydrogen 3.308 N/A PHE 291.A N TYR 287.A O no hydrogen 2.884 N/A LEU 292.A N TRP 288.A O no hydrogen 3.002 N/A LEU 293.A N PRO 289.A O no hydrogen 2.822 N/A SER 294.A N ALA 290.A O no hydrogen 2.985 N/A SER 294.A OG ASP 115.A OD2 no hydrogen 2.599 N/A ALA 295.A N PHE 291.A O no hydrogen 2.897 N/A GLY 296.A N LEU 293.A O no hydrogen 3.196 N/A LEU 297.A N LEU 292.A O no hydrogen 2.929 N/A LYS 301.A N ALA 271.A O no hydrogen 2.980 N/A LYS 302.A N ASP 272.A O no hydrogen 3.012 N/A ILE 303.A N CYS 188.A O no hydrogen 2.745 N/A VAL 304.A N HIS 274.A O no hydrogen 2.954 N/A ALA 305.A N VAL 190.A O no hydrogen 2.923 N/A HIS 306.A N ILE 276.A O no hydrogen 2.999 N/A HIS 306.A ND1 GLY 307.A O no hydrogen 2.965 N/A HIS 306.A NE2 SER 25.A OG no hydrogen 2.657 N/A TRP 308.A N ASP 351.A OD1 no hydrogen 3.024 N/A THR 310.A N GLY 352.A O no hydrogen 3.110 N/A THR 310.A OG1 GLY 352.A O no hydrogen 3.302 N/A THR 310.A OG1 ASP 353.A OD1 no hydrogen 2.636 N/A LYS 311.A N LYS 314.A O no hydrogen 3.050 N/A LYS 311.A NZ ASP 312.A OD2 no hydrogen 3.137 N/A ASP 312.A N TYR 354.A O no hydrogen 3.005 N/A ARG 313.A N ASP 353.A OD1 no hydrogen 3.074 N/A ARG 313.A N ASP 353.A OD2 no hydrogen 3.273 N/A LYS 314.A N LYS 311.A O no hydrogen 3.027 N/A SER 317.A N ASN 322.A O no hydrogen 2.964 N/A SER 319.A OG SER 317.A OG no hydrogen 3.062 N/A GLY 321.A N LYS 318.A O no hydrogen 3.338 N/A ASN 322.A N SER 317.A O no hydrogen 2.961 N/A ASN 322.A ND2 LYS 311.A O no hydrogen 2.695 N/A ASN 322.A ND2 LYS 315.A O no hydrogen 3.467 N/A LYS 329.A N ASP 325.A O no hydrogen 3.117 N/A LYS 329.A NZ ASP 356.A OD1 no hydrogen 2.774 N/A LYS 329.A NZ ASP 356.A OD2 no hydrogen 3.232 N/A ALA 330.A N PRO 326.A O no hydrogen 2.804 N/A GLU 331.A N VAL 327.A O no hydrogen 2.908 N/A GLU 332.A N GLU 328.A O no hydrogen 3.215 N/A PHE 333.A N LYS 329.A O no hydrogen 2.883 N/A GLY 334.A N ALA 330.A O no hydrogen 2.702 N/A TYR 335.A OH GLU 331.A OE2 no hydrogen 2.744 N/A LEU 338.A N GLY 334.A O no hydrogen 3.003 N/A LYS 339.A N TYR 335.A O no hydrogen 2.995 N/A LYS 339.A NZ MET 84.A O no hydrogen 2.786 N/A LYS 339.A NZ ASP 85.A O no hydrogen 3.105 N/A TYR 340.A N ASP 336.A O no hydrogen 2.772 N/A TYR 340.A OH GLU 366.A OE2 no hydrogen 2.750 N/A PHE 341.A N ALA 337.A O no hydrogen 2.967 N/A LEU 342.A N LEU 338.A O no hydrogen 2.986 N/A LEU 343.A N LYS 339.A O no hydrogen 2.992 N/A ARG 344.A N TYR 340.A O no hydrogen 2.738 N/A ARG 344.A N PHE 341.A O no hydrogen 3.212 N/A ARG 344.A NH1 ARG 344.A O no hydrogen 2.910 N/A GLU 345.A N PHE 341.A O no hydrogen 2.791 N/A SER 346.A OG GLY 347.A O no hydrogen 3.369 N/A GLY 347.A N ASP 350.A OD2 no hydrogen 3.259 N/A ASP 350.A N GLY 347.A O no hydrogen 3.158 N/A TYR 354.A N THR 310.A O no hydrogen 3.302 N/A TYR 354.A OH ASP 356.A OD1 no hydrogen 2.866 N/A ASN 358.A N SER 355.A OG no hydrogen 3.232 N/A ASN 358.A ND2 GLU 345.A OE1 no hydrogen 2.895 N/A MET 359.A N SER 355.A O no hydrogen 2.825 N/A ILE 360.A N ASP 356.A O no hydrogen 2.900 N/A ALA 361.A N LYS 357.A O no hydrogen 2.921 N/A ARG 362.A N ASN 358.A O no hydrogen 3.011 N/A ARG 362.A NE GLU 345.A OE1 no hydrogen 2.886 N/A ARG 362.A NH1 GLU 366.A OE1 no hydrogen 3.486 N/A ARG 362.A NH1 GLU 366.A OE2 no hydrogen 3.343 N/A ARG 362.A NH2 GLU 345.A OE1 no hydrogen 2.925 N/A LEU 363.A N MET 359.A O no hydrogen 3.012 N/A ASN 364.A N ILE 360.A O no hydrogen 2.889 N/A ASN 364.A ND2 ARG 526.A O no hydrogen 3.056 N/A GLY 365.A N ALA 361.A O no hydrogen 2.850 N/A GLU 366.A N ARG 362.A O no hydrogen 2.877 N/A LEU 367.A N ARG 362.A O no hydrogen 3.324 N/A ALA 368.A N LEU 363.A O no hydrogen 2.828 N/A ASP 369.A N ASN 364.A O no hydrogen 2.861 N/A THR 370.A N GLU 366.A O no hydrogen 3.287 N/A THR 370.A OG1 GLY 365.A O no hydrogen 3.011 N/A LEU 371.A N GLU 366.A O no hydrogen 3.000 N/A GLY 372.A N LEU 367.A O no hydrogen 2.759 N/A ASN 373.A N ALA 368.A O no hydrogen 2.788 N/A VAL 375.A N LEU 371.A O no hydrogen 3.165 N/A MET 376.A N GLY 372.A O no hydrogen 3.118 N/A ARG 377.A N ASN 373.A O no hydrogen 2.986 N/A CYS 378.A N LEU 374.A O no hydrogen 3.234 N/A CYS 378.A SG LEU 374.A O no hydrogen 3.366 N/A CYS 378.A SG VAL 375.A O no hydrogen 3.609 N/A THR 379.A N MET 376.A O no hydrogen 3.316 N/A THR 379.A OG1 VAL 375.A O no hydrogen 2.608 N/A THR 379.A OG1 MET 376.A O no hydrogen 3.073 N/A SER 380.A N ARG 377.A O no hydrogen 3.267 N/A SER 380.A OG ARG 377.A O no hydrogen 3.330 N/A ILE 383.A N SER 380.A OG no hydrogen 3.254 N/A ASN 384.A N SER 380.A O no hydrogen 2.834 N/A ASN 384.A ND2 CYS 378.A O no hydrogen 3.317 N/A ASN 384.A ND2 GLU 388.A O no hydrogen 2.868 N/A GLY 387.A N ASN 384.A O no hydrogen 3.155 N/A GLU 388.A N ASN 384.A OD1 no hydrogen 3.080 N/A TRP 389.A N THR 511.A O no hydrogen 2.812 N/A TRP 389.A NE1 LEU 489.A O no hydrogen 2.976 N/A ALA 393.A N THR 458.A OG1 no hydrogen 3.002 N/A THR 396.A N ASP 399.A OD2 no hydrogen 2.764 N/A ASP 399.A N THR 396.A OG1 no hydrogen 3.035 N/A GLU 400.A N THR 396.A O no hydrogen 3.013 N/A SER 401.A N GLU 397.A O no hydrogen 2.924 N/A SER 401.A OG GLU 398.A O no hydrogen 2.726 N/A LEU 402.A N GLU 398.A O no hydrogen 3.304 N/A ILE 403.A N ASP 399.A O no hydrogen 3.008 N/A GLN 404.A N GLU 400.A O no hydrogen 2.829 N/A LEU 405.A N SER 401.A O no hydrogen 3.364 N/A ILE 406.A N LEU 402.A O no hydrogen 3.083 N/A LYS 407.A N ILE 403.A O no hydrogen 2.904 N/A ASP 408.A N GLN 404.A O no hydrogen 2.971 N/A LEU 409.A N LEU 405.A O no hydrogen 3.103 N/A THR 412.A N ASP 408.A O no hydrogen 3.406 N/A THR 412.A N LEU 409.A O no hydrogen 3.083 N/A ALA 413.A N LEU 409.A O no hydrogen 2.843 N/A ASP 414.A N PRO 410.A O no hydrogen 2.894 N/A HIS 415.A N GLY 411.A O no hydrogen 3.176 N/A TYR 416.A N THR 412.A O no hydrogen 3.153 N/A TYR 417.A N ALA 413.A O no hydrogen 2.843 N/A TYR 417.A OH LEU 473.A O no hydrogen 2.775 N/A LEU 418.A N ASP 414.A O no hydrogen 3.028 N/A LEU 418.A N HIS 415.A O no hydrogen 3.138 N/A ILE 419.A N HIS 415.A O no hydrogen 3.200 N/A ILE 419.A N TYR 416.A O no hydrogen 3.248 N/A ASP 421.A N TYR 416.A O no hydrogen 2.705 N/A GLN 423.A NE2 ARG 344.A O no hydrogen 2.783 N/A LYS 424.A N ASP 421.A OD1 no hydrogen 3.129 N/A LYS 424.A NZ ASP 421.A OD2 no hydrogen 3.448 N/A ALA 425.A N ASP 421.A O no hydrogen 3.266 N/A ILE 426.A N ILE 422.A O no hydrogen 2.957 N/A ILE 427.A N GLN 423.A O no hydrogen 2.968 N/A ALA 428.A N LYS 424.A O no hydrogen 2.962 N/A VAL 429.A N ALA 425.A O no hydrogen 3.045 N/A PHE 430.A N ILE 426.A O no hydrogen 2.945 N/A ASP 431.A N ILE 427.A O no hydrogen 2.902 N/A VAL 432.A N ALA 428.A O no hydrogen 3.453 N/A LEU 433.A N VAL 429.A O no hydrogen 3.034 N/A ARG 434.A N PHE 430.A O no hydrogen 2.861 N/A ARG 434.A NH2 ASP 431.A OD1 no hydrogen 2.562 N/A ALA 435.A N ASP 431.A O no hydrogen 3.160 N/A ILE 436.A N VAL 432.A O no hydrogen 2.987 N/A ASN 437.A N LEU 433.A O no hydrogen 2.982 N/A ASN 437.A ND2 THR 370.A O no hydrogen 3.134 N/A ASN 437.A ND2 LEU 433.A O no hydrogen 3.112 N/A ALA 438.A N ARG 434.A O no hydrogen 2.965 N/A TYR 439.A N ALA 435.A O no hydrogen 2.944 N/A TYR 439.A OH ASP 399.A OD1 no hydrogen 2.602 N/A VAL 440.A N ILE 436.A O no hydrogen 2.904 N/A THR 441.A N ASN 437.A O no hydrogen 2.899 N/A THR 441.A OG1 ASN 437.A O no hydrogen 3.206 N/A ASP 442.A N ALA 438.A O no hydrogen 2.944 N/A MET 443.A N TYR 439.A O no hydrogen 2.855 N/A ALA 444.A N VAL 440.A O no hydrogen 2.822 N/A LYS 447.A N ALA 444.A O no hydrogen 2.876 N/A LEU 448.A N ALA 444.A O no hydrogen 3.332 N/A VAL 449.A N PRO 445.A O no hydrogen 3.091 N/A THR 451.A N LYS 447.A O no hydrogen 3.272 N/A THR 451.A OG1 LYS 447.A O no hydrogen 2.924 N/A ASP 452.A N LEU 448.A O no hydrogen 2.947 N/A ARG 455.A N ASP 452.A OD1 no hydrogen 3.211 N/A ARG 455.A NH1 ASP 399.A OD1 no hydrogen 3.530 N/A ARG 455.A NH1 ASP 399.A OD2 no hydrogen 2.669 N/A ARG 455.A NH2 ASP 399.A OD1 no hydrogen 2.836 N/A ARG 455.A NH2 ASP 399.A OD2 no hydrogen 3.269 N/A LEU 456.A N ASP 452.A O no hydrogen 2.990 N/A ARG 457.A N PRO 453.A O no hydrogen 3.204 N/A ARG 457.A NH1 SER 391.A O no hydrogen 2.470 N/A VAL 459.A N ARG 455.A O no hydrogen 3.176 N/A LEU 460.A N LEU 456.A O no hydrogen 2.806 N/A TYR 461.A N ARG 457.A O no hydrogen 3.017 N/A ILE 462.A N THR 458.A O no hydrogen 3.101 N/A THR 463.A N VAL 459.A O no hydrogen 3.059 N/A THR 463.A OG1 VAL 459.A O no hydrogen 2.633 N/A LEU 464.A N LEU 460.A O no hydrogen 2.913 N/A GLU 465.A N TYR 461.A O no hydrogen 3.030 N/A GLY 466.A N ILE 462.A O no hydrogen 2.874 N/A VAL 467.A N THR 463.A O no hydrogen 2.930 N/A ARG 468.A N LEU 464.A O no hydrogen 2.900 N/A ARG 468.A NE GLU 465.A OE1 no hydrogen 2.926 N/A ARG 468.A NH1 ASN 501.A O no hydrogen 2.872 N/A ARG 468.A NH2 GLU 465.A OE2 no hydrogen 2.769 N/A ARG 468.A NH2 ASN 501.A O no hydrogen 3.192 N/A VAL 469.A N GLU 465.A O no hydrogen 3.020 N/A THR 470.A N GLY 466.A O no hydrogen 3.037 N/A THR 470.A OG1 GLY 466.A O no hydrogen 2.714 N/A THR 470.A OG1 VAL 467.A O no hydrogen 2.997 N/A THR 471.A N VAL 467.A O no hydrogen 2.998 N/A THR 471.A OG1 VAL 467.A O no hydrogen 2.549 N/A LEU 472.A N ARG 468.A O no hydrogen 2.910 N/A LEU 473.A N VAL 469.A O no hydrogen 3.123 N/A LEU 474.A N THR 470.A O no hydrogen 2.896 N/A SER 475.A N LEU 472.A O no hydrogen 3.167 N/A SER 475.A OG LEU 472.A O no hydrogen 2.690 N/A ILE 477.A N LEU 474.A O no hydrogen 2.900 N/A LEU 478.A N LEU 474.A O no hydrogen 2.876 N/A ARG 480.A N ASP 336.A OD2 no hydrogen 2.853 N/A ARG 480.A NE ASP 85.A OD2 no hydrogen 2.722 N/A ARG 480.A NH2 ASP 85.A OD1 no hydrogen 2.905 N/A ARG 480.A NH2 ASP 85.A OD2 no hydrogen 3.369 N/A LYS 481.A N ASP 336.A OD2 no hydrogen 2.918 N/A LYS 481.A NZ LEU 522.A O no hydrogen 3.007 N/A SER 482.A N LEU 478.A O no hydrogen 2.888 N/A SER 482.A OG LEU 478.A O no hydrogen 3.046 N/A SER 482.A OG PRO 479.A O no hydrogen 3.027 N/A VAL 484.A N ARG 480.A O no hydrogen 3.329 N/A ILE 485.A N LYS 481.A O no hydrogen 2.920 N/A PHE 486.A N SER 482.A O no hydrogen 2.843 N/A ASP 487.A N VAL 483.A O no hydrogen 2.873 N/A MET 488.A N VAL 484.A O no hydrogen 2.893 N/A LEU 489.A N ILE 485.A O no hydrogen 2.927 N/A GLY 490.A N ASP 487.A O no hydrogen 3.041 N/A VAL 491.A N PHE 486.A O no hydrogen 2.918 N/A HIS 495.A N PRO 492.A O no hydrogen 2.995 N/A HIS 495.A ND1 ASN 501.A OD1 no hydrogen 2.697 N/A ARG 496.A N GLU 493.A O no hydrogen 2.927 N/A ARG 496.A NE VAL 491.A O no hydrogen 2.988 N/A ARG 496.A NH1 ASP 487.A OD1 no hydrogen 3.034 N/A ARG 496.A NH2 ASP 487.A OD1 no hydrogen 2.638 N/A ARG 496.A NH2 VAL 491.A O no hydrogen 3.027 N/A LYS 497.A NZ ARG 37.A O no hydrogen 3.326 N/A GLY 498.A N VAL 38.A O no hydrogen 2.581 N/A GLU 500.A N GLU 500.A OE1 no hydrogen 2.932 N/A ASN 501.A N GLY 498.A O no hydrogen 2.945 N/A ASN 501.A ND2 LYS 497.A O no hydrogen 2.727 N/A PHE 502.A N ILE 499.A O no hydrogen 3.061 N/A GLU 503.A N GLU 500.A O no hydrogen 3.487 N/A GLY 505.A N GLU 465.A OE2 no hydrogen 2.644 N/A GLY 510.A N TRP 389.A O no hydrogen 2.783 N/A THR 511.A N PRO 508.A O no hydrogen 3.272 N/A THR 511.A OG1 PRO 508.A O no hydrogen 2.700 N/A LEU 513.A N GLY 387.A O no hydrogen 3.024 N/A GLY 514.A N MET 488.A O no hydrogen 3.093 N/A VAL 517.A N GLU 520.A OE2 no hydrogen 2.710 N/A GLU 520.A N VAL 517.A O no hydrogen 3.024 N/A LYS 525.A NZ ASP 369.A OD1 no hydrogen 2.986 N/A LYS 525.A NZ ASP 369.A OD2 no hydrogen 3.299 N/A ARG 526.A N ASN 364.A OD1 no hydrogen 3.119 N/A ARG 526.A NH1.A SER 524.A O no hydrogen 2.508 N/A ARG 526.A NH2.A GLU 332.A O no hydrogen 2.983 N/A GLU 529.A N SER 527.A O no hydrogen 2.722 N/A