Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 6m58_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): SER 1.A N GLU 53.A OE1 no hydrogen 3.107 N/A SER 1.A OG CYS 58.A O no hydrogen 3.045 N/A ALA 4.A N SER 1.A OG no hydrogen 3.256 N/A HIS 5.A N SER 1.A O no hydrogen 2.984 N/A ARG 6.A N GLU 2.A O no hydrogen 2.919 N/A PHE 7.A N VAL 3.A O no hydrogen 3.180 N/A LYS 8.A N ALA 4.A O no hydrogen 3.091 N/A ASP 9.A N HIS 5.A O no hydrogen 3.042 N/A ASP 9.A N ARG 6.A O no hydrogen 3.302 N/A LEU 10.A N ARG 6.A O no hydrogen 3.242 N/A GLY 11.A N PHE 7.A O no hydrogen 3.082 N/A PHE 15.A N GLY 11.A O no hydrogen 3.041 N/A LYS 16.A N GLU 12.A O no hydrogen 2.800 N/A LYS 16.A NZ ASN 40.A OD1 no hydrogen 3.443 N/A ALA 17.A N GLU 13.A O no hydrogen 2.930 N/A LEU 18.A N ASN 14.A O no hydrogen 3.411 N/A VAL 19.A N PHE 15.A O no hydrogen 3.231 N/A LEU 20.A N LYS 16.A O no hydrogen 2.821 N/A ILE 21.A N ALA 17.A O no hydrogen 3.044 N/A ALA 22.A N LEU 18.A O no hydrogen 2.996 N/A PHE 23.A N VAL 19.A O no hydrogen 3.040 N/A ALA 24.A N LEU 20.A O no hydrogen 2.945 N/A GLN 25.A N ILE 21.A O no hydrogen 2.818 N/A GLN 25.A NE2 HIS 125.A O no hydrogen 3.519 N/A GLN 25.A NE2 PHE 128.A O no hydrogen 3.051 N/A TYR 26.A N ALA 22.A O no hydrogen 3.288 N/A TYR 26.A N PHE 23.A O no hydrogen 3.126 N/A TYR 26.A OH ASN 78.A OD1 no hydrogen 2.884 N/A LEU 27.A N PHE 23.A O no hydrogen 2.728 N/A GLN 28.A NE2 ASP 86.A O no hydrogen 3.232 N/A GLN 28.A NE2 ARG 123.A O no hydrogen 2.583 N/A ASP 34.A N PRO 31.A O no hydrogen 3.093 N/A HIS 35.A N PRO 31.A O no hydrogen 3.127 N/A HIS 35.A NE2 LEU 27.A O no hydrogen 2.886 N/A VAL 36.A N PHE 32.A O no hydrogen 2.873 N/A LYS 37.A N GLU 33.A O no hydrogen 3.247 N/A LEU 38.A N ASP 34.A O no hydrogen 3.071 N/A VAL 39.A N HIS 35.A O no hydrogen 2.783 N/A ASN 40.A N VAL 36.A O no hydrogen 2.849 N/A GLU 41.A N LYS 37.A O no hydrogen 3.112 N/A VAL 42.A N LEU 38.A O no hydrogen 3.374 N/A THR 43.A N VAL 39.A O no hydrogen 2.861 N/A THR 43.A OG1 VAL 39.A O no hydrogen 3.029 N/A GLU 44.A N ASN 40.A O no hydrogen 2.714 N/A PHE 45.A N GLU 41.A O no hydrogen 2.943 N/A ALA 46.A N VAL 42.A O no hydrogen 3.060 N/A LYS 47.A N THR 43.A O no hydrogen 3.084 N/A THR 48.A OG1 PHE 45.A O no hydrogen 2.839 N/A CYS 49.A N PHE 45.A O no hydrogen 3.343 N/A CYS 49.A SG PHE 45.A O no hydrogen 3.547 N/A VAL 50.A N ALA 46.A O no hydrogen 3.192 N/A ALA 51.A N LYS 47.A O no hydrogen 3.330 N/A ASP 52.A N THR 48.A O no hydrogen 3.027 N/A SER 54.A N ASP 52.A OD1 no hydrogen 3.263 N/A CYS 58.A SG ASP 52.A O no hydrogen 3.913 N/A LYS 60.A N ASN 57.A O no hydrogen 2.927 N/A THR 64.A N SER 61.A OG no hydrogen 3.086 N/A LEU 65.A N SER 61.A O no hydrogen 2.985 N/A PHE 66.A N LEU 62.A O no hydrogen 2.963 N/A GLY 67.A N HIS 63.A O no hydrogen 3.455 N/A ASP 68.A N THR 64.A O no hydrogen 2.934 N/A LYS 69.A N LEU 65.A O no hydrogen 2.856 N/A LEU 70.A N PHE 66.A O no hydrogen 2.667 N/A CYS 71.A N GLY 67.A O no hydrogen 2.945 N/A CYS 71.A SG GLY 67.A O no hydrogen 3.691 N/A THR 72.A OG1 LYS 69.A O no hydrogen 3.252 N/A ARG 77.A NH1 ASP 68.A OD1 no hydrogen 2.446 N/A ARG 77.A NH2 THR 64.A O no hydrogen 2.450 N/A ARG 77.A NH2 ASP 68.A OD1 no hydrogen 3.061 N/A ASN 78.A ND2 HIS 226.A O no hydrogen 2.627 N/A GLU 79.A N PRO 75.A O no hydrogen 3.448 N/A CYS 80.A N GLU 76.A O no hydrogen 2.767 N/A PHE 81.A N ARG 77.A O no hydrogen 2.876 N/A LEU 82.A N ASN 78.A O no hydrogen 2.828 N/A GLN 83.A N CYS 80.A O no hydrogen 3.313 N/A HIS 84.A N PHE 81.A O no hydrogen 3.220 N/A LYS 85.A NZ PRO 126.A O no hydrogen 3.029 N/A ASP 86.A N GLN 28.A OE1 no hydrogen 2.454 N/A ASN 88.A N ASP 86.A OD1 no hydrogen 3.110 N/A MET 102.A N GLU 98.A O no hydrogen 2.945 N/A CYS 103.A N VAL 99.A O no hydrogen 2.890 N/A CYS 103.A SG VAL 99.A O no hydrogen 3.592 N/A THR 104.A N ASP 100.A O no hydrogen 3.099 N/A THR 104.A OG1 ASP 100.A O no hydrogen 3.225 N/A ALA 105.A N VAL 101.A O no hydrogen 3.213 N/A PHE 106.A N MET 102.A O no hydrogen 2.866 N/A HIS 107.A N CYS 103.A O no hydrogen 3.139 N/A ASN 109.A N ALA 105.A O no hydrogen 3.395 N/A THR 112.A N ASN 109.A OD1 no hydrogen 3.251 N/A PHE 113.A N ASN 109.A O no hydrogen 2.909 N/A LEU 114.A N GLU 110.A O no hydrogen 3.136 N/A LYS 116.A N THR 112.A O no hydrogen 3.050 N/A TYR 117.A N PHE 113.A O no hydrogen 3.340 N/A LEU 118.A N LEU 114.A O no hydrogen 2.886 N/A TYR 119.A N LYS 115.A O no hydrogen 2.790 N/A TYR 119.A OH CYS 30.A O no hydrogen 2.809 N/A GLU 120.A N LYS 116.A O no hydrogen 2.751 N/A ILE 121.A N TYR 117.A O no hydrogen 3.088 N/A ALA 122.A N LEU 118.A O no hydrogen 3.051 N/A ARG 123.A N TYR 119.A O no hydrogen 2.994 N/A ARG 123.A NE GLN 28.A O no hydrogen 3.379 N/A ARG 123.A NH1 GLU 120.A OE1 no hydrogen 3.227 N/A ARG 123.A NH2 GLN 28.A O no hydrogen 3.471 N/A ARG 124.A N ILE 121.A O no hydrogen 3.079 N/A ARG 124.A NH1 GLU 120.A O no hydrogen 3.366 N/A ARG 124.A NH1 GLU 120.A OE1 no hydrogen 3.036 N/A ARG 124.A NH2 PRO 92.A O no hydrogen 2.445 N/A HIS 125.A N ILE 121.A O no hydrogen 2.909 N/A HIS 125.A ND1 SER 172.A OG no hydrogen 2.595 N/A PHE 128.A N HIS 125.A O no hydrogen 3.088 N/A LEU 133.A N TYR 129.A O no hydrogen 2.919 N/A LEU 134.A N ALA 130.A O no hydrogen 3.202 N/A PHE 135.A N PRO 131.A O no hydrogen 3.230 N/A PHE 136.A N GLU 132.A O no hydrogen 2.857 N/A ALA 137.A N LEU 133.A O no hydrogen 2.951 N/A LYS 138.A N LEU 134.A O no hydrogen 3.145 N/A ARG 139.A N PHE 135.A O no hydrogen 3.155 N/A ARG 139.A NH1 GLU 167.A OE2 no hydrogen 3.157 N/A ARG 139.A NH2 GLU 167.A OE2 no hydrogen 2.753 N/A TYR 140.A N PHE 136.A O no hydrogen 2.808 N/A LYS 141.A N ALA 137.A O no hydrogen 2.977 N/A LYS 141.A NZ GLU 110.A OE2 no hydrogen 3.424 N/A ALA 142.A N LYS 138.A O no hydrogen 2.965 N/A ALA 143.A N ARG 139.A O no hydrogen 3.089 N/A PHE 144.A N TYR 140.A O no hydrogen 3.309 N/A THR 145.A N LYS 141.A O no hydrogen 2.925 N/A THR 145.A OG1 LYS 141.A O no hydrogen 2.884 N/A GLU 146.A N ALA 142.A O no hydrogen 3.192 N/A CYS 147.A N ALA 143.A O no hydrogen 2.902 N/A CYS 147.A SG ALA 143.A O no hydrogen 3.164 N/A CYS 148.A N PHE 144.A O no hydrogen 3.044 N/A CYS 148.A SG PHE 144.A O no hydrogen 3.233 N/A GLN 149.A N GLU 146.A O no hydrogen 3.405 N/A ALA 150.A N CYS 147.A O no hydrogen 3.022 N/A LYS 153.A NZ ASP 100.A OD2 no hydrogen 3.177 N/A ALA 155.A N ASP 152.A OD1 no hydrogen 3.427 N/A CYS 156.A N ASP 152.A O no hydrogen 3.166 N/A CYS 156.A SG GLU 146.A OE2 no hydrogen 3.717 N/A LEU 157.A N LYS 153.A O no hydrogen 2.689 N/A LEU 158.A N ALA 154.A O no hydrogen 3.177 N/A LYS 160.A NZ GLU 146.A OE1 no hydrogen 3.213 N/A LEU 161.A N LEU 157.A O no hydrogen 2.875 N/A ASP 162.A N LEU 158.A O no hydrogen 2.823 N/A GLU 163.A N PRO 159.A O no hydrogen 3.031 N/A LEU 164.A N LYS 160.A O no hydrogen 3.119 N/A ARG 165.A N LEU 161.A O no hydrogen 3.050 N/A ASP 166.A N ASP 162.A O no hydrogen 3.078 N/A GLU 167.A N GLU 163.A O no hydrogen 2.864 N/A GLY 168.A N LEU 164.A O no hydrogen 2.745 N/A LYS 169.A N ARG 165.A O no hydrogen 3.040 N/A ALA 170.A N ASP 166.A O no hydrogen 3.101 N/A SER 171.A N GLU 167.A O no hydrogen 2.924 N/A SER 171.A OG GLU 132.A OE1 no hydrogen 2.577 N/A SER 172.A N GLY 168.A O no hydrogen 2.930 N/A SER 172.A OG HIS 125.A ND1 no hydrogen 2.595 N/A ALA 173.A N LYS 169.A O no hydrogen 3.016 N/A LYS 174.A N ALA 170.A O no hydrogen 2.894 N/A GLN 175.A N SER 171.A O no hydrogen 3.007 N/A ARG 176.A N SER 172.A O no hydrogen 2.966 N/A ARG 176.A NE ARG 176.A O no hydrogen 3.243 N/A ARG 176.A NH1 ASP 87.A OD1 no hydrogen 2.817 N/A LEU 177.A N ALA 173.A O no hydrogen 3.219 N/A LYS 178.A N LYS 174.A O no hydrogen 3.259 N/A CYS 179.A N GLN 175.A O no hydrogen 2.913 N/A CYS 179.A SG GLN 175.A O no hydrogen 3.518 N/A ALA 180.A N ARG 176.A O no hydrogen 2.876 N/A SER 181.A N LEU 177.A O no hydrogen 2.781 N/A LEU 182.A N LYS 178.A O no hydrogen 3.125 N/A GLN 183.A N CYS 179.A O no hydrogen 2.830 N/A GLN 183.A NE2 CYS 225.A O no hydrogen 3.665 N/A LYS 184.A N ALA 180.A O no hydrogen 2.935 N/A PHE 185.A N SER 181.A O no hydrogen 3.340 N/A GLY 186.A N LEU 182.A O no hydrogen 2.998 N/A ALA 189.A N GLY 186.A O no hydrogen 3.183 N/A PHE 190.A N GLY 186.A O no hydrogen 3.405 N/A LYS 191.A N GLU 187.A O no hydrogen 2.949 N/A ALA 192.A N ARG 188.A O no hydrogen 3.346 N/A TRP 193.A N ALA 189.A O no hydrogen 3.136 N/A ALA 194.A N PHE 190.A O no hydrogen 2.951 N/A VAL 195.A N LYS 191.A O no hydrogen 2.902 N/A ALA 196.A N ALA 192.A O no hydrogen 3.337 N/A ARG 197.A N TRP 193.A O no hydrogen 2.986 N/A LEU 198.A N ALA 194.A O no hydrogen 2.883 N/A SER 199.A N VAL 195.A O no hydrogen 3.009 N/A SER 199.A OG VAL 195.A O no hydrogen 2.582 N/A GLN 200.A N ALA 196.A O no hydrogen 3.246 N/A GLN 200.A NE2 HIS 317.A O no hydrogen 3.134 N/A GLN 200.A NE2 TYR 320.A O no hydrogen 2.867 N/A ARG 201.A N ARG 197.A O no hydrogen 3.114 N/A ARG 201.A NE VAL 272.A O no hydrogen 3.537 N/A PHE 202.A N LEU 198.A O no hydrogen 2.686 N/A LYS 204.A NZ ASP 248.A O no hydrogen 3.166 N/A ALA 205.A N PHE 202.A O no hydrogen 3.068 N/A VAL 210.A N GLU 206.A O no hydrogen 2.832 N/A SER 211.A N PHE 207.A O no hydrogen 2.831 N/A SER 211.A OG PHE 207.A O no hydrogen 2.662 N/A LYS 212.A N ALA 208.A O no hydrogen 2.920 N/A LYS 212.A NZ ASP 216.A OD1 no hydrogen 3.413 N/A LYS 212.A NZ ASP 216.A OD2 no hydrogen 2.685 N/A LEU 213.A N GLU 209.A O no hydrogen 3.033 N/A VAL 214.A N VAL 210.A O no hydrogen 2.971 N/A THR 215.A N SER 211.A O no hydrogen 3.150 N/A THR 215.A OG1 SER 211.A O no hydrogen 3.051 N/A ASP 216.A N LYS 212.A O no hydrogen 3.197 N/A LEU 217.A N LEU 213.A O no hydrogen 2.776 N/A THR 218.A N VAL 214.A O no hydrogen 2.796 N/A THR 218.A OG1 VAL 214.A O no hydrogen 2.720 N/A LYS 219.A N THR 215.A O no hydrogen 3.207 N/A VAL 220.A N ASP 216.A O no hydrogen 3.048 N/A HIS 221.A N LEU 217.A O no hydrogen 3.204 N/A THR 222.A N THR 218.A O no hydrogen 2.925 N/A THR 222.A OG1 THR 218.A O no hydrogen 2.671 N/A GLU 223.A N LYS 219.A O no hydrogen 3.008 N/A CYS 224.A N VAL 220.A O no hydrogen 3.134 N/A CYS 225.A N HIS 221.A O no hydrogen 2.983 N/A CYS 225.A SG HIS 221.A O no hydrogen 2.993 N/A HIS 226.A N THR 222.A O no hydrogen 2.785 N/A GLY 227.A N GLU 223.A O no hydrogen 2.999 N/A GLU 231.A N ASP 228.A OD1 no hydrogen 3.326 N/A CYS 232.A N ASP 228.A O no hydrogen 2.992 N/A CYS 232.A SG VAL 220.A O no hydrogen 3.224 N/A ALA 233.A N LEU 229.A O no hydrogen 3.017 N/A ASP 234.A N LEU 230.A O no hydrogen 3.311 N/A ASP 235.A N GLU 231.A O no hydrogen 2.841 N/A ARG 236.A N CYS 232.A O no hydrogen 3.095 N/A ARG 236.A NE ALA 233.A O no hydrogen 3.092 N/A ALA 237.A N ALA 233.A O no hydrogen 3.226 N/A ASP 238.A N ASP 234.A O no hydrogen 2.964 N/A LEU 239.A N ASP 235.A O no hydrogen 3.026 N/A ALA 240.A N ARG 236.A O no hydrogen 3.042 N/A LYS 241.A N ALA 237.A O no hydrogen 3.151 N/A LYS 241.A NZ ASP 238.A OD1 no hydrogen 3.426 N/A TYR 242.A N ASP 238.A O no hydrogen 2.918 N/A TYR 242.A OH GLU 209.A OE2 no hydrogen 2.622 N/A ILE 243.A N LEU 239.A O no hydrogen 2.875 N/A CYS 244.A N ALA 240.A O no hydrogen 2.980 N/A CYS 244.A SG ALA 240.A O no hydrogen 3.440 N/A GLU 245.A N LYS 241.A O no hydrogen 2.975 N/A ASN 246.A N TYR 242.A O no hydrogen 3.104 N/A ASN 246.A ND2 TYR 242.A O no hydrogen 3.307 N/A GLN 247.A NE2 CYS 244.A O no hydrogen 3.260 N/A SER 249.A N ASN 246.A O no hydrogen 2.925 N/A ILE 250.A N GLN 247.A O no hydrogen 2.915 N/A SER 251.A N GLN 247.A O no hydrogen 2.913 N/A SER 252.A N ASP 275.A OD2 no hydrogen 3.049 N/A SER 252.A OG ASP 275.A OD1 no hydrogen 2.553 N/A SER 252.A OG ASP 275.A OD2 no hydrogen 3.484 N/A LYS 253.A N SER 251.A OG no hydrogen 3.131 N/A LYS 253.A NZ GLU 276.A OE1 no hydrogen 2.973 N/A LYS 253.A NZ GLU 276.A OE2 no hydrogen 3.543 N/A CYS 258.A N LEU 254.A O no hydrogen 2.990 N/A CYS 258.A SG LEU 254.A O no hydrogen 3.262 N/A LYS 260.A N CYS 257.A O no hydrogen 3.251 N/A GLU 264.A N GLU 264.A OE1 no hydrogen 2.628 N/A LYS 265.A N PRO 261.A O no hydrogen 2.569 N/A SER 266.A N LEU 262.A O no hydrogen 3.020 N/A HIS 267.A N LEU 263.A O no hydrogen 3.087 N/A CYS 268.A N GLU 264.A O no hydrogen 2.735 N/A ILE 269.A N LYS 265.A O no hydrogen 2.895 N/A ALA 270.A N SER 266.A O no hydrogen 3.168 N/A GLU 271.A N HIS 267.A O no hydrogen 3.130 N/A GLU 271.A N CYS 268.A O no hydrogen 3.226 N/A ASP 275.A N ARG 201.A O no hydrogen 2.962 N/A GLU 276.A N ASP 275.A OD1 no hydrogen 2.926 N/A LEU 281.A N ALA 279.A O no hydrogen 2.995 N/A PHE 288.A N LEU 284.A O no hydrogen 3.206 N/A VAL 289.A N ALA 285.A O no hydrogen 2.968 N/A GLU 290.A N ALA 285.A O no hydrogen 2.642 N/A ASP 293.A N SER 291.A OG no hydrogen 3.038 N/A ASN 297.A N ASP 293.A O no hydrogen 2.840 N/A TYR 298.A N VAL 294.A O no hydrogen 3.021 N/A ALA 299.A N CYS 295.A O no hydrogen 2.851 N/A GLU 300.A N LYS 296.A O no hydrogen 2.728 N/A ALA 301.A N ASN 297.A O no hydrogen 2.782 N/A LYS 302.A NZ TYR 298.A OH no hydrogen 3.255 N/A PHE 305.A N ALA 301.A O no hydrogen 2.880 N/A LEU 306.A N LYS 302.A O no hydrogen 2.985 N/A GLY 307.A N ASP 303.A O no hydrogen 2.934 N/A MET 308.A N VAL 304.A O no hydrogen 2.810 N/A PHE 309.A N PHE 305.A O no hydrogen 3.101 N/A LEU 310.A N LEU 306.A O no hydrogen 3.112 N/A TYR 311.A N GLY 307.A O no hydrogen 3.130 N/A TYR 311.A OH ALA 205.A O no hydrogen 2.602 N/A GLU 312.A N MET 308.A O no hydrogen 2.923 N/A TYR 313.A N PHE 309.A O no hydrogen 2.911 N/A ALA 314.A N LEU 310.A O no hydrogen 2.769 N/A ARG 315.A N TYR 311.A O no hydrogen 3.149 N/A ARG 315.A NE GLU 312.A OE1 no hydrogen 3.241 N/A ARG 315.A NH2 GLU 312.A OE1 no hydrogen 3.516 N/A ARG 316.A NE PRO 282.A O no hydrogen 2.771 N/A ARG 316.A NH1 PRO 282.A O no hydrogen 2.650 N/A ARG 316.A NH2 GLU 312.A O no hydrogen 2.898 N/A ARG 316.A NH2 GLU 312.A OE1 no hydrogen 2.953 N/A HIS 317.A N ALA 314.A O no hydrogen 3.183 N/A ASP 319.A N ASP 319.A OD1 no hydrogen 2.629 N/A TYR 320.A N HIS 317.A O no hydrogen 3.429 N/A SER 321.A OG GLU 429.A OE1 no hydrogen 3.049 N/A VAL 322.A N ASP 430.A OD1 no hydrogen 3.403 N/A LEU 324.A N SER 321.A OG no hydrogen 3.238 N/A LEU 325.A N SER 321.A O no hydrogen 3.064 N/A LEU 326.A N VAL 322.A O no hydrogen 3.026 N/A ARG 327.A N VAL 323.A O no hydrogen 3.103 N/A ARG 327.A NE VAL 461.A O no hydrogen 3.469 N/A ARG 327.A NH2 GLU 429.A OE1 no hydrogen 3.311 N/A LEU 328.A N LEU 324.A O no hydrogen 2.984 N/A ALA 329.A N LEU 325.A O no hydrogen 2.933 N/A LYS 330.A N LEU 326.A O no hydrogen 3.037 N/A LYS 330.A NZ GLU 333.A OE1 no hydrogen 3.130 N/A LYS 330.A NZ GLU 333.A OE2 no hydrogen 3.535 N/A THR 331.A N ARG 327.A O no hydrogen 2.904 N/A THR 331.A OG1 ARG 327.A O no hydrogen 2.910 N/A TYR 332.A N LEU 328.A O no hydrogen 2.951 N/A TYR 332.A OH PHE 288.A O no hydrogen 2.480 N/A GLU 333.A N ALA 329.A O no hydrogen 2.925 N/A THR 334.A N LYS 330.A O no hydrogen 2.796 N/A THR 334.A OG1 LYS 330.A O no hydrogen 3.047 N/A THR 334.A OG1 THR 331.A O no hydrogen 3.084 N/A THR 335.A N THR 331.A O no hydrogen 2.843 N/A THR 335.A OG1 THR 331.A O no hydrogen 2.889 N/A LEU 336.A N TYR 332.A O no hydrogen 3.113 N/A GLU 337.A N GLU 333.A O no hydrogen 3.025 N/A LYS 338.A N THR 334.A O no hydrogen 3.117 N/A CYS 339.A N THR 335.A O no hydrogen 2.718 N/A CYS 340.A N LEU 336.A O no hydrogen 2.817 N/A ALA 342.A N CYS 339.A O no hydrogen 3.129 N/A GLU 347.A N ASP 344.A O no hydrogen 3.080 N/A CYS 348.A N PRO 345.A O no hydrogen 3.136 N/A CYS 348.A SG CYS 339.A O no hydrogen 3.987 N/A CYS 348.A SG PRO 345.A O no hydrogen 2.940 N/A TYR 349.A N PRO 345.A O no hydrogen 3.110 N/A ASP 354.A N LYS 351.A O no hydrogen 3.116 N/A GLU 355.A N VAL 352.A O no hydrogen 3.180 N/A PHE 356.A N PHE 353.A O no hydrogen 3.475 N/A VAL 360.A N PHE 356.A O no hydrogen 2.942 N/A VAL 360.A N LYS 357.A O no hydrogen 3.191 N/A GLU 361.A N LYS 357.A O no hydrogen 3.062 N/A GLU 362.A N PRO 358.A O no hydrogen 3.147 N/A ASN 365.A N GLU 361.A O no hydrogen 2.675 N/A LEU 366.A N GLU 362.A O no hydrogen 3.236 N/A ILE 367.A N PRO 363.A O no hydrogen 2.906 N/A LYS 368.A N GLN 364.A O no hydrogen 3.001 N/A GLN 369.A N ASN 365.A O no hydrogen 2.898 N/A ASN 370.A N LEU 366.A O no hydrogen 2.991 N/A CYS 371.A N ILE 367.A O no hydrogen 2.710 N/A GLU 372.A N LYS 368.A O no hydrogen 2.865 N/A LEU 373.A N GLN 369.A O no hydrogen 3.090 N/A PHE 374.A N ASN 370.A O no hydrogen 2.908 N/A GLU 375.A N CYS 371.A O no hydrogen 3.008 N/A LEU 377.A N LEU 373.A O no hydrogen 3.010 N/A GLY 378.A N PHE 374.A O no hydrogen 2.985 N/A PHE 382.A N GLY 378.A O no hydrogen 2.628 N/A GLN 383.A N GLU 379.A O no hydrogen 2.915 N/A GLN 383.A NE2 ARG 407.A O no hydrogen 3.104 N/A ASN 384.A N TYR 380.A O no hydrogen 3.029 N/A ALA 385.A N LYS 381.A O no hydrogen 2.872 N/A LEU 386.A N PHE 382.A O no hydrogen 3.013 N/A LEU 387.A N GLN 383.A O no hydrogen 2.645 N/A VAL 388.A N ASN 384.A O no hydrogen 2.976 N/A ARG 389.A N ALA 385.A O no hydrogen 2.990 N/A TYR 390.A N LEU 386.A O no hydrogen 2.729 N/A THR 391.A N LEU 387.A O no hydrogen 2.961 N/A THR 391.A OG1 LEU 387.A O no hydrogen 2.525 N/A LYS 392.A N VAL 388.A O no hydrogen 3.078 N/A LYS 392.A NZ ALA 518.A O no hydrogen 2.498 N/A LYS 393.A N ARG 389.A O no hydrogen 3.209 N/A LYS 393.A N TYR 390.A O no hydrogen 3.165 N/A LYS 393.A NZ PHE 467.A O no hydrogen 3.430 N/A LYS 393.A NZ SER 468.A O no hydrogen 3.509 N/A LYS 393.A NZ LEU 470.A O no hydrogen 2.673 N/A VAL 394.A N TYR 390.A O no hydrogen 3.043 N/A GLN 396.A NE2 ASP 473.A OD2 no hydrogen 2.911 N/A VAL 397.A N VAL 394.A O no hydrogen 3.141 N/A SER 398.A OG THR 401.A OG1 no hydrogen 2.987 N/A THR 399.A OG1 GLU 510.A OE2 no hydrogen 2.703 N/A THR 401.A N SER 398.A OG no hydrogen 3.169 N/A THR 401.A OG1 SER 398.A OG no hydrogen 2.987 N/A LEU 402.A N SER 398.A O no hydrogen 2.866 N/A VAL 403.A N THR 399.A O no hydrogen 3.001 N/A GLU 404.A N PRO 400.A O no hydrogen 3.004 N/A VAL 405.A N THR 401.A O no hydrogen 2.890 N/A SER 406.A N LEU 402.A O no hydrogen 3.007 N/A SER 406.A OG LEU 402.A O no hydrogen 2.516 N/A ARG 407.A N VAL 403.A O no hydrogen 2.935 N/A ARG 407.A NE GLN 505.A OE1 no hydrogen 2.773 N/A ASN 408.A N GLU 404.A O no hydrogen 3.094 N/A ASN 408.A ND2 GLN 438.A OE1 no hydrogen 2.891 N/A LEU 409.A N VAL 405.A O no hydrogen 2.819 N/A GLY 410.A N SER 406.A O no hydrogen 2.884 N/A LYS 411.A N ASN 408.A O no hydrogen 2.922 N/A LYS 411.A NZ ASN 408.A OD1 no hydrogen 2.549 N/A VAL 412.A N LEU 409.A O no hydrogen 3.327 N/A LYS 415.A N LYS 411.A O no hydrogen 2.896 N/A CYS 416.A N VAL 412.A O no hydrogen 2.711 N/A CYS 417.A N GLY 413.A O no hydrogen 3.087 N/A LYS 423.A N PRO 420.A O no hydrogen 2.854 N/A ARG 424.A NH2 CYS 417.A O no hydrogen 2.438 N/A ALA 428.A N ARG 424.A O no hydrogen 2.769 N/A GLU 429.A N MET 425.A O no hydrogen 2.835 N/A ASP 430.A N PRO 426.A O no hydrogen 3.155 N/A TYR 431.A N CYS 427.A O no hydrogen 3.152 N/A TYR 431.A OH ASN 408.A O no hydrogen 2.976 N/A LEU 432.A N ALA 428.A O no hydrogen 2.883 N/A SER 433.A N GLU 429.A O no hydrogen 3.051 N/A SER 433.A OG GLU 429.A O no hydrogen 2.742 N/A VAL 434.A N ASP 430.A O no hydrogen 3.251 N/A VAL 435.A N TYR 431.A O no hydrogen 2.962 N/A LEU 436.A N LEU 432.A O no hydrogen 2.986 N/A ASN 437.A N SER 433.A O no hydrogen 3.263 N/A GLN 438.A N VAL 434.A O no hydrogen 3.327 N/A LEU 439.A N VAL 435.A O no hydrogen 3.253 N/A CYS 440.A N LEU 436.A O no hydrogen 2.875 N/A CYS 440.A SG LEU 436.A O no hydrogen 3.157 N/A VAL 441.A N ASN 437.A O no hydrogen 3.002 N/A LEU 442.A N GLN 438.A O no hydrogen 3.083 N/A HIS 443.A N LEU 439.A O no hydrogen 3.038 N/A LYS 445.A NZ ASP 86.A OD1 no hydrogen 2.759 N/A LYS 445.A NZ ASP 86.A OD2 no hydrogen 3.258 N/A LYS 445.A NZ ASN 88.A O no hydrogen 3.165 N/A VAL 448.A N HIS 443.A NE2 no hydrogen 3.076 N/A SER 449.A N HIS 443.A NE2 no hydrogen 2.877 N/A ARG 451.A NH1 LYS 393.A O no hydrogen 2.539 N/A ARG 451.A NH1 GLU 471.A O no hydrogen 2.749 N/A ARG 451.A NH2 GLU 471.A O no hydrogen 3.092 N/A VAL 452.A N SER 449.A OG no hydrogen 3.217 N/A THR 453.A N SER 449.A O no hydrogen 3.177 N/A THR 453.A OG1 SER 449.A O no hydrogen 2.804 N/A LYS 454.A N ASP 450.A O no hydrogen 2.793 N/A LYS 454.A NZ GLU 458.A OE2 no hydrogen 3.325 N/A CYS 455.A N ARG 451.A O no hydrogen 2.800 N/A CYS 455.A SG ARG 451.A O no hydrogen 3.763 N/A CYS 456.A N VAL 452.A O no hydrogen 2.864 N/A CYS 456.A SG VAL 452.A O no hydrogen 3.111 N/A THR 457.A N THR 453.A O no hydrogen 3.033 N/A THR 457.A OG1 THR 453.A O no hydrogen 2.635 N/A GLU 458.A N LYS 454.A O no hydrogen 3.015 N/A ASN 462.A N SER 459.A OG no hydrogen 2.850 N/A ARG 463.A NE CYS 456.A O no hydrogen 3.375 N/A ARG 463.A NH1 ASN 437.A OD1 no hydrogen 3.143 N/A ARG 463.A NH2 CYS 456.A O no hydrogen 3.207 N/A ARG 464.A NE GLU 429.A OE2 no hydrogen 3.411 N/A ARG 464.A NH1 GLU 362.A OE2 no hydrogen 2.893 N/A ARG 464.A NH2 GLU 362.A OE1 no hydrogen 3.315 N/A ARG 464.A NH2 GLU 362.A OE2 no hydrogen 2.769 N/A CYS 466.A N ASN 462.A O no hydrogen 3.135 N/A PHE 467.A N ARG 463.A O no hydrogen 3.009 N/A SER 468.A N ARG 464.A O no hydrogen 2.839 N/A SER 468.A OG ARG 464.A O no hydrogen 3.287 N/A ALA 469.A N PRO 465.A O no hydrogen 2.933 N/A LEU 470.A N PHE 467.A O no hydrogen 3.132 N/A ASP 473.A N LYS 392.A O no hydrogen 2.875 N/A THR 475.A N ASP 473.A OD1 no hydrogen 2.836 N/A LYS 479.A N LYS 513.A O no hydrogen 2.804 N/A PHE 486.A N ALA 483.A O no hydrogen 3.433 N/A THR 487.A OG1 ALA 483.A O no hydrogen 3.105 N/A ILE 492.A N HIS 489.A O no hydrogen 3.363 N/A CYS 493.A N ALA 490.A O no hydrogen 3.208 N/A CYS 493.A SG ALA 490.A O no hydrogen 3.601 N/A THR 494.A N ASP 491.A O no hydrogen 3.231 N/A THR 494.A OG1 ASP 491.A O no hydrogen 2.985 N/A LEU 495.A N ILE 492.A O no hydrogen 3.391 N/A ARG 500.A N SER 496.A O no hydrogen 2.796 N/A GLN 501.A N GLU 497.A O no hydrogen 2.902 N/A ILE 502.A N LYS 498.A O no hydrogen 2.811 N/A LYS 503.A N GLU 499.A O no hydrogen 3.222 N/A LYS 504.A N ARG 500.A O no hydrogen 2.900 N/A GLN 505.A N GLN 501.A O no hydrogen 2.719 N/A GLN 505.A NE2 GLN 383.A OE1 no hydrogen 3.228 N/A GLN 505.A NE2 ASN 384.A OD1 no hydrogen 3.189 N/A THR 506.A N ILE 502.A O no hydrogen 2.815 N/A THR 506.A OG1 ILE 502.A O no hydrogen 2.372 N/A ALA 507.A N LYS 503.A O no hydrogen 3.267 N/A LEU 508.A N LYS 504.A O no hydrogen 3.152 N/A VAL 509.A N GLN 505.A O no hydrogen 3.170 N/A GLU 510.A N THR 506.A O no hydrogen 3.461 N/A LEU 511.A N ALA 507.A O no hydrogen 2.741 N/A VAL 512.A N LEU 508.A O no hydrogen 2.954 N/A LYS 513.A N VAL 509.A O no hydrogen 2.788 N/A LYS 513.A NZ VAL 397.A O no hydrogen 3.147 N/A LYS 513.A NZ THR 399.A OG1 no hydrogen 2.900 N/A HIS 514.A N LEU 511.A O no hydrogen 3.075 N/A HIS 514.A ND1 LYS 479.A O no hydrogen 2.766 N/A LYS 515.A N LEU 511.A O no hydrogen 2.895 N/A ALA 518.A N LYS 515.A O no hydrogen 3.147 N/A LEU 523.A N THR 519.A O no hydrogen 2.858 N/A LYS 524.A N LYS 520.A O no hydrogen 3.201 N/A ALA 525.A N GLU 521.A O no hydrogen 3.194 N/A ALA 525.A N GLN 522.A O no hydrogen 3.147 N/A MET 527.A N LEU 523.A O no hydrogen 3.378 N/A ASP 528.A N LYS 524.A O no hydrogen 2.965 N/A ASP 529.A N ALA 525.A O no hydrogen 2.906 N/A PHE 530.A N VAL 526.A O no hydrogen 2.562 N/A ALA 531.A N MET 527.A O no hydrogen 2.928 N/A ALA 532.A N ASP 528.A O no hydrogen 3.240 N/A PHE 533.A N ASP 529.A O no hydrogen 3.133 N/A VAL 534.A N PHE 530.A O no hydrogen 3.075 N/A GLU 535.A N ALA 531.A O no hydrogen 3.068 N/A LYS 536.A N ALA 532.A O no hydrogen 3.097 N/A CYS 537.A N PHE 533.A O no hydrogen 3.135 N/A CYS 538.A N VAL 534.A O no hydrogen 3.069 N/A CYS 538.A SG VAL 534.A O no hydrogen 3.333 N/A LYS 539.A N GLU 535.A O no hydrogen 3.224 N/A LYS 539.A N LYS 536.A O no hydrogen 3.097 N/A ALA 540.A N LYS 536.A O no hydrogen 3.170 N/A THR 545.A OG1 ASP 542.A OD1 no hydrogen 3.048 N/A THR 545.A OG1 ASP 542.A OD2 no hydrogen 2.709 N/A CYS 546.A N ASP 542.A O no hydrogen 3.436 N/A CYS 546.A SG ASP 542.A O no hydrogen 4.031 N/A PHE 547.A N LYS 543.A O no hydrogen 3.164 N/A ALA 548.A N GLU 544.A O no hydrogen 3.387 N/A GLU 549.A N THR 545.A O no hydrogen 2.955 N/A GLU 550.A N CYS 546.A O no hydrogen 2.949 N/A GLY 551.A N PHE 547.A O no hydrogen 3.215 N/A LYS 552.A N ALA 548.A O no hydrogen 3.253 N/A LYS 553.A N GLU 549.A O no hydrogen 3.268 N/A LEU 554.A N GLU 550.A O no hydrogen 2.891 N/A VAL 555.A N GLY 551.A O no hydrogen 3.020 N/A ALA 556.A N LYS 552.A O no hydrogen 3.181 N/A ALA 557.A N LYS 553.A O no hydrogen 3.303 N/A SER 558.A N LEU 554.A O no hydrogen 3.304 N/A SER 558.A OG LEU 554.A O no hydrogen 2.777 N/A GLN 559.A N VAL 555.A O no hydrogen 3.043 N/A ALA 560.A N ALA 556.A O no hydrogen 2.886 N/A ALA 561.A N ALA 557.A O no hydrogen 3.093 N/A ALA 561.A N SER 558.A O no hydrogen 3.183 N/A