Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1kfq_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ILE 4.A N GLU 188.A O no hydrogen 2.834 N/A ARG 8.A N THR 168.A O no hydrogen 2.617 N/A ARG 8.A NE ASP 170.A OD1 no hydrogen 3.482 N/A ARG 8.A NH1 GLN 10.A OE1 no hydrogen 2.662 N/A ARG 8.A NH2 ASP 170.A OD2 no hydrogen 2.385 N/A GLN 10.A N TYR 166.A O no hydrogen 3.005 N/A GLN 10.A NE2 VAL 11.A O no hydrogen 3.115 N/A THR 12.A N LYS 164.A O no hydrogen 2.888 N/A THR 12.A OG1 ASN 36.A OD1 no hydrogen 3.456 N/A THR 12.A OG1 ASN 40.A OD1 no hydrogen 2.667 N/A TYR 15.A OH PRO 35.A O no hydrogen 2.558 N/A LYS 19.A N GLY 17.A O no hydrogen 2.614 N/A GLY 21.A N GLY 24.A O no hydrogen 3.387 N/A LEU 25.A N ILE 138.A O no hydrogen 3.188 N/A ARG 26.A NH2 ALA 124.A O no hydrogen 3.100 N/A LYS 27.A N PHE 136.A O no hydrogen 3.248 N/A LYS 27.A NZ GLY 17.A O no hydrogen 3.052 N/A VAL 29.A N GLY 134.A O no hydrogen 2.759 N/A ALA 32.A N LYS 28.A O no hydrogen 3.092 N/A THR 33.A N VAL 29.A O no hydrogen 3.095 N/A THR 33.A OG1 VAL 29.A O no hydrogen 2.800 N/A THR 33.A OG1 SER 30.A O no hydrogen 3.223 N/A TYR 37.A N GLN 34.A O no hydrogen 3.206 N/A GLU 39.A N GLU 39.A OE2 no hydrogen 2.580 N/A ASN 40.A N ASN 36.A O no hydrogen 2.738 N/A ASN 40.A ND2 GLN 13.A O no hydrogen 3.461 N/A PHE 41.A N TYR 37.A O no hydrogen 3.136 N/A VAL 42.A N LEU 38.A O no hydrogen 2.924 N/A GLN 43.A N GLU 39.A O no hydrogen 2.991 N/A GLN 43.A NE2 GLN 43.A O no hydrogen 3.511 N/A GLN 43.A NE2 ASN 47.A OD1 no hydrogen 2.629 N/A GLN 43.A NE2 ASN 84.A OD1 no hydrogen 3.184 N/A SER 44.A N ASN 40.A O no hydrogen 3.132 N/A SER 44.A OG ASN 40.A O no hydrogen 2.553 N/A ILE 45.A N PHE 41.A O no hydrogen 3.120 N/A ILE 45.A N VAL 42.A O no hydrogen 3.067 N/A PHE 46.A N VAL 42.A O no hydrogen 3.173 N/A ASN 47.A N GLN 43.A O no hydrogen 2.851 N/A THR 48.A N ILE 45.A O no hydrogen 3.052 N/A THR 48.A OG1 SER 44.A O no hydrogen 2.867 N/A LEU 49.A N ILE 45.A O no hydrogen 3.391 N/A ARG 50.A NH1 ASP 52.A OD1 no hydrogen 3.296 N/A ARG 50.A NH1 ASP 52.A OD2 no hydrogen 3.023 N/A GLU 53.A N ARG 50.A O no hydrogen 2.699 N/A LEU 54.A N LYS 51.A O no hydrogen 2.960 N/A LYS 55.A NZ ASP 85.A OD2 no hydrogen 2.881 N/A ASN 58.A ND2 GLU 53.A O no hydrogen 3.368 N/A ASN 58.A ND2 LEU 54.A O no hydrogen 2.862 N/A VAL 59.A N ASN 115.A O no hydrogen 3.183 N/A LEU 60.A N GLU 88.A O no hydrogen 2.841 N/A PHE 61.A N GLY 118.A O no hydrogen 3.029 N/A VAL 62.A N HIS 90.A O no hydrogen 2.773 N/A GLY 63.A N ILE 120.A O no hydrogen 2.781 N/A GLY 64.A N MET 97.A O no hydrogen 3.207 N/A ASP 65.A N LEU 122.A O no hydrogen 2.872 N/A ARG 67.A N ASP 65.A OD2 no hydrogen 3.113 N/A ARG 67.A NE ASP 65.A OD1 no hydrogen 3.182 N/A ARG 67.A NE ASP 65.A OD2 no hydrogen 3.116 N/A ARG 67.A NH1 ASN 127.A O no hydrogen 3.217 N/A ARG 67.A NH1 PRO 128.A O no hydrogen 2.890 N/A ARG 67.A NH1 ASP 135.A O no hydrogen 2.996 N/A ARG 67.A NH2 ASP 65.A OD1 no hydrogen 3.097 N/A ARG 67.A NH2 ASN 127.A O no hydrogen 3.016 N/A TYR 68.A N GLU 267.A O no hydrogen 2.945 N/A ASN 70.A N ARG 67.A O no hydrogen 3.306 N/A ASN 70.A ND2 ASP 65.A OD2 no hydrogen 3.465 N/A ASN 70.A ND2 LEU 122.A O no hydrogen 3.085 N/A ARG 71.A NH2 ASP 180.A OD1 no hydrogen 3.030 N/A GLN 72.A N GLN 72.A OE1 no hydrogen 3.070 N/A ALA 73.A N PHE 69.A O no hydrogen 2.981 N/A ILE 74.A N ASN 70.A O no hydrogen 2.874 N/A PHE 75.A N ARG 71.A O no hydrogen 3.341 N/A SER 76.A N GLN 72.A O no hydrogen 2.832 N/A SER 76.A OG GLU 39.A OE1 no hydrogen 3.362 N/A ILE 77.A N ALA 73.A O no hydrogen 2.667 N/A ILE 78.A N ILE 74.A O no hydrogen 2.819 N/A ARG 79.A N PHE 75.A O no hydrogen 3.166 N/A ARG 79.A NH1 GLU 174.A OE2 no hydrogen 2.640 N/A ARG 79.A NH2 GLU 174.A OE1 no hydrogen 3.003 N/A ARG 79.A NH2 GLU 174.A OE2 no hydrogen 3.036 N/A LEU 80.A N SER 76.A O no hydrogen 3.066 N/A ALA 81.A N ILE 77.A O no hydrogen 2.799 N/A TYR 82.A N ILE 78.A O no hydrogen 2.982 N/A TYR 82.A OH PRO 5.A O no hydrogen 3.191 N/A ALA 83.A N ARG 79.A O no hydrogen 2.947 N/A ASN 84.A N LEU 80.A O no hydrogen 2.705 N/A ASN 84.A ND2 GLN 43.A OE1 no hydrogen 3.110 N/A ASN 84.A ND2 LEU 80.A O no hydrogen 3.318 N/A ASP 85.A N TYR 82.A O no hydrogen 3.221 N/A ILE 86.A N ALA 81.A O no hydrogen 2.981 N/A SER 87.A N ASN 58.A OD1 no hydrogen 2.895 N/A GLU 88.A N ASN 58.A O no hydrogen 2.943 N/A VAL 89.A N GLU 198.A O no hydrogen 3.276 N/A HIS 90.A N LEU 60.A O no hydrogen 2.940 N/A HIS 90.A ND1 TYR 105.A OH no hydrogen 2.834 N/A HIS 90.A NE2 GLU 88.A OE2 no hydrogen 3.005 N/A VAL 91.A N LYS 200.A O no hydrogen 3.104 N/A GLN 93.A N VAL 202.A O no hydrogen 2.985 N/A ALA 94.A N LEU 179.A O no hydrogen 2.687 N/A GLY 95.A N GLY 92.A O no hydrogen 2.774 N/A LEU 96.A N GLN 93.A O no hydrogen 2.901 N/A MET 97.A N GLY 64.A O no hydrogen 3.144 N/A SER 98.A N TYR 244.A OH no hydrogen 3.046 N/A THR 99.A N ASP 309.A O no hydrogen 3.279 N/A THR 99.A OG1 ASP 309.A OD1 no hydrogen 2.615 N/A ALA 101.A N SER 98.A OG no hydrogen 3.089 N/A SER 102.A N SER 98.A O no hydrogen 2.760 N/A SER 102.A OG MET 97.A O no hydrogen 3.261 N/A SER 102.A OG SER 98.A O no hydrogen 2.961 N/A SER 103.A N THR 99.A O no hydrogen 2.967 N/A SER 103.A OG GLY 145.A O no hydrogen 2.594 N/A HIS 104.A N PRO 100.A O no hydrogen 3.224 N/A TYR 105.A N ALA 101.A O no hydrogen 2.999 N/A TYR 105.A OH HIS 90.A ND1 no hydrogen 2.834 N/A ILE 106.A N SER 102.A O no hydrogen 3.068 N/A ARG 107.A N SER 103.A O no hydrogen 2.994 N/A ARG 107.A NH1 THR 144.A O no hydrogen 3.150 N/A LYS 108.A N HIS 104.A O no hydrogen 2.744 N/A LYS 108.A NZ GLU 112.A OE1 no hydrogen 2.660 N/A LYS 108.A NZ GLU 112.A OE2 no hydrogen 2.911 N/A VAL 109.A N TYR 105.A O no hydrogen 3.093 N/A ASN 110.A N ILE 106.A O no hydrogen 3.072 N/A ASN 110.A ND2 CYS 116.A O no hydrogen 3.255 N/A GLU 112.A N LYS 108.A O no hydrogen 3.172 N/A VAL 113.A N VAL 109.A O no hydrogen 2.817 N/A GLY 114.A N VAL 109.A O no hydrogen 2.968 N/A ASN 115.A ND2 LYS 57.A O no hydrogen 2.833 N/A CYS 116.A SG VAL 59.A O no hydrogen 3.315 N/A CYS 116.A SG GLY 118.A O no hydrogen 3.207 N/A ILE 117.A N VAL 59.A O no hydrogen 3.050 N/A GLY 119.A N ASN 141.A O no hydrogen 2.873 N/A ILE 120.A N PHE 61.A O no hydrogen 2.710 N/A ILE 121.A N LYS 139.A O no hydrogen 3.164 N/A LEU 122.A N GLY 63.A O no hydrogen 2.433 N/A THR 123.A OG1 ASP 65.A OD1 no hydrogen 2.364 N/A SER 125.A N THR 123.A OG1 no hydrogen 3.009 N/A SER 125.A OG ASP 307.A OD1 no hydrogen 3.218 N/A SER 125.A OG ASP 309.A OD2 no hydrogen 3.329 N/A ASN 127.A N ALA 124.A O no hydrogen 3.079 N/A ASN 127.A ND2 ASP 135.A OD2 no hydrogen 2.753 N/A ASP 135.A N PRO 128.A O no hydrogen 2.804 N/A PHE 136.A N LYS 27.A O no hydrogen 2.757 N/A ILE 138.A N LEU 25.A O no hydrogen 3.195 N/A LYS 139.A N ILE 121.A O no hydrogen 3.193 N/A LYS 139.A NZ GLU 403.A OE1 no hydrogen 3.013 N/A ASN 141.A N GLY 119.A O no hydrogen 2.845 N/A VAL 142.A N ALA 146.A O no hydrogen 3.171 N/A ARG 143.A NE GLU 53.A OE1 no hydrogen 2.617 N/A ARG 143.A NH2 GLU 53.A OE1 no hydrogen 2.586 N/A GLY 145.A N VAL 142.A O no hydrogen 2.789 N/A ALA 146.A N THR 144.A OG1 no hydrogen 3.298 N/A ALA 148.A N PHE 140.A O no hydrogen 2.916 N/A PHE 152.A N PRO 149.A O no hydrogen 2.891 N/A THR 153.A N PRO 149.A O no hydrogen 2.887 N/A THR 153.A OG1 GLU 150.A O no hydrogen 2.862 N/A ASP 154.A N GLU 150.A O no hydrogen 2.899 N/A GLN 155.A N ASP 151.A O no hydrogen 3.261 N/A ILE 156.A N PHE 152.A O no hydrogen 3.025 N/A TYR 157.A N THR 153.A O no hydrogen 3.218 N/A THR 158.A N ASP 154.A O no hydrogen 3.065 N/A THR 158.A OG1 ASP 154.A O no hydrogen 3.056 N/A HIS 159.A N GLN 155.A O no hydrogen 3.172 N/A THR 160.A N ILE 156.A O no hydrogen 3.163 N/A THR 160.A OG1 GLN 18.A O no hydrogen 3.347 N/A THR 160.A OG1 TYR 157.A O no hydrogen 2.503 N/A THR 161.A N THR 158.A O no hydrogen 3.175 N/A THR 161.A OG1 THR 158.A O no hydrogen 2.755 N/A LYS 162.A N HIS 159.A O no hydrogen 3.132 N/A ILE 163.A N HIS 159.A O no hydrogen 2.933 N/A TYR 166.A N GLN 10.A O no hydrogen 3.089 N/A LEU 167.A N GLN 43.A OE1 no hydrogen 2.990 N/A THR 168.A N ARG 8.A O no hydrogen 2.976 N/A TYR 171.A OH GLN 2.A O no hydrogen 2.727 N/A PHE 173.A N TYR 171.A O no hydrogen 2.990 N/A LYS 175.A N GLU 172.A O no hydrogen 3.052 N/A LYS 175.A NZ GLU 172.A OE1 no hydrogen 3.501 N/A HIS 176.A N PHE 173.A O no hydrogen 2.820 N/A ILE 177.A N PHE 173.A O no hydrogen 2.940 N/A ASP 180.A N ASN 178.A OD1 no hydrogen 3.290 N/A GLN 181.A N ASN 178.A O no hydrogen 2.791 N/A GLY 183.A N VAL 201.A O no hydrogen 3.189 N/A TYR 185.A N VAL 199.A O no hydrogen 2.806 N/A TYR 185.A OH GLN 181.A O no hydrogen 2.794 N/A LYS 186.A NZ GLU 198.A OE1 no hydrogen 2.624 N/A PHE 187.A N PHE 197.A O no hydrogen 2.802 N/A GLY 189.A N SER 195.A O no hydrogen 2.588 N/A THR 190.A N TYR 82.A OH no hydrogen 2.931 N/A THR 190.A OG1 ILE 4.A O no hydrogen 2.587 N/A ARG 191.A NH1 TYR 82.A O no hydrogen 2.653 N/A ARG 191.A NH1 ILE 86.A O no hydrogen 3.240 N/A ARG 191.A NH2 ILE 86.A O no hydrogen 3.444 N/A ARG 191.A NH2 HIS 196.A O no hydrogen 3.245 N/A LYS 194.A NZ LEU 54.A O no hydrogen 3.541 N/A LYS 194.A NZ LYS 55.A O no hydrogen 3.316 N/A LYS 194.A NZ PRO 56.A O no hydrogen 2.950 N/A LYS 194.A NZ ASP 85.A O no hydrogen 2.902 N/A LYS 194.A NZ SER 87.A OG no hydrogen 2.660 N/A PHE 197.A N PHE 187.A O no hydrogen 3.155 N/A GLU 198.A N SER 87.A O no hydrogen 3.141 N/A VAL 199.A N TYR 185.A O no hydrogen 3.062 N/A LYS 200.A N VAL 89.A O no hydrogen 3.056 N/A VAL 201.A N GLY 183.A O no hydrogen 2.918 N/A VAL 202.A N VAL 91.A O no hydrogen 2.834 N/A VAL 205.A N ASP 203.A OD1 no hydrogen 2.818 N/A GLN 206.A N ASP 203.A OD1 no hydrogen 2.902 N/A TYR 208.A OH ASP 405.A OD1 no hydrogen 2.689 N/A TYR 208.A OH ASP 405.A OD2 no hydrogen 3.337 N/A THR 209.A N VAL 205.A O no hydrogen 3.108 N/A THR 209.A OG1 VAL 205.A O no hydrogen 2.490 N/A GLN 210.A N GLN 206.A O no hydrogen 3.180 N/A LEU 211.A N ASP 207.A O no hydrogen 3.371 N/A MET 212.A N TYR 208.A O no hydrogen 2.988 N/A GLN 213.A N THR 209.A O no hydrogen 2.825 N/A LYS 214.A N LEU 211.A O no hydrogen 3.048 N/A LEU 215.A N LEU 211.A O no hydrogen 3.059 N/A PHE 216.A N MET 212.A O no hydrogen 2.862 N/A LEU 220.A N ASP 217.A OD1 no hydrogen 2.874 N/A LEU 221.A N ASP 217.A O no hydrogen 3.059 N/A LYS 222.A N PHE 218.A O no hydrogen 2.801 N/A LYS 222.A NZ ASP 219.A OD2 no hydrogen 3.461 N/A GLY 223.A N LEU 220.A O no hydrogen 3.023 N/A LEU 224.A N LEU 221.A O no hydrogen 3.036 N/A PHE 225.A N LEU 221.A O no hydrogen 3.125 N/A SER 226.A OG LYS 222.A O no hydrogen 2.774 N/A ASN 227.A N LEU 224.A O no hydrogen 2.963 N/A ASP 229.A N ASN 227.A OD1 no hydrogen 2.943 N/A PHE 230.A N ASN 227.A O no hydrogen 2.967 N/A ARG 233.A N PHE 302.A O no hydrogen 2.892 N/A ARG 233.A NH1 PHE 232.A O no hydrogen 2.859 N/A PHE 234.A N SER 259.A O no hydrogen 3.020 N/A ASP 235.A N ALA 304.A O no hydrogen 2.799 N/A GLY 236.A N LEU 261.A O no hydrogen 2.858 N/A MET 237.A N ASP 235.A OD1 no hydrogen 3.269 N/A HIS 238.A N ASN 262.A O no hydrogen 2.855 N/A GLY 239.A N GLY 236.A O no hydrogen 2.804 N/A VAL 240.A N GLY 308.A O no hydrogen 2.932 N/A GLY 242.A N GLY 239.A O no hydrogen 3.206 N/A TYR 244.A OH THR 204.A O no hydrogen 2.708 N/A ALA 245.A N ALA 241.A O no hydrogen 2.962 N/A LYS 246.A N GLY 242.A O no hydrogen 2.910 N/A LYS 246.A NZ ASP 264.A OD2 no hydrogen 2.825 N/A HIS 247.A N PRO 243.A O no hydrogen 2.997 N/A ILE 248.A N TYR 244.A O no hydrogen 2.876 N/A PHE 249.A N ALA 245.A O no hydrogen 2.973 N/A THR 251.A N LYS 246.A O no hydrogen 3.181 N/A THR 251.A OG1 LYS 246.A O no hydrogen 3.531 N/A LEU 252.A N HIS 247.A O no hydrogen 3.072 N/A LEU 253.A N ILE 248.A O no hydrogen 2.895 N/A GLY 254.A N GLY 250.A O no hydrogen 2.806 N/A CYS 255.A N PHE 249.A O no hydrogen 2.771 N/A CYS 255.A SG SER 256.A O no hydrogen 3.364 N/A SER 256.A OG SER 259.A OG no hydrogen 2.568 N/A SER 259.A N SER 256.A O no hydrogen 3.092 N/A SER 259.A OG PHE 232.A O no hydrogen 2.870 N/A SER 259.A OG SER 256.A OG no hydrogen 2.568 N/A LEU 260.A N LYS 257.A O no hydrogen 3.156 N/A LEU 261.A N PHE 234.A O no hydrogen 2.944 N/A CYS 263.A SG LEU 261.A O no hydrogen 3.613 N/A SER 266.A N HIS 238.A O no hydrogen 3.081 N/A SER 266.A OG ASP 268.A OD1 no hydrogen 2.463 N/A ASP 268.A N SER 266.A OG no hydrogen 3.236 N/A PHE 269.A N SER 266.A O no hydrogen 3.218 N/A GLY 270.A N ASP 268.A OD1 no hydrogen 3.003 N/A GLY 271.A N ASP 268.A O no hydrogen 3.182 N/A ASP 275.A N HIS 273.A O no hydrogen 2.480 N/A THR 279.A N ASN 277.A OD1 no hydrogen 2.517 N/A TYR 280.A N ASN 277.A OD1 no hydrogen 3.123 N/A ALA 281.A N ASN 277.A O no hydrogen 2.869 N/A VAL 285.A N ALA 281.A O no hydrogen 3.223 N/A GLU 286.A N HIS 282.A O no hydrogen 2.882 N/A LEU 287.A N ASP 283.A O no hydrogen 3.083 N/A LEU 288.A N LEU 284.A O no hydrogen 3.127 N/A ASP 289.A N GLU 286.A O no hydrogen 3.203 N/A ILE 290.A N VAL 285.A O no hydrogen 3.136 N/A LYS 292.A N ASP 289.A O no hydrogen 3.005 N/A LYS 292.A NZ GLN 319.A O no hydrogen 3.163 N/A LYS 293.A N ASP 289.A OD1 no hydrogen 2.845 N/A LYS 293.A N ASP 289.A OD2 no hydrogen 2.787 N/A LYS 294.A N ASP 289.A OD2 no hydrogen 3.014 N/A THR 298.A N ASP 295.A O no hydrogen 2.883 N/A THR 298.A OG1 ASP 295.A O no hydrogen 2.637 N/A VAL 299.A N VAL 296.A O no hydrogen 3.341 N/A GLN 301.A N SER 231.A OG no hydrogen 2.545 N/A PHE 302.A N SER 231.A O no hydrogen 3.157 N/A GLY 303.A N LEU 316.A O no hydrogen 2.922 N/A ALA 304.A N ARG 233.A O no hydrogen 2.905 N/A ALA 305.A N MET 314.A O no hydrogen 3.191 N/A ASP 307.A N ARG 312.A O no hydrogen 3.307 N/A GLY 308.A N PRO 274.A O no hydrogen 3.018 N/A ALA 310.A N ASP 307.A O no hydrogen 3.246 N/A ASP 311.A N ASP 307.A OD2 no hydrogen 2.589 N/A ARG 312.A N ASP 307.A OD1 no hydrogen 3.255 N/A ARG 312.A N ASP 307.A OD2 no hydrogen 3.300 N/A ARG 312.A NH1 ASP 275.A OD1 no hydrogen 3.525 N/A ASN 313.A N PHE 394.A O no hydrogen 2.871 N/A ASN 313.A ND2 THR 396.A OG1 no hydrogen 3.289 N/A MET 314.A N ALA 305.A O no hydrogen 2.766 N/A LEU 316.A N GLY 303.A O no hydrogen 2.682 N/A GLY 317.A N PHE 320.A O no hydrogen 2.889 N/A ARG 318.A NE VAL 299.A O no hydrogen 2.678 N/A ARG 318.A NH2 VAL 299.A O no hydrogen 2.923 N/A GLN 319.A N LEU 288.A O no hydrogen 2.646 N/A PHE 320.A N GLY 317.A O no hydrogen 3.130 N/A VAL 322.A N ILE 315.A O no hydrogen 3.280 N/A ASP 326.A N THR 323.A OG1 no hydrogen 3.046 N/A SER 327.A N THR 323.A O no hydrogen 2.845 N/A LEU 328.A N PRO 324.A O no hydrogen 3.186 N/A VAL 330.A N ASP 326.A O no hydrogen 2.803 N/A ILE 331.A N SER 327.A O no hydrogen 3.190 N/A ALA 332.A N LEU 328.A O no hydrogen 2.964 N/A ALA 333.A N ALA 329.A O no hydrogen 2.767 N/A ASN 334.A N VAL 330.A O no hydrogen 3.034 N/A ASN 334.A N ILE 331.A O no hydrogen 3.126 N/A ALA 335.A N ALA 332.A O no hydrogen 3.249 N/A LEU 337.A N ASN 334.A O no hydrogen 2.942 N/A ILE 338.A N ALA 335.A O no hydrogen 3.394 N/A PHE 339.A N ALA 335.A O no hydrogen 3.063 N/A GLY 342.A N PHE 339.A O no hydrogen 3.348 N/A LEU 344.A N ASN 387.A OD1 no hydrogen 2.756 N/A ALA 346.A N LYS 366.A O no hydrogen 3.038 N/A ALA 347.A N LEU 388.A O no hydrogen 3.011 N/A ARG 348.A N PHE 368.A O no hydrogen 3.206 N/A ARG 348.A NE ASP 357.A OD2 no hydrogen 2.760 N/A ARG 348.A NH1 SER 349.A O no hydrogen 3.020 N/A ARG 348.A NH1 MET 350.A O no hydrogen 3.156 N/A ARG 348.A NH1 GLU 369.A OE2 no hydrogen 3.124 N/A ARG 348.A NH2 ASP 357.A OD1 no hydrogen 2.821 N/A ARG 348.A NH2 ASP 357.A OD2 no hydrogen 3.551 N/A ARG 348.A NH2 GLU 369.A OE2 no hydrogen 2.904 N/A SER 349.A OG THR 352.A OG1 no hydrogen 2.536 N/A MET 350.A N THR 370.A O no hydrogen 2.676 N/A THR 352.A N SER 349.A O no hydrogen 2.939 N/A THR 352.A OG1 SER 349.A O no hydrogen 3.341 N/A THR 352.A OG1 SER 349.A OG no hydrogen 2.536 N/A SER 353.A N SER 325.A OG no hydrogen 2.987 N/A GLY 354.A N GLU 530.A OE1 no hydrogen 2.532 N/A ALA 355.A N SER 353.A OG no hydrogen 2.962 N/A LYS 358.A N ALA 355.A O no hydrogen 3.119 N/A LYS 358.A NZ ASP 507.A O no hydrogen 3.037 N/A ALA 360.A N LEU 356.A O no hydrogen 2.972 N/A ALA 361.A N ASP 357.A O no hydrogen 2.815 N/A LYS 362.A N LYS 358.A O no hydrogen 3.338 N/A LYS 362.A NZ GLN 440.A O no hydrogen 3.075 N/A ASN 363.A N VAL 359.A O no hydrogen 3.066 N/A ILE 365.A N ALA 360.A O no hydrogen 2.971 N/A PHE 368.A N ALA 346.A O no hydrogen 3.042 N/A THR 370.A N ARG 348.A O no hydrogen 3.038 N/A THR 370.A OG1 PRO 371.A O no hydrogen 2.924 N/A PHE 377.A N TRP 374.A O no hydrogen 3.171 N/A GLY 378.A N TRP 374.A O no hydrogen 3.470 N/A ASN 379.A N LYS 375.A O no hydrogen 3.318 N/A MET 381.A N PHE 377.A O no hydrogen 2.967 N/A ASP 382.A N GLY 378.A O no hydrogen 2.984 N/A ALA 383.A N ASN 379.A O no hydrogen 3.193 N/A GLY 384.A N MET 381.A O no hydrogen 3.059 N/A LEU 385.A N LEU 380.A O no hydrogen 2.829 N/A ASN 387.A N GLY 345.A O no hydrogen 3.167 N/A ASN 387.A ND2 GLY 342.A O no hydrogen 3.509 N/A CYS 389.A N GLY 397.A O no hydrogen 3.121 N/A CYS 389.A SG GLY 397.A O no hydrogen 3.858 N/A GLY 390.A N ALA 347.A O no hydrogen 3.144 N/A GLU 391.A N GLY 395.A O no hydrogen 2.727 N/A GLY 397.A N CYS 389.A O no hydrogen 2.949 N/A SER 398.A OG ASN 387.A O no hydrogen 2.587 N/A SER 398.A OG ASN 399.A OD1 no hydrogen 3.546 N/A ASP 405.A N THR 396.A O no hydrogen 3.200 N/A GLY 406.A N ALA 310.A O no hydrogen 3.022 N/A TRP 408.A N ASP 405.A OD1 no hydrogen 3.333 N/A ALA 409.A N ASP 405.A O no hydrogen 3.059 N/A VAL 410.A N GLY 406.A O no hydrogen 3.059 N/A LEU 411.A N ILE 407.A O no hydrogen 2.831 N/A ALA 412.A N TRP 408.A O no hydrogen 2.889 N/A TRP 413.A N ALA 409.A O no hydrogen 3.279 N/A TRP 413.A NE1 SER 327.A OG no hydrogen 3.081 N/A LEU 414.A N VAL 410.A O no hydrogen 3.075 N/A THR 415.A N LEU 411.A O no hydrogen 2.916 N/A THR 415.A OG1 LEU 411.A O no hydrogen 2.924 N/A ILE 416.A N ALA 412.A O no hydrogen 3.158 N/A LEU 417.A N TRP 413.A O no hydrogen 2.985 N/A ALA 418.A N LEU 414.A O no hydrogen 2.697 N/A HIS 419.A N THR 415.A O no hydrogen 3.062 N/A LYS 420.A N ILE 416.A O no hydrogen 3.000 N/A ASN 421.A N LEU 417.A O no hydrogen 3.080 N/A LYS 422.A N HIS 419.A O no hydrogen 3.278 N/A THR 424.A OG1 LYS 420.A O no hydrogen 3.066 N/A GLU 432.A N THR 429.A OG1 no hydrogen 3.000 N/A ILE 433.A N THR 429.A O no hydrogen 3.300 N/A VAL 434.A N VAL 430.A O no hydrogen 3.085 N/A THR 435.A N GLU 431.A O no hydrogen 2.928 N/A THR 435.A OG1 GLU 431.A O no hydrogen 3.006 N/A GLN 436.A N GLU 432.A O no hydrogen 2.886 N/A TYR 437.A N ILE 433.A O no hydrogen 3.071 N/A TRP 438.A N VAL 434.A O no hydrogen 2.900 N/A GLN 439.A N THR 435.A O no hydrogen 2.799 N/A GLN 440.A N GLN 436.A O no hydrogen 3.129 N/A GLN 440.A N TYR 437.A O no hydrogen 3.119 N/A PHE 441.A N TYR 437.A O no hydrogen 2.896 N/A GLY 442.A N TRP 438.A O no hydrogen 2.887 N/A ARG 443.A N GLU 533.A O no hydrogen 2.991 N/A ARG 443.A NH1 ILE 537.A O no hydrogen 3.248 N/A ASN 444.A ND2 GLU 530.A OE1 no hydrogen 2.961 N/A TYR 445.A N GLN 531.A O no hydrogen 2.997 N/A TYR 445.A OH GLN 536.A O no hydrogen 2.707 N/A TYR 446.A OH PRO 351.A O no hydrogen 2.559 N/A SER 447.A N PHE 529.A O no hydrogen 3.003 N/A SER 447.A OG THR 571.A O no hydrogen 2.867 N/A ARG 448.A N THR 571.A O no hydrogen 2.898 N/A ARG 448.A NE ASP 450.A OD1 no hydrogen 3.012 N/A ARG 448.A NE ASP 450.A OD2 no hydrogen 2.966 N/A ARG 448.A NH2 ASP 450.A OD1 no hydrogen 2.811 N/A ARG 448.A NH2 ASP 450.A OD2 no hydrogen 3.225 N/A TYR 449.A N ILE 527.A O no hydrogen 2.665 N/A ASP 450.A N VAL 569.A O no hydrogen 2.756 N/A TYR 451.A N ILE 525.A O no hydrogen 2.744 N/A GLU 452.A N THR 568.A OG1 no hydrogen 2.829 N/A VAL 454.A N ALA 523.A O no hydrogen 2.896 N/A SER 456.A N VAL 521.A O no hydrogen 3.179 N/A ALA 457.A N ASP 455.A OD2 no hydrogen 3.270 N/A ALA 459.A N ASP 455.A O no hydrogen 3.116 N/A ASN 460.A N SER 456.A O no hydrogen 3.133 N/A LYS 461.A N GLY 458.A O no hydrogen 2.939 N/A LYS 461.A NZ ALA 457.A O no hydrogen 3.437 N/A MET 462.A N GLY 458.A O no hydrogen 3.124 N/A MET 463.A N ALA 459.A O no hydrogen 3.302 N/A GLU 464.A N ASN 460.A O no hydrogen 3.287 N/A HIS 465.A N LYS 461.A O no hydrogen 2.663 N/A LEU 466.A N MET 462.A O no hydrogen 2.666 N/A LYS 467.A N MET 463.A O no hydrogen 3.358 N/A THR 468.A N HIS 465.A O no hydrogen 2.885 N/A THR 468.A OG1 HIS 465.A O no hydrogen 2.614 N/A LYS 469.A N LEU 466.A O no hydrogen 2.808 N/A PHE 473.A N LYS 469.A O no hydrogen 3.122 N/A GLU 474.A N PHE 470.A O no hydrogen 3.002 N/A GLN 475.A N GLN 471.A O no hydrogen 2.887 N/A LEU 476.A N TYR 472.A O no hydrogen 3.298 N/A ASN 480.A ND2 PHE 473.A O no hydrogen 2.819 N/A LYS 481.A N VAL 504.A O no hydrogen 2.946 N/A LYS 481.A NZ ASP 483.A OD1 no hydrogen 3.508 N/A ALA 482.A N GLU 474.A OE1 no hydrogen 3.216 N/A ASP 483.A N ARG 502.A O no hydrogen 3.057 N/A TYR 485.A N GLY 500.A O no hydrogen 2.980 N/A TYR 485.A OH GLU 369.A O no hydrogen 2.695 N/A TYR 487.A N SER 496.A O no hydrogen 2.691 N/A ASP 489.A N SER 494.A O no hydrogen 2.910 N/A VAL 491.A N ASP 489.A OD1 no hydrogen 2.758 N/A ASP 492.A N ASP 489.A OD1 no hydrogen 3.140 N/A SER 494.A N ASP 492.A OD2 no hydrogen 2.607 N/A SER 496.A N TYR 487.A O no hydrogen 2.830 N/A ASN 498.A N ASP 486.A OD1 no hydrogen 2.573 N/A GLN 499.A N TYR 485.A O no hydrogen 2.965 N/A VAL 501.A N PHE 513.A O no hydrogen 2.962 N/A ARG 502.A N ASP 483.A O no hydrogen 2.880 N/A ARG 502.A NE ASP 483.A OD1 no hydrogen 3.175 N/A ARG 502.A NH2 ASP 483.A OD1 no hydrogen 3.371 N/A ARG 502.A NH2 ASP 483.A OD2 no hydrogen 2.986 N/A PHE 503.A N ILE 511.A O no hydrogen 3.090 N/A VAL 504.A N LYS 481.A O no hydrogen 3.013 N/A PHE 505.A N SER 509.A O no hydrogen 2.803 N/A GLY 508.A N PHE 505.A O no hydrogen 3.102 N/A SER 509.A N ASP 507.A OD1 no hydrogen 3.182 N/A SER 509.A OG ASP 507.A OD1 no hydrogen 3.360 N/A ARG 510.A N GLU 530.A O no hydrogen 2.735 N/A ARG 510.A NH1 THR 352.A O no hydrogen 3.522 N/A ARG 510.A NH1 GLU 530.A OE2 no hydrogen 2.409 N/A ARG 510.A NH2 MET 350.A O no hydrogen 2.557 N/A ILE 511.A N PHE 503.A O no hydrogen 2.847 N/A ILE 512.A N TYR 528.A O no hydrogen 2.848 N/A PHE 513.A N VAL 501.A O no hydrogen 2.973 N/A ARG 514.A N ARG 526.A O no hydrogen 3.038 N/A ARG 514.A NH1 THR 372.A OG1 no hydrogen 2.747 N/A SER 516.A N THR 524.A O no hydrogen 2.865 N/A THR 518.A N SER 516.A O no hydrogen 3.157 N/A ALA 523.A N VAL 454.A O no hydrogen 3.010 N/A ILE 525.A N TYR 451.A O no hydrogen 2.777 N/A ARG 526.A N ARG 514.A O no hydrogen 2.858 N/A ARG 526.A NE ASP 450.A OD2 no hydrogen 2.785 N/A ARG 526.A NH1 SER 516.A OG no hydrogen 3.351 N/A ARG 526.A NH2 ASP 450.A OD2 no hydrogen 2.827 N/A ILE 527.A N TYR 449.A O no hydrogen 2.848 N/A TYR 528.A N ILE 512.A O no hydrogen 2.800 N/A PHE 529.A N SER 447.A O no hydrogen 2.773 N/A GLU 530.A N ARG 510.A O no hydrogen 2.850 N/A GLN 531.A N TYR 445.A O no hydrogen 2.950 N/A GLN 531.A NE2 PHE 532.A O no hydrogen 3.042 N/A GLN 531.A NE2 GLU 533.A OE1 no hydrogen 3.556 N/A PHE 532.A N SER 509.A OG no hydrogen 2.662 N/A GLU 533.A N ARG 443.A O no hydrogen 3.161 N/A GLN 534.A NE2 GLN 534.A O no hydrogen 3.158 N/A GLN 536.A N GLN 535.A OE1 no hydrogen 2.750 N/A ALA 544.A N GLU 540.A O no hydrogen 3.113 N/A LEU 545.A N THR 541.A O no hydrogen 2.919 N/A ALA 546.A N THR 543.A O no hydrogen 3.075 N/A ILE 549.A N LEU 545.A O no hydrogen 3.014 N/A LYS 550.A N ALA 546.A O no hydrogen 3.142 N/A LYS 550.A NZ GLU 554.A OE1 no hydrogen 2.838 N/A LEU 551.A N ASN 547.A O no hydrogen 3.118 N/A GLY 552.A N ILE 548.A O no hydrogen 2.886 N/A LEU 553.A N ILE 549.A O no hydrogen 3.010 N/A GLU 554.A N LYS 550.A O no hydrogen 3.307 N/A ILE 555.A N LEU 551.A O no hydrogen 2.792 N/A SER 556.A N GLY 552.A O no hydrogen 3.022 N/A SER 556.A OG GLY 552.A O no hydrogen 3.260 N/A ASP 557.A N LEU 553.A O no hydrogen 2.984 N/A ILE 558.A N SER 556.A OG no hydrogen 3.010 N/A GLN 560.A N ASP 557.A O no hydrogen 3.076 N/A PHE 561.A N ASP 557.A O no hydrogen 3.470 N/A THR 562.A N ILE 558.A O no hydrogen 3.189 N/A THR 562.A OG1 ILE 558.A O no hydrogen 3.394 N/A ARG 564.A NH1 GLU 452.A O no hydrogen 2.820 N/A ARG 564.A NH2 GLU 452.A O no hydrogen 2.796 N/A THR 568.A N ASP 450.A O no hydrogen 2.578 N/A VAL 569.A N ASP 450.A O no hydrogen 3.224 N/A THR 571.A N ARG 448.A O no hydrogen 3.057 N/A