Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 8r6s_F.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLU 5.A N SER 2.A OG no hydrogen 3.255 N/A ARG 6.A N SER 2.A O no hydrogen 3.257 N/A SER 7.A N ALA 3.A O no hydrogen 3.016 N/A SER 7.A OG ALA 3.A O no hydrogen 3.331 N/A SER 7.A OG LEU 4.A O no hydrogen 2.573 N/A LEU 8.A N LEU 4.A O no hydrogen 3.080 N/A ARG 9.A N GLU 5.A O no hydrogen 2.950 N/A ARG 9.A NE GLU 5.A OE2 no hydrogen 3.459 N/A ARG 9.A NH1 SER 41.A O no hydrogen 3.300 N/A ARG 9.A NH2 SER 41.A O no hydrogen 3.358 N/A LEU 10.A N ARG 6.A O no hydrogen 3.108 N/A THR 11.A N SER 7.A O no hydrogen 3.355 N/A PHE 12.A N LEU 8.A O no hydrogen 2.821 N/A MET 13.A N ARG 9.A O no hydrogen 2.780 N/A ASP 14.A N LEU 10.A O no hydrogen 2.771 N/A GLU 15.A N THR 11.A O no hydrogen 3.243 N/A LEU 16.A N PHE 12.A O no hydrogen 2.993 N/A MET 17.A N MET 13.A O no hydrogen 3.074 N/A GLU 18.A N ASP 14.A O no hydrogen 3.148 N/A ARG 19.A N LEU 16.A O no hydrogen 3.137 N/A ARG 19.A NE GLU 15.A OE2 no hydrogen 2.533 N/A ARG 19.A NH1 GLY 27.A O no hydrogen 3.102 N/A ALA 20.A N LEU 16.A O no hydrogen 3.064 N/A ARG 21.A N MET 17.A O no hydrogen 3.330 N/A ARG 23.A N ALA 20.A O no hydrogen 3.183 N/A ASP 24.A N ARG 19.A O no hydrogen 2.988 N/A GLY 27.A N ASP 24.A OD1 no hydrogen 3.235 N/A VAL 28.A N ASP 24.A O no hydrogen 3.154 N/A SER 29.A N PRO 25.A O no hydrogen 3.127 N/A SER 29.A N SER 26.A O no hydrogen 3.141 N/A SER 29.A OG PRO 25.A O no hydrogen 3.173 N/A GLU 30.A N SER 26.A O no hydrogen 3.173 N/A VAL 31.A N GLY 27.A O no hydrogen 3.209 N/A TYR 33.A N SER 29.A O no hydrogen 3.252 N/A ASP 34.A N GLU 30.A O no hydrogen 2.887 N/A MET 35.A N VAL 31.A O no hydrogen 2.762 N/A ILE 36.A N ILE 32.A O no hydrogen 2.947 N/A ALA 37.A N TYR 33.A O no hydrogen 2.977 N/A ALA 38.A N ASP 34.A O no hydrogen 2.994 N/A GLY 39.A N ILE 36.A O no hydrogen 3.095 N/A SER 46.A N GLY 43.A O no hydrogen 3.154 N/A PHE 47.A N GLY 43.A O no hydrogen 3.389 N/A HIS 48.A N PRO 44.A O no hydrogen 3.064 N/A HIS 48.A ND1 THR 81.A OG1 no hydrogen 2.627 N/A VAL 51.A N PHE 47.A O no hydrogen 2.927 N/A VAL 52.A N HIS 48.A O no hydrogen 2.918 N/A ALA 53.A N GLY 49.A O no hydrogen 3.176 N/A HIS 54.A N LEU 50.A O no hydrogen 3.320 N/A HIS 54.A ND1 ASP 59.A OD2 no hydrogen 3.281 N/A ALA 55.A N VAL 51.A O no hydrogen 2.810 N/A LEU 56.A N VAL 52.A O no hydrogen 2.764 N/A ASN 57.A N ALA 53.A O no hydrogen 3.443 N/A ASN 57.A ND2 ALA 53.A O no hydrogen 2.454 N/A ASP 59.A N HIS 54.A O no hydrogen 3.128 N/A GLN 61.A N GLN 61.A OE1 no hydrogen 2.220 N/A GLY 62.A N ASP 59.A OD1 no hydrogen 3.353 N/A ALA 63.A N ASP 59.A O no hydrogen 3.291 N/A MET 64.A N GLU 60.A O no hydrogen 3.024 N/A HIS 65.A N GLN 61.A O no hydrogen 2.876 N/A SER 66.A N GLY 62.A O no hydrogen 2.766 N/A SER 66.A OG GLY 62.A O no hydrogen 2.820 N/A LEU 67.A N ALA 63.A O no hydrogen 3.038 N/A ARG 68.A N MET 64.A O no hydrogen 3.088 N/A LYS 69.A N HIS 65.A O no hydrogen 3.014 N/A LYS 69.A NZ TYR 33.A OH no hydrogen 3.352 N/A GLU 70.A N SER 66.A O no hydrogen 3.045 N/A LEU 71.A N LEU 67.A O no hydrogen 2.956 N/A GLY 72.A N ARG 68.A O no hydrogen 2.761 N/A ALA 73.A N LYS 69.A O no hydrogen 2.886 N/A ALA 73.A N GLU 70.A O no hydrogen 3.237 N/A GLY 74.A N LEU 71.A O no hydrogen 3.082 N/A GLN 75.A N GLU 70.A O no hydrogen 3.145 N/A GLN 75.A NE2 ALA 73.A O no hydrogen 3.441 N/A ARG 76.A NH2 LEU 108.A O no hydrogen 2.208 N/A THR 81.A OG1 HIS 48.A ND1 no hydrogen 2.627 N/A MET 82.A N LEU 78.A O no hydrogen 3.225 N/A ILE 83.A N PRO 79.A O no hydrogen 3.180 N/A ALA 84.A N GLU 80.A O no hydrogen 3.023 N/A LEU 85.A N THR 81.A O no hydrogen 3.283 N/A VAL 86.A N MET 82.A O no hydrogen 2.816 N/A ARG 87.A N ILE 83.A O no hydrogen 2.878 N/A LEU 88.A N ALA 84.A O no hydrogen 3.101 N/A SER 89.A N LEU 85.A O no hydrogen 2.946 N/A SER 89.A OG GLU 60.A OE2 no hydrogen 3.225 N/A SER 89.A OG LEU 85.A O no hydrogen 3.012 N/A GLY 90.A N VAL 86.A O no hydrogen 3.131 N/A SER 91.A N ARG 87.A O no hydrogen 3.166 N/A SER 91.A OG LEU 88.A O no hydrogen 2.758 N/A LYS 92.A N LEU 88.A O no hydrogen 3.341 N/A GLY 93.A N GLY 90.A O no hydrogen 2.995 N/A ASN 94.A N SER 89.A O no hydrogen 2.782 N/A ALA 95.A N GLY 93.A O no hydrogen 3.076 N/A ARG 97.A N ASN 94.A OD1 no hydrogen 3.096 N/A GLY 98.A N ASN 94.A O no hydrogen 3.008 N/A LEU 99.A N ALA 95.A O no hydrogen 2.850 N/A GLU 100.A N GLN 96.A O no hydrogen 2.901 N/A LEU 101.A N ARG 97.A O no hydrogen 2.960 N/A LEU 102.A N GLY 98.A O no hydrogen 3.158 N/A ALA 103.A N LEU 99.A O no hydrogen 3.079 N/A ALA 104.A N GLU 100.A O no hydrogen 3.124 N/A MET 105.A N LEU 101.A O no hydrogen 3.016 N/A GLU 106.A N LEU 102.A O no hydrogen 3.157 N/A LYS 107.A N ALA 103.A O no hydrogen 2.980 N/A LEU 108.A N ALA 104.A O no hydrogen 2.663 N/A ASN 109.A N GLU 106.A O no hydrogen 2.919 N/A TYR 110.A N MET 105.A O no hydrogen 2.719 N/A TYR 110.A OH PRO 77.A O no hydrogen 2.439 N/A ARG 113.A NE ARG 145.A O no hydrogen 2.861 N/A ARG 113.A NH2 ARG 145.A O no hydrogen 3.074 N/A TRP 116.A N ILE 112.A O no hydrogen 2.775 N/A TRP 116.A NE1 VAL 135.A O no hydrogen 3.142 N/A LEU 117.A N ARG 113.A O no hydrogen 3.035 N/A ILE 118.A N GLN 114.A O no hydrogen 3.141 N/A LEU 119.A N ALA 115.A O no hydrogen 3.038 N/A VAL 120.A N TRP 116.A O no hydrogen 3.220 N/A GLU 121.A N LEU 117.A O no hydrogen 3.232 N/A GLU 122.A N ILE 118.A O no hydrogen 3.120 N/A LEU 123.A N LEU 119.A O no hydrogen 3.253 N/A VAL 124.A N VAL 120.A O no hydrogen 3.081 N/A ARG 125.A N GLU 121.A O no hydrogen 2.902 N/A ARG 125.A NH2 GLU 122.A OE1 no hydrogen 2.473 N/A THR 126.A N GLU 122.A O no hydrogen 2.953 N/A THR 126.A OG1 GLY 90.A O no hydrogen 3.393 N/A THR 126.A OG1 GLU 122.A O no hydrogen 3.079 N/A THR 126.A OG1 LEU 123.A O no hydrogen 3.495 N/A THR 126.A OG1 HIS 128.A ND1 no hydrogen 2.732 N/A ASN 127.A N VAL 124.A O no hydrogen 3.203 N/A HIS 128.A N LEU 123.A O no hydrogen 2.726 N/A HIS 128.A ND1 THR 126.A OG1 no hydrogen 2.732 N/A GLU 131.A N GLU 131.A OE1 no hydrogen 2.593 N/A ALA 132.A N HIS 128.A O no hydrogen 2.824 N/A ASN 133.A N LEU 129.A O no hydrogen 2.978 N/A ASN 133.A ND2 LEU 129.A O no hydrogen 2.990 N/A ASN 133.A ND2 ASP 158.A OD1 no hydrogen 2.861 N/A LYS 134.A N GLU 130.A O no hydrogen 3.406 N/A VAL 135.A N GLU 131.A O no hydrogen 3.088 N/A PHE 136.A N ALA 132.A O no hydrogen 2.790 N/A LEU 137.A N ASN 133.A O no hydrogen 2.965 N/A LYS 138.A N LYS 134.A O no hydrogen 3.284 N/A GLY 139.A N VAL 135.A O no hydrogen 3.170 N/A ALA 140.A N PHE 136.A O no hydrogen 2.822 N/A ARG 141.A N LEU 137.A O no hydrogen 2.716 N/A GLY 142.A N LYS 138.A O no hydrogen 2.932 N/A GLY 143.A N ALA 140.A O no hydrogen 3.283 N/A MET 144.A N GLY 139.A O no hydrogen 3.044 N/A ARG 145.A NE ALA 146.A O no hydrogen 2.920 N/A ARG 145.A NH2 ASP 148.A OD1 no hydrogen 2.803 N/A ALA 146.A N TYR 151.A OH no hydrogen 3.413 N/A GLN 149.A N GLN 149.A OE1 no hydrogen 2.313 N/A LEU 150.A N THR 147.A OG1 no hydrogen 3.199 N/A TYR 151.A N THR 147.A O no hydrogen 2.856 N/A ASP 152.A N ASP 148.A O no hydrogen 3.039 N/A LEU 153.A N GLN 149.A O no hydrogen 2.980 N/A MET 154.A N LEU 150.A O no hydrogen 2.912 N/A ILE 155.A N TYR 151.A O no hydrogen 3.149 N/A GLU 156.A N ASP 152.A O no hydrogen 3.292 N/A GLU 157.A N LEU 153.A O no hydrogen 2.991 N/A ASP 158.A N MET 154.A O no hydrogen 3.100 N/A CYS 159.A N ILE 155.A O no hydrogen 3.095 N/A CYS 159.A SG ILE 155.A O no hydrogen 3.202 N/A LYS 160.A N GLU 156.A O no hydrogen 2.973 N/A ALA 161.A N GLU 157.A O no hydrogen 3.268 N/A ALA 161.A N ASP 158.A O no hydrogen 3.204 N/A GLY 162.A N CYS 159.A O no hydrogen 3.328 N/A ASP 163.A N ASP 158.A O no hydrogen 2.806 N/A ASN 166.A N ASP 163.A OD1 no hydrogen 3.338 N/A ASN 166.A ND2 ASP 163.A OD2 no hydrogen 2.354 N/A ALA 167.A N ASP 163.A O no hydrogen 3.264 N/A LEU 168.A N HIS 164.A O no hydrogen 2.830 N/A ASP 169.A N SER 165.A O no hydrogen 3.187 N/A ILE 170.A N ASN 166.A O no hydrogen 2.988 N/A SER 171.A N ALA 167.A O no hydrogen 3.213 N/A SER 171.A OG ALA 167.A O no hydrogen 2.879 N/A SER 171.A OG LEU 168.A O no hydrogen 3.004 N/A TYR 172.A N LEU 168.A O no hydrogen 3.093 N/A GLU 173.A N ASP 169.A O no hydrogen 3.131 N/A MET 174.A N ILE 170.A O no hydrogen 2.669 N/A GLU 175.A N SER 171.A O no hydrogen 3.253 N/A ALA 176.A N TYR 172.A O no hydrogen 3.114 N/A ALA 177.A N GLU 173.A O no hydrogen 2.970 N/A GLY 178.A N MET 174.A O no hydrogen 3.331 N/A ARG 179.A N MET 174.A O no hydrogen 3.017 N/A ARG 179.A NH1 ASP 148.A O no hydrogen 3.438 N/A ARG 179.A NH1 ASP 152.A OD1 no hydrogen 2.995 N/A ARG 179.A NH2 ASP 152.A OD1 no hydrogen 3.056 N/A ARG 179.A NH2 ASP 152.A OD2 no hydrogen 3.507 N/A ALA 181.A N GLU 175.A OE2 no hydrogen 3.096 N/A THR 182.A N HIS 185.A ND1 no hydrogen 3.137 N/A THR 182.A OG1 HIS 185.A ND1 no hydrogen 3.182 N/A THR 183.A N PHE 215.A O no hydrogen 3.111 N/A THR 183.A OG1 PHE 215.A O no hydrogen 3.061 N/A THR 183.A OG1 LYS 217.A O no hydrogen 2.806 N/A HIS 185.A NE2 ASP 152.A OD1 no hydrogen 2.664 N/A PHE 186.A N THR 182.A O no hydrogen 3.204 N/A ASN 187.A N THR 183.A O no hydrogen 2.920 N/A ASN 187.A ND2 ASP 219.A OD1 no hydrogen 2.962 N/A ASN 187.A ND2 ASP 219.A OD2 no hydrogen 2.768 N/A CYS 188.A N PHE 184.A O no hydrogen 3.232 N/A CYS 188.A N HIS 185.A O no hydrogen 3.145 N/A CYS 188.A SG PHE 184.A O no hydrogen 3.425 N/A LEU 189.A N HIS 185.A O no hydrogen 3.263 N/A LEU 190.A N PHE 186.A O no hydrogen 2.875 N/A SER 191.A N ASN 187.A O no hydrogen 3.219 N/A SER 191.A OG CYS 188.A O no hydrogen 2.353 N/A VAL 192.A N LEU 189.A O no hydrogen 3.161 N/A GLN 193.A N LEU 189.A O no hydrogen 3.013 N/A GLN 193.A NE2 HIS 164.A NE2 no hydrogen 2.953 N/A ALA 194.A N LEU 190.A O no hydrogen 3.016 N/A THR 195.A N VAL 192.A O no hydrogen 3.257 N/A THR 195.A OG1 VAL 192.A O no hydrogen 2.933 N/A CYS 196.A N GLN 193.A O no hydrogen 3.427 N/A CYS 196.A SG GLN 193.A O no hydrogen 3.255 N/A CYS 196.A SG ILE 198.A O no hydrogen 3.603 N/A GLU 200.A N GLU 200.A OE1 no hydrogen 2.864 N/A VAL 201.A N ILE 198.A O no hydrogen 3.211 N/A TYR 203.A N PRO 199.A O no hydrogen 3.001 N/A ALA 204.A N GLU 200.A O no hydrogen 3.090 N/A THR 205.A OG1 GLN 193.A OE1 no hydrogen 2.751 N/A PHE 206.A N ALA 202.A O no hydrogen 3.037 N/A GLU 207.A N TYR 203.A O no hydrogen 2.975 N/A ASN 208.A N ALA 204.A O no hydrogen 3.122 N/A MET 209.A N THR 205.A O no hydrogen 3.230 N/A MET 209.A N PHE 206.A O no hydrogen 3.042 N/A GLU 210.A N PHE 206.A O no hydrogen 2.794 N/A TYR 211.A N GLU 207.A O no hydrogen 3.267 N/A GLY 212.A N MET 209.A O no hydrogen 3.264 N/A MET 216.A N GLU 213.A O no hydrogen 3.163 N/A LYS 217.A N ASP 214.A O no hydrogen 3.248 N/A LYS 217.A NZ GLU 210.A O no hydrogen 2.546 N/A ASP 219.A N THR 222.A OG1 no hydrogen 3.316 N/A THR 220.A OG1 GLN 257.A O no hydrogen 2.474 N/A THR 222.A N ASP 219.A OD1 no hydrogen 2.684 N/A THR 222.A OG1 ASN 187.A OD1 no hydrogen 2.476 N/A THR 222.A OG1 ASP 219.A OD1 no hydrogen 2.549 N/A TYR 223.A N ASP 219.A O no hydrogen 3.191 N/A ASN 224.A N THR 220.A O no hydrogen 3.069 N/A ASN 224.A ND2 ASN 259.A OD1 no hydrogen 2.956 N/A TRP 225.A N GLU 221.A O no hydrogen 3.094 N/A TRP 225.A NE1 GLU 221.A OE2 no hydrogen 3.050 N/A VAL 226.A N THR 222.A O no hydrogen 3.296 N/A ILE 227.A N TYR 223.A O no hydrogen 2.908 N/A GLN 228.A N ASN 224.A O no hydrogen 2.901 N/A ALA 229.A N TRP 225.A O no hydrogen 2.985 N/A TYR 230.A N VAL 226.A O no hydrogen 3.318 N/A THR 231.A N ILE 227.A O no hydrogen 2.991 N/A THR 231.A OG1 ILE 227.A O no hydrogen 3.487 N/A THR 231.A OG1 GLN 228.A O no hydrogen 2.896 N/A ARG 232.A N GLN 228.A O no hydrogen 3.235 N/A ARG 232.A NE GLU 268.A OE2 no hydrogen 3.364 N/A ARG 232.A NH2 GLU 268.A OE1 no hydrogen 3.240 N/A ARG 232.A NH2 ASN 298.A OD1 no hydrogen 3.389 N/A ALA 233.A N TYR 230.A O no hydrogen 3.284 N/A ARG 238.A N TYR 273.A OH no hydrogen 2.858 N/A ARG 238.A NE SER 235.A O no hydrogen 3.015 N/A ARG 238.A NH1 GLU 200.A OE2 no hydrogen 2.790 N/A ARG 238.A NH2 SER 235.A O no hydrogen 3.219 N/A VAL 239.A N ASP 237.A OD1 no hydrogen 3.234 N/A VAL 242.A N ARG 238.A O no hydrogen 3.140 N/A ALA 243.A N VAL 239.A O no hydrogen 3.104 N/A GLU 244.A N GLN 240.A O no hydrogen 3.067 N/A LEU 245.A N ASP 241.A O no hydrogen 3.030 N/A LEU 246.A N VAL 242.A O no hydrogen 2.883 N/A GLY 247.A N ALA 243.A O no hydrogen 3.179 N/A MET 248.A N GLU 244.A O no hydrogen 2.953 N/A MET 249.A N LEU 245.A O no hydrogen 2.873 N/A VAL 250.A N LEU 246.A O no hydrogen 2.917 N/A GLU 251.A N GLY 247.A O no hydrogen 3.023 N/A ASP 252.A N MET 249.A O no hydrogen 3.074 N/A LYS 254.A NZ TYR 253.A OH no hydrogen 2.438 N/A ARG 255.A N ASP 252.A O no hydrogen 3.198 N/A ARG 255.A NH1 PRO 218.A O no hydrogen 2.740 N/A ARG 255.A NH2 PRO 218.A O no hydrogen 3.023 N/A ARG 255.A NH2 ASP 252.A OD2 no hydrogen 3.231 N/A VAL 256.A N ASP 252.A O no hydrogen 2.784 N/A GLN 257.A NE2 TYR 253.A O no hydrogen 3.193 N/A GLN 257.A NE2 VAL 256.A O no hydrogen 3.339 N/A GLN 257.A NE2 VAL 503.A O no hydrogen 3.369 N/A LYS 261.A NZ GLN 228.A OE1 no hydrogen 3.009 N/A THR 262.A N ASN 259.A O no hydrogen 3.241 N/A THR 262.A N ASN 259.A OD1 no hydrogen 3.206 N/A THR 262.A OG1 ASN 224.A OD1 no hydrogen 2.397 N/A THR 262.A OG1 ASN 259.A OD1 no hydrogen 3.288 N/A ALA 264.A N VAL 260.A O no hydrogen 3.131 N/A LEU 265.A N LYS 261.A O no hydrogen 2.976 N/A LEU 266.A N THR 262.A O no hydrogen 3.091 N/A VAL 267.A N HIS 263.A O no hydrogen 2.793 N/A GLU 268.A N ALA 264.A O no hydrogen 3.021 N/A CYS 269.A N LEU 265.A O no hydrogen 2.908 N/A PHE 270.A N LEU 266.A O no hydrogen 3.092 N/A THR 271.A N VAL 267.A O no hydrogen 3.012 N/A THR 271.A OG1 VAL 267.A O no hydrogen 2.807 N/A LYS 272.A N GLU 268.A O no hydrogen 3.121 N/A TYR 273.A N CYS 269.A O no hydrogen 3.198 N/A CYS 274.A N THR 271.A O no hydrogen 2.950 N/A CYS 274.A SG THR 271.A O no hydrogen 4.009 N/A CYS 274.A SG SER 406.A O no hydrogen 3.699 N/A VAL 275.A N PHE 270.A O no hydrogen 2.679 N/A ALA 279.A N VAL 275.A O no hydrogen 3.189 N/A ILE 280.A N VAL 276.A O no hydrogen 2.910 N/A ARG 281.A N LYS 277.A O no hydrogen 3.390 N/A ARG 281.A NE GLU 509.A OE2 no hydrogen 2.497 N/A ARG 281.A NH1 GLU 278.A OE1 no hydrogen 3.349 N/A ARG 281.A NH2 GLU 509.A OE1 no hydrogen 2.668 N/A ARG 281.A NH2 GLU 509.A OE2 no hydrogen 3.285 N/A HIS 282.A N GLU 278.A O no hydrogen 3.230 N/A HIS 282.A ND1 GLU 278.A O no hydrogen 3.112 N/A PHE 283.A N ALA 279.A O no hydrogen 2.907 N/A ARG 284.A N ILE 280.A O no hydrogen 3.125 N/A ALA 285.A N ARG 281.A O no hydrogen 3.482 N/A LEU 286.A N HIS 282.A O no hydrogen 3.051 N/A LYS 287.A N PHE 283.A O no hydrogen 3.034 N/A LYS 287.A N ARG 284.A O no hydrogen 3.370 N/A LYS 287.A NZ ASP 324.A OD2 no hydrogen 3.311 N/A PHE 289.A N LEU 286.A O no hydrogen 3.247 N/A GLU 290.A N GLU 290.A OE2 no hydrogen 2.440 N/A THR 293.A N ASP 332.A OD2 no hydrogen 3.227 N/A LYS 294.A N GLY 291.A O no hydrogen 3.014 N/A VAL 295.A N GLY 292.A O no hydrogen 3.065 N/A LEU 296.A N GLY 292.A O no hydrogen 3.424 N/A HIS 297.A N THR 293.A O no hydrogen 2.853 N/A HIS 297.A ND1 ASP 304.A OD1 no hydrogen 2.778 N/A ASN 298.A N VAL 295.A O no hydrogen 3.204 N/A ASN 298.A ND2 LEU 296.A O no hydrogen 2.883 N/A GLY 300.A N HIS 297.A O no hydrogen 2.894 N/A ASN 301.A N ASN 298.A O no hydrogen 2.996 N/A ASP 304.A N ASN 301.A O no hydrogen 3.098 N/A SER 307.A OG ASP 304.A OD2 no hydrogen 2.488 N/A LEU 308.A N ASP 304.A O no hydrogen 3.246 N/A TYR 309.A N PRO 305.A O no hydrogen 3.192 N/A LEU 310.A N LEU 306.A O no hydrogen 3.294 N/A ARG 311.A N SER 307.A O no hydrogen 2.769 N/A ARG 311.A NE ASP 399.A OD1 no hydrogen 2.908 N/A ARG 311.A NE ASP 399.A OD2 no hydrogen 3.082 N/A ARG 311.A NH2 ASP 399.A OD2 no hydrogen 2.397 N/A ALA 312.A N LEU 308.A O no hydrogen 2.856 N/A LEU 313.A N TYR 309.A O no hydrogen 3.161 N/A CYS 314.A N LEU 310.A O no hydrogen 3.052 N/A ARG 315.A N ARG 311.A O no hydrogen 2.860 N/A ARG 315.A NE PRO 408.A O no hydrogen 3.012 N/A ARG 315.A NH2 PRO 408.A O no hydrogen 3.195 N/A GLY 317.A N CYS 314.A O no hydrogen 3.353 N/A ARG 318.A N LEU 313.A O no hydrogen 3.107 N/A ARG 318.A NE GLU 316.A OE1 no hydrogen 3.152 N/A GLU 321.A N GLU 321.A OE1 no hydrogen 2.650 N/A LEU 322.A N ARG 318.A O no hydrogen 2.960 N/A ILE 323.A N ILE 319.A O no hydrogen 2.883 N/A ASP 324.A N VAL 320.A O no hydrogen 3.286 N/A ALA 325.A N GLU 321.A O no hydrogen 2.940 N/A LEU 326.A N LEU 322.A O no hydrogen 3.115 N/A ASP 327.A N ILE 323.A O no hydrogen 3.019 N/A ALA 328.A N ASP 324.A O no hydrogen 3.311 N/A MET 329.A N ALA 325.A O no hydrogen 3.187 N/A ARG 330.A N LEU 326.A O no hydrogen 3.018 N/A ARG 331.A N ASP 327.A O no hydrogen 3.145 N/A ASP 332.A N ALA 328.A O no hydrogen 3.228 N/A ASN 333.A N ARG 330.A O no hydrogen 3.022 N/A GLN 334.A N MET 329.A O no hydrogen 2.857 N/A GLN 334.A NE2 PRO 335.A O no hydrogen 3.143 N/A ILE 336.A N LEU 539.A O no hydrogen 3.080 N/A ARG 339.A NH1 ARG 339.A O no hydrogen 3.190 N/A ARG 339.A NH1 ASP 399.A OD1 no hydrogen 2.668 N/A ARG 339.A NH2 ASP 399.A O no hydrogen 2.994 N/A ARG 339.A NH2 ASP 399.A OD1 no hydrogen 3.468 N/A ARG 339.A NH2 ALA 401.A O no hydrogen 2.636 N/A ALA 340.A N PRO 337.A O no hydrogen 3.137 N/A MET 341.A N PRO 337.A O no hydrogen 3.323 N/A SER 344.A N ARG 348.A O no hydrogen 2.997 N/A SER 344.A OG ARG 348.A O no hydrogen 3.201 N/A LYS 346.A NZ GLN 359.A O no hydrogen 2.311 N/A TYR 347.A N SER 344.A O no hydrogen 3.096 N/A TYR 347.A OH GLU 377.A OE2 no hydrogen 2.293 N/A ARG 348.A N SER 344.A OG no hydrogen 3.300 N/A ARG 348.A NH1 SER 352.A O no hydrogen 3.269 N/A ARG 348.A NH2 PRO 357.A O no hydrogen 2.568 N/A THR 349.A N ASP 547.A OD1 no hydrogen 3.188 N/A THR 349.A N ASP 547.A OD2 no hydrogen 2.950 N/A THR 349.A OG1 ASP 547.A OD2 no hydrogen 2.448 N/A SER 352.A N THR 349.A O no hydrogen 3.209 N/A SER 352.A OG SER 352.A O no hydrogen 2.317 N/A SER 352.A OG ASP 547.A OD1 no hydrogen 2.364 N/A SER 353.A OG THR 349.A O no hydrogen 2.521 N/A TRP 354.A NE1 LEU 350.A O no hydrogen 3.080 N/A GLN 359.A NE2 GLU 410.A OE1 no hydrogen 3.011 N/A ARG 373.A N ASP 369.A O no hydrogen 3.435 N/A ARG 373.A NH1 GLU 361.A OE2 no hydrogen 2.590 N/A ARG 373.A NH2 GLU 361.A OE1 no hydrogen 3.175 N/A ARG 373.A NH2 GLU 361.A OE2 no hydrogen 3.376 N/A TYR 374.A N TYR 370.A O no hydrogen 3.063 N/A VAL 375.A N LEU 371.A O no hydrogen 3.126 N/A GLU 376.A N ALA 372.A O no hydrogen 3.039 N/A GLY 378.A N VAL 375.A O no hydrogen 3.201 N/A GLY 379.A N TYR 374.A O no hydrogen 2.915 N/A THR 381.A N GLY 378.A O no hydrogen 3.462 N/A GLU 383.A N GLY 378.A O no hydrogen 3.232 N/A LYS 385.A NZ LEU 396.A O no hydrogen 2.871 N/A ASP 399.A N ASP 397.A OD1 no hydrogen 3.309 N/A ALA 400.A N ASP 397.A O no hydrogen 3.157 N/A ALA 401.A N PRO 398.A O no hydrogen 3.312 N/A ILE 404.A N LYS 272.A O no hydrogen 3.101 N/A TYR 405.A OH ASP 237.A OD2 no hydrogen 3.139 N/A SER 406.A OG TYR 405.A O no hydrogen 2.383 N/A SER 406.A OG ASN 407.A O no hydrogen 3.348 N/A ASN 407.A N ASN 407.A OD1 no hydrogen 2.471 N/A THR 411.A N ARG 315.A O no hydrogen 2.630 N/A THR 411.A OG1 ILE 409.A O no hydrogen 3.524 N/A PHE 413.A N TRP 354.A O no hydrogen 3.316 N/A GLN 415.A N SER 412.A OG no hydrogen 3.142 N/A ARG 416.A N SER 412.A O no hydrogen 3.057 N/A ARG 416.A NE GLU 316.A O no hydrogen 2.779 N/A ARG 416.A NH2 GLU 316.A O no hydrogen 3.435 N/A CYS 417.A N PHE 413.A O no hydrogen 3.205 N/A CYS 417.A SG PHE 413.A O no hydrogen 3.178 N/A LEU 418.A N LYS 414.A O no hydrogen 3.145 N/A GLU 419.A N GLN 415.A O no hydrogen 2.813 N/A ASP 420.A N ARG 416.A O no hydrogen 2.818 N/A TRP 421.A N CYS 417.A O no hydrogen 2.850 N/A LYS 422.A N LEU 418.A O no hydrogen 2.972 N/A VAL 423.A N GLU 419.A O no hydrogen 3.013 N/A HIS 424.A N ASP 420.A O no hydrogen 3.290 N/A ARG 426.A N LYS 422.A O no hydrogen 2.980 N/A LYS 427.A N VAL 423.A O no hydrogen 3.158 N/A LEU 428.A N HIS 424.A O no hydrogen 3.062 N/A LEU 429.A N HIS 425.A O no hydrogen 2.842 N/A ARG 430.A N ARG 426.A O no hydrogen 2.932 N/A THR 431.A N LYS 427.A O no hydrogen 2.942 N/A LEU 432.A N LEU 428.A O no hydrogen 3.079 N/A SER 434.A N THR 431.A O no hydrogen 3.316 N/A SER 434.A OG ARG 430.A O no hydrogen 3.351 N/A TYR 439.A OH LEU 432.A O no hydrogen 3.105 N/A MET 440.A N GLU 436.A O no hydrogen 3.200 N/A ARG 441.A N SER 437.A O no hydrogen 3.032 N/A ARG 441.A NH2 SER 437.A OG no hydrogen 3.358 N/A VAL 442.A N ASP 438.A O no hydrogen 2.925 N/A MET 443.A N TYR 439.A O no hydrogen 2.987 N/A GLU 444.A N MET 440.A O no hydrogen 3.058 N/A ARG 445.A N ARG 441.A O no hydrogen 3.156 N/A ARG 445.A NE ASP 452.A OD1 no hydrogen 2.753 N/A ARG 445.A NH2 ASP 452.A OD2 no hydrogen 3.145 N/A LEU 446.A N VAL 442.A O no hydrogen 3.222 N/A ARG 447.A N MET 443.A O no hydrogen 3.372 N/A ASN 448.A N GLU 444.A O no hydrogen 2.755 N/A ILE 449.A N ARG 445.A O no hydrogen 2.937 N/A ILE 450.A N LEU 446.A O no hydrogen 3.224 N/A ILE 455.A N VAL 451.A O no hydrogen 3.107 N/A CYS 456.A N ASP 452.A O no hydrogen 3.097 N/A CYS 456.A N GLU 453.A O no hydrogen 3.192 N/A ARG 457.A N LEU 454.A O no hydrogen 3.484 N/A ILE 458.A N ILE 455.A O no hydrogen 3.115 N/A GLU 462.A N ASN 514.A OD1 no hydrogen 2.761 N/A ASP 464.A N HIS 461.A O no hydrogen 3.147 N/A THR 465.A OG1 ASP 502.A OD2 no hydrogen 3.086 N/A PHE 467.A N ASP 464.A OD1 no hydrogen 3.494 N/A TRP 468.A N ASP 464.A O no hydrogen 3.238 N/A LYS 469.A N THR 465.A O no hydrogen 2.779 N/A LYS 469.A NZ VAL 494.A O no hydrogen 3.561 N/A LYS 469.A NZ MET 497.A O no hydrogen 3.488 N/A ARG 470.A N GLU 466.A O no hydrogen 3.139 N/A ARG 471.A N PHE 467.A O no hydrogen 3.104 N/A PHE 472.A N TRP 468.A O no hydrogen 2.823 N/A LEU 473.A N LYS 469.A O no hydrogen 3.060 N/A GLU 481.A N GLU 478.A OE1 no hydrogen 2.476 N/A ALA 482.A N GLU 478.A O no hydrogen 2.971 N/A PHE 483.A N PRO 479.A O no hydrogen 2.846 N/A LYS 484.A N PHE 480.A O no hydrogen 3.156 N/A LYS 484.A NZ GLU 488.A OE2 no hydrogen 3.297 N/A GLU 485.A N GLU 481.A O no hydrogen 2.915 N/A MET 486.A N ALA 482.A O no hydrogen 2.924 N/A ARG 487.A N PHE 483.A O no hydrogen 3.241 N/A ARG 487.A NH1 PHE 472.A O no hydrogen 2.825 N/A GLU 488.A N LYS 484.A O no hydrogen 2.987 N/A ARG 489.A N GLU 485.A O no hydrogen 2.955 N/A LYS 490.A N ARG 487.A O no hydrogen 3.264 N/A VAL 491.A N MET 486.A O no hydrogen 2.677 N/A PHE 492.A N MET 486.A O no hydrogen 3.253 N/A VAL 494.A N ASP 493.A OD1 no hydrogen 3.028 N/A ASP 496.A N ASP 493.A O no hydrogen 3.010 N/A MET 497.A N VAL 494.A O no hydrogen 3.041 N/A THR 499.A N ASP 502.A OD1 no hydrogen 3.260 N/A THR 499.A N ASP 502.A OD2 no hydrogen 2.983 N/A THR 499.A OG1 ASP 502.A OD2 no hydrogen 2.868 N/A ASP 502.A N THR 499.A O no hydrogen 3.259 N/A VAL 503.A N THR 499.A O no hydrogen 3.310 N/A TRP 504.A N ILE 500.A O no hydrogen 3.226 N/A TRP 506.A N ALA 501.A O no hydrogen 2.638 N/A ASP 511.A N TRP 508.A O no hydrogen 3.225 N/A PHE 512.A N GLU 509.A O no hydrogen 2.995 N/A ASN 514.A ND2 GLU 462.A O no hydrogen 2.857 N/A LYS 515.A NZ ASP 511.A O no hydrogen 3.475 N/A GLN 522.A NE2 GLU 525.A OE1 no hydrogen 2.481 N/A GLU 523.A N GLU 523.A OE1 no hydrogen 2.931 N/A TRP 524.A N SER 521.A OG no hydrogen 3.318 N/A GLU 525.A N SER 521.A O no hydrogen 3.042 N/A VAL 526.A N GLN 522.A O no hydrogen 3.174 N/A GLU 527.A N GLU 523.A O no hydrogen 3.302 N/A LEU 528.A N TRP 524.A O no hydrogen 3.167 N/A ALA 529.A N GLU 525.A O no hydrogen 3.126 N/A ILE 530.A N VAL 526.A O no hydrogen 2.920 N/A VAL 531.A N GLU 527.A O no hydrogen 3.106 N/A LEU 532.A N LEU 528.A O no hydrogen 2.733 N/A MET 533.A N ALA 529.A O no hydrogen 2.826 N/A ALA 534.A N ILE 530.A O no hydrogen 3.067 N/A LYS 535.A N VAL 531.A O no hydrogen 3.018 N/A VAL 536.A N LEU 532.A O no hydrogen 2.982 N/A ILE 537.A N MET 533.A O no hydrogen 3.069 N/A GLU 538.A N ALA 534.A O no hydrogen 3.020 N/A LEU 539.A N VAL 536.A O no hydrogen 3.270 N/A GLY 540.A N ILE 537.A O no hydrogen 3.299 N/A GLY 541.A N VAL 536.A O no hydrogen 2.684 N/A THR 544.A N ASP 547.A OD2 no hydrogen 3.443 N/A THR 544.A OG1 TYR 347.A O no hydrogen 2.917 N/A ASP 547.A N THR 544.A OG1 no hydrogen 3.017 N/A CYS 548.A N THR 544.A O no hydrogen 3.184 N/A CYS 548.A SG THR 544.A O no hydrogen 3.365 N/A ALA 549.A N ILE 545.A O no hydrogen 3.208 N/A VAL 550.A N GLY 546.A O no hydrogen 2.959 N/A ILE 551.A N ASP 547.A O no hydrogen 3.029 N/A LEU 552.A N CYS 548.A O no hydrogen 2.841 N/A ARG 553.A N ALA 549.A O no hydrogen 2.425 N/A ALA 554.A N VAL 550.A O no hydrogen 3.013 N/A ALA 555.A N ILE 551.A O no hydrogen 3.310 N/A ILE 556.A N LEU 552.A O no hydrogen 3.154 N/A ARG 557.A N ARG 553.A O no hydrogen 3.170 N/A ARG 557.A NH2 GLN 522.A OE1 no hydrogen 3.174 N/A ALA 558.A N ALA 554.A O no hydrogen 3.029 N/A SER 563.A N MET 560.A O no hydrogen 3.240 N/A SER 563.A OG MET 560.A O no hydrogen 2.787 N/A PHE 564.A N PRO 561.A O no hydrogen 3.307 N/A ILE 567.A N SER 563.A O no hydrogen 3.240 N/A LEU 568.A N PHE 564.A O no hydrogen 3.368 N/A GLN 569.A N LEU 565.A O no hydrogen 3.094 N/A THR 570.A N LYS 566.A O no hydrogen 3.013 N/A THR 571.A N ILE 567.A O no hydrogen 2.960 N/A THR 571.A OG1 ILE 567.A O no hydrogen 2.640 N/A HIS 572.A N LEU 568.A O no hydrogen 2.942 N/A HIS 572.A NE2 TYR 583.A OH no hydrogen 2.795 N/A SER 573.A N GLN 569.A O no hydrogen 3.004 N/A SER 573.A OG GLN 569.A O no hydrogen 3.401 N/A SER 573.A OG THR 570.A O no hydrogen 2.752 N/A LEU 574.A N THR 571.A O no hydrogen 3.345 N/A GLY 575.A N HIS 572.A O no hydrogen 2.918 N/A TYR 576.A N THR 571.A O no hydrogen 3.191 N/A TYR 576.A OH PRO 543.A O no hydrogen 3.050 N/A PHE 578.A N TYR 583.A OH no hydrogen 3.115 N/A GLY 579.A N LEU 364.A O no hydrogen 2.995 N/A TYR 583.A N GLY 579.A O no hydrogen 3.313 N/A TYR 583.A OH HIS 572.A NE2 no hydrogen 2.795 N/A ASP 584.A N SER 580.A O no hydrogen 2.977 N/A GLU 585.A N PRO 581.A O no hydrogen 2.861 N/A ILE 586.A N LEU 582.A O no hydrogen 3.214 N/A ILE 587.A N TYR 583.A O no hydrogen 3.294 N/A THR 588.A N ASP 584.A O no hydrogen 2.989 N/A THR 588.A OG1 ASP 584.A O no hydrogen 2.808 N/A THR 588.A OG1 ASP 584.A OD1 no hydrogen 3.054 N/A LEU 589.A N GLU 585.A O no hydrogen 2.828 N/A CYS 590.A N ILE 586.A O no hydrogen 2.918 N/A CYS 590.A SG ILE 586.A O no hydrogen 3.323 N/A LEU 591.A N ILE 587.A O no hydrogen 3.060 N/A ASP 592.A N THR 588.A O no hydrogen 2.955 N/A LEU 593.A N LEU 589.A O no hydrogen 3.156 N/A GLY 594.A N LEU 591.A O no hydrogen 3.064 N/A LEU 596.A N GLY 594.A O no hydrogen 2.844 N/A ILE 600.A N LEU 596.A O no hydrogen 2.815 N/A ALA 601.A N ASP 597.A O no hydrogen 3.178 N/A ILE 602.A N ALA 598.A O no hydrogen 2.684 N/A VAL 603.A N ALA 599.A O no hydrogen 2.955 N/A ALA 604.A N ILE 600.A O no hydrogen 3.158 N/A ASP 605.A N ALA 601.A O no hydrogen 3.050 N/A MET 606.A N ILE 602.A O no hydrogen 3.058 N/A GLU 607.A N VAL 603.A O no hydrogen 3.131 N/A THR 608.A N ALA 604.A O no hydrogen 3.217 N/A THR 608.A OG1 ASP 605.A O no hydrogen 2.539 N/A THR 609.A N ASP 605.A O no hydrogen 3.019 N/A THR 609.A OG1 ASP 605.A O no hydrogen 3.146 N/A THR 609.A OG1 MET 606.A O no hydrogen 2.528 N/A GLY 610.A N GLU 607.A O no hydrogen 3.009 N/A GLN 616.A N GLN 616.A OE1 no hydrogen 2.668 N/A THR 617.A OG1 PRO 614.A O no hydrogen 2.393 N/A LEU 618.A N PRO 614.A O no hydrogen 3.318 N/A ASP 619.A N ASP 615.A O no hydrogen 2.794 N/A LYS 620.A N GLN 616.A O no hydrogen 3.063 N/A LYS 620.A NZ GLN 616.A O no hydrogen 2.571 N/A VAL 621.A N THR 617.A O no hydrogen 3.144 N/A ILE 622.A N LEU 618.A O no hydrogen 3.073 N/A SER 623.A N ASP 619.A O no hydrogen 3.015 N/A SER 623.A OG ASP 619.A O no hydrogen 2.588 N/A ALA 624.A N LYS 620.A O no hydrogen 2.929 N/A ARG 625.A N VAL 621.A O no hydrogen 2.805 N/A GLN 626.A N ILE 622.A O no hydrogen 2.891 N/A SER 627.A N SER 623.A O no hydrogen 2.945 N/A SER 627.A OG SER 623.A O no hydrogen 3.478 N/A SER 627.A OG ALA 624.A O no hydrogen 2.703 N/A ASN 628.A N ALA 624.A O no hydrogen 3.268 N/A GLU 629.A N GLN 626.A O no hydrogen 3.434 N/A