Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4qj3_B.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLU 3.A N GLU 3.A OE1 no hydrogen 3.017 N/A ARG 12.A N VAL 8.A O no hydrogen 3.244 N/A ARG 12.A NE VAL 7.A O no hydrogen 2.731 N/A ARG 13.A N GLU 9.A O no hydrogen 2.984 N/A GLY 14.A N THR 10.A O no hydrogen 2.784 N/A SER 15.A N LEU 32.A O no hydrogen 3.160 N/A LYS 16.A NZ THR 31.A OG1 no hydrogen 3.016 N/A PHE 17.A N VAL 30.A O no hydrogen 2.986 N/A ILE 18.A N MET 106.A O no hydrogen 2.849 N/A LYS 19.A N ASN 28.A O no hydrogen 2.921 N/A TRP 20.A N ASN 104.A O no hydrogen 3.201 N/A GLU 23.A N ASP 21.A OD1 no hydrogen 3.422 N/A THR 24.A N ASP 21.A OD2 no hydrogen 3.391 N/A THR 24.A OG1 ASP 21.A OD2 no hydrogen 2.964 N/A THR 24.A OG1 SER 26.A OG no hydrogen 2.701 N/A SER 25.A OG THR 24.A O no hydrogen 2.584 N/A SER 26.A OG THR 24.A OG1 no hydrogen 2.701 N/A ASN 28.A N LYS 19.A O no hydrogen 3.256 N/A VAL 30.A N PHE 17.A O no hydrogen 2.860 N/A LEU 32.A N SER 15.A O no hydrogen 2.976 N/A ARG 33.A N TYR 42.A O no hydrogen 2.882 N/A ARG 33.A NE ARG 13.A O no hydrogen 3.190 N/A VAL 34.A N LEU 11.A O no hydrogen 2.831 N/A GLY 38.A N ASP 35.A O no hydrogen 2.705 N/A PHE 39.A N ASP 35.A OD2 no hydrogen 3.506 N/A PHE 40.A N ASP 35.A OD1 no hydrogen 2.740 N/A LEU 41.A N LEU 53.A O no hydrogen 2.962 N/A TYR 42.A N ARG 33.A O no hydrogen 2.847 N/A TRP 43.A N ASP 51.A O no hydrogen 3.047 N/A GLY 45.A N GLU 49.A O no hydrogen 3.146 N/A GLU 49.A N PRO 46.A O no hydrogen 3.277 N/A ASP 51.A N TRP 43.A O no hydrogen 2.882 N/A LEU 53.A N LEU 41.A O no hydrogen 2.731 N/A ILE 55.A N PHE 39.A O no hydrogen 3.059 N/A SER 56.A N ASP 54.A OD1 no hydrogen 3.208 N/A SER 56.A OG ASP 54.A OD1 no hydrogen 2.616 N/A SER 57.A N ASP 54.A O no hydrogen 2.849 N/A SER 57.A OG ASP 54.A O no hydrogen 2.646 N/A ILE 58.A N ILE 55.A O no hydrogen 2.972 N/A ARG 59.A N VAL 92.A O no hydrogen 2.707 N/A ARG 59.A NE GLY 94.A O no hydrogen 3.224 N/A ARG 59.A NH1 GLN 337.A OE1 no hydrogen 3.191 N/A ASP 60.A N VAL 92.A O no hydrogen 3.103 N/A THR 61.A OG1 SER 117.A O no hydrogen 2.665 N/A ARG 62.A N THR 90.A O no hydrogen 2.828 N/A ARG 62.A NE ASP 60.A OD2 no hydrogen 2.776 N/A ARG 62.A NH1 GLU 333.A OE1 no hydrogen 3.119 N/A ARG 62.A NH1 GLU 333.A OE2 no hydrogen 3.366 N/A ARG 62.A NH2 ASP 60.A OD2 no hydrogen 3.226 N/A ARG 62.A NH2 GLU 333.A OE2 no hydrogen 2.705 N/A THR 63.A OG1 LEU 88.A O no hydrogen 2.910 N/A ARG 65.A NH2 TYR 66.A OH no hydrogen 2.787 N/A TYR 66.A N THR 63.A O no hydrogen 3.309 N/A ARG 68.A N THR 90.A OG1 no hydrogen 2.870 N/A ARG 76.A N ASP 72.A O no hydrogen 3.222 N/A ARG 76.A NH1 PRO 70.A O no hydrogen 3.364 N/A GLU 77.A N PRO 73.A O no hydrogen 3.152 N/A VAL 78.A N ILE 75.A O no hydrogen 2.948 N/A LEU 79.A N ARG 76.A O no hydrogen 3.290 N/A GLY 80.A N ARG 76.A O no hydrogen 2.777 N/A GLU 85.A N ASP 81.A O no hydrogen 3.289 N/A GLU 86.A N ALA 82.A O no hydrogen 3.108 N/A LYS 87.A NZ VAL 108.A O no hydrogen 3.349 N/A LYS 87.A NZ ASP 110.A OD1 no hydrogen 2.804 N/A LEU 88.A N GLU 85.A O no hydrogen 3.338 N/A MET 89.A N PHE 105.A O no hydrogen 2.780 N/A THR 90.A N ARG 62.A O no hydrogen 2.932 N/A THR 90.A OG1 ASN 104.A OD1 no hydrogen 3.072 N/A VAL 91.A N LEU 103.A O no hydrogen 2.788 N/A VAL 92.A N ASP 60.A O no hydrogen 2.720 N/A SER 93.A N VAL 101.A O no hydrogen 3.147 N/A GLY 94.A N SER 57.A O no hydrogen 2.996 N/A ASN 99.A N ASP 96.A OD1 no hydrogen 2.749 N/A VAL 101.A N SER 93.A O no hydrogen 2.799 N/A LEU 103.A N VAL 91.A O no hydrogen 2.954 N/A PHE 105.A N MET 89.A O no hydrogen 2.758 N/A MET 106.A N ILE 18.A O no hydrogen 3.307 N/A ALA 107.A N LYS 87.A O no hydrogen 3.305 N/A VAL 108.A N LYS 16.A O no hydrogen 3.185 N/A THR 112.A OG1 ASP 110.A O no hydrogen 3.239 N/A VAL 115.A N THR 112.A O no hydrogen 3.066 N/A TRP 116.A N THR 112.A O no hydrogen 3.104 N/A TRP 116.A NE1 SER 15.A OG no hydrogen 3.092 N/A SER 117.A N ALA 113.A O no hydrogen 2.788 N/A GLU 118.A N LYS 114.A O no hydrogen 3.234 N/A GLU 119.A N VAL 115.A O no hydrogen 2.823 N/A LEU 120.A N TRP 116.A O no hydrogen 3.036 N/A PHE 121.A N SER 117.A O no hydrogen 3.262 N/A LYS 122.A N GLU 118.A O no hydrogen 3.179 N/A LEU 123.A N GLU 119.A O no hydrogen 3.188 N/A ALA 124.A N LEU 120.A O no hydrogen 2.803 N/A MET 125.A N PHE 121.A O no hydrogen 3.006 N/A ASN 126.A N LEU 123.A O no hydrogen 3.396 N/A ASN 126.A ND2 GLU 3.A O no hydrogen 3.373 N/A ALA 129.A N ASN 126.A OD1 no hydrogen 2.892 N/A GLN 130.A N ASN 126.A O no hydrogen 3.401 N/A GLN 130.A NE2 GLU 565.A OE2 no hydrogen 3.153 N/A ASN 131.A N ILE 127.A O no hydrogen 3.009 N/A ASN 131.A ND2 ILE 127.A O no hydrogen 3.163 N/A ASN 131.A ND2 GLU 565.A OE2 no hydrogen 3.173 N/A SER 133.A OG THR 136.A OG1 no hydrogen 2.756 N/A SER 133.A OG GLY 286.A O no hydrogen 3.540 N/A SER 133.A OG GLU 288.A OE2 no hydrogen 2.740 N/A ARG 134.A NH1 LEU 709.A O no hydrogen 2.856 N/A ARG 134.A NH2 LEU 709.A O no hydrogen 3.048 N/A ASN 135.A N GLY 286.A O no hydrogen 2.873 N/A ASN 135.A ND2 ARG 283.A O no hydrogen 2.995 N/A THR 136.A N SER 133.A OG no hydrogen 3.091 N/A THR 136.A OG1 SER 133.A OG no hydrogen 2.756 N/A THR 136.A OG1 GLU 288.A OE2 no hydrogen 3.299 N/A PHE 137.A N SER 133.A O no hydrogen 3.187 N/A LEU 138.A N ARG 134.A O no hydrogen 3.056 N/A ARG 139.A N ASN 135.A O no hydrogen 2.822 N/A LYS 140.A N THR 136.A O no hydrogen 2.915 N/A LYS 140.A NZ ASP 54.A OD1 no hydrogen 2.543 N/A LYS 140.A NZ ASP 54.A OD2 no hydrogen 3.281 N/A LYS 140.A NZ SER 56.A OG no hydrogen 3.087 N/A ALA 141.A N PHE 137.A O no hydrogen 3.113 N/A TYR 142.A N LEU 138.A O no hydrogen 3.044 N/A TYR 142.A OH PHE 193.A O no hydrogen 2.902 N/A THR 143.A N ARG 139.A O no hydrogen 2.921 N/A THR 143.A OG1 ARG 139.A O no hydrogen 2.658 N/A LYS 144.A N LYS 140.A O no hydrogen 3.001 N/A LEU 145.A N ALA 141.A O no hydrogen 3.361 N/A LYS 146.A N TYR 142.A O no hydrogen 3.192 N/A LYS 146.A NZ PRO 190.A O no hydrogen 3.521 N/A LEU 147.A N THR 143.A O no hydrogen 3.010 N/A LEU 147.A N LYS 144.A O no hydrogen 3.185 N/A GLN 148.A N LYS 144.A O no hydrogen 2.995 N/A ASN 150.A N ARG 154.A O no hydrogen 2.936 N/A GLY 153.A N ASN 150.A O no hydrogen 3.101 N/A ARG 154.A N ASN 150.A OD1 no hydrogen 2.669 N/A ILE 155.A N ILE 188.A O no hydrogen 2.723 N/A VAL 157.A N GLU 186.A O no hydrogen 3.151 N/A ASN 159.A N PRO 156.A O no hydrogen 3.305 N/A ASN 159.A ND2 GLN 148.A O no hydrogen 3.170 N/A LEU 161.A N VAL 157.A O no hydrogen 3.032 N/A LYS 162.A N LYS 158.A O no hydrogen 2.744 N/A MET 163.A N ASN 159.A O no hydrogen 3.015 N/A PHE 164.A N ILE 160.A O no hydrogen 3.281 N/A SER 165.A OG LYS 162.A O no hydrogen 3.128 N/A SER 165.A OG ASP 614.A O no hydrogen 2.680 N/A ARG 170.A NE ASP 167.A OD2 no hydrogen 3.041 N/A ARG 170.A NH1 ASN 647.A OD1 no hydrogen 3.306 N/A ARG 170.A NH2 ASP 167.A OD2 no hydrogen 3.177 N/A VAL 171.A N ASP 167.A O no hydrogen 3.299 N/A GLU 172.A N LYS 168.A O no hydrogen 3.208 N/A THR 173.A N LYS 169.A O no hydrogen 3.306 N/A THR 173.A OG1 LYS 169.A O no hydrogen 2.724 N/A ALA 174.A N ARG 170.A O no hydrogen 2.974 N/A LEU 175.A N VAL 171.A O no hydrogen 3.000 N/A GLU 176.A N GLU 172.A O no hydrogen 2.839 N/A SER 177.A N THR 173.A O no hydrogen 2.981 N/A CYS 178.A N ALA 174.A O no hydrogen 3.316 N/A CYS 178.A N LEU 175.A O no hydrogen 3.346 N/A CYS 178.A SG ALA 174.A O no hydrogen 3.221 N/A GLY 179.A N GLU 176.A O no hydrogen 3.115 N/A LEU 180.A N LEU 175.A O no hydrogen 3.040 N/A ASN 183.A N GLU 186.A OE2 no hydrogen 3.199 N/A SER 185.A N ASN 183.A OD1 no hydrogen 3.098 N/A GLU 186.A N ASN 183.A O no hydrogen 3.418 N/A ILE 188.A N ILE 155.A O no hydrogen 2.720 N/A GLU 192.A N ARG 189.A O no hydrogen 2.940 N/A PHE 193.A N ARG 189.A O no hydrogen 3.091 N/A PHE 193.A N PRO 190.A O no hydrogen 2.925 N/A SER 194.A OG GLU 196.A OE1 no hydrogen 2.890 N/A GLU 196.A N SER 194.A OG no hydrogen 3.221 N/A PHE 198.A N SER 194.A O no hydrogen 2.921 N/A GLU 199.A N LEU 195.A O no hydrogen 2.935 N/A ARG 200.A N GLU 196.A O no hydrogen 2.897 N/A PHE 201.A N ILE 197.A O no hydrogen 2.928 N/A LEU 202.A N PHE 198.A O no hydrogen 2.983 N/A ASN 203.A N GLU 199.A O no hydrogen 3.058 N/A LYS 204.A N ARG 200.A O no hydrogen 3.218 N/A LYS 204.A NZ SER 177.A OG no hydrogen 3.265 N/A LEU 205.A N PHE 201.A O no hydrogen 2.883 N/A CYS 206.A N LEU 202.A O no hydrogen 3.024 N/A ARG 208.A NE ASP 210.A OD1 no hydrogen 3.163 N/A ARG 208.A NE ASP 210.A OD2 no hydrogen 3.354 N/A ARG 208.A NH2 ASP 210.A OD2 no hydrogen 2.704 N/A ASP 212.A N ARG 208.A O no hydrogen 3.405 N/A LYS 213.A N PRO 209.A O no hydrogen 2.967 N/A ILE 214.A N ASP 210.A O no hydrogen 3.216 N/A LEU 215.A N ILE 211.A O no hydrogen 3.130 N/A LEU 216.A N ASP 212.A O no hydrogen 3.110 N/A GLU 217.A N LYS 213.A O no hydrogen 3.106 N/A ILE 218.A N ILE 214.A O no hydrogen 3.157 N/A THR 227.A N GLN 230.A OE1 no hydrogen 2.840 N/A THR 227.A OG1 GLN 230.A OE1 no hydrogen 3.075 N/A GLN 230.A N THR 227.A OG1 no hydrogen 3.217 N/A LEU 231.A N THR 227.A O no hydrogen 2.918 N/A MET 232.A N LEU 228.A O no hydrogen 2.834 N/A ASP 233.A N GLU 229.A O no hydrogen 2.764 N/A PHE 234.A N GLN 230.A O no hydrogen 2.867 N/A ILE 235.A N LEU 231.A O no hydrogen 2.869 N/A ASN 236.A N MET 232.A O no hydrogen 2.873 N/A ASN 236.A ND2 LEU 252.A O no hydrogen 3.097 N/A GLN 237.A N ASP 233.A O no hydrogen 2.868 N/A LYS 238.A N PHE 234.A O no hydrogen 2.778 N/A LYS 238.A NZ GLU 217.A OE2 no hydrogen 2.859 N/A LYS 238.A NZ TYR 715.A OH no hydrogen 3.364 N/A GLN 239.A N PHE 234.A O no hydrogen 3.284 N/A GLN 239.A NE2 ASN 290.A OD1 no hydrogen 2.807 N/A GLN 239.A NE2 TYR 694.A O no hydrogen 2.781 N/A ARG 240.A NH1 LEU 244.A O no hydrogen 3.410 N/A ARG 240.A NH2 ASN 245.A O no hydrogen 3.307 N/A ARG 240.A NH2 TYR 249.A O no hydrogen 2.404 N/A ARG 243.A N ASP 241.A OD1 no hydrogen 3.073 N/A ARG 243.A NE ASP 241.A OD1 no hydrogen 3.057 N/A ARG 243.A NE ASP 241.A OD2 no hydrogen 3.525 N/A ARG 243.A NH1 VAL 687.A O no hydrogen 2.830 N/A ARG 243.A NH2 ASP 241.A OD2 no hydrogen 3.329 N/A ARG 243.A NH2 VAL 687.A O no hydrogen 3.254 N/A LEU 244.A N ASP 241.A O no hydrogen 3.293 N/A GLU 246.A N GLU 246.A OE1 no hydrogen 2.784 N/A VAL 247.A N ASN 245.A OD1 no hydrogen 2.886 N/A TYR 249.A N ASN 245.A O no hydrogen 3.017 N/A LEU 252.A N ASN 236.A OD1 no hydrogen 2.721 N/A ARG 253.A N GLN 256.A OE1 no hydrogen 2.772 N/A ALA 257.A N ARG 253.A O no hydrogen 3.080 N/A ARG 258.A N PRO 254.A O no hydrogen 3.100 N/A LEU 259.A N SER 255.A O no hydrogen 3.374 N/A LEU 260.A N GLN 256.A O no hydrogen 3.155 N/A ILE 261.A N ALA 257.A O no hydrogen 3.294 N/A GLU 262.A N ARG 258.A O no hydrogen 2.992 N/A LYS 263.A N LEU 259.A O no hydrogen 3.112 N/A LYS 263.A NZ TYR 264.A OH no hydrogen 3.325 N/A LYS 263.A NZ GLU 288.A OE1 no hydrogen 3.253 N/A LYS 263.A NZ GLU 289.A OE2 no hydrogen 2.805 N/A TYR 264.A N LEU 260.A O no hydrogen 2.994 N/A TYR 264.A OH GLU 288.A OE1 no hydrogen 3.111 N/A TYR 264.A OH GLU 289.A OE1 no hydrogen 2.576 N/A GLU 265.A N ILE 261.A O no hydrogen 2.859 N/A ASN 267.A N GLU 265.A OE2 no hydrogen 3.252 N/A GLN 269.A NE2 GLU 272.A OE1 no hydrogen 3.459 N/A LEU 271.A N ASN 267.A O no hydrogen 3.206 N/A GLU 272.A N GLN 268.A O no hydrogen 3.131 N/A ARG 273.A NE GLN 275.A OE1 no hydrogen 2.744 N/A ASP 274.A N LEU 271.A O no hydrogen 3.014 N/A GLN 275.A N PHE 270.A O no hydrogen 2.903 N/A MET 276.A N LEU 226.A O no hydrogen 2.702 N/A SER 277.A N GLU 265.A OE1 no hydrogen 2.661 N/A SER 277.A OG GLU 265.A OE1 no hydrogen 2.991 N/A SER 277.A OG GLU 265.A OE2 no hydrogen 2.786 N/A SER 277.A OG GLU 279.A OE1 no hydrogen 3.353 N/A GLU 279.A N GLU 279.A OE1 no hydrogen 2.867 N/A PHE 281.A N SER 277.A O no hydrogen 2.755 N/A SER 282.A N MET 278.A O no hydrogen 2.697 N/A SER 282.A OG MET 278.A O no hydrogen 2.715 N/A ARG 283.A N GLU 279.A O no hydrogen 3.173 N/A ARG 283.A NE GLU 199.A OE1 no hydrogen 2.596 N/A TYR 284.A N GLY 280.A O no hydrogen 2.985 N/A LEU 285.A N PHE 281.A O no hydrogen 3.067 N/A GLY 287.A N TYR 284.A O no hydrogen 2.922 N/A GLU 288.A N TYR 264.A OH no hydrogen 3.157 N/A ASN 290.A ND2 LEU 285.A O no hydrogen 3.041 N/A ASN 290.A ND2 TYR 694.A O no hydrogen 2.917 N/A GLU 296.A N GLU 296.A OE1 no hydrogen 2.728 N/A ASP 299.A N LEU 295.A O no hydrogen 2.882 N/A SER 301.A N ASP 299.A O no hydrogen 2.823 N/A SER 301.A OG GLU 296.A O no hydrogen 2.695 N/A THR 302.A N ASN 567.A OD1 no hydrogen 3.258 N/A THR 305.A N ASP 303.A OD1 no hydrogen 3.056 N/A THR 305.A OG1 ASP 303.A OD1 no hydrogen 2.626 N/A THR 305.A OG1 ASP 303.A OD2 no hydrogen 3.407 N/A GLN 306.A N TYR 311.A OH no hydrogen 3.031 N/A LEU 308.A N PRO 439.A O no hydrogen 2.938 N/A SER 309.A OG LYS 515.A O no hydrogen 2.929 N/A SER 309.A OG GLN 516.A O no hydrogen 3.298 N/A ALA 310.A N PRO 307.A O no hydrogen 2.971 N/A TYR 311.A OH ASP 303.A O no hydrogen 2.751 N/A PHE 312.A N LEU 573.A O no hydrogen 2.691 N/A ILE 313.A N GLN 544.A O no hydrogen 2.750 N/A ASN 314.A N GLY 571.A O no hydrogen 3.036 N/A SER 315.A OG ILE 313.A O no hydrogen 3.102 N/A SER 316.A N CYS 345.A O no hydrogen 2.697 N/A SER 316.A OG THR 319.A OG1 no hydrogen 2.902 N/A HIS 317.A N LEU 548.A O no hydrogen 2.811 N/A HIS 317.A ND1 ASN 549.A OD1 no hydrogen 2.877 N/A ASN 318.A N GLU 347.A OE1 no hydrogen 3.121 N/A THR 319.A OG1 SER 316.A OG no hydrogen 2.902 N/A LEU 321.A N ASN 318.A O no hydrogen 3.184 N/A THR 322.A N THR 329.A O no hydrogen 3.251 N/A THR 322.A OG1 THR 329.A O no hydrogen 3.176 N/A GLN 325.A N VAL 528.A O no hydrogen 2.859 N/A GLN 325.A NE2 SER 530.A OG no hydrogen 3.063 N/A GLN 325.A NE2 ASN 549.A OD1 no hydrogen 3.466 N/A SER 330.A N THR 370.A OG1 no hydrogen 2.840 N/A SER 330.A OG THR 370.A O no hydrogen 2.725 N/A SER 331.A N TYR 320.A O no hydrogen 2.732 N/A GLU 333.A N SER 331.A OG no hydrogen 3.121 N/A TYR 335.A N VAL 332.A O no hydrogen 3.156 N/A TYR 335.A OH GLU 347.A O no hydrogen 2.676 N/A ARG 336.A NE GLU 383.A OE1 no hydrogen 3.092 N/A ARG 336.A NH1 GLU 333.A OE1 no hydrogen 2.816 N/A GLN 337.A N GLU 333.A O no hydrogen 2.856 N/A GLN 337.A NE2 GLU 333.A OE2 no hydrogen 2.827 N/A ALA 338.A N MET 334.A O no hydrogen 2.900 N/A LEU 339.A N TYR 335.A O no hydrogen 3.122 N/A LEU 340.A N ARG 336.A O no hydrogen 2.892 N/A TRP 341.A N GLN 337.A O no hydrogen 3.112 N/A GLY 342.A N LEU 339.A O no hydrogen 3.396 N/A CYS 343.A N ALA 338.A O no hydrogen 3.042 N/A CYS 343.A SG ASN 314.A O no hydrogen 3.818 N/A CYS 343.A SG CYS 345.A O no hydrogen 3.102 N/A ARG 344.A N ASN 314.A O no hydrogen 2.850 N/A ARG 344.A NE CYS 343.A O no hydrogen 2.952 N/A ARG 344.A NH1 ALA 385.A O no hydrogen 3.023 N/A ARG 344.A NH1 SER 389.A O no hydrogen 3.053 N/A ARG 344.A NH1 TYR 391.A O no hydrogen 2.868 N/A ARG 344.A NH2 LEU 339.A O no hydrogen 3.249 N/A ARG 344.A NH2 CYS 343.A O no hydrogen 3.343 N/A ARG 344.A NH2 ALA 385.A O no hydrogen 2.674 N/A CYS 345.A SG ILE 394.A O no hydrogen 4.018 N/A VAL 346.A N ILE 394.A O no hydrogen 3.283 N/A GLU 347.A N THR 319.A OG1 no hydrogen 2.995 N/A LEU 348.A N SER 396.A O no hydrogen 3.023 N/A TRP 351.A N PHE 361.A O no hydrogen 2.765 N/A GLY 353.A N GLN 406.A OE1 no hydrogen 2.958 N/A GLU 358.A N ARG 354.A O no hydrogen 2.749 N/A PHE 361.A N TRP 351.A O no hydrogen 3.333 N/A ILE 362.A N VAL 372.A O no hydrogen 2.678 N/A THR 363.A N ASP 349.A O no hydrogen 3.237 N/A THR 363.A OG1 THR 369.A O no hydrogen 3.434 N/A THR 363.A OG1 THR 369.A OG1 no hydrogen 3.310 N/A THR 363.A OG1 THR 370.A O no hydrogen 2.769 N/A THR 367.A OG1 GLN 325.A O no hydrogen 3.549 N/A THR 367.A OG1 LEU 326.A O no hydrogen 3.263 N/A THR 367.A OG1 HIS 364.A ND1 no hydrogen 3.416 N/A THR 367.A OG1 THR 369.A OG1 no hydrogen 2.891 N/A THR 369.A OG1 THR 363.A OG1 no hydrogen 3.310 N/A THR 369.A OG1 THR 367.A OG1 no hydrogen 2.891 N/A THR 370.A N GLY 328.A O no hydrogen 3.228 N/A VAL 372.A N ILE 362.A O no hydrogen 3.101 N/A LEU 374.A N PRO 360.A O no hydrogen 2.953 N/A LEU 378.A N LEU 374.A O no hydrogen 3.050 N/A GLU 379.A N ARG 375.A O no hydrogen 3.156 N/A ALA 380.A N ASP 376.A O no hydrogen 3.020 N/A ILE 381.A N VAL 377.A O no hydrogen 2.843 N/A ALA 382.A N LEU 378.A O no hydrogen 3.052 N/A GLU 383.A N GLU 379.A O no hydrogen 3.313 N/A THR 384.A N ILE 381.A O no hydrogen 3.199 N/A THR 384.A OG1 ALA 380.A O no hydrogen 2.905 N/A ALA 385.A N ILE 381.A O no hydrogen 2.778 N/A LYS 387.A N THR 384.A O no hydrogen 3.414 N/A LYS 387.A NZ ASP 60.A OD1 no hydrogen 3.241 N/A LYS 387.A NZ THR 61.A O no hydrogen 3.564 N/A THR 388.A OG1 LEU 339.A O no hydrogen 3.540 N/A THR 388.A OG1 LEU 340.A O no hydrogen 3.060 N/A SER 389.A OG SER 570.A O no hydrogen 2.587 N/A VAL 393.A N ARG 447.A O no hydrogen 3.046 N/A ILE 394.A N ARG 344.A O no hydrogen 2.824 N/A LEU 395.A N LEU 449.A O no hydrogen 2.843 N/A SER 396.A N VAL 346.A O no hydrogen 2.850 N/A PHE 397.A N LYS 451.A O no hydrogen 3.064 N/A GLU 398.A N LEU 348.A O no hydrogen 2.783 N/A ASN 399.A ND2 GLN 407.A OE1 no hydrogen 3.391 N/A HIS 400.A N VAL 350.A O no hydrogen 3.101 N/A LYS 405.A NZ GLU 358.A OE1 no hydrogen 2.797 N/A GLN 406.A NE2 GLY 353.A O no hydrogen 3.139 N/A GLN 407.A N SER 403.A O no hydrogen 2.977 N/A GLN 407.A NE2 VAL 401.A O no hydrogen 2.964 N/A ALA 408.A N ALA 404.A O no hydrogen 2.955 N/A LYS 409.A N LYS 405.A O no hydrogen 3.095 N/A MET 410.A N GLN 406.A O no hydrogen 3.236 N/A ALA 411.A N GLN 407.A O no hydrogen 3.231 N/A GLU 412.A N ALA 408.A O no hydrogen 2.915 N/A TYR 413.A N LYS 409.A O no hydrogen 2.753 N/A TYR 413.A OH GLU 359.A OE1 no hydrogen 3.398 N/A TYR 413.A OH GLU 359.A OE2 no hydrogen 2.749 N/A CYS 414.A N MET 410.A O no hydrogen 3.070 N/A CYS 414.A SG MET 410.A O no hydrogen 3.255 N/A ARG 415.A N ALA 411.A O no hydrogen 3.138 N/A SER 416.A N GLU 412.A O no hydrogen 3.032 N/A SER 416.A OG GLU 412.A O no hydrogen 3.144 N/A SER 416.A OG TYR 413.A O no hydrogen 3.399 N/A ILE 417.A N TYR 413.A O no hydrogen 2.943 N/A PHE 418.A N CYS 414.A O no hydrogen 3.110 N/A GLY 419.A N ARG 415.A O no hydrogen 3.015 N/A ALA 421.A N PHE 418.A O no hydrogen 3.328 N/A LEU 423.A N ILE 448.A O no hydrogen 2.982 N/A LEU 427.A N TYR 470.A OH no hydrogen 2.767 N/A LYS 429.A NZ TYR 430.A OH no hydrogen 2.901 N/A TYR 430.A N LEU 427.A O no hydrogen 3.354 N/A TYR 430.A OH ASP 443.A OD2 no hydrogen 3.324 N/A ALA 433.A N PRO 431.A O no hydrogen 2.922 N/A GLY 435.A N ASN 486.A O no hydrogen 2.972 N/A GLN 442.A N MET 304.A O no hydrogen 3.020 N/A ASP 443.A N SER 440.A OG no hydrogen 3.090 N/A LEU 444.A N PRO 441.A O no hydrogen 3.154 N/A GLY 446.A N PRO 390.A O no hydrogen 2.617 N/A ARG 447.A NH1 ALA 421.A O no hydrogen 3.376 N/A ARG 447.A NH1 LEU 422.A O no hydrogen 3.013 N/A ILE 448.A N ALA 421.A O no hydrogen 2.726 N/A LEU 449.A N VAL 393.A O no hydrogen 2.993 N/A LYS 451.A N LEU 395.A O no hydrogen 2.871 N/A VAL 458.A N ASN 399.A O no hydrogen 2.994 N/A ALA 460.A N ARG 455.A O no hydrogen 2.853 N/A GLU 463.A N THR 461.A OG1 no hydrogen 3.372 N/A SER 465.A N THR 461.A O no hydrogen 3.192 N/A SER 465.A OG THR 461.A O no hydrogen 2.980 N/A VAL 468.A N SER 465.A O no hydrogen 3.163 N/A ASN 469.A ND2 LEU 423.A O no hydrogen 3.362 N/A TYR 470.A N ASN 469.A OD1 no hydrogen 2.745 N/A TYR 470.A OH TYR 430.A O no hydrogen 2.529 N/A GLU 472.A N PHE 489.A O no hydrogen 3.022 N/A VAL 474.A N MET 491.A O no hydrogen 2.736 N/A ALA 481.A N SER 478.A OG no hydrogen 3.177 N/A ALA 482.A N SER 478.A O no hydrogen 3.134 N/A ARG 483.A N PHE 479.A O no hydrogen 3.110 N/A LYS 484.A N GLU 480.A O no hydrogen 2.942 N/A ARG 485.A N ALA 481.A O no hydrogen 3.011 N/A ARG 485.A NE GLU 490.A OE1 no hydrogen 2.957 N/A ARG 485.A NH2 GLU 490.A OE2 no hydrogen 2.702 N/A ASN 486.A N ALA 482.A O no hydrogen 3.189 N/A CYS 488.A SG VAL 436.A O no hydrogen 2.943 N/A MET 491.A N GLU 472.A O no hydrogen 2.799 N/A SER 492.A OG VAL 474.A O no hydrogen 2.765 N/A PHE 494.A N ARG 520.A O no hydrogen 2.761 N/A ALA 499.A N VAL 495.A O no hydrogen 2.925 N/A MET 500.A N GLU 496.A O no hydrogen 2.855 N/A GLU 501.A N THR 497.A O no hydrogen 3.076 N/A GLN 502.A N LYS 498.A O no hydrogen 3.118 N/A LEU 503.A N ALA 499.A O no hydrogen 2.988 N/A THR 504.A N MET 500.A O no hydrogen 3.076 N/A THR 504.A OG1 MET 500.A O no hydrogen 3.270 N/A THR 504.A OG1 GLU 501.A O no hydrogen 3.187 N/A LYS 505.A N GLU 501.A O no hydrogen 3.038 N/A LYS 505.A NZ GLU 501.A OE2 no hydrogen 3.546 N/A SER 506.A N GLN 502.A O no hydrogen 2.864 N/A GLU 509.A N GLU 509.A OE1 no hydrogen 3.054 N/A PHE 510.A N SER 506.A O no hydrogen 3.146 N/A VAL 511.A N PRO 507.A O no hydrogen 3.138 N/A GLU 512.A N MET 508.A O no hydrogen 3.018 N/A TYR 513.A N GLU 509.A O no hydrogen 2.780 N/A TYR 513.A OH LEU 518.A O no hydrogen 2.850 N/A ASN 514.A N PHE 510.A O no hydrogen 2.913 N/A ASN 514.A ND2 VAL 541.A O no hydrogen 2.826 N/A LYS 515.A NZ GLU 512.A OE2 no hydrogen 2.697 N/A LYS 515.A NZ PHE 578.A O no hydrogen 3.428 N/A LYS 515.A NZ ARG 581.A O no hydrogen 2.693 N/A GLN 516.A N TYR 513.A O no hydrogen 3.214 N/A GLN 516.A NE2 ASN 486.A OD1 no hydrogen 2.641 N/A GLN 517.A N TYR 513.A O no hydrogen 3.035 N/A GLN 517.A NE2 GLU 490.A O no hydrogen 2.651 N/A SER 519.A N GLN 544.A OE1 no hydrogen 2.933 N/A SER 519.A OG ASN 514.A OD1 no hydrogen 2.644 N/A SER 519.A OG GLN 544.A OE1 no hydrogen 3.376 N/A ARG 520.A N SER 492.A O no hydrogen 3.224 N/A ARG 520.A NH2 SER 316.A O no hydrogen 3.414 N/A ARG 520.A NH2 GLU 347.A OE1 no hydrogen 2.730 N/A ILE 521.A N LEU 545.A O no hydrogen 2.986 N/A TYR 522.A N PHE 494.A O no hydrogen 3.243 N/A ARG 527.A NE GLU 496.A OE1 no hydrogen 2.739 N/A ARG 527.A NH2 GLU 496.A OE2 no hydrogen 2.879 N/A VAL 528.A N THR 526.A O no hydrogen 2.707 N/A SER 530.A N ARG 527.A O no hydrogen 3.196 N/A SER 530.A OG ALA 323.A O no hydrogen 2.583 N/A ASN 532.A N ASP 554.A OD2 no hydrogen 3.305 N/A ASN 532.A ND2 ASN 549.A O no hydrogen 3.095 N/A ASN 532.A ND2 ASP 554.A OD1 no hydrogen 3.417 N/A TYR 533.A OH ILE 521.A O no hydrogen 2.797 N/A GLN 536.A NE2 GLN 536.A O no hydrogen 3.433 N/A GLN 536.A NE2 ASN 540.A OD1 no hydrogen 2.732 N/A LEU 537.A N MET 534.A O no hydrogen 3.325 N/A PHE 538.A N PRO 535.A O no hydrogen 3.033 N/A TRP 539.A N PRO 535.A O no hydrogen 3.275 N/A ASN 540.A N GLN 536.A O no hydrogen 3.167 N/A ASN 540.A ND2 GLY 627.A O no hydrogen 2.999 N/A VAL 541.A N PHE 538.A O no hydrogen 3.159 N/A GLY 542.A N TRP 539.A O no hydrogen 3.018 N/A CYS 543.A N PHE 538.A O no hydrogen 2.960 N/A CYS 543.A SG SER 519.A OG no hydrogen 3.350 N/A GLN 544.A N GLN 544.A OE1 no hydrogen 2.710 N/A GLN 544.A NE2 SER 309.A O no hydrogen 2.867 N/A GLN 544.A NE2 GLN 517.A O no hydrogen 2.976 N/A LEU 545.A N SER 519.A O no hydrogen 3.272 N/A ALA 547.A N ILE 521.A O no hydrogen 2.735 N/A LEU 548.A N SER 315.A O no hydrogen 3.144 N/A ASN 549.A N ASN 532.A OD1 no hydrogen 2.693 N/A ASN 549.A ND2 SER 531.A O no hydrogen 3.470 N/A ASN 549.A ND2 ASN 532.A OD1 no hydrogen 3.635 N/A GLN 551.A N GLN 551.A OE1 no hydrogen 2.666 N/A GLN 551.A NE2 ALA 323.A O no hydrogen 3.233 N/A GLN 551.A NE2 SER 530.A OG no hydrogen 3.428 N/A GLN 551.A NE2 ASN 549.A OD1 no hydrogen 3.628 N/A THR 552.A N ASN 549.A O no hydrogen 3.134 N/A THR 552.A OG1 SER 530.A O no hydrogen 2.625 N/A MET 557.A N ASP 554.A OD1 no hydrogen 3.216 N/A GLN 558.A N ASP 554.A O no hydrogen 3.009 N/A GLN 558.A NE2 LEU 553.A O no hydrogen 3.237 N/A LEU 559.A N VAL 555.A O no hydrogen 2.900 N/A ASN 560.A N ALA 556.A O no hydrogen 3.136 N/A ASN 560.A ND2 ASN 314.A OD1 no hydrogen 2.687 N/A ALA 561.A N MET 557.A O no hydrogen 2.822 N/A GLY 562.A N GLN 558.A O no hydrogen 2.997 N/A VAL 563.A N LEU 559.A O no hydrogen 2.909 N/A PHE 564.A N ASN 560.A O no hydrogen 3.263 N/A GLU 565.A N GLY 562.A O no hydrogen 3.382 N/A TYR 566.A N VAL 563.A O no hydrogen 3.388 N/A TYR 566.A OH ILE 684.A O no hydrogen 2.579 N/A ASN 567.A N ALA 297.A O no hydrogen 3.141 N/A ASN 567.A ND2 TYR 572.A O no hydrogen 2.816 N/A GLY 568.A N LEU 298.A O no hydrogen 2.912 N/A ARG 569.A N GLU 565.A O no hydrogen 3.015 N/A SER 570.A N ASN 567.A O no hydrogen 3.076 N/A SER 570.A OG ASN 567.A O no hydrogen 2.916 N/A TYR 572.A N SER 570.A OG no hydrogen 3.362 N/A TYR 572.A OH PRO 392.A O no hydrogen 2.518 N/A LEU 573.A N PHE 312.A O no hydrogen 2.882 N/A LYS 575.A N ALA 310.A O no hydrogen 3.078 N/A LYS 575.A NZ SER 309.A O no hydrogen 3.204 N/A LYS 575.A NZ ASN 514.A O no hydrogen 3.061 N/A LYS 575.A NZ GLY 542.A O no hydrogen 2.940 N/A MET 579.A N PRO 576.A O no hydrogen 2.979 N/A ARG 580.A N GLU 577.A O no hydrogen 3.152 N/A ARG 580.A NE LYS 575.A O no hydrogen 2.772 N/A ARG 581.A N GLU 577.A O no hydrogen 2.978 N/A ARG 581.A NE ASP 583.A OD1 no hydrogen 3.102 N/A ARG 581.A NH1 GLU 577.A OE2 no hydrogen 2.875 N/A ARG 581.A NH2 ASP 583.A OD2 no hydrogen 2.733 N/A ASP 583.A N ASP 583.A OD1 no hydrogen 2.625 N/A THR 590.A N ASP 587.A O no hydrogen 3.125 N/A THR 590.A OG1 ASP 587.A O no hydrogen 2.740 N/A ILE 597.A N VAL 594.A O no hydrogen 3.315 N/A ASN 600.A N VAL 660.A O no hydrogen 2.936 N/A ALA 601.A N SER 719.A O no hydrogen 2.914 N/A LEU 602.A N PHE 657.A O no hydrogen 2.976 N/A ARG 603.A N GLU 717.A O no hydrogen 2.829 N/A VAL 604.A N PHE 655.A O no hydrogen 2.969 N/A LYS 605.A N TYR 715.A O no hydrogen 2.975 N/A LYS 605.A NZ GLU 652.A O no hydrogen 3.503 N/A ILE 607.A N LEU 713.A O no hydrogen 3.032 N/A SER 608.A N LEU 713.A O no hydrogen 3.269 N/A SER 608.A OG ASP 210.A OD2 no hydrogen 2.908 N/A SER 608.A OG GLN 610.A OE1 no hydrogen 3.552 N/A GLY 609.A N PRO 648.A O no hydrogen 3.056 N/A GLN 610.A N ALA 711.A O no hydrogen 2.843 N/A PHE 611.A N PHE 646.A O no hydrogen 2.945 N/A LEU 612.A N SER 645.A O no hydrogen 3.229 N/A SER 613.A OG ARG 615.A O no hydrogen 3.249 N/A SER 613.A OG GLU 674.A OE2 no hydrogen 2.672 N/A ARG 615.A N SER 613.A OG no hydrogen 3.246 N/A ARG 615.A NH1 ASP 614.A OD1 no hydrogen 2.456 N/A ILE 619.A N SER 641.A OG no hydrogen 2.759 N/A TYR 620.A N PHE 673.A O no hydrogen 2.928 N/A VAL 621.A N THR 638.A OG1 no hydrogen 2.748 N/A GLU 622.A N ALA 671.A O no hydrogen 2.779 N/A VAL 623.A N TYR 636.A O no hydrogen 3.438 N/A ASP 624.A N ARG 669.A O no hydrogen 2.891 N/A MET 625.A N ARG 633.A O no hydrogen 2.946 N/A PHE 626.A N SER 667.A O no hydrogen 2.820 N/A THR 632.A N LEU 628.A O no hydrogen 3.020 N/A THR 632.A OG1 LEU 628.A O no hydrogen 3.006 N/A TYR 636.A OH ASP 656.A O no hydrogen 2.623 N/A ARG 637.A NH2 THR 640.A OG1 no hydrogen 3.282 N/A THR 638.A N VAL 621.A O no hydrogen 3.048 N/A THR 638.A OG1 VAL 621.A O no hydrogen 3.542 N/A ARG 639.A N GLU 652.A OE1 no hydrogen 2.768 N/A SER 641.A N ILE 619.A O no hydrogen 2.736 N/A SER 641.A OG ILE 619.A O no hydrogen 3.507 N/A SER 641.A OG ASN 644.A O no hydrogen 3.204 N/A GLN 642.A NE2 VAL 649.A O no hydrogen 3.143 N/A ASN 644.A ND2 ASN 647.A OD1 no hydrogen 2.812 N/A SER 645.A OG ARG 615.A O no hydrogen 2.965 N/A PHE 646.A N ASN 644.A OD1 no hydrogen 2.897 N/A ASN 647.A N ASN 644.A OD1 no hydrogen 3.221 N/A ASN 647.A ND2 LEU 207.A O no hydrogen 2.906 N/A TRP 650.A N ILE 607.A O no hydrogen 2.885 N/A TRP 650.A NE1 ARG 639.A O no hydrogen 2.859 N/A PHE 655.A N VAL 604.A O no hydrogen 2.681 N/A PHE 657.A N LEU 602.A O no hydrogen 2.833 N/A LYS 659.A NZ GLU 591.A O no hydrogen 3.128 N/A VAL 660.A N ASN 600.A O no hydrogen 2.619 N/A VAL 661.A N ASP 631.A OD1 no hydrogen 2.753 N/A LEU 662.A N ASP 631.A OD2 no hydrogen 3.214 N/A LEU 665.A N LEU 662.A O no hydrogen 3.258 N/A ALA 666.A N PRO 663.A O no hydrogen 2.941 N/A SER 667.A N PHE 626.A O no hydrogen 2.823 N/A LEU 668.A N LEU 685.A O no hydrogen 2.651 N/A ARG 669.A N ASP 624.A O no hydrogen 2.860 N/A ILE 670.A N ARG 683.A O no hydrogen 2.981 N/A ALA 671.A N GLU 622.A O no hydrogen 2.984 N/A ALA 672.A N GLY 681.A O no hydrogen 2.791 N/A PHE 673.A N TYR 620.A O no hydrogen 2.848 N/A GLU 674.A N LYS 678.A O no hydrogen 2.867 N/A GLU 675.A N GLY 618.A O no hydrogen 2.572 N/A GLY 677.A N GLU 674.A O no hydrogen 2.989 N/A VAL 680.A N ALA 672.A O no hydrogen 3.082 N/A HIS 682.A N ARG 700.A O no hydrogen 2.806 N/A ARG 683.A N ILE 670.A O no hydrogen 2.781 N/A ARG 683.A NE CYS 698.A O no hydrogen 3.436 N/A ARG 683.A NH2 ASN 131.A OD1 no hydrogen 3.502 N/A LEU 685.A N LEU 668.A O no hydrogen 2.822 N/A VAL 687.A N ALA 666.A O no hydrogen 2.777 N/A ALA 689.A N PRO 686.A O no hydrogen 3.064 N/A ILE 690.A N PRO 686.A O no hydrogen 3.141 N/A ARG 691.A N ILE 292.A O no hydrogen 3.162 N/A ARG 691.A NH1 GLU 289.A O no hydrogen 3.282 N/A ARG 691.A NH1 GLY 291.A O no hydrogen 2.954 N/A GLY 693.A N THR 716.A O no hydrogen 2.650 N/A TYR 694.A N GLN 239.A OE1 no hydrogen 2.889 N/A TYR 694.A OH GLU 217.A OE2 no hydrogen 2.996 N/A HIS 695.A N ILE 714.A O no hydrogen 2.849 N/A HIS 695.A ND1 ASN 290.A O no hydrogen 2.979 N/A HIS 695.A NE2 SER 692.A O no hydrogen 2.703 N/A VAL 697.A N LEU 712.A O no hydrogen 2.684 N/A LEU 699.A N PRO 710.A O no hydrogen 3.450 N/A ARG 700.A N HIS 682.A O no hydrogen 2.789 N/A ARG 700.A NH1 ASN 704.A O no hydrogen 3.162 N/A ASN 701.A N GLN 705.A O no hydrogen 2.912 N/A ASN 701.A ND2 PRO 95.A O no hydrogen 3.593 N/A ASN 701.A ND2 GLN 705.A OE1 no hydrogen 3.197 N/A GLU 702.A N GLU 702.A OE1 no hydrogen 2.767 N/A ASN 704.A N ASN 701.A O no hydrogen 2.951 N/A GLN 705.A N ASN 701.A OD1 no hydrogen 2.703 N/A GLN 705.A NE2 SER 57.A O no hydrogen 3.596 N/A GLN 705.A NE2 GLY 94.A O no hydrogen 2.757 N/A LEU 707.A N LEU 699.A O no hydrogen 2.944 N/A CYS 708.A SG PHE 137.A O no hydrogen 3.101 N/A ALA 711.A N GLN 610.A O no hydrogen 3.280 N/A LEU 712.A N VAL 697.A O no hydrogen 3.087 N/A LEU 713.A N SER 608.A O no hydrogen 2.746 N/A ILE 714.A N HIS 695.A O no hydrogen 2.879 N/A TYR 715.A N LYS 605.A O no hydrogen 2.978 N/A TYR 715.A OH GLU 717.A OE2 no hydrogen 2.637 N/A THR 716.A N GLY 693.A O no hydrogen 2.932 N/A THR 716.A OG1 ARG 691.A O no hydrogen 2.718 N/A THR 716.A OG1 GLY 693.A O no hydrogen 3.319 N/A GLU 717.A N ARG 603.A O no hydrogen 3.047 N/A ALA 718.A N SER 692.A OG no hydrogen 3.005 N/A SER 719.A N ALA 601.A O no hydrogen 2.964 N/A SER 719.A OG ASP 720.A O no hydrogen 3.498 N/A TYR 721.A N ALA 599.A O no hydrogen 2.960 N/A GLN 727.A N ASP 724.A O no hydrogen 3.187 N/A GLU 731.A N GLN 727.A O no hydrogen 3.233 N/A LEU 733.A N TYR 729.A O no hydrogen 3.204 N/A ILE 734.A N ALA 730.A O no hydrogen 3.045 N/A ASN 735.A N GLU 731.A O no hydrogen 3.003 N/A VAL 740.A N PRO 736.A O no hydrogen 2.862 N/A SER 741.A N ILE 737.A O no hydrogen 2.714 N/A LEU 742.A N LYS 738.A O no hydrogen 3.155 N/A MET 743.A N HIS 739.A O no hydrogen 3.030 N/A ASP 744.A N VAL 740.A O no hydrogen 2.923 N/A GLN 745.A N SER 741.A O no hydrogen 3.073 N/A ARG 746.A N LEU 742.A O no hydrogen 3.023 N/A ALA 747.A N MET 743.A O no hydrogen 3.113 N/A ARG 748.A N ASP 744.A O no hydrogen 3.000 N/A GLN 749.A N GLN 745.A O no hydrogen 2.801 N/A LEU 750.A N ARG 746.A O no hydrogen 3.141 N/A LEU 750.A N ALA 747.A O no hydrogen 3.183 N/A ALA 751.A N ARG 748.A O no hydrogen 3.321 N/A ILE 754.A N LEU 750.A O no hydrogen 2.963 N/A GLY 755.A N ALA 751.A O no hydrogen 3.141 N/A