Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4jkt_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): PHE 6.A N GLU 2.A O no hydrogen 2.902 N/A TYR 7.A N ASP 3.A O no hydrogen 2.812 N/A THR 8.A N LEU 4.A O no hydrogen 2.856 N/A THR 8.A OG1 LEU 4.A O no hydrogen 2.396 N/A ILE 9.A N PHE 6.A O no hydrogen 3.377 N/A ILE 11.A N LEU 46.A O no hydrogen 3.030 N/A LYS 15.A N PRO 12.A O no hydrogen 2.955 N/A PHE 16.A N PRO 12.A O no hydrogen 3.438 N/A PHE 16.A N VAL 13.A O no hydrogen 3.258 N/A ILE 17.A N VAL 13.A O no hydrogen 3.036 N/A THR 18.A N HIS 14.A O no hydrogen 2.642 N/A THR 18.A OG1 HIS 14.A O no hydrogen 3.221 N/A ALA 19.A N LYS 15.A O no hydrogen 3.421 N/A LEU 20.A N PHE 16.A O no hydrogen 3.045 N/A LYS 21.A N ILE 17.A O no hydrogen 3.201 N/A THR 23.A N LEU 20.A O no hydrogen 3.141 N/A THR 23.A OG1 LEU 20.A O no hydrogen 2.284 N/A GLY 24.A N LYS 21.A O no hydrogen 3.337 N/A ARG 26.A NH1 GLU 276.A OE1 no hydrogen 3.539 N/A ARG 26.A NH2 GLU 276.A OE1 no hydrogen 2.651 N/A ASP 29.A N ARG 26.A O no hydrogen 3.176 N/A ARG 31.A N ASP 29.A OD2 no hydrogen 2.988 N/A ARG 31.A NE ASP 29.A OD2 no hydrogen 3.234 N/A ARG 31.A NH2 ASP 29.A OD1 no hydrogen 3.370 N/A ARG 31.A NH2 ASP 120.A O no hydrogen 2.824 N/A LEU 32.A N ASP 29.A O no hydrogen 2.687 N/A LYS 33.A N PRO 30.A O no hydrogen 3.277 N/A GLU 34.A N GLU 34.A OE1 no hydrogen 2.711 N/A CYS 35.A N ASN 58.A OD1 no hydrogen 2.996 N/A MET 36.A N LEU 32.A O no hydrogen 2.997 N/A ASP 37.A N LYS 33.A O no hydrogen 2.963 N/A MET 38.A N GLU 34.A O no hydrogen 2.693 N/A LEU 39.A N CYS 35.A O no hydrogen 2.676 N/A ARG 40.A N MET 36.A O no hydrogen 2.898 N/A LEU 41.A N ASP 37.A O no hydrogen 3.294 N/A THR 42.A OG1 LEU 39.A O no hydrogen 2.815 N/A LYS 48.A NZ TYR 7.A OH no hydrogen 3.385 N/A ASP 49.A N ASP 49.A OD1 no hydrogen 2.568 N/A LEU 50.A N ASP 47.A OD1 no hydrogen 2.502 N/A PHE 51.A N ASP 47.A O no hydrogen 3.314 N/A LYS 52.A N LYS 48.A O no hydrogen 2.869 N/A LYS 53.A N ASP 49.A O no hydrogen 2.624 N/A CYS 54.A N LEU 50.A O no hydrogen 3.271 N/A CYS 54.A N PHE 51.A O no hydrogen 2.872 N/A CYS 54.A SG MET 38.A O no hydrogen 3.808 N/A CYS 54.A SG LEU 50.A O no hydrogen 3.149 N/A VAL 55.A N PHE 51.A O no hydrogen 3.016 N/A ASN 58.A N VAL 55.A O no hydrogen 3.241 N/A ASN 58.A ND2 GLU 34.A OE1 no hydrogen 3.515 N/A LEU 62.A N ASN 58.A O no hydrogen 2.863 N/A THR 63.A N ILE 59.A O no hydrogen 2.790 N/A GLN 64.A N VAL 60.A O no hydrogen 2.852 N/A PHE 66.A N LEU 62.A O no hydrogen 3.399 N/A ARG 67.A N THR 63.A O no hydrogen 3.074 N/A ARG 68.A N ALA 65.A O no hydrogen 3.366 N/A LYS 69.A N GLN 64.A O no hydrogen 3.350 N/A VAL 71.A N ASP 120.A OD2 no hydrogen 3.029 N/A SER 77.A OG ASP 74.A OD1 no hydrogen 3.416 N/A SER 77.A OG ASP 74.A OD2 no hydrogen 2.585 N/A THR 79.A N PHE 75.A O no hydrogen 3.374 N/A THR 79.A OG1 MET 76.A O no hydrogen 3.091 N/A SER 80.A N SER 77.A O no hydrogen 3.093 N/A SER 80.A OG MET 76.A O no hydrogen 3.328 N/A HIS 81.A N SER 77.A O no hydrogen 3.265 N/A ILE 82.A N PHE 78.A O no hydrogen 3.133 N/A ASP 83.A N THR 79.A O no hydrogen 2.989 N/A GLU 84.A N SER 80.A O no hydrogen 3.032 N/A LEU 85.A N HIS 81.A O no hydrogen 2.874 N/A TYR 86.A N ILE 82.A O no hydrogen 2.902 N/A TYR 86.A OH TRP 112.A O no hydrogen 2.686 N/A GLU 87.A N ASP 83.A O no hydrogen 2.914 N/A SER 88.A N GLU 84.A O no hydrogen 3.335 N/A ALA 89.A N LEU 85.A O no hydrogen 3.150 N/A LYS 90.A N TYR 86.A O no hydrogen 2.933 N/A LYS 91.A N SER 88.A O no hydrogen 3.341 N/A GLN 92.A N ALA 89.A O no hydrogen 2.875 N/A LYS 96.A N LEU 356.A O no hydrogen 3.012 N/A LYS 96.A NZ ASP 99.A OD2 no hydrogen 3.152 N/A TYR 100.A OH GLU 232.A OE2 no hydrogen 2.226 N/A ALA 105.A N ILE 101.A O no hydrogen 3.031 N/A LYS 106.A N PRO 102.A O no hydrogen 2.548 N/A LEU 111.A N SER 108.A O no hydrogen 3.312 N/A TRP 112.A N ASP 128.A OD2 no hydrogen 3.421 N/A TRP 112.A NE1 TYR 86.A O no hydrogen 3.277 N/A GLY 113.A N TRP 352.A O no hydrogen 3.150 N/A VAL 114.A N ILE 126.A O no hydrogen 2.917 N/A SER 115.A N MET 350.A O no hydrogen 3.318 N/A SER 115.A OG SER 125.A OG no hydrogen 3.118 N/A VAL 116.A N HIS 124.A O no hydrogen 3.084 N/A CYS 117.A N GLY 348.A O no hydrogen 2.942 N/A CYS 117.A SG THR 118.A O no hydrogen 3.461 N/A THR 118.A N GLN 122.A O no hydrogen 2.956 N/A THR 118.A OG1 GLN 122.A OE1 no hydrogen 2.547 N/A VAL 119.A N VAL 346.A O no hydrogen 3.030 N/A ASP 120.A N THR 118.A OG1 no hydrogen 3.106 N/A GLY 121.A N THR 118.A O no hydrogen 3.169 N/A GLN 122.A N THR 118.A OG1 no hydrogen 3.025 N/A GLN 122.A NE2 ILE 72.A O no hydrogen 3.002 N/A ARG 123.A N GLY 24.A O no hydrogen 2.634 N/A ARG 123.A NH2 GLU 220.A OE1 no hydrogen 2.853 N/A HIS 124.A N VAL 116.A O no hydrogen 3.241 N/A HIS 124.A NE2 ASP 83.A OD1 no hydrogen 2.918 N/A SER 125.A OG SER 115.A OG no hydrogen 3.118 N/A ILE 126.A N VAL 114.A O no hydrogen 3.113 N/A ASP 128.A N TRP 112.A O no hydrogen 3.212 N/A THR 129.A N GLY 127.A O no hydrogen 2.882 N/A THR 129.A OG1 SER 125.A OG no hydrogen 2.527 N/A THR 129.A OG1 GLU 276.A OE2 no hydrogen 3.494 N/A LYS 130.A NZ GLU 276.A OE2 no hydrogen 3.311 N/A PHE 133.A N VAL 273.A O no hydrogen 2.732 N/A CYS 134.A SG THR 228.A OG1 no hydrogen 3.666 N/A CYS 134.A SG SER 270.A O no hydrogen 3.770 N/A LEU 135.A N ILE 271.A O no hydrogen 2.956 N/A GLN 136.A N CYS 269.A O no hydrogen 2.914 N/A CYS 138.A N LEU 135.A O no hydrogen 2.789 N/A CYS 138.A SG LEU 135.A O no hydrogen 3.480 N/A CYS 138.A SG LYS 332.A O no hydrogen 3.614 N/A CYS 138.A SG GLY 338.A O no hydrogen 3.347 N/A LYS 140.A NZ SER 137.A OG no hydrogen 3.213 N/A LYS 143.A N VAL 139.A O no hydrogen 3.164 N/A LYS 143.A NZ THR 193.A OG1 no hydrogen 2.817 N/A TYR 144.A N LYS 140.A O no hydrogen 3.244 N/A TYR 144.A OH HIS 157.A NE2 no hydrogen 2.472 N/A ALA 145.A N PRO 141.A O no hydrogen 2.804 N/A ILE 146.A N LEU 142.A O no hydrogen 2.818 N/A ALA 147.A N LYS 143.A O no hydrogen 2.725 N/A VAL 148.A N TYR 144.A O no hydrogen 2.958 N/A ASN 149.A N ALA 145.A O no hydrogen 2.916 N/A ASN 149.A ND2 ASP 150.A OD1 no hydrogen 3.567 N/A ASP 150.A N ILE 146.A O no hydrogen 3.108 N/A LEU 151.A N ALA 147.A O no hydrogen 2.874 N/A GLY 152.A N VAL 148.A O no hydrogen 2.682 N/A VAL 156.A N GLY 152.A O no hydrogen 3.339 N/A HIS 157.A N THR 153.A O no hydrogen 3.273 N/A HIS 157.A ND1 VAL 160.A O no hydrogen 2.732 N/A HIS 157.A NE2 TYR 144.A OH no hydrogen 2.472 N/A ARG 158.A N TYR 155.A O no hydrogen 3.050 N/A GLY 161.A N PRO 180.A O no hydrogen 2.967 N/A ASN 170.A ND2 SER 165.A OG no hydrogen 2.104 N/A ASN 175.A N LYS 179.A O no hydrogen 2.858 N/A ASP 177.A N ASN 175.A OD1 no hydrogen 2.868 N/A ASP 178.A N ASN 175.A O no hydrogen 3.243 N/A LYS 179.A N ASN 175.A OD1 no hydrogen 3.068 N/A HIS 181.A NE2 LEU 172.A O no hydrogen 3.137 N/A ASN 182.A ND2 GLU 163.A O no hydrogen 3.296 N/A MET 184.A N ASN 182.A OD1 no hydrogen 3.059 N/A VAL 185.A N ASN 182.A O no hydrogen 3.500 N/A ALA 189.A N VAL 185.A O no hydrogen 2.765 N/A ILE 190.A N ASN 186.A O no hydrogen 3.103 N/A VAL 192.A N GLY 188.A O no hydrogen 3.005 N/A THR 193.A N ALA 189.A O no hydrogen 2.628 N/A THR 193.A OG1 ALA 189.A O no hydrogen 2.641 N/A SER 194.A N ILE 190.A O no hydrogen 3.056 N/A SER 194.A OG VAL 191.A O no hydrogen 2.946 N/A LEU 195.A N VAL 192.A O no hydrogen 3.155 N/A ILE 196.A N THR 193.A O no hydrogen 3.351 N/A GLN 198.A NE2 TYR 155.A OH no hydrogen 2.206 N/A ASN 202.A ND2 GLY 260.A O no hydrogen 3.292 N/A LYS 205.A N ASN 201.A O no hydrogen 2.621 N/A PHE 206.A N ASN 202.A O no hydrogen 2.934 N/A ASP 207.A N ALA 203.A O no hydrogen 3.141 N/A TYR 208.A N GLU 204.A O no hydrogen 2.872 N/A TYR 208.A OH ASP 150.A OD2 no hydrogen 2.452 N/A VAL 209.A N LYS 205.A O no hydrogen 3.294 N/A MET 210.A N PHE 206.A O no hydrogen 3.335 N/A GLN 211.A N ASP 207.A O no hydrogen 3.215 N/A PHE 212.A N TYR 208.A O no hydrogen 3.257 N/A LEU 213.A N VAL 209.A O no hydrogen 2.801 N/A ASN 214.A N MET 210.A O no hydrogen 2.811 N/A LYS 215.A N GLN 211.A O no hydrogen 2.907 N/A MET 216.A N PHE 212.A O no hydrogen 3.074 N/A ALA 217.A N ASN 214.A O no hydrogen 3.227 N/A GLY 218.A N LYS 215.A O no hydrogen 3.408 N/A ASN 219.A N ASN 214.A O no hydrogen 3.061 N/A GLU 220.A N ALA 217.A O no hydrogen 3.096 N/A GLY 223.A N GLU 272.A O no hydrogen 2.771 N/A SER 225.A N SER 270.A O no hydrogen 3.151 N/A PHE 229.A N SER 225.A O no hydrogen 3.204 N/A GLN 230.A N ASN 226.A O no hydrogen 3.013 N/A SER 231.A OG THR 228.A O no hydrogen 2.996 N/A GLU 232.A N THR 228.A O no hydrogen 3.042 N/A ARG 233.A N PHE 229.A O no hydrogen 3.068 N/A GLU 234.A N GLN 230.A O no hydrogen 2.870 N/A SER 235.A N SER 231.A O no hydrogen 2.714 N/A SER 235.A OG SER 235.A O no hydrogen 2.315 N/A ASN 239.A N GLY 236.A O no hydrogen 2.870 N/A PHE 240.A N GLY 236.A O no hydrogen 3.176 N/A ALA 241.A N ASP 237.A O no hydrogen 2.939 N/A ILE 242.A N ARG 238.A O no hydrogen 3.102 N/A GLY 243.A N ASN 239.A O no hydrogen 3.021 N/A TYR 244.A N PHE 240.A O no hydrogen 2.970 N/A TYR 245.A N ALA 241.A O no hydrogen 3.008 N/A LEU 246.A N ILE 242.A O no hydrogen 2.759 N/A LYS 247.A N GLY 243.A O no hydrogen 3.116 N/A GLU 248.A N TYR 244.A O no hydrogen 3.129 N/A LYS 249.A N TYR 245.A O no hydrogen 3.298 N/A LYS 250.A N LYS 247.A O no hydrogen 3.290 N/A CYS 251.A N LEU 246.A O no hydrogen 2.850 N/A CYS 251.A SG ASP 178.A O no hydrogen 3.530 N/A CYS 251.A SG LEU 246.A O no hydrogen 3.352 N/A THR 256.A OG1 PRO 253.A O no hydrogen 2.488 N/A ILE 261.A N ASP 257.A O no hydrogen 2.813 N/A LEU 262.A N MET 258.A O no hydrogen 3.210 N/A ASP 263.A N VAL 259.A O no hydrogen 3.343 N/A PHE 264.A N GLY 260.A O no hydrogen 3.300 N/A TYR 265.A N ILE 261.A O no hydrogen 2.644 N/A PHE 266.A N LEU 262.A O no hydrogen 2.744 N/A GLN 267.A N ASP 263.A O no hydrogen 2.995 N/A GLN 267.A NE2 ASP 263.A O no hydrogen 2.805 N/A LEU 268.A N PHE 264.A O no hydrogen 2.924 N/A CYS 269.A N TYR 265.A O no hydrogen 3.199 N/A CYS 269.A SG GLN 136.A O no hydrogen 3.229 N/A CYS 269.A SG TYR 265.A O no hydrogen 3.251 N/A SER 270.A N GLN 267.A O no hydrogen 3.007 N/A SER 270.A OG PHE 266.A O no hydrogen 2.530 N/A GLU 272.A N GLY 223.A O no hydrogen 2.695 N/A VAL 273.A N PHE 133.A O no hydrogen 2.846 N/A THR 274.A N SER 277.A OG no hydrogen 3.080 N/A CYS 275.A SG GLY 113.A O no hydrogen 3.477 N/A CYS 275.A SG MET 350.A O no hydrogen 3.975 N/A GLU 276.A N THR 274.A OG1 no hydrogen 3.314 N/A SER 277.A OG TYR 221.A O no hydrogen 2.612 N/A SER 277.A OG THR 274.A O no hydrogen 3.466 N/A ALA 278.A N THR 274.A O no hydrogen 3.173 N/A SER 279.A N GLU 276.A O no hydrogen 3.016 N/A SER 279.A OG GLU 276.A O no hydrogen 2.638 N/A VAL 280.A N GLU 276.A O no hydrogen 3.421 N/A ALA 282.A N ALA 278.A O no hydrogen 3.019 N/A ALA 283.A N SER 279.A O no hydrogen 3.238 N/A THR 284.A N VAL 280.A O no hydrogen 2.882 N/A THR 284.A OG1 MET 216.A O no hydrogen 2.900 N/A THR 284.A OG1 VAL 280.A O no hydrogen 3.134 N/A ALA 286.A N ALA 283.A O no hydrogen 3.075 N/A ASN 287.A N THR 284.A O no hydrogen 3.190 N/A ASN 287.A ND2 ASN 287.A O no hydrogen 2.531 N/A GLY 289.A N THR 284.A O no hydrogen 3.235 N/A PHE 290.A N ASN 287.A O no hydrogen 3.342 N/A CYS 291.A SG LYS 215.A O no hydrogen 3.799 N/A CYS 291.A SG THR 294.A OG1 no hydrogen 3.145 N/A THR 294.A N CYS 291.A O no hydrogen 3.197 N/A THR 294.A OG1 CYS 291.A O no hydrogen 3.430 N/A THR 294.A OG1 GLU 296.A OE2 no hydrogen 3.533 N/A GLY 295.A N CYS 291.A O no hydrogen 2.804 N/A VAL 298.A N GLY 289.A O no hydrogen 2.735 N/A SER 300.A N ASN 149.A OD1 no hydrogen 2.513 N/A SER 300.A OG ASN 149.A OD1 no hydrogen 3.233 N/A VAL 304.A N SER 300.A O no hydrogen 3.122 N/A ARG 305.A N PRO 301.A O no hydrogen 3.071 N/A ASN 306.A N GLU 302.A O no hydrogen 3.220 N/A THR 307.A N ALA 303.A O no hydrogen 3.057 N/A THR 307.A OG1 ALA 303.A O no hydrogen 2.429 N/A LEU 308.A N VAL 304.A O no hydrogen 3.074 N/A SER 309.A N ARG 305.A O no hydrogen 3.191 N/A SER 309.A OG ARG 305.A O no hydrogen 2.592 N/A LEU 310.A N ASN 306.A O no hydrogen 3.151 N/A MET 311.A N THR 307.A O no hydrogen 3.205 N/A HIS 312.A N LEU 308.A O no hydrogen 3.135 N/A SER 313.A OG SER 309.A O no hydrogen 2.881 N/A CYS 314.A N LEU 310.A O no hydrogen 2.709 N/A CYS 314.A SG SER 313.A OG no hydrogen 3.458 N/A GLY 315.A N MET 311.A O no hydrogen 3.172 N/A MET 316.A N SER 320.A OG no hydrogen 2.845 N/A PHE 319.A N MET 316.A O no hydrogen 3.089 N/A SER 320.A N TYR 317.A O no hydrogen 3.208 N/A SER 320.A OG TYR 317.A O no hydrogen 2.358 N/A PHE 323.A N PHE 319.A O no hydrogen 3.002 N/A ALA 324.A N SER 320.A O no hydrogen 3.089 N/A PHE 325.A N GLY 321.A O no hydrogen 3.259 N/A HIS 326.A N GLN 322.A O no hydrogen 3.226 N/A VAL 327.A N PHE 323.A O no hydrogen 2.763 N/A GLY 328.A N PHE 323.A O no hydrogen 2.927 N/A LYS 332.A NZ MET 184.A O no hydrogen 3.535 N/A LYS 332.A NZ GLY 315.A O no hydrogen 3.096 N/A SER 333.A OG ASN 361.A OD1 no hydrogen 2.749 N/A GLY 334.A N GLY 338.A O no hydrogen 3.118 N/A GLY 337.A N GLY 334.A O no hydrogen 3.084 N/A ILE 339.A N CYS 351.A O no hydrogen 2.917 N/A LEU 340.A N LYS 332.A O no hydrogen 2.886 N/A LEU 341.A N MET 349.A O no hydrogen 3.216 N/A VAL 342.A N PRO 330.A O no hydrogen 3.024 N/A VAL 343.A N MET 347.A O no hydrogen 2.847 N/A ASN 345.A N ALA 286.A O no hydrogen 3.257 N/A VAL 346.A N VAL 343.A O no hydrogen 3.039 N/A MET 347.A N VAL 343.A O no hydrogen 2.836 N/A GLY 348.A N CYS 117.A O no hydrogen 2.962 N/A MET 349.A N LEU 341.A O no hydrogen 2.906 N/A MET 350.A N SER 115.A O no hydrogen 3.211 N/A CYS 351.A N ILE 339.A O no hydrogen 3.370 N/A TRP 352.A N GLY 113.A O no hydrogen 2.860 N/A TRP 352.A NE1 ALA 336.A O no hydrogen 3.079 N/A SER 353.A N GLY 337.A O no hydrogen 3.014 N/A SER 353.A OG LEU 111.A O no hydrogen 3.436 N/A LEU 356.A N LYS 96.A O no hydrogen 3.007 N/A ASP 357.A N ASN 361.A O no hydrogen 2.677 N/A GLY 360.A N ASP 357.A O no hydrogen 2.876 N/A ASN 361.A N ASP 357.A OD1 no hydrogen 2.492 N/A ASN 361.A ND2 MET 316.A O no hydrogen 3.539 N/A SER 362.A OG GLY 337.A O no hydrogen 3.476 N/A SER 362.A OG SER 353.A O no hydrogen 3.210 N/A VAL 363.A N PRO 355.A O no hydrogen 3.264 N/A GLY 365.A N SER 362.A OG no hydrogen 3.307 N/A ILE 366.A N SER 362.A O no hydrogen 3.119 N/A HIS 367.A N VAL 363.A O no hydrogen 3.356 N/A PHE 368.A N LYS 364.A O no hydrogen 2.989 N/A CYS 369.A N GLY 365.A O no hydrogen 2.879 N/A CYS 369.A SG GLY 365.A O no hydrogen 3.204 N/A HIS 370.A N ILE 366.A O no hydrogen 2.996 N/A HIS 370.A ND1 ILE 366.A O no hydrogen 2.946 N/A ASP 371.A N HIS 367.A O no hydrogen 3.118 N/A LEU 372.A N PHE 368.A O no hydrogen 2.970 N/A VAL 373.A N HIS 370.A O no hydrogen 3.003 N/A SER 374.A N HIS 370.A O no hydrogen 3.133 N/A SER 374.A OG HIS 370.A O no hydrogen 3.035 N/A LEU 375.A N ASP 371.A O no hydrogen 3.240 N/A CYS 376.A N LEU 372.A O no hydrogen 3.140 N/A ASN 377.A N LEU 391.A O no hydrogen 3.130 N/A ASN 377.A ND2 ASP 392.A OD2 no hydrogen 3.465 N/A PHE 378.A N CYS 376.A O no hydrogen 2.878 N/A HIS 379.A NE2 PHE 325.A O no hydrogen 3.131 N/A ASN 380.A N GLY 328.A O no hydrogen 2.893 N/A TYR 381.A N HIS 379.A ND1 no hydrogen 3.018 N/A ASP 382.A N HIS 379.A O no hydrogen 3.055 N/A ARG 385.A N ASN 383.A OD1 no hydrogen 2.808 N/A HIS 386.A N ASN 383.A OD1 no hydrogen 2.672 N/A LYS 390.A NZ VAL 373.A O no hydrogen 2.915 N/A LYS 390.A NZ ASP 382.A OD2 no hydrogen 3.317 N/A LEU 391.A N LEU 375.A O no hydrogen 2.798 N/A ARG 394.A N ASP 392.A OD1 no hydrogen 3.142 N/A ARG 394.A NH1 ASN 377.A OD1 no hydrogen 3.386 N/A ARG 394.A NH1 ASP 392.A OD1 no hydrogen 2.389 N/A ARG 394.A NH2 ASN 377.A O no hydrogen 2.658 N/A ARG 395.A N ASP 392.A O no hydrogen 2.987 N/A