Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3w9t_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LEU 7.A N ILE 47.A O no hydrogen 2.802 N/A ASP 8.A N ILE 47.A O no hydrogen 3.191 N/A GLY 10.A N ILE 45.A O no hydrogen 3.008 N/A ARG 13.A N TYR 144.A O no hydrogen 3.044 N/A ARG 13.A NE GLU 11.A OE1 no hydrogen 3.189 N/A ARG 13.A NH1 LYS 18.A O no hydrogen 3.360 N/A ARG 13.A NH1 CYS 223.A O no hydrogen 3.231 N/A ARG 13.A NH2 GLU 11.A OE1 no hydrogen 2.678 N/A ARG 13.A NH2 CYS 223.A O no hydrogen 2.787 N/A SER 14.A N GLN 19.A O no hydrogen 2.995 N/A PHE 15.A N TYR 142.A O no hydrogen 3.090 N/A SER 17.A OG ASP 125.A OD2 no hydrogen 3.120 N/A LYS 18.A N SER 14.A O no hydrogen 2.801 N/A LYS 18.A NZ ASP 225.A OD1 no hydrogen 2.738 N/A CYS 20.A N TYR 35.A O no hydrogen 3.253 N/A CYS 20.A SG GLN 43.A OE1 no hydrogen 3.858 N/A VAL 21.A N LEU 12.A O no hydrogen 2.799 N/A ASP 22.A N ALA 33.A O no hydrogen 2.802 N/A VAL 24.A N ASN 31.A O no hydrogen 3.140 N/A GLY 30.A N SER 74.A O no hydrogen 3.228 N/A ASN 31.A ND2 ASN 71.A OD1 no hydrogen 2.946 N/A ILE 32.A N VAL 72.A O no hydrogen 3.182 N/A ALA 33.A N ASP 22.A O no hydrogen 2.812 N/A THR 34.A N GLY 128.A O no hydrogen 3.195 N/A TYR 35.A N CYS 20.A O no hydrogen 2.932 N/A ASP 38.A N GLN 43.A OE1 no hydrogen 2.863 N/A LEU 40.A N ASP 38.A OD1 no hydrogen 3.237 N/A GLN 43.A N LEU 40.A O no hydrogen 2.874 N/A GLN 43.A NE2 ASP 22.A OD1 no hydrogen 3.066 N/A GLN 43.A NE2 ASP 36.A O no hydrogen 3.164 N/A GLN 44.A N SER 41.A O no hydrogen 3.174 N/A ILE 45.A N GLY 10.A O no hydrogen 2.647 N/A ILE 46.A N ARG 54.A O no hydrogen 2.618 N/A ILE 47.A N ASP 8.A O no hydrogen 2.799 N/A CYS 48.A N THR 52.A O no hydrogen 3.038 N/A CYS 48.A SG ASP 50.A OD1 no hydrogen 3.416 N/A CYS 48.A SG ASP 50.A OD2 no hydrogen 3.400 N/A GLY 49.A N ASN 5.A O no hydrogen 2.797 N/A GLY 51.A N CYS 48.A O no hydrogen 2.799 N/A THR 52.A N ASP 50.A OD1 no hydrogen 3.025 N/A THR 52.A OG1 ASP 50.A OD1 no hydrogen 2.472 N/A ARG 54.A N ILE 46.A O no hydrogen 2.801 N/A ARG 54.A NE THR 52.A OG1 no hydrogen 2.997 N/A ARG 54.A NH1 VAL 1.A O no hydrogen 2.777 N/A ARG 54.A NH1 ASN 59.A OD1 no hydrogen 2.993 N/A ASN 55.A ND2 GLY 28.A O no hydrogen 3.484 N/A GLU 56.A N GLN 44.A O no hydrogen 2.813 N/A ALA 57.A N ASN 55.A OD1 no hydrogen 3.083 N/A ARG 58.A N ASN 55.A O no hydrogen 3.430 N/A ARG 58.A N ASN 55.A OD1 no hydrogen 3.196 N/A ARG 58.A NH1 GLN 27.A O no hydrogen 3.001 N/A ASN 59.A ND2 VAL 1.A O no hydrogen 2.990 N/A TYR 60.A N ARG 58.A O no hydrogen 2.679 N/A CYS 61.A N SER 75.A O no hydrogen 2.802 N/A PHE 62.A N ILE 53.A O no hydrogen 2.801 N/A THR 63.A N MET 73.A O no hydrogen 2.800 N/A THR 63.A OG1 CYS 61.A O no hydrogen 2.761 N/A THR 63.A OG1 SER 75.A OG no hydrogen 3.294 N/A ASP 65.A N ASN 71.A O no hydrogen 2.593 N/A VAL 72.A N ILE 130.A O no hydrogen 2.797 N/A MET 73.A N THR 63.A O no hydrogen 2.801 N/A SER 74.A N GLY 30.A O no hydrogen 2.799 N/A SER 74.A OG GLY 28.A O no hydrogen 2.872 N/A SER 75.A N CYS 61.A O no hydrogen 3.121 N/A SER 75.A OG THR 63.A OG1 no hydrogen 3.294 N/A CYS 77.A SG ASN 59.A O no hydrogen 3.819 N/A THR 78.A N GLN 87.A OE1 no hydrogen 3.023 N/A GLN 87.A N PRO 84.A O no hydrogen 3.430 N/A GLN 87.A NE2 THR 63.A OG1 no hydrogen 3.137 N/A GLN 87.A NE2 PRO 76.A O no hydrogen 3.022 N/A ARG 88.A N SER 85.A O no hydrogen 3.066 N/A ARG 88.A NE ASP 50.A O no hydrogen 2.727 N/A ARG 88.A NH2 ASP 50.A O no hydrogen 3.204 N/A TRP 89.A N GLY 51.A O no hydrogen 2.798 N/A TRP 89.A NE1 PHE 62.A O no hydrogen 3.267 N/A ARG 90.A N ILE 111.A O no hydrogen 2.800 N/A ARG 90.A NH1 GLN 91.A O no hydrogen 3.111 N/A GLY 92.A N GLU 109.A O no hydrogen 2.967 N/A ARG 93.A N GLU 109.A OE1 no hydrogen 3.169 N/A ARG 93.A NE GLU 109.A OE1 no hydrogen 2.849 N/A ARG 93.A NH2 GLU 109.A OE1 no hydrogen 2.880 N/A ARG 93.A NH2 GLU 109.A OE2 no hydrogen 3.182 N/A PHE 97.A N GLN 105.A O no hydrogen 3.057 N/A ASP 99.A N ILE 103.A O no hydrogen 3.163 N/A ASN 100.A ND2 ASP 225.A O no hydrogen 2.614 N/A GLY 101.A N ASP 99.A OD1 no hydrogen 2.979 N/A GLY 102.A N ASP 99.A O no hydrogen 2.914 N/A ILE 103.A N ASP 99.A OD1 no hydrogen 3.237 N/A GLN 105.A N PHE 97.A O no hydrogen 2.800 N/A GLN 105.A NE2 ASP 99.A OD2 no hydrogen 2.798 N/A GLN 105.A NE2 SER 147.A O no hydrogen 2.712 N/A THR 108.A N PHE 143.A O no hydrogen 2.434 N/A THR 108.A OG1 GLU 109.A O no hydrogen 2.864 N/A GLU 109.A N ARG 93.A O no hydrogen 3.113 N/A ILE 111.A N ARG 90.A O no hydrogen 2.796 N/A ASN 112.A N LYS 117.A O no hydrogen 2.798 N/A ASN 112.A ND2 SER 86.A O no hydrogen 2.900 N/A LEU 113.A N ARG 88.A O no hydrogen 3.001 N/A ALA 114.A N ASN 112.A OD1 no hydrogen 2.667 N/A SER 115.A N ASN 112.A OD1 no hydrogen 3.155 N/A LYS 117.A NZ ASN 69.A OD1 no hydrogen 2.795 N/A LYS 117.A NZ ASP 134.A OD2 no hydrogen 3.519 N/A CYS 118.A N TYR 133.A O no hydrogen 2.371 N/A CYS 118.A SG GLU 109.A OE2 no hydrogen 3.497 N/A CYS 118.A SG GLN 141.A OE1 no hydrogen 3.742 N/A LEU 119.A N ILE 110.A O no hydrogen 2.797 N/A GLU 122.A N ASP 129.A O no hydrogen 3.194 N/A GLY 126.A N GLU 122.A O no hydrogen 3.303 N/A GLY 128.A N THR 34.A OG1 no hydrogen 3.273 N/A ILE 130.A N ILE 32.A O no hydrogen 3.345 N/A GLY 131.A N ASP 120.A O no hydrogen 2.800 N/A VAL 132.A N ALA 70.A O no hydrogen 3.349 N/A GLN 136.A N GLN 141.A OE1 no hydrogen 2.957 N/A LEU 138.A N GLN 136.A OE1 no hydrogen 3.337 N/A GLN 141.A N LEU 138.A O no hydrogen 3.119 N/A GLN 141.A NE2 ASP 134.A O no hydrogen 2.960 N/A PHE 143.A N THR 108.A O no hydrogen 2.597 N/A TYR 144.A N ARG 13.A O no hydrogen 3.201 N/A ARG 146.A N GLU 11.A O no hydrogen 3.091 N/A ARG 146.A NH1 ASP 99.A OD2 no hydrogen 3.531 N/A ARG 146.A NH2 GLU 197.A OE2 no hydrogen 2.586 N/A SER 147.A N GLN 105.A OE1 no hydrogen 2.691 N/A ARG 148.A NE GLU 197.A OE1 no hydrogen 2.649 N/A GLY 149.A N SER 147.A OG no hydrogen 3.235 N/A LEU 152.A N TYR 192.A O no hydrogen 2.797 N/A PHE 153.A N TYR 192.A O no hydrogen 3.406 N/A GLY 155.A N PHE 190.A O no hydrogen 3.037 N/A ARG 156.A N VAL 281.A O no hydrogen 3.111 N/A ARG 156.A NH1 ASP 283.A O no hydrogen 3.314 N/A ARG 156.A NH1 TRP 285.A O no hydrogen 3.177 N/A ARG 156.A NH2 GLU 183.A O no hydrogen 3.007 N/A ARG 156.A NH2 TRP 285.A O no hydrogen 3.057 N/A ARG 158.A N LYS 279.A O no hydrogen 2.927 N/A ARG 158.A NH2 ASP 283.A OD2 no hydrogen 3.104 N/A ASN 159.A N LEU 164.A O no hydrogen 2.797 N/A ASN 159.A ND2 ASP 275.A O no hydrogen 3.120 N/A GLU 160.A N ARG 277.A O no hydrogen 2.880 N/A LYS 161.A N ASN 159.A OD1 no hydrogen 2.843 N/A SER 162.A N ASN 159.A OD1 no hydrogen 3.341 N/A SER 162.A OG GLY 261.A O no hydrogen 2.675 N/A ASP 163.A N ASN 159.A O no hydrogen 2.801 N/A LEU 164.A N SER 162.A OG no hydrogen 3.184 N/A CYS 165.A N TYR 180.A O no hydrogen 2.800 N/A LEU 166.A N LEU 157.A O no hydrogen 2.801 N/A ASP 167.A N LEU 178.A O no hydrogen 2.803 N/A GLU 169.A N ASN 176.A O no hydrogen 3.155 N/A LYS 174.A N ASP 172.A OD1 no hydrogen 2.991 N/A ASN 176.A ND2 ASP 264.A OD1 no hydrogen 3.170 N/A VAL 177.A N VAL 218.A O no hydrogen 3.070 N/A LEU 178.A N ASP 167.A O no hydrogen 2.798 N/A MET 179.A N GLY 263.A O no hydrogen 3.169 N/A TYR 180.A N CYS 165.A O no hydrogen 3.222 N/A CYS 182.A SG ASP 163.A O no hydrogen 3.838 N/A GLU 183.A N GLN 188.A OE1 no hydrogen 3.198 N/A ASP 184.A N GLU 286.A OE1 no hydrogen 3.002 N/A GLN 188.A N ASN 185.A O no hydrogen 3.337 N/A GLN 188.A NE2 ASP 167.A OD1 no hydrogen 2.982 N/A GLN 188.A NE2 SER 181.A O no hydrogen 3.308 N/A TRP 189.A N LEU 186.A O no hydrogen 3.386 N/A PHE 190.A N GLY 155.A O no hydrogen 2.796 N/A ARG 191.A N VAL 199.A O no hydrogen 2.800 N/A ARG 191.A NE GLU 151.A OE2 no hydrogen 3.422 N/A TYR 192.A N PHE 153.A O no hydrogen 2.913 N/A TYR 192.A OH TRP 231.A O no hydrogen 2.579 N/A TYR 193.A N GLU 197.A O no hydrogen 2.998 N/A GLU 194.A N PRO 150.A O no hydrogen 2.602 N/A ASN 195.A N ARG 148.A O no hydrogen 2.925 N/A ASN 195.A ND2 GLU 197.A OE1 no hydrogen 3.020 N/A GLY 196.A N TYR 193.A O no hydrogen 2.802 N/A GLU 197.A N ASN 195.A OD1 no hydrogen 2.956 N/A VAL 199.A N ARG 191.A O no hydrogen 2.802 N/A ASN 200.A N MET 205.A O no hydrogen 2.802 N/A ASN 200.A ND2 ASP 187.A O no hydrogen 2.987 N/A ALA 201.A N TRP 189.A O no hydrogen 2.800 N/A LYS 202.A N ASN 200.A OD1 no hydrogen 2.872 N/A SER 203.A N ASN 200.A OD1 no hydrogen 3.070 N/A SER 203.A OG GLY 173.A O no hydrogen 2.865 N/A SER 203.A OG ASN 200.A OD1 no hydrogen 3.496 N/A GLY 204.A N ASN 200.A O no hydrogen 2.798 N/A MET 205.A N SER 203.A OG no hydrogen 3.372 N/A CYS 206.A N TYR 221.A O no hydrogen 2.944 N/A LEU 207.A N ILE 198.A O no hydrogen 2.800 N/A ASP 208.A N GLY 219.A O no hydrogen 2.802 N/A GLU 210.A N ASN 217.A O no hydrogen 2.880 N/A ASP 213.A N ASP 213.A OD1 no hydrogen 2.494 N/A GLY 216.A N THR 267.A OG1 no hydrogen 3.113 N/A ASN 217.A ND2 ASN 176.A OD1 no hydrogen 2.744 N/A VAL 218.A N VAL 265.A O no hydrogen 2.972 N/A GLY 219.A N ASP 208.A O no hydrogen 2.803 N/A ILE 220.A N GLY 175.A O no hydrogen 2.803 N/A TYR 221.A N CYS 206.A O no hydrogen 3.033 N/A ASP 224.A N GLN 229.A OE1 no hydrogen 3.089 N/A GLN 229.A N LEU 226.A O no hydrogen 3.260 N/A GLN 229.A NE2 ASP 208.A OD1 no hydrogen 3.235 N/A GLN 229.A NE2 ARG 222.A O no hydrogen 2.791 N/A MET 230.A N ARG 227.A O no hydrogen 3.240 N/A TRP 231.A N GLY 196.A O no hydrogen 2.801 N/A TRP 231.A NE1 LEU 207.A O no hydrogen 3.185 N/A SER 232.A N LEU 246.A O no hydrogen 2.799 N/A SER 232.A OG LEU 246.A O no hydrogen 3.372 N/A TYR 237.A N PRO 234.A O no hydrogen 3.064 N/A CYS 238.A N ASN 235.A O no hydrogen 3.343 N/A CYS 238.A SG PRO 234.A O no hydrogen 3.636 N/A ASN 239.A N TYR 242.A O no hydrogen 2.800 N/A ASN 239.A ND2 GLU 160.A OE1 no hydrogen 3.356 N/A ASN 239.A ND2 GLU 160.A OE2 no hydrogen 3.458 N/A TYR 242.A N ASN 239.A O no hydrogen 3.263 N/A CYS 243.A N PHE 278.A O no hydrogen 2.801 N/A SER 244.A OG GLN 276.A O no hydrogen 2.954 N/A LEU 246.A N SER 232.A O no hydrogen 2.800 N/A ASN 247.A N LYS 252.A O no hydrogen 2.799 N/A ASN 247.A ND2 ASP 228.A O no hydrogen 2.859 N/A LYS 248.A N MET 230.A O no hydrogen 2.802 N/A GLU 249.A N ASN 247.A OD1 no hydrogen 2.975 N/A SER 250.A OG GLY 214.A O no hydrogen 2.766 N/A SER 250.A OG ASN 247.A OD1 no hydrogen 3.409 N/A LYS 252.A N SER 250.A OG no hydrogen 3.390 N/A LYS 252.A NZ SER 215.A OG no hydrogen 2.918 N/A CYS 253.A N TRP 268.A O no hydrogen 2.802 N/A LEU 254.A N PHE 245.A O no hydrogen 2.799 N/A ASP 255.A N GLY 266.A O no hydrogen 2.800 N/A SER 257.A N ASP 264.A O no hydrogen 3.085 N/A GLN 260.A NE2 ASP 259.A OD1 no hydrogen 3.404 N/A ASP 264.A N SER 257.A OG no hydrogen 3.347 N/A VAL 265.A N VAL 177.A O no hydrogen 3.346 N/A VAL 265.A N ASP 264.A OD1 no hydrogen 2.679 N/A GLY 266.A N ASP 255.A O no hydrogen 2.988 N/A THR 267.A N GLY 216.A O no hydrogen 3.009 N/A THR 267.A OG1 GLY 214.A O no hydrogen 3.032 N/A THR 267.A OG1 GLY 216.A O no hydrogen 3.434 N/A TRP 268.A N CYS 253.A O no hydrogen 2.947 N/A ASP 271.A N GLN 276.A OE1 no hydrogen 3.206 N/A LEU 273.A N ASP 271.A OD1 no hydrogen 3.132 N/A GLN 276.A N LEU 273.A O no hydrogen 2.883 N/A GLN 276.A NE2 ASP 255.A OD1 no hydrogen 3.308 N/A GLN 276.A NE2 GLN 269.A O no hydrogen 3.251 N/A ARG 277.A N PRO 274.A O no hydrogen 3.072 N/A ARG 277.A NE GLU 160.A OE1 no hydrogen 2.808 N/A ARG 277.A NH1 GLY 272.A O no hydrogen 2.921 N/A ARG 277.A NH2 GLU 160.A OE2 no hydrogen 3.471 N/A PHE 278.A N CYS 243.A O no hydrogen 2.801 N/A LYS 279.A N ARG 158.A O no hydrogen 2.799 N/A VAL 281.A N ARG 156.A O no hydrogen 2.925 N/A TRP 285.A N ASP 283.A OD2 no hydrogen 3.167 N/A GLU 286.A N CYS 428.A O no hydrogen 2.996 N/A THR 289.A OG1 VAL 287.A O no hydrogen 3.465 N/A TRP 292.A NE1 CYS 414.A O no hydrogen 2.985 N/A ASN 293.A N GLN 382.A O no hydrogen 2.798 N/A VAL 295.A N MET 380.A O no hydrogen 2.891 N/A ASP 298.A N GLY 378.A O no hydrogen 2.801 N/A ASN 300.A N ASP 298.A OD2 no hydrogen 2.924 N/A GLN 305.A N TYR 364.A O no hydrogen 2.930 N/A ILE 307.A N ILE 362.A O no hydrogen 2.795 N/A ASN 309.A N THR 360.A O no hydrogen 2.966 N/A ASN 309.A ND2 ASN 399.A OD1 no hydrogen 3.342 N/A ILE 311.A N GLY 358.A O no hydrogen 2.972 N/A PHE 313.A N GLN 356.A O no hydrogen 2.974 N/A SER 315.A N ASN 354.A O no hydrogen 3.060 N/A THR 316.A OG1 THR 353.A OG1 no hydrogen 3.110 N/A VAL 317.A N TRP 352.A O no hydrogen 2.863 N/A ALA 319.A N LYS 350.A O no hydrogen 3.051 N/A VAL 321.A N LEU 348.A O no hydrogen 3.011 N/A VAL 323.A N ALA 346.A O no hydrogen 2.976 N/A VAL 325.A N VAL 344.A O no hydrogen 2.800 N/A SER 327.A N VAL 342.A O no hydrogen 3.077 N/A THR 328.A OG1 THR 339.A OG1 no hydrogen 3.099 N/A ILE 329.A N VAL 340.A O no hydrogen 3.191 N/A LYS 331.A N ALA 338.A O no hydrogen 3.307 N/A ALA 338.A N LYS 331.A O no hydrogen 3.443 N/A THR 339.A OG1 THR 328.A OG1 no hydrogen 3.099 N/A VAL 340.A N ILE 329.A O no hydrogen 3.115 N/A VAL 342.A N SER 327.A O no hydrogen 3.059 N/A VAL 344.A N VAL 325.A O no hydrogen 3.412 N/A ALA 346.A N VAL 323.A O no hydrogen 2.950 N/A LEU 348.A N VAL 321.A O no hydrogen 3.037 N/A LYS 350.A N ALA 319.A O no hydrogen 2.803 N/A TRP 352.A N VAL 317.A O no hydrogen 2.804 N/A THR 353.A OG1 THR 316.A OG1 no hydrogen 3.110 N/A ASN 354.A N SER 315.A O no hydrogen 3.104 N/A GLN 356.A N PHE 313.A O no hydrogen 2.909 N/A GLY 358.A N ILE 311.A O no hydrogen 2.900 N/A THR 360.A N ASN 309.A O no hydrogen 2.965 N/A THR 360.A OG1 VAL 397.A O no hydrogen 2.731 N/A ILE 362.A N ILE 307.A O no hydrogen 2.802 N/A TYR 364.A N GLN 305.A O no hydrogen 2.800 N/A TYR 364.A OH GLN 401.A O no hydrogen 3.428 N/A THR 365.A OG1 ASP 367.A OD1 no hydrogen 3.147 N/A THR 365.A OG1 ASP 367.A OD2 no hydrogen 3.470 N/A CYS 366.A N VAL 303.A O no hydrogen 3.167 N/A TYR 369.A N GLU 373.A O no hydrogen 3.030 N/A TYR 369.A OH ARG 377.A O no hydrogen 2.553 N/A ASP 372.A N TYR 369.A O no hydrogen 2.799 N/A PHE 375.A N ASP 367.A O no hydrogen 2.797 N/A THR 376.A N TYR 369.A OH no hydrogen 3.250 N/A ARG 377.A N TYR 369.A OH no hydrogen 3.284 N/A ARG 377.A NE GLN 299.A O no hydrogen 2.769 N/A GLY 378.A N ASP 298.A O no hydrogen 2.796 N/A CYS 379.A N THR 406.A O no hydrogen 3.121 N/A CYS 379.A SG SER 408.A O no hydrogen 3.547 N/A MET 380.A N GLY 296.A O no hydrogen 2.801 N/A TRP 381.A N LYS 404.A O no hydrogen 2.585 N/A TRP 381.A NE1 THR 406.A OG1 no hydrogen 2.775 N/A GLN 382.A N ASN 293.A O no hydrogen 2.798 N/A LEU 383.A N ILE 402.A O no hydrogen 2.800 N/A ALA 384.A N THR 291.A O no hydrogen 2.975 N/A VAL 390.A N TRP 398.A O no hydrogen 3.010 N/A SER 392.A N LEU 396.A O no hydrogen 3.031 N/A TRP 398.A N VAL 390.A O no hydrogen 2.803 N/A GLN 401.A NE2 ASN 399.A O no hydrogen 2.929 N/A LYS 404.A N TRP 381.A O no hydrogen 2.801 N/A LYS 404.A NZ ASP 370.A OD2 no hydrogen 2.439 N/A THR 406.A N CYS 379.A O no hydrogen 2.975 N/A THR 406.A OG1 SER 408.A O no hydrogen 2.662 N/A ARG 407.A NH2 SER 371.A OG no hydrogen 2.997 N/A THR 418.A OG1 PRO 416.A O no hydrogen 3.517 N/A LYS 419.A N THR 429.A O no hydrogen 2.797 N/A ALA 421.A N PHE 427.A O no hydrogen 2.799 N/A ASN 422.A ND2 THR 426.A OG1 no hydrogen 3.326 N/A CYS 425.A N ASN 422.A O no hydrogen 2.800 N/A THR 426.A N ASN 422.A OD1 no hydrogen 2.999 N/A PHE 427.A N ASN 422.A OD1 no hydrogen 3.209 N/A CYS 428.A N GLU 286.A O no hydrogen 2.799 N/A THR 429.A N LYS 419.A O no hydrogen 2.797 N/A THR 429.A OG1 ASP 284.A OD1 no hydrogen 3.099 N/A ILE 431.A N PHE 417.A O no hydrogen 3.090 N/A