Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4m76_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): VAL 4.A N TYR 36.A OH no hydrogen 2.820 N/A GLU 7.A N ASP 5.A OD1 no hydrogen 3.472 N/A ARG 8.A N ASP 5.A O no hydrogen 3.199 N/A LEU 9.A N ALA 6.A O no hydrogen 3.087 N/A HIS 11.A NE2 GLY 272.A O no hydrogen 2.940 N/A LEU 12.A N LEU 9.A O no hydrogen 3.359 N/A ILE 13.A N LYS 10.A O no hydrogen 3.449 N/A VAL 14.A N THR 30.A OG1 no hydrogen 2.994 N/A GLY 20.A N ALA 77.A O no hydrogen 2.896 N/A ASN 23.A N ALA 19.A O no hydrogen 3.045 N/A ASN 23.A ND2 GLY 61.A O no hydrogen 2.851 N/A ASN 23.A ND2 GLN 65.A OE1 no hydrogen 3.155 N/A ILE 25.A N GLU 21.A O no hydrogen 3.232 N/A MET 27.A N ASN 23.A O no hydrogen 2.840 N/A THR 28.A N MET 24.A O no hydrogen 2.844 N/A THR 28.A OG1 MET 24.A O no hydrogen 2.840 N/A THR 28.A OG1 TYR 90.A OH no hydrogen 2.467 N/A THR 30.A OG1 LEU 12.A O no hydrogen 3.453 N/A THR 30.A OG1 VAL 14.A O no hydrogen 2.781 N/A VAL 31.A N MET 27.A O no hydrogen 3.108 N/A ILE 32.A N THR 28.A O no hydrogen 3.167 N/A ALA 33.A N THR 30.A O no hydrogen 3.242 N/A VAL 34.A N THR 30.A O no hydrogen 3.347 N/A HIS 35.A N VAL 31.A O no hydrogen 3.283 N/A TYR 36.A N ILE 32.A O no hydrogen 3.268 N/A LEU 37.A N ALA 33.A O no hydrogen 3.092 N/A ASP 38.A N VAL 34.A O no hydrogen 2.830 N/A GLU 39.A N HIS 35.A O no hydrogen 3.430 N/A THR 40.A N TYR 36.A O no hydrogen 2.945 N/A THR 40.A OG1 TYR 36.A O no hydrogen 2.857 N/A GLN 42.A N LEU 37.A O no hydrogen 3.346 N/A GLN 42.A NE2 VAL 4.A O no hydrogen 2.734 N/A GLN 42.A NE2 THR 40.A OG1 no hydrogen 2.959 N/A TRP 43.A NE1 ASP 38.A OD1 no hydrogen 2.918 N/A GLY 47.A N TRP 43.A O no hydrogen 3.029 N/A LYS 50.A N GLY 47.A O no hydrogen 3.097 N/A ARG 51.A N LEU 48.A O no hydrogen 3.186 N/A ARG 51.A NH2 ASP 38.A OD2 no hydrogen 3.348 N/A ALA 54.A N ARG 51.A O no hydrogen 3.117 N/A LEU 55.A N ARG 51.A O no hydrogen 2.715 N/A GLU 56.A N GLN 52.A O no hydrogen 3.271 N/A ILE 58.A N ALA 54.A O no hydrogen 3.277 N/A LYS 59.A N LEU 55.A O no hydrogen 3.379 N/A LYS 60.A N GLU 56.A O no hydrogen 2.913 N/A LYS 60.A NZ PRO 16.A O no hydrogen 2.674 N/A LYS 60.A NZ GLN 64.A OE1 no hydrogen 2.699 N/A GLY 61.A N LEU 57.A O no hydrogen 3.005 N/A TYR 62.A N ILE 58.A O no hydrogen 2.981 N/A THR 63.A N LYS 59.A O no hydrogen 3.096 N/A THR 63.A OG1 LYS 59.A O no hydrogen 3.211 N/A THR 63.A OG1 LYS 60.A O no hydrogen 2.924 N/A GLN 64.A N LYS 60.A O no hydrogen 3.030 N/A GLN 64.A NE2 PRO 16.A O no hydrogen 2.984 N/A GLN 64.A NE2 ASN 23.A OD1 no hydrogen 2.944 N/A GLN 65.A N GLY 61.A O no hydrogen 3.045 N/A GLN 65.A N TYR 62.A O no hydrogen 3.193 N/A GLN 65.A NE2 GLY 20.A O no hydrogen 2.793 N/A LEU 66.A N TYR 62.A O no hydrogen 3.158 N/A LEU 66.A N THR 63.A O no hydrogen 3.236 N/A PHE 68.A N GLN 65.A O no hydrogen 3.122 N/A ARG 69.A N LEU 66.A O no hydrogen 3.208 N/A GLN 70.A N ALA 74.A O no hydrogen 2.824 N/A GLN 70.A NE2 PHE 78.A O no hydrogen 3.591 N/A GLN 70.A NE2 ARG 81.A O no hydrogen 2.625 N/A SER 73.A N GLN 70.A O no hydrogen 2.685 N/A PHE 75.A N THR 88.A OG1 no hydrogen 3.105 N/A ARG 81.A NH2 PRO 132.A O no hydrogen 2.561 N/A SER 84.A N PHE 75.A O no hydrogen 3.069 N/A SER 84.A OG GLU 129.A OE1 no hydrogen 3.382 N/A SER 84.A OG GLU 129.A OE2 no hydrogen 2.527 N/A SER 84.A OG ALA 131.A O no hydrogen 3.404 N/A THR 85.A N GLU 129.A OE1 no hydrogen 2.627 N/A THR 85.A OG1 GLN 128.A O no hydrogen 2.748 N/A THR 85.A OG1 GLU 129.A OE1 no hydrogen 3.468 N/A TRP 86.A N GLU 129.A OE2 no hydrogen 2.948 N/A LEU 87.A N SER 84.A OG no hydrogen 3.351 N/A THR 88.A N SER 84.A O no hydrogen 3.254 N/A THR 88.A OG1 PHE 75.A O no hydrogen 3.423 N/A THR 88.A OG1 SER 84.A O no hydrogen 2.682 N/A ALA 89.A N THR 85.A O no hydrogen 3.209 N/A TYR 90.A N TRP 86.A O no hydrogen 2.796 N/A TYR 90.A N LEU 87.A O no hydrogen 3.103 N/A TYR 90.A OH THR 28.A OG1 no hydrogen 2.467 N/A VAL 91.A N LEU 87.A O no hydrogen 2.866 N/A VAL 92.A N THR 88.A O no hydrogen 3.182 N/A LYS 93.A N ALA 89.A O no hydrogen 3.251 N/A VAL 94.A N TYR 90.A O no hydrogen 2.988 N/A PHE 95.A N VAL 91.A O no hydrogen 3.015 N/A SER 96.A N VAL 92.A O no hydrogen 3.005 N/A SER 96.A OG VAL 92.A O no hydrogen 2.486 N/A LEU 97.A N VAL 94.A O no hydrogen 3.277 N/A ALA 98.A N PHE 95.A O no hydrogen 2.999 N/A ASN 100.A N ASN 100.A OD1 no hydrogen 2.581 N/A LEU 101.A N ALA 98.A O no hydrogen 3.150 N/A ILE 102.A N ALA 98.A O no hydrogen 3.158 N/A ASP 105.A N TYR 62.A OH no hydrogen 2.946 N/A GLN 107.A N ASP 105.A OD1 no hydrogen 3.137 N/A VAL 108.A N ASP 105.A O no hydrogen 3.304 N/A LEU 109.A N ASP 105.A O no hydrogen 3.489 N/A CYS 110.A N SER 106.A O no hydrogen 2.877 N/A CYS 110.A SG SER 106.A O no hydrogen 3.259 N/A CYS 110.A SG ILE 166.A O no hydrogen 3.781 N/A GLY 111.A N GLN 107.A O no hydrogen 3.058 N/A ALA 112.A N VAL 108.A O no hydrogen 3.307 N/A VAL 113.A N LEU 109.A O no hydrogen 3.332 N/A LYS 114.A N CYS 110.A O no hydrogen 2.982 N/A TRP 115.A N GLY 111.A O no hydrogen 3.120 N/A LEU 116.A N ALA 112.A O no hydrogen 3.097 N/A ILE 117.A N VAL 113.A O no hydrogen 3.171 N/A LEU 118.A N LYS 114.A O no hydrogen 3.016 N/A GLU 119.A N TRP 115.A O no hydrogen 3.071 N/A LYS 120.A N LEU 116.A O no hydrogen 3.270 N/A LYS 120.A NZ ASP 130.A OD2 no hydrogen 2.697 N/A GLN 121.A NE2 GLY 125.A O no hydrogen 3.206 N/A GLN 121.A NE2 SER 177.A O no hydrogen 3.233 N/A LYS 122.A N VAL 126.A O no hydrogen 2.574 N/A GLY 125.A N LYS 122.A O no hydrogen 2.739 N/A VAL 126.A N ASP 124.A OD1 no hydrogen 3.422 N/A PHE 127.A N THR 153.A OG1 no hydrogen 3.147 N/A GLN 128.A N LYS 120.A O no hydrogen 3.242 N/A ALA 131.A N GLU 129.A OE1 no hydrogen 3.291 N/A ILE 134.A N GLU 21.A OE2 no hydrogen 3.271 N/A HIS 135.A N GLU 21.A OE1 no hydrogen 3.143 N/A HIS 135.A ND1 GLU 21.A OE1 no hydrogen 3.178 N/A GLN 136.A NE2 VAL 133.A O no hydrogen 2.824 N/A GLU 137.A N GLU 137.A OE1 no hydrogen 2.665 N/A MET 138.A N HIS 135.A O no hydrogen 3.394 N/A GLY 141.A N GLU 240.A OE1 no hydrogen 2.872 N/A LEU 142.A N ILE 139.A O no hydrogen 3.337 N/A ARG 143.A N GLY 140.A O no hydrogen 3.258 N/A LEU 152.A N LYS 148.A O no hydrogen 3.441 N/A THR 153.A N ASP 149.A O no hydrogen 2.892 N/A THR 153.A OG1 ASP 149.A O no hydrogen 2.550 N/A ALA 154.A N MET 150.A O no hydrogen 2.910 N/A PHE 155.A N ALA 151.A O no hydrogen 3.137 N/A VAL 156.A N LEU 152.A O no hydrogen 2.991 N/A LEU 157.A N THR 153.A O no hydrogen 2.935 N/A ILE 158.A N ALA 154.A O no hydrogen 3.132 N/A SER 159.A N PHE 155.A O no hydrogen 3.339 N/A SER 159.A OG ALA 89.A O no hydrogen 2.733 N/A SER 159.A OG PHE 155.A O no hydrogen 3.387 N/A LEU 160.A N VAL 156.A O no hydrogen 3.002 N/A GLN 161.A N LEU 157.A O no hydrogen 3.030 N/A GLN 161.A NE2 ALA 204.A O no hydrogen 3.434 N/A GLU 162.A N ILE 158.A O no hydrogen 3.195 N/A ALA 163.A N LEU 160.A O no hydrogen 3.162 N/A LYS 164.A N GLN 161.A O no hydrogen 3.442 N/A LYS 164.A NZ GLU 168.A OE1 no hydrogen 3.381 N/A CYS 167.A N ALA 163.A O no hydrogen 3.261 N/A VAL 171.A N CYS 167.A O no hydrogen 3.171 N/A SER 177.A N SER 173.A O no hydrogen 3.146 N/A SER 177.A OG SER 173.A O no hydrogen 3.325 N/A SER 177.A OG LEU 174.A O no hydrogen 2.738 N/A ILE 178.A N LEU 174.A O no hydrogen 3.024 N/A THR 179.A N PRO 175.A O no hydrogen 3.112 N/A THR 179.A OG1 PRO 175.A O no hydrogen 2.983 N/A LYS 180.A N GLY 176.A O no hydrogen 3.096 N/A LYS 180.A NZ PRO 123.A O no hydrogen 2.462 N/A ALA 181.A N SER 177.A O no hydrogen 2.959 N/A GLY 182.A N ILE 178.A O no hydrogen 2.973 N/A ASP 183.A N THR 179.A O no hydrogen 2.842 N/A PHE 184.A N LYS 180.A O no hydrogen 3.278 N/A LEU 185.A N ALA 181.A O no hydrogen 3.268 N/A GLU 186.A N GLY 182.A O no hydrogen 3.089 N/A ALA 187.A N ASP 183.A O no hydrogen 3.163 N/A ASN 188.A N LEU 185.A O no hydrogen 3.181 N/A ASN 188.A ND2 PHE 184.A O no hydrogen 3.071 N/A TYR 189.A OH VAL 198.A O no hydrogen 2.573 N/A LEU 192.A N TYR 189.A O no hydrogen 3.282 N/A GLN 193.A N GLU 147.A OE2 no hydrogen 2.842 N/A GLN 193.A NE2 ASN 191.A O no hydrogen 3.234 N/A ARG 194.A N GLU 147.A OE1 no hydrogen 3.390 N/A SER 195.A N ASP 231.A OD1 no hydrogen 3.207 N/A TYR 196.A N ASP 231.A OD2 no hydrogen 3.238 N/A TYR 196.A OH GLU 240.A OE2 no hydrogen 2.630 N/A THR 197.A OG1 GLU 147.A O no hydrogen 3.522 N/A THR 197.A OG1 GLU 147.A OE1 no hydrogen 3.190 N/A VAL 198.A N ARG 194.A O no hydrogen 3.264 N/A ALA 199.A N SER 195.A O no hydrogen 2.970 N/A ILE 200.A N TYR 196.A O no hydrogen 3.005 N/A ALA 201.A N THR 197.A O no hydrogen 2.931 N/A GLY 202.A N VAL 198.A O no hydrogen 3.026 N/A TYR 203.A N ALA 199.A O no hydrogen 3.166 N/A ALA 204.A N ILE 200.A O no hydrogen 3.355 N/A LEU 205.A N ALA 201.A O no hydrogen 3.017 N/A ALA 206.A N GLY 202.A O no hydrogen 2.933 N/A GLN 207.A N TYR 203.A O no hydrogen 3.056 N/A MET 208.A N LEU 205.A O no hydrogen 3.057 N/A GLY 209.A N LEU 205.A O no hydrogen 3.140 N/A GLY 209.A N ALA 206.A O no hydrogen 3.229 N/A ARG 210.A N LEU 205.A O no hydrogen 2.957 N/A ARG 210.A NE GLU 186.A OE1 no hydrogen 2.705 N/A ARG 210.A NH1 THR 179.A O no hydrogen 3.562 N/A ARG 210.A NH1 ASP 183.A OD1 no hydrogen 3.156 N/A ARG 210.A NH2 ASP 183.A OD1 no hydrogen 2.575 N/A ARG 210.A NH2 GLU 186.A OE1 no hydrogen 2.635 N/A LEU 215.A N LYS 212.A O no hydrogen 3.230 N/A LEU 216.A N GLY 213.A O no hydrogen 3.181 N/A ASN 217.A N GLY 213.A O no hydrogen 3.209 N/A LYS 218.A N PRO 214.A O no hydrogen 2.900 N/A LYS 218.A NZ MET 190.A O no hydrogen 3.493 N/A LYS 218.A NZ LEU 192.A O no hydrogen 2.517 N/A PHE 219.A N LEU 215.A O no hydrogen 3.056 N/A LEU 220.A N LEU 216.A O no hydrogen 2.855 N/A THR 221.A N ASN 217.A O no hydrogen 3.038 N/A THR 221.A OG1 ASN 217.A O no hydrogen 2.423 N/A THR 221.A OG1 LYS 218.A O no hydrogen 3.519 N/A THR 222.A OG1 LYS 218.A O no hydrogen 2.278 N/A ALA 223.A N LEU 220.A O no hydrogen 3.399 N/A LYS 224.A N ARG 228.A O no hydrogen 2.758 N/A LYS 226.A N ALA 223.A O no hydrogen 3.412 N/A ASN 227.A N LYS 224.A O no hydrogen 3.341 N/A ARG 228.A NE GLU 230.A OE1 no hydrogen 3.115 N/A ARG 228.A NH1 ASP 225.A OD2 no hydrogen 3.510 N/A ARG 228.A NH1 ASN 227.A OD1 no hydrogen 3.061 N/A ARG 228.A NH2 GLU 230.A OE1 no hydrogen 3.026 N/A TRP 229.A N THR 242.A OG1 no hydrogen 3.347 N/A TRP 229.A NE1 PHE 219.A O no hydrogen 3.105 N/A ASP 231.A N ASN 238.A OD1 no hydrogen 2.643 N/A GLN 235.A NE2 GLN 268.A OE1 no hydrogen 2.493 N/A TYR 237.A N LYS 234.A O no hydrogen 2.990 N/A ASN 238.A ND2 ASP 231.A O no hydrogen 2.815 N/A VAL 239.A N GLN 235.A O no hydrogen 3.028 N/A GLU 240.A N LEU 236.A O no hydrogen 3.226 N/A ALA 241.A N TYR 237.A O no hydrogen 2.880 N/A THR 242.A N ASN 238.A O no hydrogen 3.036 N/A THR 242.A OG1 ASN 238.A O no hydrogen 2.677 N/A SER 243.A N VAL 239.A O no hydrogen 3.083 N/A SER 243.A OG VAL 239.A O no hydrogen 2.745 N/A TYR 244.A N GLU 240.A O no hydrogen 3.180 N/A ALA 245.A N ALA 241.A O no hydrogen 3.034 N/A LEU 246.A N THR 242.A O no hydrogen 2.914 N/A LEU 247.A N SER 243.A O no hydrogen 3.099 N/A ALA 248.A N TYR 244.A O no hydrogen 3.027 N/A LEU 249.A N ALA 245.A O no hydrogen 2.720 N/A LEU 250.A N LEU 246.A O no hydrogen 2.858 N/A GLN 251.A N LEU 247.A O no hydrogen 3.091 N/A LEU 252.A N ALA 248.A O no hydrogen 3.077 N/A LYS 253.A N LEU 250.A O no hydrogen 3.409 N/A ASP 254.A N LEU 249.A O no hydrogen 2.995 N/A ASP 256.A N ASP 254.A OD1 no hydrogen 3.132 N/A PHE 257.A N ASP 254.A OD1 no hydrogen 3.146 N/A VAL 258.A N ASP 254.A O no hydrogen 3.327 N/A VAL 262.A N VAL 258.A O no hydrogen 2.908 N/A ARG 263.A N PRO 259.A O no hydrogen 2.864 N/A TRP 264.A N PRO 260.A O no hydrogen 3.093 N/A LEU 265.A N VAL 261.A O no hydrogen 3.063 N/A ASN 266.A N VAL 262.A O no hydrogen 3.008 N/A GLU 267.A N ARG 263.A O no hydrogen 3.244 N/A GLU 267.A N TRP 264.A O no hydrogen 3.086 N/A GLN 268.A N LEU 265.A O no hydrogen 3.332 N/A GLN 268.A NE2 TRP 264.A O no hydrogen 3.608 N/A TYR 270.A OH THR 281.A OG1 no hydrogen 3.348 N/A GLY 273.A N THR 281.A OG1 no hydrogen 3.369 N/A SER 277.A OG GLY 274.A O no hydrogen 2.898 N/A GLN 279.A NE2 MET 138.A O no hydrogen 2.993 N/A THR 281.A N SER 277.A O no hydrogen 2.884 N/A THR 281.A OG1 TYR 270.A OH no hydrogen 3.348 N/A THR 281.A OG1 SER 277.A O no hydrogen 2.435 N/A PHE 282.A N THR 278.A O no hydrogen 3.007 N/A MET 283.A N GLN 279.A O no hydrogen 2.730 N/A VAL 284.A N ALA 280.A O no hydrogen 2.884 N/A GLN 286.A N PHE 282.A O no hydrogen 3.141 N/A ALA 287.A N MET 283.A O no hydrogen 2.942 N/A LEU 288.A N VAL 284.A O no hydrogen 3.460 N/A ALA 289.A N PHE 285.A O no hydrogen 3.229 N/A GLN 290.A N GLN 286.A O no hydrogen 3.131 N/A GLN 290.A NE2 ASP 294.A OD1 no hydrogen 3.059 N/A GLN 290.A NE2 ASP 294.A OD2 no hydrogen 3.329 N/A TYR 291.A N ALA 287.A O no hydrogen 2.864 N/A GLN 292.A N LEU 288.A O no hydrogen 2.987 N/A LYS 293.A N ALA 289.A O no hydrogen 3.011 N/A ASP 294.A N GLN 290.A O no hydrogen 3.069 N/A ASP 294.A N TYR 291.A O no hydrogen 3.095 N/A ALA 295.A N TYR 291.A O no hydrogen 2.652 N/A