Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3adu_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLU 5.A N GLU 5.A OE1 no hydrogen 2.693 N/A SER 6.A N ASN 3.A O no hydrogen 3.119 N/A ARG 10.A N SER 6.A O no hydrogen 3.144 N/A ARG 10.A N ALA 7.A O no hydrogen 2.780 N/A ALA 11.A N ALA 7.A O no hydrogen 2.869 N/A LEU 12.A N ASP 8.A O no hydrogen 2.940 N/A ALA 13.A N LEU 9.A O no hydrogen 3.216 N/A LYS 14.A N ARG 10.A O no hydrogen 3.066 N/A HIS 15.A N ALA 11.A O no hydrogen 3.030 N/A HIS 15.A NE2 SER 85.A O no hydrogen 2.758 N/A LEU 16.A N LEU 12.A O no hydrogen 3.021 N/A TYR 17.A N ALA 13.A O no hydrogen 3.005 N/A ASP 18.A N LYS 14.A O no hydrogen 3.017 N/A SER 19.A N HIS 15.A O no hydrogen 3.235 N/A SER 19.A OG HIS 15.A O no hydrogen 2.714 N/A SER 19.A OG SER 85.A OG no hydrogen 3.299 N/A TYR 20.A N LEU 16.A O no hydrogen 2.956 N/A TYR 20.A OH ASP 164.A OD1 no hydrogen 2.365 N/A ILE 21.A N TYR 17.A O no hydrogen 2.936 N/A LYS 22.A N ASP 18.A O no hydrogen 3.102 N/A LYS 22.A NZ ASP 18.A OD2 no hydrogen 2.661 N/A SER 23.A N TYR 20.A O no hydrogen 3.397 N/A SER 23.A OG SER 19.A O no hydrogen 3.017 N/A PHE 24.A N TYR 20.A O no hydrogen 3.011 N/A LYS 28.A N ASP 164.A OD1 no hydrogen 2.903 N/A LYS 28.A NZ LEU 162.A O no hydrogen 2.605 N/A ALA 29.A N ASP 164.A OD2 no hydrogen 2.949 N/A LYS 30.A N THR 27.A OG1 no hydrogen 3.334 N/A ALA 31.A N THR 27.A O no hydrogen 2.944 N/A ARG 32.A N LYS 28.A O no hydrogen 2.658 N/A ARG 32.A NH2 MET 117.A O no hydrogen 2.553 N/A ALA 33.A N ALA 29.A O no hydrogen 2.989 N/A ILE 34.A N LYS 30.A O no hydrogen 2.897 N/A LEU 35.A N ALA 31.A O no hydrogen 2.974 N/A THR 36.A N ARG 32.A O no hydrogen 3.030 N/A THR 36.A OG1 ARG 32.A O no hydrogen 3.128 N/A LYS 38.A N ALA 33.A O no hydrogen 3.311 N/A LYS 38.A NZ THR 36.A OG1 no hydrogen 3.288 N/A PHE 45.A N GLN 128.A O no hydrogen 3.013 N/A ILE 47.A N PHE 130.A O no hydrogen 2.853 N/A SER 52.A N ASP 49.A OD1 no hydrogen 2.591 N/A SER 52.A OG ASP 49.A OD1 no hydrogen 2.828 N/A LEU 53.A N ASP 49.A O no hydrogen 2.812 N/A MET 54.A N MET 50.A O no hydrogen 2.864 N/A MET 55.A N ASN 51.A O no hydrogen 2.953 N/A GLY 56.A N SER 52.A O no hydrogen 2.639 N/A ASP 58.A N MET 54.A O no hydrogen 3.336 N/A ARG 63.A N GLU 59.A O no hydrogen 3.301 N/A ILE 64.A N VAL 60.A O no hydrogen 3.223 N/A PHE 65.A N ALA 61.A O no hydrogen 3.401 N/A GLN 66.A N ILE 62.A O no hydrogen 3.054 N/A GLY 67.A N ARG 63.A O no hydrogen 2.994 N/A CYS 68.A N ILE 64.A O no hydrogen 2.920 N/A CYS 68.A SG ILE 64.A O no hydrogen 3.404 N/A GLN 69.A N PHE 65.A O no hydrogen 3.063 N/A GLN 69.A NE2 SER 247.A O no hydrogen 3.294 N/A PHE 70.A N GLN 66.A O no hydrogen 3.109 N/A ARG 71.A N GLY 67.A O no hydrogen 3.090 N/A ARG 71.A NH2 GLU 78.A OE1 no hydrogen 3.020 N/A SER 72.A N CYS 68.A O no hydrogen 2.982 N/A SER 72.A OG CYS 68.A O no hydrogen 3.134 N/A VAL 73.A N GLN 69.A O no hydrogen 3.103 N/A GLU 74.A N PHE 70.A O no hydrogen 3.018 N/A ALA 75.A N ARG 71.A O no hydrogen 2.868 N/A VAL 76.A N SER 72.A O no hydrogen 2.720 N/A GLN 77.A N VAL 73.A O no hydrogen 3.322 N/A GLN 77.A N GLU 74.A O no hydrogen 2.831 N/A GLU 78.A N GLU 74.A O no hydrogen 3.027 N/A ILE 79.A N ALA 75.A O no hydrogen 2.709 N/A THR 80.A N VAL 76.A O no hydrogen 3.012 N/A THR 80.A OG1 VAL 76.A O no hydrogen 2.603 N/A GLU 81.A N GLN 77.A O no hydrogen 3.089 N/A TYR 82.A N GLU 78.A O no hydrogen 2.911 N/A ALA 83.A N ILE 79.A O no hydrogen 2.641 N/A LYS 84.A N THR 80.A O no hydrogen 3.071 N/A SER 85.A N TYR 82.A O no hydrogen 2.935 N/A SER 85.A OG TYR 82.A O no hydrogen 2.712 N/A ILE 86.A N ALA 83.A O no hydrogen 2.920 N/A PHE 89.A N ILE 86.A O no hydrogen 2.837 N/A LEU 92.A N PHE 89.A O no hydrogen 3.038 N/A GLN 97.A N ASP 93.A O no hydrogen 3.004 N/A GLN 97.A NE2 VAL 90.A O no hydrogen 2.813 N/A GLN 97.A NE2 LEU 92.A O no hydrogen 2.525 N/A VAL 98.A N LEU 94.A O no hydrogen 3.192 N/A THR 99.A N ASN 95.A O no hydrogen 3.014 N/A LEU 100.A N ASP 96.A O no hydrogen 3.045 N/A LEU 101.A N GLN 97.A O no hydrogen 3.236 N/A LYS 102.A N VAL 98.A O no hydrogen 2.867 N/A LYS 102.A NZ ILE 255.A O no hydrogen 2.582 N/A LYS 102.A NZ LYS 257.A O no hydrogen 2.745 N/A TYR 103.A N THR 99.A O no hydrogen 2.989 N/A GLY 104.A N LEU 100.A O no hydrogen 2.683 N/A VAL 105.A N LEU 101.A O no hydrogen 2.832 N/A ILE 108.A N GLY 104.A O no hydrogen 3.042 N/A ILE 109.A N VAL 105.A O no hydrogen 3.016 N/A TYR 110.A N HIS 106.A O no hydrogen 3.162 N/A THR 111.A N GLU 107.A O no hydrogen 3.266 N/A THR 111.A OG1 GLU 107.A O no hydrogen 3.021 N/A MET 112.A N ILE 108.A O no hydrogen 3.045 N/A LEU 113.A N ILE 109.A O no hydrogen 2.656 N/A ALA 114.A N TYR 110.A O no hydrogen 3.272 N/A SER 115.A N MET 112.A O no hydrogen 3.163 N/A LEU 116.A N LEU 113.A O no hydrogen 2.841 N/A MET 117.A N ALA 114.A O no hydrogen 3.010 N/A ASN 118.A N GLY 121.A O no hydrogen 3.277 N/A LYS 119.A NZ ASP 120.A OD1 no hydrogen 3.490 N/A LYS 119.A NZ ASP 120.A OD2 no hydrogen 3.422 N/A ASP 120.A N ASN 118.A OD1 no hydrogen 2.528 N/A GLY 121.A N ASN 118.A OD1 no hydrogen 3.056 N/A VAL 122.A N MET 131.A O no hydrogen 2.788 N/A LEU 123.A N LEU 116.A O no hydrogen 3.026 N/A ILE 124.A N GLY 129.A O no hydrogen 2.884 N/A SER 125.A OG GLN 128.A OE1 no hydrogen 3.265 N/A GLY 127.A N ILE 124.A O no hydrogen 3.038 N/A GLN 128.A N SER 125.A O no hydrogen 3.017 N/A GLY 129.A N ILE 124.A O no hydrogen 3.016 N/A PHE 130.A N PHE 45.A O no hydrogen 3.089 N/A MET 131.A N VAL 122.A O no hydrogen 2.735 N/A THR 132.A N ILE 47.A O no hydrogen 3.042 N/A ARG 133.A N ASP 120.A O no hydrogen 2.620 N/A ARG 133.A NE GLU 148.A OE1 no hydrogen 3.453 N/A ARG 133.A NE GLU 148.A OE2 no hydrogen 2.648 N/A ARG 133.A NH1 LYS 119.A O no hydrogen 3.291 N/A ARG 133.A NH2 GLU 148.A OE1 no hydrogen 3.136 N/A PHE 135.A N THR 132.A OG1 no hydrogen 3.353 N/A LEU 136.A N THR 132.A O no hydrogen 3.152 N/A LYS 137.A N ARG 133.A O no hydrogen 2.998 N/A LYS 137.A NZ GLU 134.A OE2 no hydrogen 3.296 N/A LYS 137.A NZ GLU 148.A OE1 no hydrogen 3.349 N/A SER 138.A N PHE 135.A O no hydrogen 3.228 N/A SER 138.A OG PHE 135.A O no hydrogen 2.682 N/A LEU 139.A N LEU 136.A O no hydrogen 3.383 N/A ARG 140.A NE GLU 59.A OE1 no hydrogen 3.208 N/A ARG 140.A NE GLU 59.A OE2 no hydrogen 2.459 N/A ARG 140.A NH2 GLU 243.A OE2 no hydrogen 3.061 N/A PHE 143.A N ARG 140.A O no hydrogen 2.834 N/A GLY 144.A N LYS 141.A O no hydrogen 3.282 N/A ASP 145.A N PRO 142.A O no hydrogen 3.214 N/A PHE 146.A N PHE 143.A O no hydrogen 3.256 N/A LYS 150.A N MET 147.A O no hydrogen 3.079 N/A LYS 150.A NZ PHE 146.A O no hydrogen 2.794 N/A PHE 151.A N MET 147.A O no hydrogen 2.934 N/A GLU 152.A N GLU 148.A O no hydrogen 2.719 N/A PHE 153.A N PRO 149.A O no hydrogen 2.994 N/A ALA 154.A N LYS 150.A O no hydrogen 2.802 N/A VAL 155.A N PHE 151.A O no hydrogen 3.202 N/A PHE 157.A N PHE 153.A O no hydrogen 2.786 N/A ASN 158.A N ALA 154.A O no hydrogen 2.660 N/A ASN 158.A ND2 ALA 114.A O no hydrogen 3.258 N/A ALA 159.A N LYS 156.A O no hydrogen 3.282 N/A LEU 160.A N PHE 157.A O no hydrogen 3.075 N/A GLU 161.A N ASN 158.A O no hydrogen 2.759 N/A ASP 163.A N ASP 166.A OD2 no hydrogen 3.074 N/A SER 165.A N ASP 163.A OD1 no hydrogen 3.070 N/A SER 165.A OG ASP 163.A OD1 no hydrogen 2.683 N/A SER 165.A OG GLN 203.A OE1 no hydrogen 2.743 N/A ASP 166.A N ASP 163.A O no hydrogen 2.837 N/A ASP 166.A N ASP 163.A OD1 no hydrogen 3.082 N/A LEU 167.A N ASP 163.A O no hydrogen 2.932 N/A ALA 168.A N ASP 164.A O no hydrogen 2.966 N/A ILE 169.A N ASP 166.A O no hydrogen 3.255 N/A PHE 170.A N ASP 166.A O no hydrogen 3.237 N/A ILE 171.A N LEU 167.A O no hydrogen 2.880 N/A VAL 173.A N ILE 169.A O no hydrogen 3.016 N/A ILE 174.A N PHE 170.A O no hydrogen 3.119 N/A ILE 175.A N ILE 171.A O no hydrogen 3.354 N/A LEU 176.A N ALA 172.A O no hydrogen 3.225 N/A SER 177.A OG ILE 174.A O no hydrogen 2.699 N/A ARG 180.A NH1 GLU 107.A OE1 no hydrogen 3.320 N/A ARG 180.A NH1 GLU 107.A OE2 no hydrogen 3.056 N/A ARG 180.A NH2 GLU 107.A OE1 no hydrogen 2.826 N/A ARG 180.A NH2 ILE 174.A O no hydrogen 3.310 N/A LEU 184.A N ASP 96.A OD2 no hydrogen 2.723 N/A ASN 185.A N ASP 96.A OD1 no hydrogen 2.881 N/A LYS 187.A NZ ASP 191.A OD2 no hydrogen 3.353 N/A GLU 190.A N VAL 186.A O no hydrogen 2.839 N/A ASP 191.A N LYS 187.A O no hydrogen 3.010 N/A ASP 191.A N PRO 188.A O no hydrogen 3.253 N/A ILE 192.A N PRO 188.A O no hydrogen 3.272 N/A GLN 193.A N ILE 189.A O no hydrogen 3.027 N/A ASP 194.A N GLU 190.A O no hydrogen 2.798 N/A ASN 195.A N ASP 191.A O no hydrogen 3.188 N/A LEU 196.A N ILE 192.A O no hydrogen 2.901 N/A LEU 197.A N GLN 193.A O no hydrogen 2.740 N/A GLN 198.A N ASP 194.A O no hydrogen 3.280 N/A ALA 199.A N ASN 195.A O no hydrogen 3.185 N/A LEU 200.A N LEU 196.A O no hydrogen 3.004 N/A GLU 201.A N LEU 197.A O no hydrogen 2.963 N/A LEU 202.A N GLN 198.A O no hydrogen 3.102 N/A GLN 203.A N ALA 199.A O no hydrogen 2.930 N/A LEU 204.A N LEU 200.A O no hydrogen 2.907 N/A LYS 205.A N LEU 202.A O no hydrogen 2.989 N/A LEU 206.A N LEU 202.A O no hydrogen 3.011 N/A ASN 207.A N GLN 203.A O no hydrogen 3.017 N/A ASN 207.A ND2 ASP 163.A OD2 no hydrogen 2.871 N/A ASN 207.A ND2 ASP 166.A OD1 no hydrogen 2.951 N/A HIS 208.A N LEU 204.A O no hydrogen 2.795 N/A SER 211.A N HIS 208.A O no hydrogen 2.919 N/A LYS 217.A N GLN 213.A O no hydrogen 2.815 N/A LEU 218.A N LEU 214.A O no hydrogen 2.699 N/A LEU 219.A N PHE 215.A O no hydrogen 3.053 N/A GLN 220.A N ALA 216.A O no hydrogen 2.958 N/A GLN 220.A NE2 ALA 216.A O no hydrogen 3.472 N/A LYS 221.A N LEU 218.A O no hydrogen 3.022 N/A MET 222.A N LEU 219.A O no hydrogen 3.320 N/A THR 223.A N GLN 220.A O no hydrogen 2.979 N/A THR 223.A OG1 GLN 220.A O no hydrogen 3.259 N/A THR 223.A OG1 ASP 224.A OD1 no hydrogen 3.195 N/A LEU 225.A N LYS 221.A O no hydrogen 3.279 N/A ARG 226.A N MET 222.A O no hydrogen 3.390 N/A ARG 226.A NH1 GLU 107.A OE2 no hydrogen 2.591 N/A GLN 227.A N THR 223.A O no hydrogen 3.185 N/A ILE 228.A N ASP 224.A O no hydrogen 3.089 N/A VAL 229.A N LEU 225.A O no hydrogen 2.990 N/A THR 230.A N ARG 226.A O no hydrogen 2.846 N/A THR 230.A OG1 ARG 226.A O no hydrogen 3.225 N/A GLU 231.A N GLN 227.A O no hydrogen 2.946 N/A HIS 232.A N ILE 228.A O no hydrogen 2.868 N/A VAL 233.A N VAL 229.A O no hydrogen 3.188 N/A GLN 234.A N THR 230.A O no hydrogen 3.437 N/A LEU 235.A N GLU 231.A O no hydrogen 3.014 N/A LEU 236.A N HIS 232.A O no hydrogen 2.619 N/A GLN 237.A N VAL 233.A O no hydrogen 2.789 N/A ILE 239.A N LEU 235.A O no hydrogen 3.302 N/A LYS 240.A N LEU 236.A O no hydrogen 3.173 N/A LYS 241.A N VAL 238.A O no hydrogen 3.054 N/A THR 242.A N VAL 238.A O no hydrogen 3.248 N/A THR 242.A OG1 VAL 238.A O no hydrogen 3.527 N/A THR 242.A OG1 ILE 239.A O no hydrogen 3.403 N/A THR 242.A OG1 GLU 243.A OE2 no hydrogen 3.458 N/A GLU 243.A N ILE 239.A O no hydrogen 2.996 N/A MET 246.A N GLU 243.A O no hydrogen 3.334 N/A LEU 251.A N HIS 249.A ND1 no hydrogen 3.199 N/A GLN 253.A N HIS 249.A O no hydrogen 2.946 N/A GLU 254.A N PRO 250.A O no hydrogen 2.990 N/A GLU 254.A N LEU 251.A O no hydrogen 3.203 N/A ILE 255.A N LEU 251.A O no hydrogen 3.272 N/A TYR 256.A N LEU 252.A O no hydrogen 3.317 N/A LYS 257.A NZ GLU 254.A OE1 no hydrogen 3.248 N/A LEU 259.A N TYR 256.A O no hydrogen 3.383 N/A