Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1s80_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): THR 3.A OG1 ASP 74.A OD1 no hydrogen 2.577 N/A ASP 5.A N SER 1.A O no hydrogen 3.074 N/A VAL 6.A N LEU 2.A O no hydrogen 2.872 N/A TRP 7.A N THR 3.A O no hydrogen 2.970 N/A TRP 7.A NE1 GLN 35.A O no hydrogen 3.087 N/A GLN 8.A N LEU 4.A O no hydrogen 2.920 N/A HIS 9.A N ASP 5.A O no hydrogen 2.982 N/A ILE 10.A N VAL 6.A O no hydrogen 2.947 N/A ILE 10.A N TRP 7.A O no hydrogen 3.190 N/A ARG 11.A N TRP 7.A O no hydrogen 3.006 N/A ARG 11.A NH1 LEU 32.A O no hydrogen 3.207 N/A ARG 11.A NH2 LEU 32.A O no hydrogen 3.174 N/A GLN 12.A N GLN 8.A O no hydrogen 3.064 N/A GLU 13.A N HIS 9.A O no hydrogen 3.222 N/A ALA 14.A N ILE 10.A O no hydrogen 2.966 N/A LYS 15.A N ARG 11.A O no hydrogen 3.354 N/A GLU 16.A N GLN 12.A O no hydrogen 3.507 N/A LEU 17.A N GLU 13.A O no hydrogen 2.763 N/A ALA 18.A N ALA 14.A O no hydrogen 2.825 N/A GLU 19.A N LYS 15.A O no hydrogen 3.261 N/A ASN 20.A N GLU 16.A O no hydrogen 3.238 N/A ASN 20.A N LEU 17.A O no hydrogen 3.219 N/A GLU 21.A N LEU 17.A O no hydrogen 3.048 N/A ALA 24.A N PRO 22.A O no hydrogen 3.356 N/A PHE 27.A N LEU 23.A O no hydrogen 3.117 N/A HIS 28.A N ALA 24.A O no hydrogen 3.089 N/A SER 29.A N SER 25.A O no hydrogen 2.924 N/A SER 29.A OG SER 25.A O no hydrogen 2.822 N/A SER 29.A OG PHE 26.A O no hydrogen 3.553 N/A THR 30.A N PHE 26.A O no hydrogen 2.934 N/A THR 30.A OG1 PHE 26.A O no hydrogen 2.859 N/A ILE 31.A N PHE 27.A O no hydrogen 2.888 N/A LEU 32.A N PHE 27.A O no hydrogen 3.022 N/A LYS 33.A N HIS 28.A O no hydrogen 2.891 N/A HIS 34.A N ILE 31.A O no hydrogen 2.961 N/A HIS 34.A ND1 THR 30.A O no hydrogen 2.864 N/A GLY 39.A N ASN 36.A O no hydrogen 3.170 N/A GLY 39.A N ASN 36.A OD1 no hydrogen 3.046 N/A ALA 40.A N ASN 36.A O no hydrogen 3.428 N/A LEU 41.A N LEU 37.A O no hydrogen 2.902 N/A SER 42.A N GLY 38.A O no hydrogen 3.177 N/A SER 42.A OG GLY 38.A O no hydrogen 2.773 N/A SER 42.A OG GLY 39.A O no hydrogen 3.220 N/A SER 42.A OG GLU 63.A OE2 no hydrogen 3.357 N/A TYR 43.A N GLY 39.A O no hydrogen 3.311 N/A LEU 44.A N ALA 40.A O no hydrogen 3.158 N/A LEU 45.A N LEU 41.A O no hydrogen 3.018 N/A ALA 46.A N SER 42.A O no hydrogen 3.207 N/A ASN 47.A N TYR 43.A O no hydrogen 3.087 N/A LYS 48.A N LEU 44.A O no hydrogen 2.991 N/A LEU 49.A N LEU 45.A O no hydrogen 2.886 N/A ILE 53.A N ASN 51.A OD1 no hydrogen 2.862 N/A SER 57.A N PRO 54.A O no hydrogen 3.033 N/A LEU 58.A N PRO 54.A O no hydrogen 3.068 N/A ARG 59.A N ALA 55.A O no hydrogen 2.897 N/A ARG 59.A NH1 SER 42.A OG no hydrogen 3.220 N/A ILE 61.A N SER 57.A O no hydrogen 3.439 N/A ILE 62.A N LEU 58.A O no hydrogen 3.059 N/A GLU 63.A N ARG 59.A O no hydrogen 2.984 N/A GLU 64.A N GLU 60.A O no hydrogen 2.883 N/A ALA 65.A N ILE 61.A O no hydrogen 3.201 N/A TYR 66.A N ILE 62.A O no hydrogen 2.973 N/A GLN 67.A N GLU 63.A O no hydrogen 2.705 N/A SER 68.A N GLU 64.A O no hydrogen 2.910 N/A SER 68.A OG GLU 64.A O no hydrogen 3.243 N/A SER 68.A OG TYR 114.A OH no hydrogen 2.602 N/A ASN 69.A N TYR 66.A O no hydrogen 3.405 N/A SER 71.A OG ASN 69.A OD1 no hydrogen 3.302 N/A ILE 72.A N ASN 69.A O no hydrogen 3.113 N/A ILE 73.A N PRO 70.A O no hydrogen 3.190 N/A ASP 74.A N PRO 70.A O no hydrogen 3.485 N/A CYS 75.A N SER 71.A O no hydrogen 2.947 N/A CYS 75.A SG SER 71.A O no hydrogen 3.230 N/A ALA 76.A N ILE 72.A O no hydrogen 3.324 N/A ALA 77.A N ILE 73.A O no hydrogen 3.250 N/A CYS 78.A N ASP 74.A O no hydrogen 3.214 N/A CYS 78.A SG ASP 74.A O no hydrogen 3.179 N/A ASP 79.A N CYS 75.A O no hydrogen 2.829 N/A ILE 80.A N ALA 76.A O no hydrogen 2.857 N/A GLN 81.A N ALA 77.A O no hydrogen 3.040 N/A ALA 82.A N CYS 78.A O no hydrogen 2.742 N/A VAL 83.A N ASP 79.A O no hydrogen 2.939 N/A ARG 84.A N ILE 80.A O no hydrogen 3.073 N/A ARG 84.A NE GLU 91.A O no hydrogen 2.742 N/A HIS 85.A N GLN 81.A O no hydrogen 2.992 N/A ARG 86.A N ALA 82.A O no hydrogen 3.036 N/A ARG 86.A NH1 GLY 148.A O no hydrogen 3.034 N/A ARG 86.A NH1 VAL 168.A O no hydrogen 3.473 N/A ARG 86.A NH1 SER 169.A OG no hydrogen 2.993 N/A ARG 86.A NH2 GLY 148.A O no hydrogen 2.800 N/A ASP 87.A N VAL 83.A O no hydrogen 2.838 N/A ALA 89.A N ASP 87.A OD1 no hydrogen 2.838 N/A VAL 90.A N ASP 87.A O no hydrogen 3.081 N/A TRP 93.A N GLU 13.A OE2 no hydrogen 2.966 N/A SER 94.A N GLU 13.A OE1 no hydrogen 2.818 N/A SER 94.A OG GLU 13.A OE1 no hydrogen 3.343 N/A LEU 98.A N SER 94.A O no hydrogen 2.950 N/A LEU 98.A N THR 95.A O no hydrogen 3.248 N/A TYR 99.A N THR 95.A O no hydrogen 2.852 N/A LYS 101.A NZ ASP 136.A OD1 no hydrogen 2.698 N/A HIS 104.A N LEU 100.A O no hydrogen 3.073 N/A HIS 104.A NE2 LEU 97.A O no hydrogen 2.713 N/A ALA 105.A N LYS 101.A O no hydrogen 2.956 N/A ILE 106.A N GLY 102.A O no hydrogen 3.144 N/A GLN 107.A N PHE 103.A O no hydrogen 3.095 N/A GLN 107.A NE2 ASP 79.A OD2 no hydrogen 2.739 N/A GLN 107.A NE2 PHE 103.A O no hydrogen 3.574 N/A SER 108.A N HIS 104.A O no hydrogen 2.940 N/A SER 108.A OG HIS 104.A O no hydrogen 2.838 N/A TYR 109.A N ALA 105.A O no hydrogen 2.914 N/A TYR 109.A OH ALA 143.A O no hydrogen 2.338 N/A ARG 110.A N ILE 106.A O no hydrogen 3.182 N/A ARG 110.A NE GLN 107.A OE1 no hydrogen 3.081 N/A ARG 110.A NH1 ILE 145.A O no hydrogen 3.322 N/A ARG 110.A NH1 GLY 146.A O no hydrogen 2.965 N/A ARG 110.A NH2 ASP 79.A OD2 no hydrogen 2.671 N/A ARG 110.A NH2 GLY 146.A O no hydrogen 2.955 N/A THR 112.A N SER 108.A O no hydrogen 3.160 N/A THR 112.A OG1 TYR 109.A O no hydrogen 2.670 N/A HIS 113.A N TYR 109.A O no hydrogen 2.746 N/A HIS 113.A ND1 PRO 141.A O no hydrogen 2.648 N/A TYR 114.A N ARG 110.A O no hydrogen 3.156 N/A TYR 114.A OH GLU 64.A OE1 no hydrogen 3.298 N/A TYR 114.A OH GLU 64.A OE2 no hydrogen 2.430 N/A TYR 114.A OH SER 68.A OG no hydrogen 2.602 N/A LEU 115.A N ILE 111.A O no hydrogen 3.102 N/A TRP 116.A N THR 112.A O no hydrogen 3.047 N/A ASN 117.A N HIS 113.A O no hydrogen 3.062 N/A GLN 118.A N TYR 114.A O no hydrogen 3.110 N/A GLN 118.A N LEU 115.A O no hydrogen 3.126 N/A ASN 119.A N TRP 116.A O no hydrogen 2.957 N/A ARG 120.A N LEU 115.A O no hydrogen 2.802 N/A ALA 124.A N ARG 120.A O no hydrogen 3.168 N/A LEU 125.A N LYS 121.A O no hydrogen 2.856 N/A TYR 126.A N SER 122.A O no hydrogen 2.803 N/A LEU 127.A N LEU 123.A O no hydrogen 2.932 N/A GLN 128.A N ALA 124.A O no hydrogen 2.891 N/A GLN 128.A NE2 ASP 138.A OD1 no hydrogen 2.918 N/A ASN 129.A N LEU 125.A O no hydrogen 3.346 N/A GLN 130.A N TYR 126.A O no hydrogen 3.280 N/A ILE 131.A N LEU 127.A O no hydrogen 2.842 N/A SER 132.A N GLN 128.A O no hydrogen 3.023 N/A VAL 133.A N ASN 129.A O no hydrogen 2.882 N/A ALA 134.A N GLN 130.A O no hydrogen 2.802 N/A PHE 135.A N ILE 131.A O no hydrogen 2.809 N/A ASP 138.A N ILE 156.A O no hydrogen 2.846 N/A HIS 140.A N VAL 158.A O no hydrogen 3.174 N/A ALA 142.A N HIS 140.A ND1 no hydrogen 3.128 N/A ALA 143.A N HIS 140.A O no hydrogen 2.991 N/A LYS 144.A N SER 162.A O no hydrogen 3.113 N/A GLY 146.A N ILE 164.A O no hydrogen 2.714 N/A HIS 147.A N ASN 166.A OD1 no hydrogen 3.003 N/A ILE 149.A N ASP 79.A OD1 no hydrogen 2.852 N/A ASP 151.A N ILE 170.A O no hydrogen 2.934 N/A GLY 155.A N ASP 136.A O no hydrogen 3.023 N/A ILE 156.A N ALA 153.A O no hydrogen 3.243 N/A VAL 157.A N VAL 174.A O no hydrogen 2.944 N/A VAL 158.A N ASP 138.A O no hydrogen 2.761 N/A GLY 159.A N LEU 176.A O no hydrogen 3.107 N/A THR 161.A N HIS 187.A ND1 no hydrogen 3.186 N/A SER 162.A N GLY 159.A O no hydrogen 2.945 N/A SER 162.A OG GLY 159.A O no hydrogen 2.798 N/A VAL 163.A N PRO 188.A O no hydrogen 3.156 N/A ILE 164.A N LYS 144.A O no hydrogen 2.766 N/A GLU 165.A N VAL 190.A O no hydrogen 2.909 N/A ASP 167.A N HIS 147.A O no hydrogen 2.986 N/A SER 169.A N VAL 194.A O no hydrogen 2.807 N/A LEU 171.A N ILE 195.A O no hydrogen 3.218 N/A GLN 172.A N GLN 172.A OE1 no hydrogen 2.853 N/A GLY 173.A N THR 154.A O no hydrogen 3.087 N/A THR 175.A N ALA 199.A O no hydrogen 2.996 N/A LEU 176.A N VAL 157.A O no hydrogen 2.687 N/A GLU 182.A N GLY 180.A O no hydrogen 2.268 N/A ARG 186.A NH1 GLU 160.A OE1 no hydrogen 3.088 N/A ARG 186.A NH2 GLU 160.A OE1 no hydrogen 3.280 N/A LYS 189.A N ILE 205.A O no hydrogen 2.782 N/A LYS 189.A NZ THR 161.A O no hydrogen 3.438 N/A LYS 189.A NZ ASP 185.A OD2 no hydrogen 2.588 N/A LYS 189.A NZ HIS 187.A O no hydrogen 2.571 N/A LYS 189.A NZ ASN 204.A OD1 no hydrogen 2.952 N/A VAL 190.A N VAL 163.A O no hydrogen 2.821 N/A ARG 191.A N VAL 207.A O no hydrogen 2.953 N/A ARG 191.A NE GLU 206.A OE1 no hydrogen 3.005 N/A ARG 191.A NH1 GLU 165.A OE2 no hydrogen 3.219 N/A ARG 191.A NH2 GLU 206.A OE1 no hydrogen 3.566 N/A ARG 191.A NH2 GLU 206.A OE2 no hydrogen 2.864 N/A GLU 192.A N GLU 165.A OE1 no hydrogen 2.870 N/A GLY 193.A N ASN 166.A O no hydrogen 3.067 N/A VAL 194.A N ARG 191.A O no hydrogen 3.331 N/A GLY 196.A N ILE 213.A O no hydrogen 2.776 N/A GLY 198.A N GLN 172.A O no hydrogen 3.033 N/A ALA 199.A N GLY 196.A O no hydrogen 3.252 N/A LYS 200.A N SER 217.A O no hydrogen 2.860 N/A LYS 200.A NZ GLY 173.A O no hydrogen 3.354 N/A LYS 200.A NZ GLY 198.A O no hydrogen 3.259 N/A ILE 201.A N THR 175.A O no hydrogen 2.969 N/A LEU 202.A N VAL 219.A O no hydrogen 2.897 N/A ILE 205.A N GLY 203.A O no hydrogen 2.845 N/A VAL 207.A N LYS 189.A O no hydrogen 2.861 N/A GLY 208.A N VAL 223.A O no hydrogen 2.855 N/A TYR 210.A N GLU 192.A O no hydrogen 2.858 N/A ALA 211.A N GLY 208.A O no hydrogen 3.147 N/A LYS 212.A N ALA 227.A O no hydrogen 2.793 N/A GLY 214.A N ALA 229.A O no hydrogen 2.832 N/A ASN 216.A N ALA 197.A O no hydrogen 2.809 N/A SER 217.A N GLY 214.A O no hydrogen 3.325 N/A SER 217.A OG GLY 214.A O no hydrogen 2.388 N/A SER 217.A OG ALA 215.A O no hydrogen 3.470 N/A VAL 218.A N GLY 231.A O no hydrogen 3.262 N/A VAL 219.A N LYS 200.A O no hydrogen 2.886 N/A VAL 223.A N GLU 206.A O no hydrogen 2.824 N/A TYR 226.A N LYS 209.A O no hydrogen 2.794 N/A ALA 227.A N PRO 224.A O no hydrogen 3.289 N/A ALA 229.A N LYS 212.A O no hydrogen 2.956 N/A ALA 230.A N ARG 235.A O no hydrogen 3.149 N/A ALA 234.A N VAL 218.A O no hydrogen 2.830 N/A ARG 235.A N ALA 230.A O no hydrogen 2.891 N/A VAL 237.A N THR 228.A O no hydrogen 2.961 N/A