Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4pg2_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): HIS 2.A ND1 ASP 28.A OD1 no hydrogen 3.097 N/A HIS 2.A ND1 ASP 28.A OD2 no hydrogen 2.709 N/A SER 3.A N ASP 28.A OD1 no hydrogen 3.228 N/A MET 4.A N CYS 100.A O no hydrogen 2.917 N/A ARG 5.A N TYR 26.A O no hydrogen 2.825 N/A ARG 5.A NH1 MET 4.A O no hydrogen 3.514 N/A ARG 5.A NH1 ASP 101.A OD1 no hydrogen 2.660 N/A ARG 5.A NH2 ASP 101.A OD1 no hydrogen 3.039 N/A TYR 6.A N SER 98.A O no hydrogen 2.971 N/A PHE 7.A N VAL 24.A O no hydrogen 2.816 N/A GLU 8.A N GLN 96.A O no hydrogen 2.892 N/A THR 9.A N ILE 22.A O no hydrogen 2.864 N/A ALA 10.A N LEU 94.A O no hydrogen 2.759 N/A VAL 11.A N ARG 20.A O no hydrogen 2.578 N/A SER 12.A N HIS 92.A O no hydrogen 3.079 N/A SER 12.A OG HIS 92.A O no hydrogen 3.297 N/A ARG 13.A NH2 GLU 18.A O no hydrogen 3.241 N/A LEU 16.A N ARG 13.A O no hydrogen 3.084 N/A ARG 20.A N VAL 11.A O no hydrogen 2.676 N/A ARG 20.A NH2 ASP 36.A OD2 no hydrogen 2.695 N/A TYR 21.A N SER 37.A OG no hydrogen 2.755 N/A TYR 21.A OH GLU 8.A OE1 no hydrogen 2.953 N/A ILE 22.A N THR 9.A O no hydrogen 2.821 N/A SER 23.A N PHE 35.A O no hydrogen 2.827 N/A SER 23.A OG TYR 44.A OH no hydrogen 2.743 N/A VAL 24.A N PHE 7.A O no hydrogen 2.949 N/A GLY 25.A N VAL 33.A O no hydrogen 2.624 N/A TYR 26.A N ARG 5.A O no hydrogen 2.557 N/A VAL 27.A N LYS 30.A O no hydrogen 2.927 N/A ASP 28.A N SER 3.A O no hydrogen 3.013 N/A LYS 30.A N VAL 27.A O no hydrogen 2.857 N/A LYS 30.A NZ GLU 31.A O no hydrogen 3.119 N/A PHE 32.A N GLY 25.A O no hydrogen 2.889 N/A ARG 34.A N GLU 45.A O no hydrogen 3.396 N/A ARG 34.A NE GLU 31.A OE2 no hydrogen 2.781 N/A PHE 35.A N SER 23.A O no hydrogen 2.656 N/A SER 37.A N TYR 21.A O no hydrogen 3.014 N/A SER 37.A OG TYR 21.A O no hydrogen 2.980 N/A ASP 38.A N ASP 36.A OD1 no hydrogen 2.940 N/A TYR 44.A N THR 63.A OG1 no hydrogen 3.197 N/A TYR 44.A OH SER 23.A OG no hydrogen 2.743 N/A GLU 45.A N ARG 34.A O no hydrogen 3.096 N/A ARG 47.A N PHE 32.A O no hydrogen 2.747 N/A ARG 47.A NE GLU 31.A OE2 no hydrogen 3.040 N/A ARG 47.A NH2 GLU 31.A OE2 no hydrogen 3.541 N/A MET 51.A N ALA 48.A O no hydrogen 2.989 N/A GLU 52.A N PRO 49.A O no hydrogen 3.475 N/A GLN 53.A NE2 TRP 50.A O no hydrogen 2.725 N/A GLU 54.A N MET 51.A O no hydrogen 3.140 N/A TYR 58.A OH TYR 170.A OH no hydrogen 2.525 N/A GLU 60.A N PRO 56.A O no hydrogen 2.901 N/A ARG 61.A N GLU 57.A O no hydrogen 3.161 N/A GLU 62.A N TYR 58.A O no hydrogen 3.087 N/A THR 63.A N TRP 59.A O no hydrogen 3.133 N/A THR 63.A OG1 TRP 59.A O no hydrogen 2.787 N/A GLN 64.A N GLU 60.A O no hydrogen 3.159 N/A LYS 65.A N ARG 61.A O no hydrogen 2.959 N/A LYS 65.A NZ GLU 62.A OE1 no hydrogen 3.368 N/A LYS 65.A NZ GLU 62.A OE2 no hydrogen 3.173 N/A ALA 66.A N GLU 62.A O no hydrogen 2.785 N/A LYS 67.A N THR 63.A O no hydrogen 2.928 N/A GLY 68.A N GLN 64.A O no hydrogen 3.133 N/A GLN 69.A N LYS 65.A O no hydrogen 2.888 N/A GLN 69.A NE2 GLU 8.A OE1 no hydrogen 2.963 N/A GLU 70.A N ALA 66.A O no hydrogen 2.971 N/A GLN 71.A N LYS 67.A O no hydrogen 3.292 N/A GLN 71.A NE2 GLU 18.A OE1 no hydrogen 3.186 N/A GLN 71.A NE2 GLU 18.A OE2 no hydrogen 3.512 N/A TRP 72.A N GLY 68.A O no hydrogen 3.022 N/A PHE 73.A N GLN 69.A O no hydrogen 3.030 N/A ARG 74.A N GLU 70.A O no hydrogen 2.839 N/A ARG 74.A NH1 GLN 71.A OE1 no hydrogen 3.206 N/A VAL 75.A N GLN 71.A O no hydrogen 2.886 N/A SER 76.A N TRP 72.A O no hydrogen 2.891 N/A SER 76.A OG TRP 72.A O no hydrogen 2.883 N/A LEU 77.A N PHE 73.A O no hydrogen 2.667 N/A ARG 78.A N ARG 74.A O no hydrogen 3.389 N/A ASN 79.A N VAL 75.A O no hydrogen 3.163 N/A LEU 80.A N SER 76.A O no hydrogen 3.137 N/A LEU 81.A N LEU 77.A O no hydrogen 2.884 N/A GLY 82.A N ASN 79.A O no hydrogen 2.743 N/A TYR 83.A N ASN 79.A O no hydrogen 3.034 N/A TYR 84.A N LEU 80.A O no hydrogen 2.984 N/A TYR 84.A OH ASP 136.A OD2 no hydrogen 2.872 N/A ASN 85.A N GLY 82.A O no hydrogen 3.439 N/A GLN 86.A N LEU 81.A O no hydrogen 2.999 N/A GLN 86.A NE2 GLU 118.A OE2 no hydrogen 3.374 N/A GLY 89.A N SER 87.A OG no hydrogen 2.943 N/A GLY 90.A N SER 87.A O no hydrogen 3.441 N/A SER 91.A OG SER 12.A O no hydrogen 2.675 N/A HIS 92.A N SER 12.A OG no hydrogen 3.042 N/A HIS 92.A ND1 GLU 118.A OE2 no hydrogen 2.632 N/A HIS 92.A NE2 SER 87.A O no hydrogen 2.864 N/A THR 93.A N GLU 118.A OE1 no hydrogen 3.031 N/A LEU 94.A N ALA 10.A O no hydrogen 3.012 N/A GLN 95.A N ALA 116.A O no hydrogen 3.030 N/A GLN 96.A N GLU 8.A O no hydrogen 2.902 N/A MET 97.A N GLN 114.A O no hydrogen 2.880 N/A SER 98.A N TYR 6.A O no hydrogen 3.174 N/A GLY 99.A N TYR 112.A O no hydrogen 2.873 N/A CYS 100.A N MET 4.A O no hydrogen 3.040 N/A ASP 101.A N ARG 110.A O no hydrogen 2.928 N/A LEU 102.A N HIS 2.A O no hydrogen 2.666 N/A GLY 103.A N ARG 107.A O no hydrogen 2.782 N/A TRP 106.A N GLY 103.A O no hydrogen 2.932 N/A ARG 107.A N ASP 105.A OD1 no hydrogen 3.473 N/A LEU 109.A N ASP 101.A O no hydrogen 2.743 N/A TYR 112.A N GLY 99.A O no hydrogen 2.774 N/A TYR 112.A OH ASP 101.A OD2 no hydrogen 2.971 N/A GLN 114.A N MET 97.A O no hydrogen 2.714 N/A PHE 115.A N ILE 123.A O no hydrogen 2.872 N/A ALA 116.A N GLN 95.A O no hydrogen 2.916 N/A TYR 117.A N ARG 120.A O no hydrogen 2.834 N/A TYR 117.A OH GLN 86.A OE1 no hydrogen 2.496 N/A GLU 118.A N THR 93.A O no hydrogen 2.976 N/A ARG 120.A N TYR 117.A O no hydrogen 3.083 N/A TYR 122.A N PHE 115.A O no hydrogen 3.058 N/A TYR 122.A OH THR 142.A OG1 no hydrogen 2.554 N/A ALA 124.A N THR 133.A O no hydrogen 3.066 N/A LEU 125.A N LEU 113.A O no hydrogen 2.910 N/A ASN 126.A N THR 131.A O no hydrogen 3.029 N/A ASN 126.A ND2 THR 131.A OG1 no hydrogen 2.939 N/A LEU 129.A N ASN 126.A O no hydrogen 2.795 N/A LYS 130.A N ASP 128.A OD1 no hydrogen 2.740 N/A THR 131.A N ASP 128.A OD1 no hydrogen 3.192 N/A THR 131.A OG1 ASP 128.A OD2 no hydrogen 3.440 N/A THR 133.A N ALA 124.A O no hydrogen 2.863 N/A THR 133.A OG1 ASN 126.A OD1 no hydrogen 2.781 N/A ALA 135.A N TYR 122.A O no hydrogen 2.877 N/A ALA 138.A N ASP 136.A OD1 no hydrogen 2.627 N/A ALA 139.A N ASP 136.A OD1 no hydrogen 3.290 N/A GLN 140.A N ASP 136.A O no hydrogen 3.148 N/A GLN 140.A N MET 137.A O no hydrogen 3.157 N/A ILE 141.A N MET 137.A O no hydrogen 3.345 N/A THR 142.A OG1 TYR 122.A OH no hydrogen 2.554 N/A ARG 143.A N ALA 139.A O no hydrogen 2.824 N/A ARG 143.A NH1 GLU 147.A OE2 no hydrogen 3.064 N/A ARG 144.A N GLN 140.A O no hydrogen 3.041 N/A LYS 145.A N ILE 141.A O no hydrogen 3.226 N/A TRP 146.A N THR 142.A O no hydrogen 2.859 N/A GLU 147.A N ARG 143.A O no hydrogen 2.829 N/A GLN 148.A N ARG 144.A O no hydrogen 2.921 N/A SER 149.A N LYS 145.A O no hydrogen 3.253 N/A GLY 150.A N GLU 147.A O no hydrogen 3.492 N/A ALA 151.A N TRP 146.A O no hydrogen 3.242 N/A HIS 154.A N ALA 151.A O no hydrogen 3.256 N/A LYS 156.A N ALA 152.A O no hydrogen 2.918 N/A LYS 156.A NZ GLU 160.A OE1 no hydrogen 2.706 N/A LYS 156.A NZ GLU 160.A OE2 no hydrogen 3.377 N/A ALA 157.A N GLU 153.A O no hydrogen 3.034 N/A TYR 158.A N HIS 154.A O no hydrogen 3.289 N/A LEU 159.A N TYR 155.A O no hydrogen 2.910 N/A GLU 160.A N LYS 156.A O no hydrogen 2.993 N/A CYS 163.A N TYR 158.A O no hydrogen 2.926 N/A GLU 165.A N GLY 161.A O no hydrogen 3.029 N/A TRP 166.A N GLU 162.A O no hydrogen 2.819 N/A LEU 167.A N CYS 163.A O no hydrogen 3.138 N/A HIS 168.A N VAL 164.A O no hydrogen 2.999 N/A HIS 168.A NE2 TRP 106.A O no hydrogen 2.756 N/A ARG 169.A N GLU 165.A O no hydrogen 3.248 N/A ARG 169.A NE GLU 54.A OE2 no hydrogen 3.042 N/A ARG 169.A NH2 GLU 54.A OE1 no hydrogen 3.356 N/A TYR 170.A N TRP 166.A O no hydrogen 2.810 N/A TYR 170.A OH TYR 58.A OH no hydrogen 2.525 N/A LEU 171.A N LEU 167.A O no hydrogen 2.711 N/A LYS 172.A N HIS 168.A O no hydrogen 2.993 N/A ASN 173.A N ARG 169.A O no hydrogen 2.925 N/A GLY 174.A N TYR 170.A O no hydrogen 2.770 N/A ASN 175.A N LEU 171.A O no hydrogen 2.929 N/A THR 177.A N GLY 174.A O no hydrogen 2.793 N/A LEU 178.A N GLY 174.A O no hydrogen 3.104 N/A LEU 179.A N ASN 175.A O no hydrogen 3.078 N/A ASP 182.A N TYR 203.A O no hydrogen 2.913 N/A LYS 185.A N LEU 200.A O no hydrogen 2.904 N/A THR 189.A N ARG 196.A O no hydrogen 2.950 N/A THR 189.A OG1 HIS 191.A NE2 no hydrogen 3.322 N/A HIS 191.A N THR 194.A O no hydrogen 3.444 N/A LEU 195.A N VAL 232.A O no hydrogen 3.506 N/A ARG 196.A N THR 189.A O no hydrogen 2.937 N/A CYS 197.A N ALA 230.A O no hydrogen 3.056 N/A TRP 198.A N HIS 187.A O no hydrogen 3.103 N/A ALA 199.A N LYS 228.A O no hydrogen 2.842 N/A LEU 200.A N LYS 185.A O no hydrogen 2.929 N/A TYR 203.A N ASP 182.A O no hydrogen 3.029 N/A THR 208.A N TYR 241.A O no hydrogen 3.244 N/A THR 210.A N ARG 239.A O no hydrogen 3.256 N/A TRP 211.A NE1 ALA 230.A O no hydrogen 3.017 N/A GLU 214.A N SER 231.A O no hydrogen 3.139 N/A VAL 216.A N TRP 229.A O no hydrogen 3.297 N/A ARG 219.A N GLN 227.A O no hydrogen 2.929 N/A ARG 219.A NE GLN 227.A OE1 no hydrogen 3.095 N/A ARG 219.A NH2 GLN 227.A OE1 no hydrogen 3.319 N/A ALA 221.A N THR 225.A O no hydrogen 3.008 N/A THR 225.A N ASP 223.A OD1 no hydrogen 3.390 N/A THR 225.A OG1 ASP 223.A OD1 no hydrogen 3.378 N/A PHE 226.A N PHE 202.A O no hydrogen 2.797 N/A GLN 227.A N ARG 219.A O no hydrogen 2.798 N/A LYS 228.A N ALA 199.A O no hydrogen 3.317 N/A LYS 228.A NZ VAL 216.A O no hydrogen 3.198 N/A LYS 228.A NZ THR 218.A OG1 no hydrogen 3.413 N/A ALA 230.A N CYS 197.A O no hydrogen 3.345 N/A SER 231.A N GLU 214.A O no hydrogen 2.872 N/A GLN 234.A NE2 GLN 234.A O no hydrogen 3.059 N/A CYS 238.A N LEU 251.A O no hydrogen 2.883 N/A CYS 238.A SG THR 210.A O no hydrogen 3.995 N/A ARG 239.A N THR 210.A O no hydrogen 2.921 N/A VAL 240.A N LEU 249.A O no hydrogen 2.997 N/A TYR 241.A N THR 208.A O no hydrogen 3.137 N/A HIS 242.A NE2 PRO 204.A O no hydrogen 2.857 N/A GLY 244.A N HIS 242.A ND1 no hydrogen 2.992 N/A LEU 245.A N HIS 242.A O no hydrogen 2.760 N/A LEU 249.A N VAL 240.A O no hydrogen 3.110 N/A LEU 251.A N CYS 238.A O no hydrogen 2.810 N/A